USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 696 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 57 GLN : amide:sc= 0.147 K(o=0.44,f=-3!) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.293 K(o=0.44,f=-3.5!) USER MOD Set 2.1: A 44 MET CE :methyl 177:sc= -0.331 (180deg=-0.421) USER MOD Set 2.2: A 55 MET CE :methyl 173:sc= 0 (180deg=-0.0448) USER MOD Set 3.1: A 37 HIS : no HD1:sc= 0.097 K(o=0.35,f=-5.9!) USER MOD Set 3.2: A 38 THR OG1 : rot -79:sc= 0.249 USER MOD Set 4.1: A 19 ASN : amide:sc= 0.187 K(o=0.38,f=-0.33) USER MOD Set 4.2: A 31 GLN : amide:sc= 0.191 K(o=0.38,f=-0.33) USER MOD Set 5.1: A 28 SER OG : rot -122:sc= 1.4 USER MOD Set 5.2: A 47 TYR OH : rot 178:sc= 0.0376 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 21 LYS NZ :NH3+ -105:sc= 0.468 (180deg=-1.1!) USER MOD Single : A 25 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.17) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 179:sc= 1.34 (180deg=1.28) USER MOD Single : A 41 SER OG : rot -124:sc= 1.39 USER MOD Single : A 42 LYS NZ :NH3+ -142:sc= 1.2 (180deg=-1.35!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot 74:sc= -4.6! USER MOD Single : A 51 GLN : amide:sc= -0.038 K(o=-0.038,f=-0.85) USER MOD Single : A 54 SER OG : rot 180:sc= 0.13 USER MOD Single : A 65 GLN : amide:sc= -0.55 X(o=-0.55,f=-0.97) USER MOD Single : A 68 ASN : amide:sc= 1.26 K(o=1.3,f=-0.054) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.783 USER MOD Single : A 75 GLN : amide:sc= -0.0124 K(o=-0.012,f=-0.72) USER MOD Single : A 78 MET CE :methyl -107:sc= -0.376 (180deg=-2.08!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.56) USER MOD Single : A 90 GLN : amide:sc= -0.0182 K(o=-0.018,f=-1.5) USER MOD Single : A 91 THR OG1 : rot -81:sc= 0.107 USER MOD Single : B 357 ASN : amide:sc= -0.695 K(o=-0.69,f=-6.3!) USER MOD Single : B 358 ASN : amide:sc= -0.556 X(o=-0.56,f=-0.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -4.708 23.424 5.691 1.00 10.00 N ATOM 2 CA ASP A 16 -5.843 22.564 6.094 1.00 10.00 C ATOM 3 C ASP A 16 -5.589 21.128 5.673 1.00 10.00 C ATOM 4 O ASP A 16 -4.724 20.863 4.834 1.00 10.00 O ATOM 5 CB ASP A 16 -7.144 23.071 5.480 1.00 10.00 C ATOM 6 CG ASP A 16 -8.009 23.785 6.495 1.00 10.00 C ATOM 7 OD1 ASP A 16 -9.138 23.322 6.755 1.00 10.00 O ATOM 8 OD2 ASP A 16 -7.560 24.812 7.043 1.00 10.00 O ATOM 0 HA ASP A 16 -5.936 22.601 7.179 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -6.917 23.748 4.657 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -7.697 22.232 5.059 1.00 10.00 H new ATOM 13 N HIS A 17 -6.336 20.206 6.258 1.00 10.00 N ATOM 14 CA HIS A 17 -6.184 18.792 5.954 1.00 10.00 C ATOM 15 C HIS A 17 -7.184 18.357 4.895 1.00 10.00 C ATOM 16 O HIS A 17 -8.316 18.846 4.852 1.00 10.00 O ATOM 17 CB HIS A 17 -6.370 17.950 7.217 1.00 10.00 C ATOM 18 CG HIS A 17 -5.296 18.149 8.242 1.00 10.00 C ATOM 19 ND1 HIS A 17 -5.459 19.022 9.292 1.00 10.00 N ATOM 20 CD2 HIS A 17 -4.078 17.565 8.335 1.00 10.00 C ATOM 21 CE1 HIS A 17 -4.346 18.948 9.997 1.00 10.00 C ATOM 22 NE2 HIS A 17 -3.480 18.077 9.458 1.00 10.00 N ATOM 0 H HIS A 17 -7.057 20.413 6.949 1.00 10.00 H new ATOM 0 HA HIS A 17 -5.176 18.637 5.568 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -7.334 18.191 7.664 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -6.402 16.897 6.938 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.659 16.837 7.656 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -4.156 19.517 10.895 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -2.554 17.841 9.815 1.00 10.00 H new ATOM 30 N ILE A 18 -6.762 17.436 4.048 1.00 10.00 N ATOM 31 CA ILE A 18 -7.607 16.922 2.987 1.00 10.00 C ATOM 32 C ILE A 18 -8.007 15.480 3.300 1.00 10.00 C ATOM 33 O ILE A 18 -7.186 14.679 3.756 1.00 10.00 O ATOM 34 CB ILE A 18 -6.893 17.008 1.613 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.838 16.623 0.473 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.647 16.135 1.586 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.252 16.873 -0.901 1.00 10.00 C ATOM 0 H ILE A 18 -5.829 17.025 4.076 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.506 17.536 2.929 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.588 18.044 1.468 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -8.095 15.568 0.564 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.765 17.187 0.573 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -5.167 16.215 0.610 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.954 16.466 2.359 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.926 15.097 1.769 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -7.973 16.579 -1.663 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.020 17.932 -1.011 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.340 16.288 -1.019 1.00 10.00 H new ATOM 49 N ASN A 19 -9.271 15.156 3.092 1.00 10.00 N ATOM 50 CA ASN A 19 -9.758 13.816 3.368 1.00 10.00 C ATOM 51 C ASN A 19 -9.674 12.947 2.128 1.00 10.00 C ATOM 52 O ASN A 19 -10.581 12.940 1.293 1.00 10.00 O ATOM 53 CB ASN A 19 -11.196 13.852 3.893 1.00 10.00 C ATOM 54 CG ASN A 19 -11.259 13.881 5.410 1.00 10.00 C ATOM 55 OD1 ASN A 19 -11.209 12.840 6.069 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.385 15.072 5.977 1.00 10.00 N ATOM 0 H ASN A 19 -9.977 15.800 2.734 1.00 10.00 H new ATOM 0 HA ASN A 19 -9.122 13.383 4.140 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.703 14.731 3.494 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -11.735 12.979 3.526 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.444 15.150 6.992 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.423 15.911 5.398 1.00 10.00 H new ATOM 63 N LEU A 20 -8.570 12.231 2.001 1.00 10.00 N ATOM 64 CA LEU A 20 -8.367 11.343 0.871 1.00 10.00 C ATOM 65 C LEU A 20 -8.781 9.935 1.260 1.00 10.00 C ATOM 66 O LEU A 20 -8.537 9.499 2.387 1.00 10.00 O ATOM 67 CB LEU A 20 -6.904 11.366 0.417 1.00 10.00 C ATOM 68 CG LEU A 20 -6.446 12.675 -0.232 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.974 12.598 -0.608 1.00 10.00 C ATOM 70 CD2 LEU A 20 -7.291 12.992 -1.458 1.00 10.00 C ATOM 0 H LEU A 20 -7.799 12.248 2.669 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.980 11.683 0.036 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -6.269 11.165 1.280 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.747 10.553 -0.292 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.577 13.479 0.493 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.666 13.537 -1.068 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -4.379 12.420 0.288 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.821 11.781 -1.313 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.949 13.926 -1.904 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -7.194 12.186 -2.185 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.336 13.092 -1.164 1.00 10.00 H new ATOM 82 N LYS A 21 -9.420 9.233 0.346 1.00 10.00 N ATOM 83 CA LYS A 21 -9.868 7.883 0.619 1.00 10.00 C ATOM 84 C LYS A 21 -9.235 6.899 -0.343 1.00 10.00 C ATOM 85 O LYS A 21 -9.280 7.079 -1.558 1.00 10.00 O ATOM 86 CB LYS A 21 -11.391 7.792 0.525 1.00 10.00 C ATOM 87 CG LYS A 21 -12.115 8.400 1.713 1.00 10.00 C ATOM 88 CD LYS A 21 -13.594 8.585 1.421 1.00 10.00 C ATOM 89 CE LYS A 21 -14.362 9.004 2.663 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.645 9.661 2.316 1.00 10.00 N ATOM 0 H LYS A 21 -9.640 9.574 -0.590 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.560 7.628 1.633 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -11.720 8.294 -0.385 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.678 6.745 0.433 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.992 7.757 2.585 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.668 9.363 1.961 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.720 9.338 0.643 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -14.008 7.654 1.033 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.557 8.129 3.283 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.752 9.686 3.256 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.562 10.687 2.466 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.872 9.475 1.318 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -16.403 9.283 2.920 1.00 10.00 H new ATOM 104 N VAL A 22 -8.626 5.867 0.202 1.00 10.00 N ATOM 105 CA VAL A 22 -8.006 4.842 -0.612 1.00 10.00 C ATOM 106 C VAL A 22 -8.794 3.552 -0.451 1.00 10.00 C ATOM 107 O VAL A 22 -9.227 3.223 0.653 1.00 10.00 O ATOM 108 CB VAL A 22 -6.527 4.620 -0.226 1.00 10.00 C ATOM 109 CG1 VAL A 22 -5.848 3.674 -1.197 1.00 10.00 C ATOM 110 CG2 VAL A 22 -5.783 5.943 -0.166 1.00 10.00 C ATOM 0 H VAL A 22 -8.547 5.715 1.208 1.00 10.00 H new ATOM 0 HA VAL A 22 -8.019 5.165 -1.653 1.00 10.00 H new ATOM 0 HB VAL A 22 -6.504 4.165 0.764 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -4.808 3.535 -0.902 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -6.360 2.712 -1.186 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -5.887 4.094 -2.202 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -4.743 5.764 0.108 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -5.823 6.428 -1.142 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -6.248 6.588 0.579 1.00 10.00 H new ATOM 120 N ALA A 23 -9.005 2.842 -1.543 1.00 10.00 N ATOM 121 CA ALA A 23 -9.764 1.608 -1.496 1.00 10.00 C ATOM 122 C ALA A 23 -8.967 0.439 -2.050 1.00 10.00 C ATOM 123 O ALA A 23 -8.401 0.518 -3.141 1.00 10.00 O ATOM 124 CB ALA A 23 -11.070 1.770 -2.262 1.00 10.00 C ATOM 0 H ALA A 23 -8.663 3.097 -2.469 1.00 10.00 H new ATOM 0 HA ALA A 23 -9.985 1.389 -0.451 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -11.634 0.838 -2.221 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -11.659 2.570 -1.813 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.854 2.018 -3.301 1.00 10.00 H new ATOM 130 N GLY A 24 -8.909 -0.636 -1.283 1.00 10.00 N ATOM 131 CA GLY A 24 -8.204 -1.820 -1.723 1.00 10.00 C ATOM 132 C GLY A 24 -9.128 -2.754 -2.472 1.00 10.00 C ATOM 133 O GLY A 24 -10.341 -2.536 -2.492 1.00 10.00 O ATOM 0 H GLY A 24 -9.339 -0.711 -0.361 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -7.371 -1.534 -2.366 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -7.780 -2.336 -0.862 1.00 10.00 H new ATOM 137 N GLN A 25 -8.573 -3.793 -3.081 1.00 10.00 N ATOM 138 CA GLN A 25 -9.376 -4.754 -3.834 1.00 10.00 C ATOM 139 C GLN A 25 -10.340 -5.502 -2.912 1.00 10.00 C ATOM 140 O GLN A 25 -11.396 -5.962 -3.343 1.00 10.00 O ATOM 141 CB GLN A 25 -8.472 -5.752 -4.568 1.00 10.00 C ATOM 142 CG GLN A 25 -7.598 -5.120 -5.645 1.00 10.00 C ATOM 143 CD GLN A 25 -8.404 -4.383 -6.697 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.866 -4.978 -7.672 1.00 10.00 O ATOM 145 NE2 GLN A 25 -8.560 -3.082 -6.522 1.00 10.00 N ATOM 0 H GLN A 25 -7.573 -3.994 -3.070 1.00 10.00 H new ATOM 0 HA GLN A 25 -9.960 -4.200 -4.569 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -7.831 -6.250 -3.840 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -9.094 -6.522 -5.025 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -6.898 -4.427 -5.178 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -7.004 -5.897 -6.127 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -8.162 -2.627 -5.701 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -9.079 -2.534 -7.208 1.00 10.00 H new ATOM 154 N ASP A 26 -9.978 -5.593 -1.640 1.00 10.00 N ATOM 155 CA ASP A 26 -10.801 -6.281 -0.648 1.00 10.00 C ATOM 156 C ASP A 26 -11.903 -5.368 -0.119 1.00 10.00 C ATOM 157 O ASP A 26 -12.689 -5.765 0.740 1.00 10.00 O ATOM 158 CB ASP A 26 -9.934 -6.770 0.517 1.00 10.00 C ATOM 159 CG ASP A 26 -9.368 -5.624 1.334 1.00 10.00 C ATOM 160 OD1 ASP A 26 -8.529 -4.869 0.798 1.00 10.00 O ATOM 161 OD2 ASP A 26 -9.758 -5.474 2.510 1.00 10.00 O ATOM 0 H ASP A 26 -9.115 -5.197 -1.267 1.00 10.00 H new ATOM 0 HA ASP A 26 -11.265 -7.137 -1.137 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -10.529 -7.415 1.164 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -9.115 -7.375 0.128 1.00 10.00 H new ATOM 166 N GLY A 27 -11.954 -4.142 -0.627 1.00 10.00 N ATOM 167 CA GLY A 27 -12.970 -3.201 -0.193 1.00 10.00 C ATOM 168 C GLY A 27 -12.594 -2.500 1.095 1.00 10.00 C ATOM 169 O GLY A 27 -13.453 -2.175 1.913 1.00 10.00 O ATOM 0 H GLY A 27 -11.310 -3.783 -1.332 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -13.131 -2.458 -0.974 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -13.914 -3.728 -0.055 1.00 10.00 H new ATOM 173 N SER A 28 -11.304 -2.281 1.283 1.00 10.00 N ATOM 174 CA SER A 28 -10.809 -1.613 2.473 1.00 10.00 C ATOM 175 C SER A 28 -10.882 -0.101 2.306 1.00 10.00 C ATOM 176 O SER A 28 -10.128 0.480 1.527 1.00 10.00 O ATOM 177 CB SER A 28 -9.363 -2.039 2.737 1.00 10.00 C ATOM 178 OG SER A 28 -8.700 -2.352 1.519 1.00 10.00 O ATOM 0 H SER A 28 -10.578 -2.558 0.623 1.00 10.00 H new ATOM 0 HA SER A 28 -11.432 -1.898 3.321 1.00 10.00 H new ATOM 0 HB2 SER A 28 -8.831 -1.238 3.251 1.00 10.00 H new ATOM 0 HB3 SER A 28 -9.349 -2.906 3.397 1.00 10.00 H new ATOM 0 HG SER A 28 -8.372 -3.275 1.553 1.00 10.00 H new ATOM 184 N VAL A 29 -11.804 0.526 3.017 1.00 10.00 N ATOM 185 CA VAL A 29 -11.955 1.969 2.957 1.00 10.00 C ATOM 186 C VAL A 29 -11.075 2.626 4.012 1.00 10.00 C ATOM 187 O VAL A 29 -11.404 2.616 5.200 1.00 10.00 O ATOM 188 CB VAL A 29 -13.428 2.396 3.162 1.00 10.00 C ATOM 189 CG1 VAL A 29 -13.555 3.909 3.259 1.00 10.00 C ATOM 190 CG2 VAL A 29 -14.303 1.857 2.041 1.00 10.00 C ATOM 0 H VAL A 29 -12.459 0.058 3.643 1.00 10.00 H new ATOM 0 HA VAL A 29 -11.646 2.297 1.965 1.00 10.00 H new ATOM 0 HB VAL A 29 -13.771 1.970 4.105 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -14.602 4.178 3.403 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -12.968 4.270 4.104 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -13.186 4.365 2.340 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -15.335 2.168 2.203 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -13.952 2.248 1.086 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -14.250 0.768 2.029 1.00 10.00 H new ATOM 200 N VAL A 30 -9.939 3.167 3.590 1.00 10.00 N ATOM 201 CA VAL A 30 -9.039 3.823 4.524 1.00 10.00 C ATOM 202 C VAL A 30 -9.169 5.335 4.441 1.00 10.00 C ATOM 203 O VAL A 30 -9.105 5.924 3.357 1.00 10.00 O ATOM 204 CB VAL A 30 -7.553 3.440 4.322 1.00 10.00 C ATOM 205 CG1 VAL A 30 -7.287 2.018 4.770 1.00 10.00 C ATOM 206 CG2 VAL A 30 -7.116 3.630 2.885 1.00 10.00 C ATOM 0 H VAL A 30 -9.624 3.164 2.620 1.00 10.00 H new ATOM 0 HA VAL A 30 -9.343 3.470 5.510 1.00 10.00 H new ATOM 0 HB VAL A 30 -6.963 4.113 4.944 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -6.235 1.779 4.616 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -7.530 1.918 5.828 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -7.904 1.332 4.190 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -6.067 3.351 2.784 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -7.723 3.001 2.234 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -7.242 4.675 2.601 1.00 10.00 H new ATOM 216 N GLN A 31 -9.381 5.952 5.589 1.00 10.00 N ATOM 217 CA GLN A 31 -9.490 7.395 5.673 1.00 10.00 C ATOM 218 C GLN A 31 -8.105 7.965 5.911 1.00 10.00 C ATOM 219 O GLN A 31 -7.486 7.689 6.940 1.00 10.00 O ATOM 220 CB GLN A 31 -10.434 7.805 6.805 1.00 10.00 C ATOM 221 CG GLN A 31 -10.767 9.288 6.815 1.00 10.00 C ATOM 222 CD GLN A 31 -11.296 9.752 8.156 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.859 8.968 8.918 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.137 11.032 8.444 1.00 10.00 N ATOM 0 H GLN A 31 -9.482 5.471 6.483 1.00 10.00 H new ATOM 0 HA GLN A 31 -9.902 7.785 4.742 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -11.359 7.234 6.720 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.981 7.537 7.759 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.874 9.860 6.562 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -11.508 9.496 6.043 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.664 11.648 7.783 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -11.487 11.403 9.327 1.00 10.00 H new ATOM 233 N PHE A 32 -7.612 8.739 4.961 1.00 10.00 N ATOM 234 CA PHE A 32 -6.284 9.313 5.069 1.00 10.00 C ATOM 235 C PHE A 32 -6.319 10.769 5.496 1.00 10.00 C ATOM 236 O PHE A 32 -6.737 11.642 4.732 1.00 10.00 O ATOM 237 CB PHE A 32 -5.549 9.196 3.735 1.00 10.00 C ATOM 238 CG PHE A 32 -4.547 8.080 3.698 1.00 10.00 C ATOM 239 CD1 PHE A 32 -4.897 6.831 3.209 1.00 10.00 C ATOM 240 CD2 PHE A 32 -3.252 8.284 4.142 1.00 10.00 C ATOM 241 CE1 PHE A 32 -3.972 5.804 3.168 1.00 10.00 C ATOM 242 CE2 PHE A 32 -2.323 7.261 4.105 1.00 10.00 C ATOM 243 CZ PHE A 32 -2.683 6.022 3.616 1.00 10.00 C ATOM 0 H PHE A 32 -8.112 8.984 4.106 1.00 10.00 H new ATOM 0 HA PHE A 32 -5.756 8.750 5.839 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -6.279 9.045 2.940 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -5.040 10.137 3.526 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -5.903 6.658 2.856 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -2.964 9.253 4.522 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -4.256 4.834 2.787 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -1.317 7.431 4.458 1.00 10.00 H new ATOM 0 HZ PHE A 32 -1.957 5.223 3.583 1.00 10.00 H new ATOM 253 N LYS A 33 -5.892 11.022 6.722 1.00 10.00 N ATOM 254 CA LYS A 33 -5.821 12.378 7.231 1.00 10.00 C ATOM 255 C LYS A 33 -4.464 12.952 6.855 1.00 10.00 C ATOM 256 O LYS A 33 -3.489 12.813 7.597 1.00 10.00 O ATOM 257 CB LYS A 33 -6.012 12.413 8.750 1.00 10.00 C ATOM 258 CG LYS A 33 -6.098 13.821 9.317 1.00 10.00 C ATOM 259 CD LYS A 33 -6.134 13.811 10.835 1.00 10.00 C ATOM 260 CE LYS A 33 -6.179 15.220 11.405 1.00 10.00 C ATOM 261 NZ LYS A 33 -6.108 15.225 12.891 1.00 10.00 N ATOM 0 H LYS A 33 -5.590 10.305 7.382 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.622 12.974 6.792 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -6.922 11.870 9.007 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.183 11.888 9.225 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.242 14.404 8.977 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -6.992 14.314 8.935 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -7.006 13.253 11.175 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -5.255 13.292 11.217 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -5.350 15.801 11.001 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -7.098 15.711 11.085 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -6.142 16.205 13.237 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -6.913 14.693 13.279 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -5.219 14.780 13.198 1.00 10.00 H new ATOM 275 N ILE A 34 -4.400 13.562 5.685 1.00 10.00 N ATOM 276 CA ILE A 34 -3.158 14.116 5.184 1.00 10.00 C ATOM 277 C ILE A 34 -3.378 15.543 4.656 1.00 10.00 C ATOM 278 O ILE A 34 -4.510 16.017 4.598 1.00 10.00 O ATOM 279 CB ILE A 34 -2.599 13.200 4.058 1.00 10.00 C ATOM 280 CG1 ILE A 34 -1.222 13.666 3.576 1.00 10.00 C ATOM 281 CG2 ILE A 34 -3.571 13.138 2.888 1.00 10.00 C ATOM 282 CD1 ILE A 34 -0.405 12.575 2.923 1.00 10.00 C ATOM 0 H ILE A 34 -5.198 13.686 5.063 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.435 14.164 5.998 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.483 12.201 4.479 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -1.353 14.483 2.867 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -0.666 14.066 4.424 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -3.163 12.493 2.110 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -4.525 12.737 3.229 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -3.721 14.140 2.486 1.00 10.00 H new ATOM 0 HD11 ILE A 34 0.557 12.980 2.608 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.242 11.766 3.636 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.939 12.191 2.054 1.00 10.00 H new ATOM 294 N LYS A 35 -2.298 16.235 4.307 1.00 10.00 N ATOM 295 CA LYS A 35 -2.389 17.579 3.754 1.00 10.00 C ATOM 296 C LYS A 35 -2.299 17.499 2.232 1.00 10.00 C ATOM 297 O LYS A 35 -2.304 16.409 1.663 1.00 10.00 O ATOM 298 CB LYS A 35 -1.275 18.473 4.295 1.00 10.00 C ATOM 299 CG LYS A 35 -1.484 18.936 5.727 1.00 10.00 C ATOM 300 CD LYS A 35 -0.416 19.939 6.129 1.00 10.00 C ATOM 301 CE LYS A 35 -0.444 20.242 7.617 1.00 10.00 C ATOM 302 NZ LYS A 35 0.818 20.889 8.067 1.00 10.00 N ATOM 0 H LYS A 35 -1.345 15.883 4.399 1.00 10.00 H new ATOM 0 HA LYS A 35 -3.343 18.016 4.049 1.00 10.00 H new ATOM 0 HB2 LYS A 35 -0.330 17.933 4.234 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -1.183 19.349 3.652 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -2.471 19.388 5.828 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -1.456 18.079 6.399 1.00 10.00 H new ATOM 0 HD2 LYS A 35 0.566 19.550 5.858 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.559 20.863 5.569 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.288 20.895 7.840 1.00 10.00 H new ATOM 0 HE3 LYS A 35 -0.599 19.318 8.174 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.758 21.097 9.084 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.618 20.248 7.891 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.961 21.774 7.540 1.00 10.00 H new ATOM 316 N ARG A 36 -2.197 18.643 1.572 1.00 10.00 N ATOM 317 CA ARG A 36 -2.121 18.664 0.115 1.00 10.00 C ATOM 318 C ARG A 36 -0.674 18.756 -0.364 1.00 10.00 C ATOM 319 O ARG A 36 -0.376 18.451 -1.520 1.00 10.00 O ATOM 320 CB ARG A 36 -2.937 19.836 -0.448 1.00 10.00 C ATOM 321 CG ARG A 36 -4.378 19.869 0.044 1.00 10.00 C ATOM 322 CD ARG A 36 -5.126 21.087 -0.479 1.00 10.00 C ATOM 323 NE ARG A 36 -5.429 20.984 -1.907 1.00 10.00 N ATOM 324 CZ ARG A 36 -6.654 20.803 -2.405 1.00 10.00 C ATOM 325 NH1 ARG A 36 -7.706 20.709 -1.598 1.00 10.00 N ATOM 326 NH2 ARG A 36 -6.833 20.730 -3.717 1.00 10.00 N ATOM 0 H ARG A 36 -2.165 19.561 2.015 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.542 17.728 -0.253 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -2.448 20.772 -0.177 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -2.935 19.779 -1.537 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -4.892 18.962 -0.275 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.390 19.875 1.134 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.055 21.207 0.079 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -4.529 21.981 -0.300 1.00 10.00 H new ATOM 0 HE ARG A 36 -4.653 21.055 -2.565 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.581 20.775 -0.588 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -8.638 20.571 -1.989 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.034 20.812 -4.346 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -7.769 20.592 -4.097 1.00 10.00 H new ATOM 340 N HIS A 37 0.227 19.169 0.525 1.00 10.00 N ATOM 341 CA HIS A 37 1.636 19.309 0.166 1.00 10.00 C ATOM 342 C HIS A 37 2.444 18.061 0.536 1.00 10.00 C ATOM 343 O HIS A 37 3.541 17.853 0.023 1.00 10.00 O ATOM 344 CB HIS A 37 2.241 20.563 0.826 1.00 10.00 C ATOM 345 CG HIS A 37 2.640 20.400 2.269 1.00 10.00 C ATOM 346 ND1 HIS A 37 3.885 20.773 2.713 1.00 10.00 N ATOM 347 CD2 HIS A 37 1.928 19.918 3.318 1.00 10.00 C ATOM 348 CE1 HIS A 37 3.904 20.509 4.009 1.00 10.00 C ATOM 349 NE2 HIS A 37 2.742 19.991 4.420 1.00 10.00 N ATOM 0 H HIS A 37 0.009 19.411 1.492 1.00 10.00 H new ATOM 0 HA HIS A 37 1.689 19.423 -0.917 1.00 10.00 H new ATOM 0 HB2 HIS A 37 3.119 20.867 0.255 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.518 21.376 0.755 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.914 19.547 3.291 1.00 10.00 H new ATOM 0 HE1 HIS A 37 4.751 20.689 4.654 1.00 10.00 H new ATOM 0 HE2 HIS A 37 2.506 19.705 5.370 1.00 10.00 H new ATOM 357 N THR A 38 1.896 17.239 1.423 1.00 10.00 N ATOM 358 CA THR A 38 2.569 16.024 1.857 1.00 10.00 C ATOM 359 C THR A 38 2.629 15.002 0.716 1.00 10.00 C ATOM 360 O THR A 38 1.605 14.667 0.123 1.00 10.00 O ATOM 361 CB THR A 38 1.854 15.409 3.075 1.00 10.00 C ATOM 362 OG1 THR A 38 1.490 16.451 3.997 1.00 10.00 O ATOM 363 CG2 THR A 38 2.738 14.389 3.786 1.00 10.00 C ATOM 0 H THR A 38 0.985 17.394 1.856 1.00 10.00 H new ATOM 0 HA THR A 38 3.586 16.289 2.146 1.00 10.00 H new ATOM 0 HB THR A 38 0.962 14.895 2.718 1.00 10.00 H new ATOM 0 HG1 THR A 38 2.275 16.711 4.523 1.00 10.00 H new ATOM 0 HG21 THR A 38 2.202 13.975 4.640 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.995 13.586 3.095 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.650 14.876 4.131 1.00 10.00 H new ATOM 371 N PRO A 39 3.843 14.518 0.387 1.00 10.00 N ATOM 372 CA PRO A 39 4.060 13.546 -0.698 1.00 10.00 C ATOM 373 C PRO A 39 3.176 12.303 -0.593 1.00 10.00 C ATOM 374 O PRO A 39 2.955 11.766 0.495 1.00 10.00 O ATOM 375 CB PRO A 39 5.532 13.157 -0.536 1.00 10.00 C ATOM 376 CG PRO A 39 6.160 14.322 0.139 1.00 10.00 C ATOM 377 CD PRO A 39 5.108 14.888 1.048 1.00 10.00 C ATOM 0 HA PRO A 39 3.809 13.979 -1.667 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.638 12.250 0.059 1.00 10.00 H new ATOM 0 HB3 PRO A 39 5.998 12.961 -1.502 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.041 14.018 0.704 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.488 15.065 -0.588 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.175 14.466 2.051 1.00 10.00 H new ATOM 0 HD3 PRO A 39 5.206 15.969 1.150 1.00 10.00 H new ATOM 385 N LEU A 40 2.698 11.834 -1.747 1.00 10.00 N ATOM 386 CA LEU A 40 1.837 10.654 -1.811 1.00 10.00 C ATOM 387 C LEU A 40 2.611 9.399 -1.423 1.00 10.00 C ATOM 388 O LEU A 40 2.028 8.337 -1.191 1.00 10.00 O ATOM 389 CB LEU A 40 1.247 10.493 -3.215 1.00 10.00 C ATOM 390 CG LEU A 40 0.312 11.616 -3.663 1.00 10.00 C ATOM 391 CD1 LEU A 40 0.001 11.491 -5.144 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.973 11.602 -2.854 1.00 10.00 C ATOM 0 H LEU A 40 2.895 12.257 -2.654 1.00 10.00 H new ATOM 0 HA LEU A 40 1.021 10.793 -1.102 1.00 10.00 H new ATOM 0 HB2 LEU A 40 2.067 10.418 -3.929 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.702 9.550 -3.256 1.00 10.00 H new ATOM 0 HG LEU A 40 0.817 12.566 -3.491 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -0.666 12.299 -5.445 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.927 11.552 -5.717 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.481 10.532 -5.335 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.623 12.410 -3.190 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.480 10.647 -2.992 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.740 11.739 -1.798 1.00 10.00 H new ATOM 404 N SER A 41 3.929 9.531 -1.359 1.00 10.00 N ATOM 405 CA SER A 41 4.800 8.434 -0.982 1.00 10.00 C ATOM 406 C SER A 41 4.462 7.954 0.426 1.00 10.00 C ATOM 407 O SER A 41 4.561 6.764 0.733 1.00 10.00 O ATOM 408 CB SER A 41 6.251 8.900 -1.059 1.00 10.00 C ATOM 409 OG SER A 41 6.323 10.192 -1.644 1.00 10.00 O ATOM 0 H SER A 41 4.420 10.400 -1.567 1.00 10.00 H new ATOM 0 HA SER A 41 4.656 7.599 -1.667 1.00 10.00 H new ATOM 0 HB2 SER A 41 6.687 8.921 -0.060 1.00 10.00 H new ATOM 0 HB3 SER A 41 6.836 8.194 -1.648 1.00 10.00 H new ATOM 0 HG SER A 41 6.921 10.167 -2.420 1.00 10.00 H new ATOM 415 N LYS A 42 4.038 8.889 1.272 1.00 10.00 N ATOM 416 CA LYS A 42 3.670 8.563 2.642 1.00 10.00 C ATOM 417 C LYS A 42 2.381 7.750 2.671 1.00 10.00 C ATOM 418 O LYS A 42 2.219 6.861 3.504 1.00 10.00 O ATOM 419 CB LYS A 42 3.521 9.831 3.484 1.00 10.00 C ATOM 420 CG LYS A 42 4.831 10.309 4.086 1.00 10.00 C ATOM 421 CD LYS A 42 4.623 10.939 5.455 1.00 10.00 C ATOM 422 CE LYS A 42 5.940 11.093 6.201 1.00 10.00 C ATOM 423 NZ LYS A 42 5.739 11.401 7.639 1.00 10.00 N ATOM 0 H LYS A 42 3.942 9.876 1.031 1.00 10.00 H new ATOM 0 HA LYS A 42 4.470 7.961 3.073 1.00 10.00 H new ATOM 0 HB2 LYS A 42 3.103 10.624 2.864 1.00 10.00 H new ATOM 0 HB3 LYS A 42 2.807 9.644 4.286 1.00 10.00 H new ATOM 0 HG2 LYS A 42 5.520 9.469 4.173 1.00 10.00 H new ATOM 0 HG3 LYS A 42 5.295 11.034 3.418 1.00 10.00 H new ATOM 0 HD2 LYS A 42 4.152 11.915 5.340 1.00 10.00 H new ATOM 0 HD3 LYS A 42 3.941 10.323 6.041 1.00 10.00 H new ATOM 0 HE2 LYS A 42 6.519 10.174 6.106 1.00 10.00 H new ATOM 0 HE3 LYS A 42 6.526 11.888 5.740 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 6.460 12.082 7.952 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 4.793 11.810 7.778 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 5.823 10.527 8.196 1.00 10.00 H new ATOM 437 N LEU A 43 1.474 8.050 1.744 1.00 10.00 N ATOM 438 CA LEU A 43 0.206 7.333 1.651 1.00 10.00 C ATOM 439 C LEU A 43 0.458 5.862 1.369 1.00 10.00 C ATOM 440 O LEU A 43 -0.128 4.982 2.002 1.00 10.00 O ATOM 441 CB LEU A 43 -0.669 7.908 0.535 1.00 10.00 C ATOM 442 CG LEU A 43 -1.602 9.044 0.948 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.058 10.373 0.464 1.00 10.00 C ATOM 444 CD2 LEU A 43 -2.998 8.809 0.397 1.00 10.00 C ATOM 0 H LEU A 43 1.594 8.785 1.047 1.00 10.00 H new ATOM 0 HA LEU A 43 -0.312 7.447 2.603 1.00 10.00 H new ATOM 0 HB2 LEU A 43 -0.019 8.267 -0.263 1.00 10.00 H new ATOM 0 HB3 LEU A 43 -1.271 7.101 0.117 1.00 10.00 H new ATOM 0 HG LEU A 43 -1.660 9.069 2.036 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -1.733 11.174 0.765 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -0.074 10.544 0.901 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -0.975 10.358 -0.623 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -3.651 9.627 0.700 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -2.956 8.762 -0.691 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -3.389 7.869 0.786 1.00 10.00 H new ATOM 456 N MET A 44 1.345 5.610 0.418 1.00 10.00 N ATOM 457 CA MET A 44 1.689 4.254 0.032 1.00 10.00 C ATOM 458 C MET A 44 2.325 3.511 1.200 1.00 10.00 C ATOM 459 O MET A 44 1.930 2.391 1.518 1.00 10.00 O ATOM 460 CB MET A 44 2.635 4.266 -1.172 1.00 10.00 C ATOM 461 CG MET A 44 2.021 4.882 -2.418 1.00 10.00 C ATOM 462 SD MET A 44 3.005 4.598 -3.905 1.00 10.00 S ATOM 463 CE MET A 44 4.391 5.694 -3.610 1.00 10.00 C ATOM 0 H MET A 44 1.841 6.334 -0.102 1.00 10.00 H new ATOM 0 HA MET A 44 0.774 3.733 -0.250 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.537 4.819 -0.910 1.00 10.00 H new ATOM 0 HB3 MET A 44 2.941 3.244 -1.394 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.023 4.470 -2.566 1.00 10.00 H new ATOM 0 HG3 MET A 44 1.904 5.955 -2.266 1.00 10.00 H new ATOM 0 HE1 MET A 44 5.115 5.591 -4.419 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.038 6.724 -3.568 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.865 5.434 -2.663 1.00 10.00 H new ATOM 473 N LYS A 45 3.294 4.155 1.846 1.00 10.00 N ATOM 474 CA LYS A 45 3.986 3.560 2.985 1.00 10.00 C ATOM 475 C LYS A 45 3.017 3.228 4.114 1.00 10.00 C ATOM 476 O LYS A 45 2.989 2.100 4.605 1.00 10.00 O ATOM 477 CB LYS A 45 5.061 4.506 3.517 1.00 10.00 C ATOM 478 CG LYS A 45 6.290 4.614 2.629 1.00 10.00 C ATOM 479 CD LYS A 45 7.497 5.103 3.416 1.00 10.00 C ATOM 480 CE LYS A 45 7.268 6.489 4.003 1.00 10.00 C ATOM 481 NZ LYS A 45 8.263 6.817 5.059 1.00 10.00 N ATOM 0 H LYS A 45 3.618 5.090 1.599 1.00 10.00 H new ATOM 0 HA LYS A 45 4.449 2.638 2.633 1.00 10.00 H new ATOM 0 HB2 LYS A 45 4.627 5.498 3.640 1.00 10.00 H new ATOM 0 HB3 LYS A 45 5.370 4.168 4.506 1.00 10.00 H new ATOM 0 HG2 LYS A 45 6.510 3.642 2.188 1.00 10.00 H new ATOM 0 HG3 LYS A 45 6.088 5.299 1.806 1.00 10.00 H new ATOM 0 HD2 LYS A 45 7.716 4.400 4.220 1.00 10.00 H new ATOM 0 HD3 LYS A 45 8.371 5.124 2.765 1.00 10.00 H new ATOM 0 HE2 LYS A 45 7.324 7.233 3.208 1.00 10.00 H new ATOM 0 HE3 LYS A 45 6.263 6.544 4.422 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 8.072 7.769 5.432 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 8.193 6.122 5.830 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 9.221 6.790 4.654 1.00 10.00 H new ATOM 495 N ALA A 46 2.225 4.215 4.519 1.00 10.00 N ATOM 496 CA ALA A 46 1.266 4.042 5.602 1.00 10.00 C ATOM 497 C ALA A 46 0.296 2.898 5.329 1.00 10.00 C ATOM 498 O ALA A 46 0.026 2.084 6.215 1.00 10.00 O ATOM 499 CB ALA A 46 0.511 5.335 5.847 1.00 10.00 C ATOM 0 H ALA A 46 2.230 5.149 4.110 1.00 10.00 H new ATOM 0 HA ALA A 46 1.827 3.782 6.500 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -0.202 5.192 6.659 1.00 10.00 H new ATOM 0 HB2 ALA A 46 1.215 6.122 6.117 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -0.023 5.622 4.941 1.00 10.00 H new ATOM 505 N TYR A 47 -0.219 2.825 4.107 1.00 10.00 N ATOM 506 CA TYR A 47 -1.152 1.767 3.750 1.00 10.00 C ATOM 507 C TYR A 47 -0.451 0.408 3.779 1.00 10.00 C ATOM 508 O TYR A 47 -1.032 -0.588 4.216 1.00 10.00 O ATOM 509 CB TYR A 47 -1.772 2.027 2.373 1.00 10.00 C ATOM 510 CG TYR A 47 -2.820 1.006 1.977 1.00 10.00 C ATOM 511 CD1 TYR A 47 -2.497 -0.075 1.163 1.00 10.00 C ATOM 512 CD2 TYR A 47 -4.131 1.121 2.423 1.00 10.00 C ATOM 513 CE1 TYR A 47 -3.450 -1.012 0.812 1.00 10.00 C ATOM 514 CE2 TYR A 47 -5.088 0.188 2.073 1.00 10.00 C ATOM 515 CZ TYR A 47 -4.743 -0.874 1.265 1.00 10.00 C ATOM 516 OH TYR A 47 -5.691 -1.808 0.919 1.00 10.00 O ATOM 0 H TYR A 47 -0.008 3.480 3.354 1.00 10.00 H new ATOM 0 HA TYR A 47 -1.957 1.758 4.485 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -2.223 3.019 2.368 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -0.981 2.033 1.623 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -1.486 -0.184 0.800 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -4.406 1.953 3.054 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -3.182 -1.849 0.185 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -6.102 0.290 2.431 1.00 10.00 H new ATOM 0 HH TYR A 47 -6.544 -1.583 1.347 1.00 10.00 H new ATOM 526 N CYS A 48 0.801 0.374 3.332 1.00 10.00 N ATOM 527 CA CYS A 48 1.574 -0.863 3.330 1.00 10.00 C ATOM 528 C CYS A 48 1.802 -1.352 4.755 1.00 10.00 C ATOM 529 O CYS A 48 1.668 -2.542 5.038 1.00 10.00 O ATOM 530 CB CYS A 48 2.911 -0.661 2.620 1.00 10.00 C ATOM 531 SG CYS A 48 2.752 -0.302 0.859 1.00 10.00 S ATOM 0 H CYS A 48 1.300 1.186 2.968 1.00 10.00 H new ATOM 0 HA CYS A 48 1.006 -1.620 2.789 1.00 10.00 H new ATOM 0 HB2 CYS A 48 3.448 0.157 3.101 1.00 10.00 H new ATOM 0 HB3 CYS A 48 3.518 -1.558 2.745 1.00 10.00 H new ATOM 0 HG CYS A 48 2.321 0.914 0.701 1.00 10.00 H new ATOM 537 N GLU A 49 2.133 -0.423 5.649 1.00 10.00 N ATOM 538 CA GLU A 49 2.359 -0.749 7.055 1.00 10.00 C ATOM 539 C GLU A 49 1.056 -1.222 7.702 1.00 10.00 C ATOM 540 O GLU A 49 1.057 -2.083 8.583 1.00 10.00 O ATOM 541 CB GLU A 49 2.897 0.477 7.808 1.00 10.00 C ATOM 542 CG GLU A 49 4.213 1.020 7.264 1.00 10.00 C ATOM 543 CD GLU A 49 5.422 0.242 7.746 1.00 10.00 C ATOM 544 OE1 GLU A 49 6.438 0.209 7.022 1.00 10.00 O ATOM 545 OE2 GLU A 49 5.366 -0.327 8.856 1.00 10.00 O ATOM 0 H GLU A 49 2.251 0.565 5.424 1.00 10.00 H new ATOM 0 HA GLU A 49 3.097 -1.550 7.110 1.00 10.00 H new ATOM 0 HB2 GLU A 49 2.148 1.268 7.772 1.00 10.00 H new ATOM 0 HB3 GLU A 49 3.032 0.214 8.857 1.00 10.00 H new ATOM 0 HG2 GLU A 49 4.185 0.999 6.175 1.00 10.00 H new ATOM 0 HG3 GLU A 49 4.318 2.064 7.560 1.00 10.00 H new ATOM 552 N ARG A 50 -0.052 -0.652 7.239 1.00 10.00 N ATOM 553 CA ARG A 50 -1.380 -0.986 7.744 1.00 10.00 C ATOM 554 C ARG A 50 -1.776 -2.413 7.359 1.00 10.00 C ATOM 555 O ARG A 50 -2.443 -3.111 8.123 1.00 10.00 O ATOM 556 CB ARG A 50 -2.401 0.003 7.173 1.00 10.00 C ATOM 557 CG ARG A 50 -3.688 0.127 7.977 1.00 10.00 C ATOM 558 CD ARG A 50 -3.626 1.285 8.963 1.00 10.00 C ATOM 559 NE ARG A 50 -3.159 0.868 10.284 1.00 10.00 N ATOM 560 CZ ARG A 50 -3.948 0.771 11.353 1.00 10.00 C ATOM 561 NH1 ARG A 50 -5.256 0.958 11.244 1.00 10.00 N ATOM 562 NH2 ARG A 50 -3.431 0.453 12.531 1.00 10.00 N ATOM 0 H ARG A 50 -0.055 0.054 6.503 1.00 10.00 H new ATOM 0 HA ARG A 50 -1.363 -0.921 8.832 1.00 10.00 H new ATOM 0 HB2 ARG A 50 -1.935 0.986 7.105 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -2.652 -0.301 6.157 1.00 10.00 H new ATOM 0 HG2 ARG A 50 -4.529 0.271 7.298 1.00 10.00 H new ATOM 0 HG3 ARG A 50 -3.871 -0.802 8.517 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -2.962 2.056 8.572 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -4.615 1.733 9.055 1.00 10.00 H new ATOM 0 HE ARG A 50 -2.171 0.638 10.394 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -5.666 1.178 10.336 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -5.852 0.882 12.068 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -2.429 0.283 12.619 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -4.035 0.379 13.350 1.00 10.00 H new ATOM 576 N GLN A 51 -1.366 -2.836 6.168 1.00 10.00 N ATOM 577 CA GLN A 51 -1.681 -4.172 5.676 1.00 10.00 C ATOM 578 C GLN A 51 -0.584 -5.171 6.035 1.00 10.00 C ATOM 579 O GLN A 51 -0.813 -6.381 6.046 1.00 10.00 O ATOM 580 CB GLN A 51 -1.876 -4.144 4.158 1.00 10.00 C ATOM 581 CG GLN A 51 -3.118 -3.385 3.718 1.00 10.00 C ATOM 582 CD GLN A 51 -4.406 -4.098 4.085 1.00 10.00 C ATOM 583 OE1 GLN A 51 -4.460 -5.329 4.132 1.00 10.00 O ATOM 584 NE2 GLN A 51 -5.453 -3.333 4.347 1.00 10.00 N ATOM 0 H GLN A 51 -0.813 -2.271 5.524 1.00 10.00 H new ATOM 0 HA GLN A 51 -2.606 -4.493 6.156 1.00 10.00 H new ATOM 0 HB2 GLN A 51 -1.000 -3.689 3.696 1.00 10.00 H new ATOM 0 HB3 GLN A 51 -1.936 -5.168 3.789 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -3.114 -2.395 4.175 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -3.085 -3.238 2.638 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -5.368 -2.318 4.297 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -6.345 -3.758 4.599 1.00 10.00 H new ATOM 593 N GLY A 52 0.603 -4.659 6.328 1.00 10.00 N ATOM 594 CA GLY A 52 1.719 -5.518 6.673 1.00 10.00 C ATOM 595 C GLY A 52 2.365 -6.116 5.443 1.00 10.00 C ATOM 596 O GLY A 52 2.800 -7.268 5.454 1.00 10.00 O ATOM 0 H GLY A 52 0.814 -3.661 6.333 1.00 10.00 H new ATOM 0 HA2 GLY A 52 2.460 -4.946 7.231 1.00 10.00 H new ATOM 0 HA3 GLY A 52 1.374 -6.318 7.328 1.00 10.00 H new ATOM 600 N LEU A 53 2.428 -5.328 4.380 1.00 10.00 N ATOM 601 CA LEU A 53 3.008 -5.779 3.123 1.00 10.00 C ATOM 602 C LEU A 53 4.087 -4.817 2.651 1.00 10.00 C ATOM 603 O LEU A 53 4.275 -3.744 3.227 1.00 10.00 O ATOM 604 CB LEU A 53 1.924 -5.896 2.047 1.00 10.00 C ATOM 605 CG LEU A 53 0.790 -6.875 2.358 1.00 10.00 C ATOM 606 CD1 LEU A 53 -0.321 -6.745 1.327 1.00 10.00 C ATOM 607 CD2 LEU A 53 1.311 -8.302 2.400 1.00 10.00 C ATOM 0 H LEU A 53 2.083 -4.368 4.363 1.00 10.00 H new ATOM 0 HA LEU A 53 3.456 -6.758 3.292 1.00 10.00 H new ATOM 0 HB2 LEU A 53 1.493 -4.909 1.881 1.00 10.00 H new ATOM 0 HB3 LEU A 53 2.396 -6.199 1.112 1.00 10.00 H new ATOM 0 HG LEU A 53 0.383 -6.629 3.339 1.00 10.00 H new ATOM 0 HD11 LEU A 53 -1.120 -7.448 1.562 1.00 10.00 H new ATOM 0 HD12 LEU A 53 -0.715 -5.729 1.343 1.00 10.00 H new ATOM 0 HD13 LEU A 53 0.075 -6.965 0.336 1.00 10.00 H new ATOM 0 HD21 LEU A 53 0.489 -8.983 2.623 1.00 10.00 H new ATOM 0 HD22 LEU A 53 1.744 -8.560 1.434 1.00 10.00 H new ATOM 0 HD23 LEU A 53 2.074 -8.388 3.174 1.00 10.00 H new ATOM 619 N SER A 54 4.787 -5.208 1.597 1.00 10.00 N ATOM 620 CA SER A 54 5.838 -4.380 1.028 1.00 10.00 C ATOM 621 C SER A 54 5.251 -3.434 -0.011 1.00 10.00 C ATOM 622 O SER A 54 4.313 -3.791 -0.730 1.00 10.00 O ATOM 623 CB SER A 54 6.925 -5.259 0.398 1.00 10.00 C ATOM 624 OG SER A 54 7.868 -4.482 -0.323 1.00 10.00 O ATOM 0 H SER A 54 4.645 -6.097 1.117 1.00 10.00 H new ATOM 0 HA SER A 54 6.291 -3.789 1.824 1.00 10.00 H new ATOM 0 HB2 SER A 54 7.437 -5.822 1.178 1.00 10.00 H new ATOM 0 HB3 SER A 54 6.464 -5.986 -0.270 1.00 10.00 H new ATOM 0 HG SER A 54 8.549 -5.071 -0.711 1.00 10.00 H new ATOM 630 N MET A 55 5.815 -2.236 -0.101 1.00 10.00 N ATOM 631 CA MET A 55 5.347 -1.238 -1.056 1.00 10.00 C ATOM 632 C MET A 55 5.670 -1.672 -2.483 1.00 10.00 C ATOM 633 O MET A 55 5.135 -1.129 -3.450 1.00 10.00 O ATOM 634 CB MET A 55 5.982 0.125 -0.764 1.00 10.00 C ATOM 635 CG MET A 55 5.150 1.299 -1.258 1.00 10.00 C ATOM 636 SD MET A 55 5.945 2.893 -0.970 1.00 10.00 S ATOM 637 CE MET A 55 7.172 2.896 -2.275 1.00 10.00 C ATOM 0 H MET A 55 6.598 -1.931 0.477 1.00 10.00 H new ATOM 0 HA MET A 55 4.266 -1.148 -0.954 1.00 10.00 H new ATOM 0 HB2 MET A 55 6.134 0.224 0.311 1.00 10.00 H new ATOM 0 HB3 MET A 55 6.967 0.166 -1.230 1.00 10.00 H new ATOM 0 HG2 MET A 55 4.961 1.180 -2.325 1.00 10.00 H new ATOM 0 HG3 MET A 55 4.181 1.287 -0.759 1.00 10.00 H new ATOM 0 HE1 MET A 55 7.664 3.868 -2.310 1.00 10.00 H new ATOM 0 HE2 MET A 55 7.913 2.121 -2.079 1.00 10.00 H new ATOM 0 HE3 MET A 55 6.687 2.700 -3.231 1.00 10.00 H new ATOM 647 N ARG A 56 6.541 -2.664 -2.605 1.00 10.00 N ATOM 648 CA ARG A 56 6.938 -3.182 -3.903 1.00 10.00 C ATOM 649 C ARG A 56 6.029 -4.339 -4.324 1.00 10.00 C ATOM 650 O ARG A 56 6.073 -4.795 -5.466 1.00 10.00 O ATOM 651 CB ARG A 56 8.398 -3.642 -3.858 1.00 10.00 C ATOM 652 CG ARG A 56 9.013 -3.879 -5.229 1.00 10.00 C ATOM 653 CD ARG A 56 10.499 -4.165 -5.120 1.00 10.00 C ATOM 654 NE ARG A 56 11.095 -4.504 -6.410 1.00 10.00 N ATOM 655 CZ ARG A 56 11.679 -3.620 -7.219 1.00 10.00 C ATOM 656 NH1 ARG A 56 11.688 -2.327 -6.908 1.00 10.00 N ATOM 657 NH2 ARG A 56 12.238 -4.029 -8.351 1.00 10.00 N ATOM 0 H ARG A 56 6.988 -3.128 -1.814 1.00 10.00 H new ATOM 0 HA ARG A 56 6.840 -2.385 -4.640 1.00 10.00 H new ATOM 0 HB2 ARG A 56 8.988 -2.893 -3.331 1.00 10.00 H new ATOM 0 HB3 ARG A 56 8.461 -4.563 -3.279 1.00 10.00 H new ATOM 0 HG2 ARG A 56 8.513 -4.717 -5.715 1.00 10.00 H new ATOM 0 HG3 ARG A 56 8.853 -3.004 -5.859 1.00 10.00 H new ATOM 0 HD2 ARG A 56 11.005 -3.293 -4.707 1.00 10.00 H new ATOM 0 HD3 ARG A 56 10.658 -4.987 -4.422 1.00 10.00 H new ATOM 0 HE ARG A 56 11.062 -5.478 -6.710 1.00 10.00 H new ATOM 0 HH11 ARG A 56 11.246 -2.007 -6.046 1.00 10.00 H new ATOM 0 HH12 ARG A 56 12.137 -1.656 -7.531 1.00 10.00 H new ATOM 0 HH21 ARG A 56 12.220 -5.018 -8.600 1.00 10.00 H new ATOM 0 HH22 ARG A 56 12.685 -3.354 -8.972 1.00 10.00 H new ATOM 671 N GLN A 57 5.188 -4.792 -3.402 1.00 10.00 N ATOM 672 CA GLN A 57 4.277 -5.900 -3.674 1.00 10.00 C ATOM 673 C GLN A 57 2.957 -5.395 -4.256 1.00 10.00 C ATOM 674 O GLN A 57 2.252 -6.126 -4.955 1.00 10.00 O ATOM 675 CB GLN A 57 4.010 -6.699 -2.394 1.00 10.00 C ATOM 676 CG GLN A 57 3.193 -7.961 -2.621 1.00 10.00 C ATOM 677 CD GLN A 57 2.702 -8.590 -1.331 1.00 10.00 C ATOM 678 OE1 GLN A 57 3.363 -8.514 -0.293 1.00 10.00 O ATOM 679 NE2 GLN A 57 1.533 -9.208 -1.389 1.00 10.00 N ATOM 0 H GLN A 57 5.117 -4.410 -2.459 1.00 10.00 H new ATOM 0 HA GLN A 57 4.751 -6.551 -4.408 1.00 10.00 H new ATOM 0 HB2 GLN A 57 4.963 -6.970 -1.940 1.00 10.00 H new ATOM 0 HB3 GLN A 57 3.487 -6.062 -1.681 1.00 10.00 H new ATOM 0 HG2 GLN A 57 2.336 -7.724 -3.252 1.00 10.00 H new ATOM 0 HG3 GLN A 57 3.798 -8.686 -3.165 1.00 10.00 H new ATOM 0 HE21 GLN A 57 1.020 -9.247 -2.270 1.00 10.00 H new ATOM 0 HE22 GLN A 57 1.145 -9.646 -0.553 1.00 10.00 H new ATOM 688 N ILE A 58 2.625 -4.145 -3.975 1.00 10.00 N ATOM 689 CA ILE A 58 1.384 -3.562 -4.470 1.00 10.00 C ATOM 690 C ILE A 58 1.655 -2.359 -5.367 1.00 10.00 C ATOM 691 O ILE A 58 2.788 -1.890 -5.467 1.00 10.00 O ATOM 692 CB ILE A 58 0.450 -3.140 -3.316 1.00 10.00 C ATOM 693 CG1 ILE A 58 1.232 -2.400 -2.225 1.00 10.00 C ATOM 694 CG2 ILE A 58 -0.258 -4.359 -2.739 1.00 10.00 C ATOM 695 CD1 ILE A 58 0.382 -1.983 -1.045 1.00 10.00 C ATOM 0 H ILE A 58 3.194 -3.515 -3.409 1.00 10.00 H new ATOM 0 HA ILE A 58 0.888 -4.337 -5.054 1.00 10.00 H new ATOM 0 HB ILE A 58 -0.302 -2.457 -3.712 1.00 10.00 H new ATOM 0 HG12 ILE A 58 2.040 -3.041 -1.871 1.00 10.00 H new ATOM 0 HG13 ILE A 58 1.695 -1.514 -2.659 1.00 10.00 H new ATOM 0 HG21 ILE A 58 -0.914 -4.048 -1.926 1.00 10.00 H new ATOM 0 HG22 ILE A 58 -0.849 -4.839 -3.519 1.00 10.00 H new ATOM 0 HG23 ILE A 58 0.482 -5.064 -2.359 1.00 10.00 H new ATOM 0 HD11 ILE A 58 1.003 -1.465 -0.314 1.00 10.00 H new ATOM 0 HD12 ILE A 58 -0.410 -1.316 -1.385 1.00 10.00 H new ATOM 0 HD13 ILE A 58 -0.060 -2.867 -0.585 1.00 10.00 H new ATOM 707 N ARG A 59 0.610 -1.887 -6.037 1.00 10.00 N ATOM 708 CA ARG A 59 0.704 -0.740 -6.928 1.00 10.00 C ATOM 709 C ARG A 59 -0.470 0.201 -6.680 1.00 10.00 C ATOM 710 O ARG A 59 -1.619 -0.237 -6.608 1.00 10.00 O ATOM 711 CB ARG A 59 0.694 -1.183 -8.396 1.00 10.00 C ATOM 712 CG ARG A 59 1.856 -2.084 -8.784 1.00 10.00 C ATOM 713 CD ARG A 59 3.192 -1.359 -8.681 1.00 10.00 C ATOM 714 NE ARG A 59 4.293 -2.188 -9.168 1.00 10.00 N ATOM 715 CZ ARG A 59 5.024 -2.989 -8.396 1.00 10.00 C ATOM 716 NH1 ARG A 59 4.795 -3.059 -7.094 1.00 10.00 N ATOM 717 NH2 ARG A 59 5.988 -3.722 -8.937 1.00 10.00 N ATOM 0 H ARG A 59 -0.325 -2.290 -5.977 1.00 10.00 H new ATOM 0 HA ARG A 59 1.643 -0.226 -6.724 1.00 10.00 H new ATOM 0 HB2 ARG A 59 -0.240 -1.706 -8.599 1.00 10.00 H new ATOM 0 HB3 ARG A 59 0.708 -0.297 -9.031 1.00 10.00 H new ATOM 0 HG2 ARG A 59 1.868 -2.961 -8.137 1.00 10.00 H new ATOM 0 HG3 ARG A 59 1.714 -2.442 -9.804 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.150 -0.434 -9.256 1.00 10.00 H new ATOM 0 HD3 ARG A 59 3.377 -1.081 -7.643 1.00 10.00 H new ATOM 0 HE ARG A 59 4.515 -2.150 -10.163 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.054 -2.497 -6.676 1.00 10.00 H new ATOM 0 HH12 ARG A 59 5.360 -3.675 -6.509 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.166 -3.670 -9.940 1.00 10.00 H new ATOM 0 HH22 ARG A 59 6.551 -4.337 -8.350 1.00 10.00 H new ATOM 731 N PHE A 60 -0.179 1.484 -6.542 1.00 10.00 N ATOM 732 CA PHE A 60 -1.215 2.478 -6.308 1.00 10.00 C ATOM 733 C PHE A 60 -1.505 3.241 -7.594 1.00 10.00 C ATOM 734 O PHE A 60 -0.594 3.797 -8.214 1.00 10.00 O ATOM 735 CB PHE A 60 -0.790 3.454 -5.207 1.00 10.00 C ATOM 736 CG PHE A 60 -0.696 2.832 -3.842 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.353 1.986 -3.517 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.657 3.098 -2.884 1.00 10.00 C ATOM 739 CE1 PHE A 60 0.442 1.420 -2.261 1.00 10.00 C ATOM 740 CE2 PHE A 60 -1.574 2.536 -1.625 1.00 10.00 C ATOM 741 CZ PHE A 60 -0.524 1.694 -1.314 1.00 10.00 C ATOM 0 H PHE A 60 0.767 1.863 -6.588 1.00 10.00 H new ATOM 0 HA PHE A 60 -2.120 1.963 -5.984 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.178 3.881 -5.468 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.502 4.278 -5.171 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.110 1.767 -4.256 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -2.482 3.753 -3.123 1.00 10.00 H new ATOM 0 HE1 PHE A 60 1.266 0.764 -2.020 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -2.329 2.755 -0.885 1.00 10.00 H new ATOM 0 HZ PHE A 60 -0.459 1.251 -0.331 1.00 10.00 H new ATOM 751 N ARG A 61 -2.764 3.261 -7.997 1.00 10.00 N ATOM 752 CA ARG A 61 -3.156 3.955 -9.215 1.00 10.00 C ATOM 753 C ARG A 61 -4.248 4.974 -8.934 1.00 10.00 C ATOM 754 O ARG A 61 -5.224 4.687 -8.237 1.00 10.00 O ATOM 755 CB ARG A 61 -3.625 2.963 -10.282 1.00 10.00 C ATOM 756 CG ARG A 61 -2.495 2.159 -10.906 1.00 10.00 C ATOM 757 CD ARG A 61 -2.776 1.830 -12.365 1.00 10.00 C ATOM 758 NE ARG A 61 -3.781 0.776 -12.513 1.00 10.00 N ATOM 759 CZ ARG A 61 -4.731 0.772 -13.450 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.809 1.761 -14.337 1.00 10.00 N ATOM 761 NH2 ARG A 61 -5.596 -0.232 -13.510 1.00 10.00 N ATOM 0 H ARG A 61 -3.531 2.807 -7.502 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.279 4.482 -9.591 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.345 2.276 -9.836 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.149 3.508 -11.068 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.565 2.722 -10.833 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.353 1.235 -10.345 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -3.117 2.729 -12.879 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -1.851 1.518 -12.849 1.00 10.00 H new ATOM 0 HE ARG A 61 -3.753 -0.005 -11.858 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.139 2.530 -14.304 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -5.538 1.750 -15.050 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -5.534 -0.999 -12.841 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -6.323 -0.237 -14.226 1.00 10.00 H new ATOM 775 N PHE A 62 -4.066 6.166 -9.479 1.00 10.00 N ATOM 776 CA PHE A 62 -5.021 7.245 -9.313 1.00 10.00 C ATOM 777 C PHE A 62 -5.535 7.692 -10.672 1.00 10.00 C ATOM 778 O PHE A 62 -4.758 8.113 -11.532 1.00 10.00 O ATOM 779 CB PHE A 62 -4.384 8.424 -8.571 1.00 10.00 C ATOM 780 CG PHE A 62 -5.254 9.648 -8.528 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.395 9.677 -7.743 1.00 10.00 C ATOM 782 CD2 PHE A 62 -4.934 10.768 -9.281 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.200 10.798 -7.707 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.733 11.893 -9.249 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.867 11.908 -8.464 1.00 10.00 C ATOM 0 H PHE A 62 -3.255 6.410 -10.047 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.858 6.881 -8.717 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.151 8.118 -7.551 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.439 8.677 -9.051 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.658 8.812 -7.152 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.049 10.760 -9.900 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.087 10.809 -7.090 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.471 12.760 -9.837 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.495 12.786 -8.440 1.00 10.00 H new ATOM 795 N ASP A 63 -6.843 7.557 -10.863 1.00 10.00 N ATOM 796 CA ASP A 63 -7.512 7.945 -12.107 1.00 10.00 C ATOM 797 C ASP A 63 -6.951 7.182 -13.308 1.00 10.00 C ATOM 798 O ASP A 63 -7.062 7.621 -14.455 1.00 10.00 O ATOM 799 CB ASP A 63 -7.398 9.454 -12.334 1.00 10.00 C ATOM 800 CG ASP A 63 -8.522 9.992 -13.195 1.00 10.00 C ATOM 801 OD1 ASP A 63 -9.686 9.612 -12.965 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.246 10.803 -14.105 1.00 10.00 O ATOM 0 H ASP A 63 -7.474 7.174 -10.159 1.00 10.00 H new ATOM 0 HA ASP A 63 -8.566 7.684 -12.008 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -7.404 9.965 -11.371 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -6.442 9.677 -12.808 1.00 10.00 H new ATOM 807 N GLY A 64 -6.342 6.036 -13.036 1.00 10.00 N ATOM 808 CA GLY A 64 -5.786 5.218 -14.093 1.00 10.00 C ATOM 809 C GLY A 64 -4.273 5.250 -14.137 1.00 10.00 C ATOM 810 O GLY A 64 -3.637 4.250 -14.471 1.00 10.00 O ATOM 0 H GLY A 64 -6.223 5.657 -12.096 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.118 4.188 -13.960 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -6.178 5.558 -15.051 1.00 10.00 H new ATOM 814 N GLN A 65 -3.688 6.384 -13.783 1.00 10.00 N ATOM 815 CA GLN A 65 -2.239 6.525 -13.809 1.00 10.00 C ATOM 816 C GLN A 65 -1.618 6.134 -12.471 1.00 10.00 C ATOM 817 O GLN A 65 -2.166 6.443 -11.412 1.00 10.00 O ATOM 818 CB GLN A 65 -1.846 7.956 -14.179 1.00 10.00 C ATOM 819 CG GLN A 65 -1.845 8.215 -15.678 1.00 10.00 C ATOM 820 CD GLN A 65 -1.017 7.200 -16.441 1.00 10.00 C ATOM 821 OE1 GLN A 65 -1.526 6.173 -16.894 1.00 10.00 O ATOM 822 NE2 GLN A 65 0.271 7.473 -16.589 1.00 10.00 N ATOM 0 H GLN A 65 -4.191 7.217 -13.476 1.00 10.00 H new ATOM 0 HA GLN A 65 -1.853 5.846 -14.570 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.536 8.650 -13.699 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -0.853 8.167 -13.781 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -2.870 8.195 -16.048 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -1.456 9.215 -15.871 1.00 10.00 H new ATOM 0 HE21 GLN A 65 0.658 8.333 -16.200 1.00 10.00 H new ATOM 0 HE22 GLN A 65 0.876 6.823 -17.091 1.00 10.00 H new ATOM 831 N PRO A 66 -0.478 5.424 -12.499 1.00 10.00 N ATOM 832 CA PRO A 66 0.223 5.006 -11.282 1.00 10.00 C ATOM 833 C PRO A 66 0.803 6.195 -10.523 1.00 10.00 C ATOM 834 O PRO A 66 1.248 7.175 -11.125 1.00 10.00 O ATOM 835 CB PRO A 66 1.354 4.104 -11.792 1.00 10.00 C ATOM 836 CG PRO A 66 1.007 3.787 -13.204 1.00 10.00 C ATOM 837 CD PRO A 66 0.217 4.955 -13.710 1.00 10.00 C ATOM 0 HA PRO A 66 -0.448 4.506 -10.584 1.00 10.00 H new ATOM 0 HB2 PRO A 66 2.317 4.610 -11.729 1.00 10.00 H new ATOM 0 HB3 PRO A 66 1.431 3.196 -11.194 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.906 3.636 -13.802 1.00 10.00 H new ATOM 0 HG3 PRO A 66 0.425 2.867 -13.265 1.00 10.00 H new ATOM 0 HD2 PRO A 66 0.861 5.727 -14.132 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.484 4.662 -14.491 1.00 10.00 H new ATOM 845 N ILE A 67 0.793 6.098 -9.203 1.00 10.00 N ATOM 846 CA ILE A 67 1.311 7.156 -8.352 1.00 10.00 C ATOM 847 C ILE A 67 2.816 6.997 -8.149 1.00 10.00 C ATOM 848 O ILE A 67 3.303 5.897 -7.869 1.00 10.00 O ATOM 849 CB ILE A 67 0.599 7.155 -6.981 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.898 7.419 -7.164 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.219 8.186 -6.049 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.688 7.390 -5.872 1.00 10.00 C ATOM 0 H ILE A 67 0.429 5.291 -8.696 1.00 10.00 H new ATOM 0 HA ILE A 67 1.119 8.107 -8.849 1.00 10.00 H new ATOM 0 HB ILE A 67 0.725 6.173 -6.525 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.030 8.392 -7.638 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.308 6.674 -7.846 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.702 8.167 -5.090 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.273 7.952 -5.897 1.00 10.00 H new ATOM 0 HG23 ILE A 67 1.127 9.178 -6.491 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.739 7.586 -6.084 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.588 6.410 -5.406 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.306 8.154 -5.195 1.00 10.00 H new ATOM 864 N ASN A 68 3.552 8.089 -8.317 1.00 10.00 N ATOM 865 CA ASN A 68 4.997 8.065 -8.145 1.00 10.00 C ATOM 866 C ASN A 68 5.367 8.478 -6.729 1.00 10.00 C ATOM 867 O ASN A 68 4.567 9.081 -6.015 1.00 10.00 O ATOM 868 CB ASN A 68 5.684 8.999 -9.145 1.00 10.00 C ATOM 869 CG ASN A 68 5.382 8.642 -10.585 1.00 10.00 C ATOM 870 OD1 ASN A 68 6.029 7.777 -11.173 1.00 10.00 O ATOM 871 ND2 ASN A 68 4.400 9.313 -11.163 1.00 10.00 N ATOM 0 H ASN A 68 3.171 9.000 -8.572 1.00 10.00 H new ATOM 0 HA ASN A 68 5.338 7.046 -8.326 1.00 10.00 H new ATOM 0 HB2 ASN A 68 5.366 10.024 -8.955 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.762 8.965 -8.985 1.00 10.00 H new ATOM 0 HD21 ASN A 68 4.153 9.121 -12.134 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.889 10.023 -10.638 1.00 10.00 H new ATOM 878 N GLU A 69 6.595 8.172 -6.336 1.00 10.00 N ATOM 879 CA GLU A 69 7.080 8.511 -5.003 1.00 10.00 C ATOM 880 C GLU A 69 7.470 9.983 -4.935 1.00 10.00 C ATOM 881 O GLU A 69 7.889 10.478 -3.889 1.00 10.00 O ATOM 882 CB GLU A 69 8.275 7.629 -4.642 1.00 10.00 C ATOM 883 CG GLU A 69 7.977 6.145 -4.752 1.00 10.00 C ATOM 884 CD GLU A 69 9.230 5.297 -4.802 1.00 10.00 C ATOM 885 OE1 GLU A 69 9.767 4.961 -3.732 1.00 10.00 O ATOM 886 OE2 GLU A 69 9.677 4.964 -5.920 1.00 10.00 O ATOM 0 H GLU A 69 7.276 7.689 -6.922 1.00 10.00 H new ATOM 0 HA GLU A 69 6.280 8.334 -4.284 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.111 7.875 -5.297 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.591 7.855 -3.624 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.369 5.837 -3.901 1.00 10.00 H new ATOM 0 HG3 GLU A 69 7.385 5.963 -5.649 1.00 10.00 H new ATOM 893 N THR A 70 7.327 10.672 -6.056 1.00 10.00 N ATOM 894 CA THR A 70 7.657 12.084 -6.145 1.00 10.00 C ATOM 895 C THR A 70 6.418 12.917 -6.472 1.00 10.00 C ATOM 896 O THR A 70 6.522 14.071 -6.893 1.00 10.00 O ATOM 897 CB THR A 70 8.726 12.310 -7.229 1.00 10.00 C ATOM 898 OG1 THR A 70 9.097 11.051 -7.809 1.00 10.00 O ATOM 899 CG2 THR A 70 9.955 12.984 -6.646 1.00 10.00 C ATOM 0 H THR A 70 6.980 10.269 -6.927 1.00 10.00 H new ATOM 0 HA THR A 70 8.045 12.400 -5.177 1.00 10.00 H new ATOM 0 HB THR A 70 8.307 12.961 -7.996 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.776 11.197 -8.500 1.00 10.00 H new ATOM 0 HG21 THR A 70 10.696 13.133 -7.432 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.675 13.949 -6.224 1.00 10.00 H new ATOM 0 HG23 THR A 70 10.378 12.355 -5.863 1.00 10.00 H new ATOM 907 N ASP A 71 5.244 12.326 -6.269 1.00 10.00 N ATOM 908 CA ASP A 71 3.984 13.006 -6.551 1.00 10.00 C ATOM 909 C ASP A 71 3.322 13.480 -5.264 1.00 10.00 C ATOM 910 O ASP A 71 3.535 12.908 -4.192 1.00 10.00 O ATOM 911 CB ASP A 71 3.019 12.075 -7.298 1.00 10.00 C ATOM 912 CG ASP A 71 3.281 12.009 -8.792 1.00 10.00 C ATOM 913 OD1 ASP A 71 3.650 13.043 -9.387 1.00 10.00 O ATOM 914 OD2 ASP A 71 3.106 10.918 -9.381 1.00 10.00 O ATOM 0 H ASP A 71 5.139 11.377 -5.910 1.00 10.00 H new ATOM 0 HA ASP A 71 4.211 13.869 -7.177 1.00 10.00 H new ATOM 0 HB2 ASP A 71 3.096 11.072 -6.878 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.996 12.413 -7.130 1.00 10.00 H new ATOM 919 N THR A 72 2.523 14.528 -5.378 1.00 10.00 N ATOM 920 CA THR A 72 1.802 15.085 -4.244 1.00 10.00 C ATOM 921 C THR A 72 0.340 15.304 -4.629 1.00 10.00 C ATOM 922 O THR A 72 0.026 15.388 -5.819 1.00 10.00 O ATOM 923 CB THR A 72 2.419 16.426 -3.778 1.00 10.00 C ATOM 924 OG1 THR A 72 2.756 17.232 -4.910 1.00 10.00 O ATOM 925 CG2 THR A 72 3.662 16.201 -2.934 1.00 10.00 C ATOM 0 H THR A 72 2.356 15.016 -6.258 1.00 10.00 H new ATOM 0 HA THR A 72 1.873 14.377 -3.418 1.00 10.00 H new ATOM 0 HB THR A 72 1.675 16.938 -3.168 1.00 10.00 H new ATOM 0 HG1 THR A 72 3.144 18.079 -4.605 1.00 10.00 H new ATOM 0 HG21 THR A 72 4.070 17.163 -2.623 1.00 10.00 H new ATOM 0 HG22 THR A 72 3.402 15.615 -2.052 1.00 10.00 H new ATOM 0 HG23 THR A 72 4.407 15.663 -3.520 1.00 10.00 H new ATOM 933 N PRO A 73 -0.577 15.394 -3.647 1.00 10.00 N ATOM 934 CA PRO A 73 -2.003 15.611 -3.920 1.00 10.00 C ATOM 935 C PRO A 73 -2.230 16.871 -4.750 1.00 10.00 C ATOM 936 O PRO A 73 -3.056 16.890 -5.664 1.00 10.00 O ATOM 937 CB PRO A 73 -2.623 15.765 -2.528 1.00 10.00 C ATOM 938 CG PRO A 73 -1.671 15.091 -1.605 1.00 10.00 C ATOM 939 CD PRO A 73 -0.306 15.279 -2.200 1.00 10.00 C ATOM 0 HA PRO A 73 -2.440 14.796 -4.497 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -2.749 16.816 -2.266 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -3.610 15.304 -2.482 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.724 15.525 -0.607 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -1.910 14.032 -1.505 1.00 10.00 H new ATOM 0 HD2 PRO A 73 0.183 16.172 -1.810 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.348 14.436 -1.979 1.00 10.00 H new ATOM 947 N ALA A 74 -1.479 17.918 -4.433 1.00 10.00 N ATOM 948 CA ALA A 74 -1.580 19.182 -5.148 1.00 10.00 C ATOM 949 C ALA A 74 -1.015 19.060 -6.559 1.00 10.00 C ATOM 950 O ALA A 74 -1.547 19.640 -7.504 1.00 10.00 O ATOM 951 CB ALA A 74 -0.854 20.275 -4.380 1.00 10.00 C ATOM 0 H ALA A 74 -0.790 17.915 -3.681 1.00 10.00 H new ATOM 0 HA ALA A 74 -2.634 19.446 -5.230 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -0.935 21.217 -4.923 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -1.303 20.385 -3.393 1.00 10.00 H new ATOM 0 HB3 ALA A 74 0.197 20.008 -4.273 1.00 10.00 H new ATOM 957 N GLN A 75 0.060 18.289 -6.693 1.00 10.00 N ATOM 958 CA GLN A 75 0.713 18.083 -7.983 1.00 10.00 C ATOM 959 C GLN A 75 -0.224 17.381 -8.963 1.00 10.00 C ATOM 960 O GLN A 75 -0.243 17.696 -10.154 1.00 10.00 O ATOM 961 CB GLN A 75 1.990 17.258 -7.794 1.00 10.00 C ATOM 962 CG GLN A 75 2.735 16.948 -9.082 1.00 10.00 C ATOM 963 CD GLN A 75 3.282 18.188 -9.758 1.00 10.00 C ATOM 964 OE1 GLN A 75 3.589 19.186 -9.102 1.00 10.00 O ATOM 965 NE2 GLN A 75 3.418 18.130 -11.072 1.00 10.00 N ATOM 0 H GLN A 75 0.500 17.793 -5.918 1.00 10.00 H new ATOM 0 HA GLN A 75 0.971 19.057 -8.398 1.00 10.00 H new ATOM 0 HB2 GLN A 75 2.659 17.796 -7.122 1.00 10.00 H new ATOM 0 HB3 GLN A 75 1.732 16.320 -7.303 1.00 10.00 H new ATOM 0 HG2 GLN A 75 3.557 16.266 -8.865 1.00 10.00 H new ATOM 0 HG3 GLN A 75 2.064 16.432 -9.769 1.00 10.00 H new ATOM 0 HE21 GLN A 75 3.151 17.284 -11.575 1.00 10.00 H new ATOM 0 HE22 GLN A 75 3.790 18.931 -11.582 1.00 10.00 H new ATOM 974 N LEU A 76 -0.996 16.427 -8.453 1.00 10.00 N ATOM 975 CA LEU A 76 -1.931 15.676 -9.281 1.00 10.00 C ATOM 976 C LEU A 76 -3.290 16.365 -9.346 1.00 10.00 C ATOM 977 O LEU A 76 -4.213 15.862 -9.991 1.00 10.00 O ATOM 978 CB LEU A 76 -2.103 14.250 -8.744 1.00 10.00 C ATOM 979 CG LEU A 76 -0.872 13.345 -8.859 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.231 11.915 -8.482 1.00 10.00 C ATOM 981 CD2 LEU A 76 -0.294 13.393 -10.266 1.00 10.00 C ATOM 0 H LEU A 76 -0.992 16.156 -7.470 1.00 10.00 H new ATOM 0 HA LEU A 76 -1.515 15.633 -10.288 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -2.391 14.309 -7.695 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -2.929 13.778 -9.276 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.113 13.710 -8.167 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.347 11.283 -8.568 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.596 11.890 -7.455 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.007 11.546 -9.152 1.00 10.00 H new ATOM 0 HD21 LEU A 76 0.579 12.743 -10.323 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -1.045 13.055 -10.980 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -0.001 14.415 -10.504 1.00 10.00 H new ATOM 993 N GLU A 77 -3.408 17.514 -8.679 1.00 10.00 N ATOM 994 CA GLU A 77 -4.655 18.280 -8.658 1.00 10.00 C ATOM 995 C GLU A 77 -5.798 17.455 -8.072 1.00 10.00 C ATOM 996 O GLU A 77 -6.904 17.415 -8.618 1.00 10.00 O ATOM 997 CB GLU A 77 -5.007 18.759 -10.067 1.00 10.00 C ATOM 998 CG GLU A 77 -4.202 19.963 -10.510 1.00 10.00 C ATOM 999 CD GLU A 77 -4.724 21.247 -9.912 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -4.372 21.559 -8.758 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -5.495 21.951 -10.596 1.00 10.00 O ATOM 0 H GLU A 77 -2.650 17.937 -8.143 1.00 10.00 H new ATOM 0 HA GLU A 77 -4.508 19.150 -8.018 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -4.845 17.943 -10.771 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -6.068 19.006 -10.105 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -3.159 19.827 -10.222 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -4.226 20.034 -11.597 1.00 10.00 H new ATOM 1008 N MET A 78 -5.524 16.806 -6.954 1.00 10.00 N ATOM 1009 CA MET A 78 -6.516 15.981 -6.280 1.00 10.00 C ATOM 1010 C MET A 78 -7.336 16.833 -5.323 1.00 10.00 C ATOM 1011 O MET A 78 -6.849 17.840 -4.808 1.00 10.00 O ATOM 1012 CB MET A 78 -5.831 14.849 -5.515 1.00 10.00 C ATOM 1013 CG MET A 78 -4.929 13.993 -6.385 1.00 10.00 C ATOM 1014 SD MET A 78 -3.929 12.835 -5.433 1.00 10.00 S ATOM 1015 CE MET A 78 -5.209 11.843 -4.669 1.00 10.00 C ATOM 0 H MET A 78 -4.616 16.834 -6.490 1.00 10.00 H new ATOM 0 HA MET A 78 -7.179 15.547 -7.029 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.242 15.274 -4.702 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.592 14.215 -5.060 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.540 13.438 -7.097 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.272 14.640 -6.966 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.278 12.091 -3.610 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.165 12.047 -5.152 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.965 10.786 -4.779 1.00 10.00 H new ATOM 1025 N GLU A 79 -8.572 16.432 -5.085 1.00 10.00 N ATOM 1026 CA GLU A 79 -9.446 17.173 -4.194 1.00 10.00 C ATOM 1027 C GLU A 79 -9.921 16.302 -3.041 1.00 10.00 C ATOM 1028 O GLU A 79 -9.524 15.142 -2.916 1.00 10.00 O ATOM 1029 CB GLU A 79 -10.647 17.730 -4.960 1.00 10.00 C ATOM 1030 CG GLU A 79 -10.625 19.243 -5.101 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.377 19.946 -3.781 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -9.590 20.916 -3.760 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.959 19.529 -2.758 1.00 10.00 O ATOM 0 H GLU A 79 -8.993 15.598 -5.496 1.00 10.00 H new ATOM 0 HA GLU A 79 -8.873 18.004 -3.782 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -10.675 17.281 -5.953 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -11.563 17.434 -4.449 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -9.849 19.527 -5.812 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -11.575 19.580 -5.515 1.00 10.00 H new ATOM 1040 N ASP A 80 -10.761 16.876 -2.195 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.303 16.168 -1.044 1.00 10.00 C ATOM 1042 C ASP A 80 -12.234 15.055 -1.502 1.00 10.00 C ATOM 1043 O ASP A 80 -12.910 15.188 -2.529 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.058 17.142 -0.138 1.00 10.00 C ATOM 1045 CG ASP A 80 -11.984 16.762 1.325 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -10.915 16.946 1.935 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -13.001 16.313 1.885 1.00 10.00 O ATOM 0 H ASP A 80 -11.085 17.839 -2.284 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.479 15.728 -0.483 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.649 18.144 -0.269 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.103 17.181 -0.446 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.237 13.955 -0.752 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.076 12.791 -1.042 1.00 10.00 C ATOM 1054 C GLU A 81 -12.570 12.018 -2.262 1.00 10.00 C ATOM 1055 O GLU A 81 -13.223 11.078 -2.719 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.541 13.201 -1.236 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.224 13.648 0.046 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.550 12.486 0.956 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -16.662 11.930 0.840 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -14.700 12.110 1.785 1.00 10.00 O ATOM 0 H GLU A 81 -11.655 13.844 0.078 1.00 10.00 H new ATOM 0 HA GLU A 81 -13.015 12.128 -0.179 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.589 14.010 -1.964 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.092 12.360 -1.657 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.578 14.350 0.574 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -16.141 14.182 -0.201 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.406 12.405 -2.781 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.829 11.717 -3.934 1.00 10.00 C ATOM 1069 C ASP A 82 -10.464 10.293 -3.537 1.00 10.00 C ATOM 1070 O ASP A 82 -10.006 10.056 -2.415 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.603 12.459 -4.469 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.777 12.883 -5.916 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.064 12.011 -6.760 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.633 14.092 -6.216 1.00 10.00 O ATOM 0 H ASP A 82 -10.849 13.182 -2.426 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.568 11.693 -4.735 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.416 13.339 -3.854 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.726 11.818 -4.383 1.00 10.00 H new ATOM 1079 N THR A 83 -10.660 9.349 -4.445 1.00 10.00 N ATOM 1080 CA THR A 83 -10.393 7.951 -4.145 1.00 10.00 C ATOM 1081 C THR A 83 -9.244 7.369 -4.971 1.00 10.00 C ATOM 1082 O THR A 83 -9.140 7.595 -6.178 1.00 10.00 O ATOM 1083 CB THR A 83 -11.661 7.102 -4.366 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.787 7.747 -3.753 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.496 5.706 -3.783 1.00 10.00 C ATOM 0 H THR A 83 -11.001 9.524 -5.390 1.00 10.00 H new ATOM 0 HA THR A 83 -10.093 7.916 -3.098 1.00 10.00 H new ATOM 0 HB THR A 83 -11.826 7.009 -5.439 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.592 7.206 -3.896 1.00 10.00 H new ATOM 0 HG21 THR A 83 -12.406 5.130 -3.954 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.655 5.207 -4.265 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.309 5.779 -2.712 1.00 10.00 H new ATOM 1093 N ILE A 84 -8.383 6.620 -4.288 1.00 10.00 N ATOM 1094 CA ILE A 84 -7.246 5.958 -4.913 1.00 10.00 C ATOM 1095 C ILE A 84 -7.460 4.446 -4.867 1.00 10.00 C ATOM 1096 O ILE A 84 -7.995 3.930 -3.885 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.924 6.304 -4.189 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.739 7.821 -4.115 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.737 5.653 -4.889 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.575 8.245 -3.244 1.00 10.00 C ATOM 0 H ILE A 84 -8.456 6.456 -3.284 1.00 10.00 H new ATOM 0 HA ILE A 84 -7.173 6.304 -5.944 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.976 5.911 -3.174 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.590 8.211 -5.122 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.654 8.272 -3.731 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.818 5.910 -4.362 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.864 4.570 -4.890 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -4.679 6.012 -5.917 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.503 9.333 -3.237 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.732 7.885 -2.227 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.651 7.823 -3.640 1.00 10.00 H new ATOM 1112 N ASP A 85 -7.056 3.742 -5.916 1.00 10.00 N ATOM 1113 CA ASP A 85 -7.227 2.293 -5.968 1.00 10.00 C ATOM 1114 C ASP A 85 -5.898 1.579 -5.749 1.00 10.00 C ATOM 1115 O ASP A 85 -4.842 2.062 -6.173 1.00 10.00 O ATOM 1116 CB ASP A 85 -7.823 1.874 -7.310 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.842 0.759 -7.170 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.643 -0.145 -6.332 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -9.855 0.788 -7.901 1.00 10.00 O ATOM 0 H ASP A 85 -6.610 4.146 -6.739 1.00 10.00 H new ATOM 0 HA ASP A 85 -7.911 2.008 -5.169 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -8.295 2.737 -7.779 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -7.022 1.549 -7.974 1.00 10.00 H new ATOM 1124 N VAL A 86 -5.949 0.429 -5.086 1.00 10.00 N ATOM 1125 CA VAL A 86 -4.752 -0.350 -4.805 1.00 10.00 C ATOM 1126 C VAL A 86 -4.829 -1.720 -5.463 1.00 10.00 C ATOM 1127 O VAL A 86 -5.764 -2.486 -5.223 1.00 10.00 O ATOM 1128 CB VAL A 86 -4.531 -0.544 -3.289 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -3.166 -1.162 -3.021 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -4.674 0.771 -2.548 1.00 10.00 C ATOM 0 H VAL A 86 -6.812 0.015 -4.732 1.00 10.00 H new ATOM 0 HA VAL A 86 -3.914 0.214 -5.214 1.00 10.00 H new ATOM 0 HB VAL A 86 -5.297 -1.226 -2.921 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -3.029 -1.291 -1.947 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -3.103 -2.132 -3.514 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -2.387 -0.506 -3.410 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -4.514 0.607 -1.482 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.936 1.481 -2.921 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -5.675 1.171 -2.707 1.00 10.00 H new ATOM 1140 N PHE A 87 -3.837 -2.022 -6.285 1.00 10.00 N ATOM 1141 CA PHE A 87 -3.773 -3.300 -6.978 1.00 10.00 C ATOM 1142 C PHE A 87 -2.525 -4.060 -6.549 1.00 10.00 C ATOM 1143 O PHE A 87 -1.561 -3.458 -6.083 1.00 10.00 O ATOM 1144 CB PHE A 87 -3.750 -3.085 -8.493 1.00 10.00 C ATOM 1145 CG PHE A 87 -4.935 -2.320 -9.015 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -6.157 -2.947 -9.193 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.821 -0.977 -9.338 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -7.245 -2.246 -9.676 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.905 -0.273 -9.820 1.00 10.00 C ATOM 1150 CZ PHE A 87 -7.118 -0.909 -9.993 1.00 10.00 C ATOM 0 H PHE A 87 -3.059 -1.395 -6.490 1.00 10.00 H new ATOM 0 HA PHE A 87 -4.658 -3.881 -6.718 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -2.838 -2.552 -8.761 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -3.709 -4.055 -8.988 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -6.260 -3.995 -8.952 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.873 -0.476 -9.211 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -8.194 -2.744 -9.805 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.805 0.775 -10.062 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.966 -0.361 -10.376 1.00 10.00 H new ATOM 1160 N GLN A 88 -2.547 -5.374 -6.691 1.00 10.00 N ATOM 1161 CA GLN A 88 -1.403 -6.196 -6.327 1.00 10.00 C ATOM 1162 C GLN A 88 -0.550 -6.475 -7.552 1.00 10.00 C ATOM 1163 O GLN A 88 -1.052 -6.478 -8.678 1.00 10.00 O ATOM 1164 CB GLN A 88 -1.851 -7.514 -5.700 1.00 10.00 C ATOM 1165 CG GLN A 88 -2.178 -7.413 -4.221 1.00 10.00 C ATOM 1166 CD GLN A 88 -1.364 -8.375 -3.380 1.00 10.00 C ATOM 1167 OE1 GLN A 88 -0.242 -8.743 -3.738 1.00 10.00 O ATOM 1168 NE2 GLN A 88 -1.920 -8.789 -2.254 1.00 10.00 N ATOM 0 H GLN A 88 -3.344 -5.896 -7.056 1.00 10.00 H new ATOM 0 HA GLN A 88 -0.814 -5.648 -5.592 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -2.730 -7.878 -6.232 1.00 10.00 H new ATOM 0 HB3 GLN A 88 -1.065 -8.256 -5.838 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -1.995 -6.394 -3.881 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -3.239 -7.614 -4.072 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -2.850 -8.461 -1.994 1.00 10.00 H new ATOM 0 HE22 GLN A 88 -1.419 -9.436 -1.646 1.00 10.00 H new ATOM 1177 N GLN A 89 0.733 -6.696 -7.331 1.00 10.00 N ATOM 1178 CA GLN A 89 1.649 -6.988 -8.419 1.00 10.00 C ATOM 1179 C GLN A 89 1.598 -8.472 -8.756 1.00 10.00 C ATOM 1180 O GLN A 89 1.560 -9.320 -7.862 1.00 10.00 O ATOM 1181 CB GLN A 89 3.076 -6.571 -8.047 1.00 10.00 C ATOM 1182 CG GLN A 89 4.090 -6.799 -9.157 1.00 10.00 C ATOM 1183 CD GLN A 89 3.725 -6.078 -10.439 1.00 10.00 C ATOM 1184 OE1 GLN A 89 3.156 -4.987 -10.419 1.00 10.00 O ATOM 1185 NE2 GLN A 89 4.041 -6.693 -11.566 1.00 10.00 N ATOM 0 H GLN A 89 1.165 -6.679 -6.407 1.00 10.00 H new ATOM 0 HA GLN A 89 1.345 -6.417 -9.296 1.00 10.00 H new ATOM 0 HB2 GLN A 89 3.077 -5.515 -7.777 1.00 10.00 H new ATOM 0 HB3 GLN A 89 3.388 -7.126 -7.163 1.00 10.00 H new ATOM 0 HG2 GLN A 89 5.071 -6.462 -8.822 1.00 10.00 H new ATOM 0 HG3 GLN A 89 4.171 -7.868 -9.356 1.00 10.00 H new ATOM 0 HE21 GLN A 89 4.513 -7.597 -11.539 1.00 10.00 H new ATOM 0 HE22 GLN A 89 3.813 -6.263 -12.463 1.00 10.00 H new ATOM 1194 N GLN A 90 1.565 -8.776 -10.045 1.00 10.00 N ATOM 1195 CA GLN A 90 1.528 -10.156 -10.507 1.00 10.00 C ATOM 1196 C GLN A 90 2.808 -10.888 -10.111 1.00 10.00 C ATOM 1197 O GLN A 90 3.910 -10.369 -10.299 1.00 10.00 O ATOM 1198 CB GLN A 90 1.356 -10.212 -12.024 1.00 10.00 C ATOM 1199 CG GLN A 90 -0.090 -10.193 -12.490 1.00 10.00 C ATOM 1200 CD GLN A 90 -0.725 -8.816 -12.405 1.00 10.00 C ATOM 1201 OE1 GLN A 90 -0.045 -7.795 -12.483 1.00 10.00 O ATOM 1202 NE2 GLN A 90 -2.037 -8.786 -12.260 1.00 10.00 N ATOM 0 H GLN A 90 1.563 -8.082 -10.793 1.00 10.00 H new ATOM 0 HA GLN A 90 0.676 -10.646 -10.035 1.00 10.00 H new ATOM 0 HB2 GLN A 90 1.880 -9.366 -12.469 1.00 10.00 H new ATOM 0 HB3 GLN A 90 1.835 -11.117 -12.399 1.00 10.00 H new ATOM 0 HG2 GLN A 90 -0.138 -10.546 -13.520 1.00 10.00 H new ATOM 0 HG3 GLN A 90 -0.669 -10.892 -11.886 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -2.563 -9.658 -12.199 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -2.524 -7.891 -12.209 1.00 10.00 H new ATOM 1211 N THR A 91 2.656 -12.081 -9.556 1.00 10.00 N ATOM 1212 CA THR A 91 3.794 -12.883 -9.137 1.00 10.00 C ATOM 1213 C THR A 91 4.444 -13.569 -10.333 1.00 10.00 C ATOM 1214 O THR A 91 5.660 -13.497 -10.522 1.00 10.00 O ATOM 1215 CB THR A 91 3.351 -13.937 -8.111 1.00 10.00 C ATOM 1216 OG1 THR A 91 1.931 -14.124 -8.209 1.00 10.00 O ATOM 1217 CG2 THR A 91 3.715 -13.500 -6.701 1.00 10.00 C ATOM 0 H THR A 91 1.750 -12.517 -9.385 1.00 10.00 H new ATOM 0 HA THR A 91 4.526 -12.219 -8.677 1.00 10.00 H new ATOM 0 HB THR A 91 3.864 -14.875 -8.324 1.00 10.00 H new ATOM 0 HG1 THR A 91 1.472 -13.412 -7.716 1.00 10.00 H new ATOM 0 HG21 THR A 91 3.393 -14.260 -5.990 1.00 10.00 H new ATOM 0 HG22 THR A 91 4.795 -13.369 -6.628 1.00 10.00 H new ATOM 0 HG23 THR A 91 3.219 -12.556 -6.473 1.00 10.00 H new ATOM 1225 N GLY A 92 3.625 -14.215 -11.145 1.00 10.00 N ATOM 1226 CA GLY A 92 4.121 -14.903 -12.311 1.00 10.00 C ATOM 1227 C GLY A 92 2.991 -15.429 -13.164 1.00 10.00 C ATOM 1228 O GLY A 92 1.907 -15.700 -12.610 1.00 10.00 O ATOM 0 H GLY A 92 2.615 -14.274 -11.013 1.00 10.00 H new ATOM 0 HA2 GLY A 92 4.738 -14.225 -12.900 1.00 10.00 H new ATOM 0 HA3 GLY A 92 4.761 -15.730 -12.003 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -19.719 -2.362 5.543 1.00 10.00 N ATOM 1234 CA ASN B 357 -18.773 -1.233 5.450 1.00 10.00 C ATOM 1235 C ASN B 357 -17.540 -1.534 6.276 1.00 10.00 C ATOM 1236 O ASN B 357 -17.635 -1.808 7.470 1.00 10.00 O ATOM 1237 CB ASN B 357 -19.440 0.063 5.951 1.00 10.00 C ATOM 1238 CG ASN B 357 -18.554 1.306 5.851 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -17.329 1.229 5.831 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -19.179 2.475 5.817 1.00 10.00 N ATOM 0 HA ASN B 357 -18.483 -1.096 4.408 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -20.351 0.234 5.378 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -19.738 -0.074 6.991 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -18.640 3.340 5.773 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -20.198 2.509 5.835 1.00 10.00 H new ATOM 1247 N ASN B 358 -16.383 -1.467 5.641 1.00 10.00 N ATOM 1248 CA ASN B 358 -15.131 -1.701 6.329 1.00 10.00 C ATOM 1249 C ASN B 358 -14.349 -0.404 6.295 1.00 10.00 C ATOM 1250 O ASN B 358 -14.063 0.132 5.223 1.00 10.00 O ATOM 1251 CB ASN B 358 -14.359 -2.837 5.633 1.00 10.00 C ATOM 1252 CG ASN B 358 -12.938 -3.009 6.138 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -12.655 -2.831 7.326 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -12.036 -3.365 5.233 1.00 10.00 N ATOM 0 H ASN B 358 -16.287 -1.252 4.649 1.00 10.00 H new ATOM 0 HA ASN B 358 -15.297 -2.006 7.362 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -14.901 -3.772 5.774 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -14.333 -2.643 4.561 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -11.064 -3.503 5.509 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -12.315 -3.501 4.261 1.00 10.00 H new ATOM 1261 N ARG B 359 -14.018 0.097 7.465 1.00 10.00 N ATOM 1262 CA ARG B 359 -13.304 1.349 7.572 1.00 10.00 C ATOM 1263 C ARG B 359 -12.035 1.201 8.380 1.00 10.00 C ATOM 1264 O ARG B 359 -12.046 0.695 9.504 1.00 10.00 O ATOM 1265 CB ARG B 359 -14.202 2.429 8.183 1.00 10.00 C ATOM 1266 CG ARG B 359 -15.180 1.908 9.224 1.00 10.00 C ATOM 1267 CD ARG B 359 -16.261 2.930 9.524 1.00 10.00 C ATOM 1268 NE ARG B 359 -17.339 2.371 10.333 1.00 10.00 N ATOM 1269 CZ ARG B 359 -18.545 2.918 10.434 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -18.839 4.006 9.735 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -19.459 2.370 11.221 1.00 10.00 N ATOM 0 H ARG B 359 -14.233 -0.346 8.358 1.00 10.00 H new ATOM 0 HA ARG B 359 -13.022 1.653 6.564 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -13.573 3.193 8.641 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -14.763 2.915 7.384 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -15.638 0.985 8.867 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -14.643 1.663 10.141 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.821 3.780 10.046 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -16.671 3.309 8.588 1.00 10.00 H new ATOM 0 HE ARG B 359 -17.156 1.511 10.850 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -18.139 4.422 9.120 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -19.765 4.427 9.812 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -19.237 1.527 11.750 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -20.385 2.791 11.298 1.00 10.00 H new ATOM 1285 N ASP B 360 -10.954 1.646 7.792 1.00 10.00 N ATOM 1286 CA ASP B 360 -9.655 1.636 8.432 1.00 10.00 C ATOM 1287 C ASP B 360 -9.147 3.069 8.431 1.00 10.00 C ATOM 1288 O ASP B 360 -9.252 3.754 7.417 1.00 10.00 O ATOM 1289 CB ASP B 360 -8.675 0.697 7.723 1.00 10.00 C ATOM 1290 CG ASP B 360 -7.595 0.186 8.659 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -6.649 0.944 8.954 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -7.699 -0.975 9.112 1.00 10.00 O ATOM 0 H ASP B 360 -10.946 2.030 6.847 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.742 1.258 9.451 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -9.222 -0.148 7.305 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -8.211 1.221 6.887 1.00 10.00 H new ATOM 1297 N PRO B 361 -8.614 3.582 9.539 1.00 10.00 N ATOM 1298 CA PRO B 361 -8.160 4.951 9.593 1.00 10.00 C ATOM 1299 C PRO B 361 -6.646 5.074 9.633 1.00 10.00 C ATOM 1300 O PRO B 361 -5.959 4.447 10.440 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.766 5.386 10.926 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.755 4.142 11.782 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.522 2.959 10.857 1.00 10.00 C ATOM 0 HA PRO B 361 -8.448 5.540 8.722 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -8.183 6.185 11.383 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -9.779 5.766 10.794 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.970 4.201 12.536 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.700 4.033 12.314 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.549 2.497 11.023 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.272 2.180 10.994 1.00 10.00 H new ATOM 1311 N ILE B 362 -6.137 5.901 8.740 1.00 10.00 N ATOM 1312 CA ILE B 362 -4.713 6.117 8.620 1.00 10.00 C ATOM 1313 C ILE B 362 -4.379 7.581 8.861 1.00 10.00 C ATOM 1314 O ILE B 362 -5.017 8.483 8.316 1.00 10.00 O ATOM 1315 CB ILE B 362 -4.157 5.654 7.249 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -4.570 4.195 6.973 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -2.640 5.798 7.228 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.733 3.483 5.919 1.00 10.00 C ATOM 0 H ILE B 362 -6.699 6.439 8.081 1.00 10.00 H new ATOM 0 HA ILE B 362 -4.230 5.506 9.383 1.00 10.00 H new ATOM 0 HB ILE B 362 -4.576 6.283 6.463 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -4.510 3.633 7.905 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -5.614 4.181 6.659 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -2.257 5.471 6.261 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -2.371 6.842 7.390 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -2.205 5.185 8.017 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.097 2.463 5.793 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -3.811 4.016 4.971 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -2.691 3.459 6.237 1.00 10.00 H new ATOM 1330 N VAL B 363 -3.375 7.798 9.679 1.00 10.00 N ATOM 1331 CA VAL B 363 -2.938 9.131 10.040 1.00 10.00 C ATOM 1332 C VAL B 363 -1.545 9.361 9.499 1.00 10.00 C ATOM 1333 O VAL B 363 -0.685 8.479 9.540 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.961 9.358 11.574 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.490 10.765 11.933 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -4.357 9.109 12.124 1.00 10.00 C ATOM 0 H VAL B 363 -2.834 7.052 10.116 1.00 10.00 H new ATOM 0 HA VAL B 363 -3.634 9.846 9.601 1.00 10.00 H new ATOM 0 HB VAL B 363 -2.271 8.648 12.030 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.518 10.893 13.015 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.470 10.909 11.576 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -3.146 11.499 11.464 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.358 9.272 13.202 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -5.061 9.794 11.653 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.654 8.082 11.912 1.00 10.00 H new ATOM 1346 N ILE B 364 -1.352 10.538 8.967 1.00 10.00 N ATOM 1347 CA ILE B 364 -0.104 10.928 8.361 1.00 10.00 C ATOM 1348 C ILE B 364 0.558 12.000 9.197 1.00 10.00 C ATOM 1349 O ILE B 364 -0.115 12.843 9.802 1.00 10.00 O ATOM 1350 CB ILE B 364 -0.287 11.430 6.909 1.00 10.00 C ATOM 1351 CG1 ILE B 364 0.715 10.740 5.987 1.00 10.00 C ATOM 1352 CG2 ILE B 364 -0.131 12.942 6.818 1.00 10.00 C ATOM 1353 CD1 ILE B 364 0.387 9.291 5.722 1.00 10.00 C ATOM 0 H ILE B 364 -2.067 11.265 8.941 1.00 10.00 H new ATOM 0 HA ILE B 364 0.530 10.043 8.320 1.00 10.00 H new ATOM 0 HB ILE B 364 -1.299 11.180 6.592 1.00 10.00 H new ATOM 0 HG12 ILE B 364 0.753 11.276 5.038 1.00 10.00 H new ATOM 0 HG13 ILE B 364 1.709 10.805 6.430 1.00 10.00 H new ATOM 0 HG21 ILE B 364 -0.266 13.260 5.784 1.00 10.00 H new ATOM 0 HG22 ILE B 364 -0.880 13.424 7.446 1.00 10.00 H new ATOM 0 HG23 ILE B 364 0.865 13.226 7.158 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.140 8.863 5.060 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.377 8.742 6.664 1.00 10.00 H new ATOM 0 HD13 ILE B 364 -0.593 9.220 5.251 1.00 10.00 H new HETATM 1365 N SEP B 365 1.866 11.929 9.281 1.00 10.00 N HETATM 1366 CA SEP B 365 2.613 12.879 10.056 1.00 10.00 C HETATM 1367 CB SEP B 365 3.620 12.117 10.923 1.00 10.00 C HETATM 1368 OG SEP B 365 4.465 11.285 10.119 1.00 10.00 O HETATM 1369 C SEP B 365 3.315 13.819 9.091 1.00 10.00 C HETATM 1370 O SEP B 365 4.022 13.392 8.177 1.00 10.00 O HETATM 1371 P SEP B 365 4.087 9.757 9.785 1.00 10.00 P HETATM 1372 O1P SEP B 365 3.154 9.589 8.657 1.00 10.00 O HETATM 1373 O2P SEP B 365 3.753 8.936 10.959 1.00 10.00 O HETATM 1374 O3P SEP B 365 5.451 9.131 9.243 1.00 10.00 O HETATM 0 HB3 SEP B 365 4.229 12.824 11.485 1.00 10.00 H new HETATM 0 HB2 SEP B 365 3.088 11.505 11.651 1.00 10.00 H new HETATM 0 HA SEP B 365 1.967 13.462 10.713 1.00 10.00 H new HETATM 0 H SEP B 365 2.059 10.932 9.373 1.00 10.00 H new ATOM 1379 N ASP B 366 3.093 15.106 9.303 1.00 10.00 N ATOM 1380 CA ASP B 366 3.624 16.137 8.428 1.00 10.00 C ATOM 1381 C ASP B 366 4.522 17.099 9.184 1.00 10.00 C ATOM 1382 O ASP B 366 4.159 17.602 10.251 1.00 10.00 O ATOM 1383 CB ASP B 366 2.450 16.894 7.796 1.00 10.00 C ATOM 1384 CG ASP B 366 2.881 17.926 6.780 1.00 10.00 C ATOM 1385 OD1 ASP B 366 2.551 19.121 6.967 1.00 10.00 O ATOM 1386 OD2 ASP B 366 3.519 17.545 5.776 1.00 10.00 O ATOM 0 H ASP B 366 2.542 15.464 10.083 1.00 10.00 H new ATOM 0 HA ASP B 366 4.231 15.667 7.654 1.00 10.00 H new ATOM 0 HB2 ASP B 366 1.782 16.179 7.316 1.00 10.00 H new ATOM 0 HB3 ASP B 366 1.878 17.386 8.583 1.00 10.00 H new HETATM 1391 N SEP B 367 5.703 17.323 8.642 1.00 10.00 N HETATM 1392 CA SEP B 367 6.658 18.234 9.238 1.00 10.00 C HETATM 1393 CB SEP B 367 8.055 17.911 8.720 1.00 10.00 C HETATM 1394 OG SEP B 367 8.320 16.518 8.842 1.00 10.00 O HETATM 1395 C SEP B 367 6.290 19.683 8.922 1.00 10.00 C HETATM 1396 O SEP B 367 6.170 20.061 7.752 1.00 10.00 O HETATM 1397 P SEP B 367 8.382 15.593 7.539 1.00 10.00 P HETATM 1398 O1P SEP B 367 9.003 16.238 6.372 1.00 10.00 O HETATM 1399 O2P SEP B 367 8.880 14.230 7.800 1.00 10.00 O HETATM 1400 O3P SEP B 367 6.858 15.373 7.109 1.00 10.00 O HETATM 0 HB3 SEP B 367 8.142 18.214 7.677 1.00 10.00 H new HETATM 0 HB2 SEP B 367 8.798 18.479 9.280 1.00 10.00 H new HETATM 0 HA SEP B 367 6.640 18.113 10.321 1.00 10.00 H new HETATM 0 H SEP B 367 6.020 16.609 7.986 1.00 10.00 H new ATOM 1405 N PRO B 368 6.092 20.509 9.966 1.00 10.00 N ATOM 1406 CA PRO B 368 5.729 21.919 9.793 1.00 10.00 C ATOM 1407 C PRO B 368 6.831 22.717 9.109 1.00 10.00 C ATOM 1408 O PRO B 368 6.505 23.601 8.294 1.00 10.00 O ATOM 1409 CB PRO B 368 5.517 22.421 11.224 1.00 10.00 C ATOM 1410 CG PRO B 368 6.280 21.473 12.083 1.00 10.00 C ATOM 1411 CD PRO B 368 6.208 20.141 11.390 1.00 10.00 C ATOM 0 HA PRO B 368 4.851 22.035 9.157 1.00 10.00 H new ATOM 0 HB2 PRO B 368 5.882 23.441 11.342 1.00 10.00 H new ATOM 0 HB3 PRO B 368 4.459 22.428 11.487 1.00 10.00 H new ATOM 0 HG2 PRO B 368 7.314 21.797 12.200 1.00 10.00 H new ATOM 0 HG3 PRO B 368 5.849 21.417 13.082 1.00 10.00 H new ATOM 0 HD2 PRO B 368 7.097 19.540 11.580 1.00 10.00 H new ATOM 0 HD3 PRO B 368 5.351 19.558 11.726 1.00 10.00 H new TER 1419 PRO B 368