USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 915 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 LYS NZ :NH3+ -141:sc= 0.271 (180deg=0) USER MOD Set 1.2: A 130 TYR OH : rot 165:sc= 0.275 USER MOD Set 2.1: A 109 THR OG1 : rot 131:sc= 0.463 USER MOD Set 2.2: A 112 GLN : amide:sc= 0.752 K(o=1.2,f=-2.6!) USER MOD Set 3.1: A 97 SER OG : rot 180:sc= 0.0146 USER MOD Set 3.2: A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 96 THR OG1 : rot 165:sc= 0.479 USER MOD Set 4.2: A 101 THR OG1 : rot 180:sc= 0.422 USER MOD Set 5.1: A 27 GLN : amide:sc= 0.121 K(o=0.072,f=-0.52) USER MOD Set 5.2: A 118 TYR OH : rot 180:sc= -0.0492 USER MOD Set 6.1: A 24 THR OG1 : rot -150:sc= -0.51 USER MOD Set 6.2: A 26 GLN : amide:sc= -0.645 K(o=-1.2,f=-2.6!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.206 X(o=-0.21,f=0) USER MOD Single : A 44 ASN : amide:sc= 1.41 K(o=1.4,f=-0.6) USER MOD Single : A 48 ASN : amide:sc= -0.379 X(o=-0.38,f=-0.013) USER MOD Single : A 49 GLN : amide:sc= 0.217 X(o=0.22,f=-0.078) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0.00366 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 165:sc= 0 USER MOD Single : A 69 SER OG : rot 134:sc= 1.31 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -146:sc= 0.709 (180deg=-0.131) USER MOD Single : A 89 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.0636 USER MOD Single : A 94 LYS NZ :NH3+ -152:sc= 0.722 (180deg=0.36) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.0578 X(o=-0.058,f=-0.48) USER MOD Single : A 100 ASN : amide:sc= -0.581 X(o=-0.58,f=-0.36) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 146:sc= 1.24 (180deg=1.13) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= 0.226 X(o=0.23,f=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -1.47 K(o=-1.5,f=-12!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N PHE A 23 -11.366 -9.306 -0.958 1.00 0.00 N ATOM 65 CA PHE A 23 -10.240 -8.385 -0.990 1.00 0.00 C ATOM 66 C PHE A 23 -9.050 -9.143 -1.584 1.00 0.00 C ATOM 67 O PHE A 23 -8.702 -10.200 -1.058 1.00 0.00 O ATOM 68 CB PHE A 23 -9.926 -7.923 0.438 1.00 0.00 C ATOM 69 CG PHE A 23 -10.771 -6.768 0.937 1.00 0.00 C ATOM 70 CD1 PHE A 23 -10.599 -5.507 0.345 1.00 0.00 C ATOM 71 CD2 PHE A 23 -11.678 -6.912 2.004 1.00 0.00 C ATOM 72 CE1 PHE A 23 -11.367 -4.411 0.770 1.00 0.00 C ATOM 73 CE2 PHE A 23 -12.403 -5.798 2.472 1.00 0.00 C ATOM 74 CZ PHE A 23 -12.251 -4.545 1.853 1.00 0.00 C ATOM 0 HA PHE A 23 -10.462 -7.504 -1.592 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -10.056 -8.768 1.114 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -8.876 -7.634 0.488 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -9.871 -5.379 -0.443 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.818 -7.879 2.465 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -11.278 -3.462 0.262 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -13.077 -5.907 3.309 1.00 0.00 H new ATOM 0 HZ PHE A 23 -12.810 -3.692 2.208 1.00 0.00 H new ATOM 84 N THR A 24 -8.443 -8.644 -2.659 1.00 0.00 N ATOM 85 CA THR A 24 -7.247 -9.238 -3.255 1.00 0.00 C ATOM 86 C THR A 24 -6.011 -8.546 -2.662 1.00 0.00 C ATOM 87 O THR A 24 -6.139 -7.467 -2.079 1.00 0.00 O ATOM 88 CB THR A 24 -7.301 -9.144 -4.798 1.00 0.00 C ATOM 89 OG1 THR A 24 -6.984 -7.854 -5.253 1.00 0.00 O ATOM 90 CG2 THR A 24 -8.657 -9.544 -5.394 1.00 0.00 C ATOM 0 H THR A 24 -8.770 -7.809 -3.145 1.00 0.00 H new ATOM 0 HA THR A 24 -7.192 -10.301 -3.019 1.00 0.00 H new ATOM 0 HB THR A 24 -6.554 -9.860 -5.140 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.457 -7.678 -6.093 1.00 0.00 H new ATOM 0 HG21 THR A 24 -8.618 -9.453 -6.479 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.883 -10.576 -5.124 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.434 -8.888 -5.002 1.00 0.00 H new ATOM 98 N ASP A 25 -4.809 -9.109 -2.832 1.00 0.00 N ATOM 99 CA ASP A 25 -3.575 -8.483 -2.329 1.00 0.00 C ATOM 100 C ASP A 25 -3.431 -7.069 -2.895 1.00 0.00 C ATOM 101 O ASP A 25 -3.130 -6.126 -2.162 1.00 0.00 O ATOM 102 CB ASP A 25 -2.322 -9.282 -2.729 1.00 0.00 C ATOM 103 CG ASP A 25 -2.093 -10.570 -1.945 1.00 0.00 C ATOM 104 OD1 ASP A 25 -2.638 -10.719 -0.826 1.00 0.00 O ATOM 105 OD2 ASP A 25 -1.390 -11.467 -2.464 1.00 0.00 O ATOM 0 H ASP A 25 -4.662 -9.996 -3.313 1.00 0.00 H new ATOM 0 HA ASP A 25 -3.653 -8.461 -1.242 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.391 -9.528 -3.789 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.448 -8.642 -2.607 1.00 0.00 H new ATOM 110 N GLN A 26 -3.692 -6.930 -4.200 1.00 0.00 N ATOM 111 CA GLN A 26 -3.616 -5.659 -4.905 1.00 0.00 C ATOM 112 C GLN A 26 -4.545 -4.637 -4.245 1.00 0.00 C ATOM 113 O GLN A 26 -4.136 -3.517 -3.947 1.00 0.00 O ATOM 114 CB GLN A 26 -3.995 -5.809 -6.382 1.00 0.00 C ATOM 115 CG GLN A 26 -3.468 -7.047 -7.104 1.00 0.00 C ATOM 116 CD GLN A 26 -4.458 -8.211 -7.040 1.00 0.00 C ATOM 117 OE1 GLN A 26 -4.247 -9.160 -6.290 1.00 0.00 O ATOM 118 NE2 GLN A 26 -5.587 -8.170 -7.740 1.00 0.00 N ATOM 0 H GLN A 26 -3.965 -7.711 -4.797 1.00 0.00 H new ATOM 0 HA GLN A 26 -2.584 -5.313 -4.850 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -5.083 -5.810 -6.456 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -3.640 -4.927 -6.915 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -3.265 -6.800 -8.146 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -2.521 -7.351 -6.658 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -5.771 -7.386 -8.366 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -6.269 -8.923 -7.652 1.00 0.00 H new ATOM 127 N GLN A 27 -5.807 -5.031 -4.035 1.00 0.00 N ATOM 128 CA GLN A 27 -6.864 -4.175 -3.515 1.00 0.00 C ATOM 129 C GLN A 27 -6.465 -3.641 -2.140 1.00 0.00 C ATOM 130 O GLN A 27 -6.594 -2.442 -1.879 1.00 0.00 O ATOM 131 CB GLN A 27 -8.191 -4.961 -3.444 1.00 0.00 C ATOM 132 CG GLN A 27 -8.722 -5.489 -4.793 1.00 0.00 C ATOM 133 CD GLN A 27 -9.721 -4.615 -5.541 1.00 0.00 C ATOM 134 OE1 GLN A 27 -10.590 -3.980 -4.948 1.00 0.00 O ATOM 135 NE2 GLN A 27 -9.648 -4.635 -6.861 1.00 0.00 N ATOM 0 H GLN A 27 -6.123 -5.981 -4.229 1.00 0.00 H new ATOM 0 HA GLN A 27 -7.009 -3.326 -4.183 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -8.057 -5.807 -2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -8.951 -4.318 -3.001 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -7.868 -5.661 -5.448 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -9.188 -6.458 -4.616 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.914 -5.172 -7.323 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -10.325 -4.113 -7.417 1.00 0.00 H new ATOM 144 N ILE A 28 -6.004 -4.518 -1.246 1.00 0.00 N ATOM 145 CA ILE A 28 -5.684 -4.141 0.127 1.00 0.00 C ATOM 146 C ILE A 28 -4.502 -3.169 0.110 1.00 0.00 C ATOM 147 O ILE A 28 -4.480 -2.226 0.898 1.00 0.00 O ATOM 148 CB ILE A 28 -5.398 -5.392 0.984 1.00 0.00 C ATOM 149 CG1 ILE A 28 -6.553 -6.419 0.923 1.00 0.00 C ATOM 150 CG2 ILE A 28 -5.166 -5.001 2.453 1.00 0.00 C ATOM 151 CD1 ILE A 28 -6.071 -7.833 1.273 1.00 0.00 C ATOM 0 H ILE A 28 -5.844 -5.504 -1.454 1.00 0.00 H new ATOM 0 HA ILE A 28 -6.537 -3.640 0.585 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.501 -5.852 0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -7.342 -6.122 1.614 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -6.988 -6.419 -0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.966 -5.897 3.041 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.313 -4.326 2.519 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -6.054 -4.503 2.842 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.910 -8.527 1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.300 -8.140 0.566 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.660 -7.838 2.282 1.00 0.00 H new ATOM 163 N GLY A 29 -3.549 -3.361 -0.809 1.00 0.00 N ATOM 164 CA GLY A 29 -2.413 -2.473 -0.959 1.00 0.00 C ATOM 165 C GLY A 29 -2.825 -1.032 -1.235 1.00 0.00 C ATOM 166 O GLY A 29 -2.167 -0.117 -0.736 1.00 0.00 O ATOM 0 H GLY A 29 -3.553 -4.141 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.809 -2.506 -0.052 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.784 -2.829 -1.775 1.00 0.00 H new ATOM 170 N VAL A 30 -3.893 -0.819 -2.003 1.00 0.00 N ATOM 171 CA VAL A 30 -4.351 0.514 -2.363 1.00 0.00 C ATOM 172 C VAL A 30 -4.932 1.200 -1.119 1.00 0.00 C ATOM 173 O VAL A 30 -4.575 2.340 -0.823 1.00 0.00 O ATOM 174 CB VAL A 30 -5.318 0.386 -3.562 1.00 0.00 C ATOM 175 CG1 VAL A 30 -5.999 1.699 -3.922 1.00 0.00 C ATOM 176 CG2 VAL A 30 -4.554 -0.074 -4.818 1.00 0.00 C ATOM 0 H VAL A 30 -4.463 -1.570 -2.392 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.541 1.163 -2.695 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.072 -0.338 -3.253 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.665 1.543 -4.771 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -6.576 2.055 -3.069 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.244 2.440 -4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.247 -0.160 -5.655 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.781 0.655 -5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.092 -1.043 -4.628 1.00 0.00 H new ATOM 186 N LEU A 31 -5.777 0.495 -0.361 1.00 0.00 N ATOM 187 CA LEU A 31 -6.371 0.980 0.885 1.00 0.00 C ATOM 188 C LEU A 31 -5.301 1.318 1.921 1.00 0.00 C ATOM 189 O LEU A 31 -5.373 2.366 2.555 1.00 0.00 O ATOM 190 CB LEU A 31 -7.338 -0.085 1.437 1.00 0.00 C ATOM 191 CG LEU A 31 -8.831 0.210 1.219 1.00 0.00 C ATOM 192 CD1 LEU A 31 -9.178 0.575 -0.224 1.00 0.00 C ATOM 193 CD2 LEU A 31 -9.692 -0.980 1.670 1.00 0.00 C ATOM 0 H LEU A 31 -6.073 -0.450 -0.604 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.920 1.898 0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.102 -1.043 0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.158 -0.196 2.506 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.052 1.085 1.831 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.248 0.770 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.624 1.467 -0.517 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.910 -0.251 -0.883 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.745 -0.750 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.420 -1.865 1.094 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -9.522 -1.171 2.730 1.00 0.00 H new ATOM 205 N ALA A 32 -4.323 0.433 2.104 1.00 0.00 N ATOM 206 CA ALA A 32 -3.179 0.635 2.973 1.00 0.00 C ATOM 207 C ALA A 32 -2.489 1.965 2.652 1.00 0.00 C ATOM 208 O ALA A 32 -2.266 2.765 3.566 1.00 0.00 O ATOM 209 CB ALA A 32 -2.253 -0.580 2.873 1.00 0.00 C ATOM 0 H ALA A 32 -4.310 -0.472 1.633 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.496 0.712 4.013 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.391 -0.435 3.524 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -2.793 -1.475 3.181 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.915 -0.696 1.843 1.00 0.00 H new ATOM 215 N GLY A 33 -2.218 2.222 1.368 1.00 0.00 N ATOM 216 CA GLY A 33 -1.607 3.465 0.919 1.00 0.00 C ATOM 217 C GLY A 33 -2.470 4.694 1.169 1.00 0.00 C ATOM 218 O GLY A 33 -1.927 5.762 1.431 1.00 0.00 O ATOM 0 H GLY A 33 -2.419 1.567 0.612 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.651 3.594 1.426 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.395 3.391 -0.148 1.00 0.00 H new ATOM 222 N LEU A 34 -3.801 4.581 1.160 1.00 0.00 N ATOM 223 CA LEU A 34 -4.640 5.747 1.440 1.00 0.00 C ATOM 224 C LEU A 34 -4.447 6.275 2.857 1.00 0.00 C ATOM 225 O LEU A 34 -4.692 7.452 3.115 1.00 0.00 O ATOM 226 CB LEU A 34 -6.120 5.465 1.169 1.00 0.00 C ATOM 227 CG LEU A 34 -6.423 5.403 -0.331 1.00 0.00 C ATOM 228 CD1 LEU A 34 -7.877 4.974 -0.542 1.00 0.00 C ATOM 229 CD2 LEU A 34 -6.124 6.752 -1.010 1.00 0.00 C ATOM 0 H LEU A 34 -4.309 3.718 0.967 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.312 6.526 0.751 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -6.401 4.521 1.636 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.728 6.243 1.631 1.00 0.00 H new ATOM 0 HG LEU A 34 -5.774 4.662 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -8.092 4.930 -1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -8.034 3.990 -0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -8.542 5.696 -0.067 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -6.348 6.681 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -6.741 7.530 -0.561 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -5.071 7.001 -0.876 1.00 0.00 H new ATOM 241 N ALA A 35 -3.967 5.428 3.764 1.00 0.00 N ATOM 242 CA ALA A 35 -3.630 5.830 5.118 1.00 0.00 C ATOM 243 C ALA A 35 -2.139 6.187 5.267 1.00 0.00 C ATOM 244 O ALA A 35 -1.785 6.832 6.253 1.00 0.00 O ATOM 245 CB ALA A 35 -4.077 4.723 6.077 1.00 0.00 C ATOM 0 H ALA A 35 -3.802 4.439 3.575 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.161 6.748 5.369 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.832 5.007 7.100 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.154 4.578 5.989 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -3.564 3.795 5.826 1.00 0.00 H new ATOM 251 N ILE A 36 -1.264 5.803 4.330 1.00 0.00 N ATOM 252 CA ILE A 36 0.169 6.094 4.344 1.00 0.00 C ATOM 253 C ILE A 36 0.503 6.752 2.997 1.00 0.00 C ATOM 254 O ILE A 36 0.799 6.075 2.012 1.00 0.00 O ATOM 255 CB ILE A 36 1.024 4.838 4.670 1.00 0.00 C ATOM 256 CG1 ILE A 36 0.966 4.406 6.161 1.00 0.00 C ATOM 257 CG2 ILE A 36 2.526 5.102 4.431 1.00 0.00 C ATOM 258 CD1 ILE A 36 -0.241 3.601 6.603 1.00 0.00 C ATOM 0 H ILE A 36 -1.548 5.262 3.513 1.00 0.00 H new ATOM 0 HA ILE A 36 0.422 6.783 5.150 1.00 0.00 H new ATOM 0 HB ILE A 36 0.603 4.072 4.019 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.860 3.821 6.378 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.016 5.305 6.775 1.00 0.00 H new ATOM 0 HG21 ILE A 36 3.096 4.204 4.668 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.687 5.368 3.386 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.858 5.921 5.069 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.153 3.367 7.664 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.148 4.182 6.433 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.290 2.675 6.030 1.00 0.00 H new ATOM 270 N SER A 37 0.501 8.087 2.977 1.00 0.00 N ATOM 271 CA SER A 37 0.775 8.916 1.807 1.00 0.00 C ATOM 272 C SER A 37 -0.230 8.646 0.661 1.00 0.00 C ATOM 273 O SER A 37 0.164 8.206 -0.420 1.00 0.00 O ATOM 274 CB SER A 37 2.262 8.778 1.421 1.00 0.00 C ATOM 275 OG SER A 37 2.824 10.024 1.046 1.00 0.00 O ATOM 0 H SER A 37 0.300 8.640 3.810 1.00 0.00 H new ATOM 0 HA SER A 37 0.614 9.967 2.046 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.820 8.366 2.262 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.360 8.072 0.597 1.00 0.00 H new ATOM 0 HG SER A 37 3.767 9.900 0.810 1.00 0.00 H new ATOM 281 N PRO A 38 -1.528 8.972 0.849 1.00 0.00 N ATOM 282 CA PRO A 38 -2.558 8.778 -0.176 1.00 0.00 C ATOM 283 C PRO A 38 -2.206 9.493 -1.480 1.00 0.00 C ATOM 284 O PRO A 38 -2.370 8.935 -2.562 1.00 0.00 O ATOM 285 CB PRO A 38 -3.859 9.358 0.403 1.00 0.00 C ATOM 286 CG PRO A 38 -3.418 10.208 1.593 1.00 0.00 C ATOM 287 CD PRO A 38 -2.120 9.549 2.049 1.00 0.00 C ATOM 0 HA PRO A 38 -2.652 7.719 -0.417 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -4.387 9.959 -0.337 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.540 8.566 0.715 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -3.260 11.247 1.305 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.167 10.207 2.385 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -1.450 10.278 2.505 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -2.313 8.781 2.798 1.00 0.00 H new ATOM 295 N GLU A 39 -1.738 10.733 -1.354 1.00 0.00 N ATOM 296 CA GLU A 39 -1.487 11.621 -2.471 1.00 0.00 C ATOM 297 C GLU A 39 -0.341 11.092 -3.316 1.00 0.00 C ATOM 298 O GLU A 39 -0.417 11.129 -4.539 1.00 0.00 O ATOM 299 CB GLU A 39 -1.236 13.043 -1.952 1.00 0.00 C ATOM 300 CG GLU A 39 -2.465 13.500 -1.160 1.00 0.00 C ATOM 301 CD GLU A 39 -2.516 14.998 -0.890 1.00 0.00 C ATOM 302 OE1 GLU A 39 -2.975 15.733 -1.791 1.00 0.00 O ATOM 303 OE2 GLU A 39 -2.259 15.414 0.261 1.00 0.00 O ATOM 0 H GLU A 39 -1.520 11.151 -0.449 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.362 11.661 -3.120 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -0.349 13.063 -1.319 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.049 13.722 -2.784 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.363 13.210 -1.706 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.486 12.970 -0.208 1.00 0.00 H new ATOM 310 N TRP A 40 0.703 10.534 -2.693 1.00 0.00 N ATOM 311 CA TRP A 40 1.777 9.870 -3.417 1.00 0.00 C ATOM 312 C TRP A 40 1.178 8.778 -4.301 1.00 0.00 C ATOM 313 O TRP A 40 1.341 8.820 -5.520 1.00 0.00 O ATOM 314 CB TRP A 40 2.816 9.308 -2.439 1.00 0.00 C ATOM 315 CG TRP A 40 3.884 8.440 -3.035 1.00 0.00 C ATOM 316 CD1 TRP A 40 5.006 8.877 -3.644 1.00 0.00 C ATOM 317 CD2 TRP A 40 3.941 6.984 -3.101 1.00 0.00 C ATOM 318 NE1 TRP A 40 5.793 7.797 -4.003 1.00 0.00 N ATOM 319 CE2 TRP A 40 5.172 6.598 -3.712 1.00 0.00 C ATOM 320 CE3 TRP A 40 3.068 5.951 -2.704 1.00 0.00 C ATOM 321 CZ2 TRP A 40 5.527 5.248 -3.889 1.00 0.00 C ATOM 322 CZ3 TRP A 40 3.388 4.598 -2.907 1.00 0.00 C ATOM 323 CH2 TRP A 40 4.623 4.249 -3.485 1.00 0.00 C ATOM 0 H TRP A 40 0.821 10.533 -1.680 1.00 0.00 H new ATOM 0 HA TRP A 40 2.295 10.586 -4.054 1.00 0.00 H new ATOM 0 HB2 TRP A 40 3.297 10.144 -1.932 1.00 0.00 H new ATOM 0 HB3 TRP A 40 2.292 8.732 -1.676 1.00 0.00 H new ATOM 0 HD1 TRP A 40 5.252 9.913 -3.824 1.00 0.00 H new ATOM 0 HE1 TRP A 40 6.716 7.876 -4.429 1.00 0.00 H new ATOM 0 HE3 TRP A 40 2.130 6.206 -2.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 6.478 4.983 -4.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 2.688 3.827 -2.620 1.00 0.00 H new ATOM 0 HH2 TRP A 40 4.878 3.208 -3.619 1.00 0.00 H new ATOM 334 N LEU A 41 0.428 7.837 -3.722 1.00 0.00 N ATOM 335 CA LEU A 41 -0.156 6.733 -4.483 1.00 0.00 C ATOM 336 C LEU A 41 -0.991 7.261 -5.652 1.00 0.00 C ATOM 337 O LEU A 41 -0.751 6.885 -6.800 1.00 0.00 O ATOM 338 CB LEU A 41 -0.933 5.811 -3.530 1.00 0.00 C ATOM 339 CG LEU A 41 -1.695 4.661 -4.225 1.00 0.00 C ATOM 340 CD1 LEU A 41 -1.661 3.392 -3.366 1.00 0.00 C ATOM 341 CD2 LEU A 41 -3.154 5.032 -4.499 1.00 0.00 C ATOM 0 H LEU A 41 0.211 7.819 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 41 0.630 6.130 -4.937 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.235 5.384 -2.810 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.646 6.412 -2.965 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.194 4.479 -5.176 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -2.203 2.594 -3.874 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.627 3.086 -3.210 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -2.129 3.592 -2.402 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -3.656 4.197 -4.988 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -3.656 5.255 -3.557 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -3.191 5.908 -5.147 1.00 0.00 H new ATOM 353 N LYS A 42 -1.925 8.173 -5.382 1.00 0.00 N ATOM 354 CA LYS A 42 -2.808 8.751 -6.392 1.00 0.00 C ATOM 355 C LYS A 42 -2.015 9.396 -7.534 1.00 0.00 C ATOM 356 O LYS A 42 -2.301 9.118 -8.699 1.00 0.00 O ATOM 357 CB LYS A 42 -3.751 9.745 -5.693 1.00 0.00 C ATOM 358 CG LYS A 42 -4.861 9.019 -4.909 1.00 0.00 C ATOM 359 CD LYS A 42 -5.521 9.907 -3.839 1.00 0.00 C ATOM 360 CE LYS A 42 -7.002 9.551 -3.654 1.00 0.00 C ATOM 361 NZ LYS A 42 -7.868 10.351 -4.545 1.00 0.00 N ATOM 0 H LYS A 42 -2.091 8.535 -4.443 1.00 0.00 H new ATOM 0 HA LYS A 42 -3.403 7.967 -6.860 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -3.177 10.375 -5.013 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.201 10.404 -6.435 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.624 8.672 -5.606 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.441 8.134 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -4.996 9.789 -2.891 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -5.430 10.955 -4.126 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.150 8.490 -3.857 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -7.291 9.720 -2.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -8.735 10.619 -4.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -7.362 11.209 -4.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.118 9.788 -5.383 1.00 0.00 H new ATOM 375 N GLN A 43 -1.004 10.216 -7.236 1.00 0.00 N ATOM 376 CA GLN A 43 -0.231 10.904 -8.258 1.00 0.00 C ATOM 377 C GLN A 43 0.556 9.896 -9.089 1.00 0.00 C ATOM 378 O GLN A 43 0.677 10.069 -10.301 1.00 0.00 O ATOM 379 CB GLN A 43 0.728 11.920 -7.619 1.00 0.00 C ATOM 380 CG GLN A 43 0.015 13.145 -7.019 1.00 0.00 C ATOM 381 CD GLN A 43 0.964 14.242 -6.547 1.00 0.00 C ATOM 382 OE1 GLN A 43 0.583 15.409 -6.498 1.00 0.00 O ATOM 383 NE2 GLN A 43 2.211 13.942 -6.204 1.00 0.00 N ATOM 0 H GLN A 43 -0.704 10.417 -6.282 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.922 11.440 -8.909 1.00 0.00 H new ATOM 0 HB2 GLN A 43 1.301 11.424 -6.836 1.00 0.00 H new ATOM 0 HB3 GLN A 43 1.441 12.257 -8.371 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.663 13.560 -7.765 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.597 12.821 -6.178 1.00 0.00 H new ATOM 0 HE21 GLN A 43 2.532 12.975 -6.243 1.00 0.00 H new ATOM 0 HE22 GLN A 43 2.848 14.679 -5.901 1.00 0.00 H new ATOM 392 N ASN A 44 1.100 8.848 -8.474 1.00 0.00 N ATOM 393 CA ASN A 44 1.885 7.857 -9.204 1.00 0.00 C ATOM 394 C ASN A 44 0.988 7.039 -10.136 1.00 0.00 C ATOM 395 O ASN A 44 1.382 6.776 -11.272 1.00 0.00 O ATOM 396 CB ASN A 44 2.654 6.939 -8.251 1.00 0.00 C ATOM 397 CG ASN A 44 3.887 7.600 -7.662 1.00 0.00 C ATOM 398 OD1 ASN A 44 4.941 7.665 -8.283 1.00 0.00 O ATOM 399 ND2 ASN A 44 3.794 8.088 -6.447 1.00 0.00 N ATOM 0 H ASN A 44 1.012 8.664 -7.475 1.00 0.00 H new ATOM 0 HA ASN A 44 2.616 8.393 -9.809 1.00 0.00 H new ATOM 0 HB2 ASN A 44 1.993 6.628 -7.442 1.00 0.00 H new ATOM 0 HB3 ASN A 44 2.952 6.036 -8.785 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.605 8.527 -6.010 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.911 8.028 -5.940 1.00 0.00 H new ATOM 406 N ILE A 45 -0.207 6.626 -9.696 1.00 0.00 N ATOM 407 CA ILE A 45 -1.149 5.887 -10.540 1.00 0.00 C ATOM 408 C ILE A 45 -1.494 6.693 -11.800 1.00 0.00 C ATOM 409 O ILE A 45 -1.561 6.118 -12.890 1.00 0.00 O ATOM 410 CB ILE A 45 -2.417 5.511 -9.740 1.00 0.00 C ATOM 411 CG1 ILE A 45 -2.181 4.449 -8.647 1.00 0.00 C ATOM 412 CG2 ILE A 45 -3.528 5.007 -10.664 1.00 0.00 C ATOM 413 CD1 ILE A 45 -1.806 3.049 -9.145 1.00 0.00 C ATOM 0 H ILE A 45 -0.545 6.795 -8.749 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.675 4.960 -10.862 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.713 6.437 -9.247 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.389 4.804 -7.988 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.085 4.369 -8.044 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.406 4.751 -10.071 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.788 5.787 -11.379 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -3.182 4.124 -11.201 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -1.664 2.385 -8.292 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.605 2.662 -9.777 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.882 3.103 -9.720 1.00 0.00 H new ATOM 425 N ALA A 46 -1.678 8.011 -11.677 1.00 0.00 N ATOM 426 CA ALA A 46 -2.096 8.865 -12.784 1.00 0.00 C ATOM 427 C ALA A 46 -1.120 8.852 -13.973 1.00 0.00 C ATOM 428 O ALA A 46 -1.520 9.161 -15.092 1.00 0.00 O ATOM 429 CB ALA A 46 -2.337 10.280 -12.247 1.00 0.00 C ATOM 0 H ALA A 46 -1.539 8.514 -10.801 1.00 0.00 H new ATOM 0 HA ALA A 46 -3.024 8.464 -13.192 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.650 10.931 -13.064 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.116 10.252 -11.486 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.416 10.665 -11.809 1.00 0.00 H new ATOM 435 N ALA A 47 0.141 8.450 -13.780 1.00 0.00 N ATOM 436 CA ALA A 47 1.129 8.278 -14.854 1.00 0.00 C ATOM 437 C ALA A 47 1.650 6.835 -14.935 1.00 0.00 C ATOM 438 O ALA A 47 2.748 6.580 -15.444 1.00 0.00 O ATOM 439 CB ALA A 47 2.224 9.351 -14.743 1.00 0.00 C ATOM 0 H ALA A 47 0.512 8.231 -12.855 1.00 0.00 H new ATOM 0 HA ALA A 47 0.643 8.437 -15.816 1.00 0.00 H new ATOM 0 HB1 ALA A 47 2.951 9.214 -15.544 1.00 0.00 H new ATOM 0 HB2 ALA A 47 1.774 10.340 -14.827 1.00 0.00 H new ATOM 0 HB3 ALA A 47 2.725 9.261 -13.779 1.00 0.00 H new ATOM 445 N ASN A 48 0.860 5.878 -14.424 1.00 0.00 N ATOM 446 CA ASN A 48 1.167 4.447 -14.311 1.00 0.00 C ATOM 447 C ASN A 48 2.587 4.237 -13.772 1.00 0.00 C ATOM 448 O ASN A 48 3.324 3.349 -14.197 1.00 0.00 O ATOM 449 CB ASN A 48 0.911 3.743 -15.653 1.00 0.00 C ATOM 450 CG ASN A 48 0.763 2.228 -15.514 1.00 0.00 C ATOM 451 OD1 ASN A 48 -0.307 1.723 -15.186 1.00 0.00 O ATOM 452 ND2 ASN A 48 1.794 1.450 -15.792 1.00 0.00 N ATOM 0 H ASN A 48 -0.066 6.098 -14.057 1.00 0.00 H new ATOM 0 HA ASN A 48 0.499 3.986 -13.584 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.007 4.151 -16.104 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.733 3.961 -16.334 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.698 0.436 -15.734 1.00 0.00 H new ATOM 0 HD22 ASN A 48 2.686 1.863 -16.065 1.00 0.00 H new ATOM 459 N GLN A 49 3.015 5.118 -12.867 1.00 0.00 N ATOM 460 CA GLN A 49 4.358 5.107 -12.293 1.00 0.00 C ATOM 461 C GLN A 49 4.443 4.052 -11.202 1.00 0.00 C ATOM 462 O GLN A 49 5.525 3.811 -10.698 1.00 0.00 O ATOM 463 CB GLN A 49 4.692 6.457 -11.628 1.00 0.00 C ATOM 464 CG GLN A 49 4.541 7.697 -12.503 1.00 0.00 C ATOM 465 CD GLN A 49 5.656 7.849 -13.526 1.00 0.00 C ATOM 466 OE1 GLN A 49 6.587 8.625 -13.319 1.00 0.00 O ATOM 467 NE2 GLN A 49 5.574 7.136 -14.635 1.00 0.00 N ATOM 0 H GLN A 49 2.428 5.871 -12.508 1.00 0.00 H new ATOM 0 HA GLN A 49 5.054 4.903 -13.107 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.052 6.575 -10.754 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.720 6.416 -11.267 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.584 7.652 -13.023 1.00 0.00 H new ATOM 0 HG3 GLN A 49 4.518 8.582 -11.867 1.00 0.00 H new ATOM 0 HE21 GLN A 49 4.788 6.501 -14.776 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.296 7.220 -15.350 1.00 0.00 H new ATOM 476 N LEU A 50 3.322 3.501 -10.745 1.00 0.00 N ATOM 477 CA LEU A 50 3.248 2.886 -9.427 1.00 0.00 C ATOM 478 C LEU A 50 3.172 1.381 -9.592 1.00 0.00 C ATOM 479 O LEU A 50 2.271 0.905 -10.276 1.00 0.00 O ATOM 480 CB LEU A 50 2.026 3.408 -8.664 1.00 0.00 C ATOM 481 CG LEU A 50 2.299 3.588 -7.158 1.00 0.00 C ATOM 482 CD1 LEU A 50 0.989 3.851 -6.439 1.00 0.00 C ATOM 483 CD2 LEU A 50 2.961 2.425 -6.431 1.00 0.00 C ATOM 0 H LEU A 50 2.449 3.469 -11.272 1.00 0.00 H new ATOM 0 HA LEU A 50 4.137 3.142 -8.851 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.717 4.363 -9.090 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.195 2.715 -8.798 1.00 0.00 H new ATOM 0 HG LEU A 50 3.008 4.415 -7.128 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.178 3.979 -5.373 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.531 4.756 -6.837 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.316 3.007 -6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.096 2.682 -5.380 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.330 1.540 -6.510 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.932 2.220 -6.882 1.00 0.00 H new ATOM 495 N VAL A 51 4.092 0.639 -8.986 1.00 0.00 N ATOM 496 CA VAL A 51 4.167 -0.811 -9.067 1.00 0.00 C ATOM 497 C VAL A 51 3.823 -1.406 -7.727 1.00 0.00 C ATOM 498 O VAL A 51 4.186 -0.845 -6.701 1.00 0.00 O ATOM 499 CB VAL A 51 5.555 -1.226 -9.589 1.00 0.00 C ATOM 500 CG1 VAL A 51 6.699 -1.230 -8.631 1.00 0.00 C ATOM 501 CG2 VAL A 51 5.611 -2.637 -10.165 1.00 0.00 C ATOM 0 H VAL A 51 4.828 1.045 -8.408 1.00 0.00 H new ATOM 0 HA VAL A 51 3.439 -1.201 -9.778 1.00 0.00 H new ATOM 0 HB VAL A 51 5.674 -0.427 -10.321 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.606 -1.544 -9.148 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.840 -0.227 -8.228 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.488 -1.922 -7.816 1.00 0.00 H new ATOM 0 HG21 VAL A 51 6.623 -2.849 -10.510 1.00 0.00 H new ATOM 0 HG22 VAL A 51 5.332 -3.356 -9.395 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.918 -2.716 -11.003 1.00 0.00 H new ATOM 511 N TYR A 52 3.128 -2.533 -7.748 1.00 0.00 N ATOM 512 CA TYR A 52 2.960 -3.453 -6.640 1.00 0.00 C ATOM 513 C TYR A 52 3.963 -4.590 -6.856 1.00 0.00 C ATOM 514 O TYR A 52 4.101 -5.057 -7.983 1.00 0.00 O ATOM 515 CB TYR A 52 1.511 -3.958 -6.699 1.00 0.00 C ATOM 516 CG TYR A 52 1.253 -5.231 -5.919 1.00 0.00 C ATOM 517 CD1 TYR A 52 1.186 -5.211 -4.513 1.00 0.00 C ATOM 518 CD2 TYR A 52 1.107 -6.444 -6.619 1.00 0.00 C ATOM 519 CE1 TYR A 52 0.993 -6.410 -3.803 1.00 0.00 C ATOM 520 CE2 TYR A 52 0.892 -7.638 -5.915 1.00 0.00 C ATOM 521 CZ TYR A 52 0.872 -7.631 -4.503 1.00 0.00 C ATOM 522 OH TYR A 52 0.801 -8.812 -3.836 1.00 0.00 O ATOM 0 H TYR A 52 2.640 -2.845 -8.587 1.00 0.00 H new ATOM 0 HA TYR A 52 3.139 -3.001 -5.664 1.00 0.00 H new ATOM 0 HB2 TYR A 52 0.852 -3.176 -6.321 1.00 0.00 H new ATOM 0 HB3 TYR A 52 1.241 -4.126 -7.742 1.00 0.00 H new ATOM 0 HD1 TYR A 52 1.283 -4.277 -3.980 1.00 0.00 H new ATOM 0 HD2 TYR A 52 1.161 -6.455 -7.698 1.00 0.00 H new ATOM 0 HE1 TYR A 52 0.937 -6.397 -2.725 1.00 0.00 H new ATOM 0 HE2 TYR A 52 0.742 -8.562 -6.453 1.00 0.00 H new ATOM 0 HH TYR A 52 0.719 -9.547 -4.479 1.00 0.00 H new ATOM 532 N GLY A 53 4.652 -5.058 -5.818 1.00 0.00 N ATOM 533 CA GLY A 53 5.570 -6.188 -5.944 1.00 0.00 C ATOM 534 C GLY A 53 5.726 -6.913 -4.615 1.00 0.00 C ATOM 535 O GLY A 53 5.131 -6.495 -3.621 1.00 0.00 O ATOM 0 H GLY A 53 4.592 -4.670 -4.876 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.199 -6.881 -6.699 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.543 -5.835 -6.286 1.00 0.00 H new ATOM 539 N ILE A 54 6.516 -7.986 -4.588 1.00 0.00 N ATOM 540 CA ILE A 54 6.914 -8.717 -3.389 1.00 0.00 C ATOM 541 C ILE A 54 8.427 -8.554 -3.236 1.00 0.00 C ATOM 542 O ILE A 54 9.170 -8.513 -4.221 1.00 0.00 O ATOM 543 CB ILE A 54 6.524 -10.212 -3.490 1.00 0.00 C ATOM 544 CG1 ILE A 54 5.014 -10.444 -3.690 1.00 0.00 C ATOM 545 CG2 ILE A 54 7.002 -11.030 -2.275 1.00 0.00 C ATOM 546 CD1 ILE A 54 4.121 -10.209 -2.463 1.00 0.00 C ATOM 0 H ILE A 54 6.912 -8.385 -5.439 1.00 0.00 H new ATOM 0 HA ILE A 54 6.398 -8.319 -2.515 1.00 0.00 H new ATOM 0 HB ILE A 54 7.040 -10.563 -4.384 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.671 -9.791 -4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 54 4.867 -11.470 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.702 -12.071 -2.397 1.00 0.00 H new ATOM 0 HG22 ILE A 54 8.088 -10.971 -2.201 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.554 -10.627 -1.366 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.081 -10.404 -2.727 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.423 -10.880 -1.659 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.224 -9.176 -2.131 1.00 0.00 H new ATOM 558 N VAL A 55 8.867 -8.509 -1.984 1.00 0.00 N ATOM 559 CA VAL A 55 10.265 -8.544 -1.562 1.00 0.00 C ATOM 560 C VAL A 55 10.981 -9.760 -2.146 1.00 0.00 C ATOM 561 O VAL A 55 11.727 -9.599 -3.140 1.00 0.00 O ATOM 562 CB VAL A 55 10.261 -8.492 -0.010 1.00 0.00 C ATOM 563 CG1 VAL A 55 11.607 -8.882 0.604 1.00 0.00 C ATOM 564 CG2 VAL A 55 9.906 -7.076 0.444 1.00 0.00 C ATOM 0 H VAL A 55 8.226 -8.444 -1.193 1.00 0.00 H new ATOM 0 HA VAL A 55 10.831 -7.693 -1.940 1.00 0.00 H new ATOM 0 HB VAL A 55 9.522 -9.217 0.332 1.00 0.00 H new ATOM 0 HG11 VAL A 55 11.541 -8.826 1.691 1.00 0.00 H new ATOM 0 HG12 VAL A 55 11.861 -9.900 0.308 1.00 0.00 H new ATOM 0 HG13 VAL A 55 12.379 -8.198 0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 55 9.902 -7.033 1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 55 10.644 -6.374 0.056 1.00 0.00 H new ATOM 0 HG23 VAL A 55 8.919 -6.810 0.067 1.00 0.00 H new ATOM 574 N LYS A 56 10.741 -10.942 -1.615 1.00 0.00 N ATOM 575 CA LYS A 56 11.576 -12.159 -1.627 1.00 0.00 C ATOM 576 C LYS A 56 12.991 -11.894 -1.086 1.00 0.00 C ATOM 577 O LYS A 56 13.481 -10.767 -1.098 1.00 0.00 O ATOM 578 CB LYS A 56 11.580 -12.770 -3.034 1.00 0.00 C ATOM 579 CG LYS A 56 10.185 -13.254 -3.470 1.00 0.00 C ATOM 580 CD LYS A 56 9.957 -14.755 -3.255 1.00 0.00 C ATOM 581 CE LYS A 56 8.538 -15.098 -3.727 1.00 0.00 C ATOM 582 NZ LYS A 56 8.497 -15.748 -5.055 1.00 0.00 N ATOM 0 H LYS A 56 9.871 -11.106 -1.109 1.00 0.00 H new ATOM 0 HA LYS A 56 11.140 -12.890 -0.946 1.00 0.00 H new ATOM 0 HB2 LYS A 56 11.944 -12.030 -3.747 1.00 0.00 H new ATOM 0 HB3 LYS A 56 12.277 -13.608 -3.061 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.428 -12.698 -2.917 1.00 0.00 H new ATOM 0 HG3 LYS A 56 10.043 -13.022 -4.525 1.00 0.00 H new ATOM 0 HD2 LYS A 56 10.693 -15.335 -3.812 1.00 0.00 H new ATOM 0 HD3 LYS A 56 10.080 -15.011 -2.203 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.070 -15.756 -2.995 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.944 -14.184 -3.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.510 -15.952 -5.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 8.915 -15.114 -5.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 9.037 -16.636 -5.023 1.00 0.00 H new ATOM 596 N PRO A 57 13.714 -12.922 -0.620 1.00 0.00 N ATOM 597 CA PRO A 57 15.145 -12.808 -0.338 1.00 0.00 C ATOM 598 C PRO A 57 15.967 -12.693 -1.631 1.00 0.00 C ATOM 599 O PRO A 57 17.176 -12.482 -1.575 1.00 0.00 O ATOM 600 CB PRO A 57 15.498 -14.049 0.476 1.00 0.00 C ATOM 601 CG PRO A 57 14.430 -15.076 0.103 1.00 0.00 C ATOM 602 CD PRO A 57 13.207 -14.255 -0.308 1.00 0.00 C ATOM 0 HA PRO A 57 15.380 -11.901 0.218 1.00 0.00 H new ATOM 0 HB2 PRO A 57 16.497 -14.411 0.233 1.00 0.00 H new ATOM 0 HB3 PRO A 57 15.487 -13.837 1.545 1.00 0.00 H new ATOM 0 HG2 PRO A 57 14.767 -15.715 -0.713 1.00 0.00 H new ATOM 0 HG3 PRO A 57 14.201 -15.729 0.945 1.00 0.00 H new ATOM 0 HD2 PRO A 57 12.711 -14.697 -1.172 1.00 0.00 H new ATOM 0 HD3 PRO A 57 12.473 -14.216 0.497 1.00 0.00 H new ATOM 610 N SER A 58 15.330 -12.809 -2.794 1.00 0.00 N ATOM 611 CA SER A 58 15.900 -12.603 -4.120 1.00 0.00 C ATOM 612 C SER A 58 16.277 -11.140 -4.402 1.00 0.00 C ATOM 613 O SER A 58 16.693 -10.845 -5.524 1.00 0.00 O ATOM 614 CB SER A 58 14.881 -13.115 -5.149 1.00 0.00 C ATOM 615 OG SER A 58 14.322 -14.373 -4.776 1.00 0.00 O ATOM 0 H SER A 58 14.343 -13.065 -2.837 1.00 0.00 H new ATOM 0 HA SER A 58 16.837 -13.156 -4.185 1.00 0.00 H new ATOM 0 HB2 SER A 58 14.081 -12.383 -5.260 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.365 -13.209 -6.121 1.00 0.00 H new ATOM 0 HG SER A 58 13.679 -14.660 -5.457 1.00 0.00 H new ATOM 621 N ASP A 59 16.139 -10.212 -3.448 1.00 0.00 N ATOM 622 CA ASP A 59 16.348 -8.777 -3.647 1.00 0.00 C ATOM 623 C ASP A 59 17.151 -8.178 -2.479 1.00 0.00 C ATOM 624 O ASP A 59 17.455 -8.867 -1.499 1.00 0.00 O ATOM 625 CB ASP A 59 14.978 -8.097 -3.818 1.00 0.00 C ATOM 626 CG ASP A 59 15.022 -6.728 -4.503 1.00 0.00 C ATOM 627 OD1 ASP A 59 16.112 -6.199 -4.817 1.00 0.00 O ATOM 628 OD2 ASP A 59 13.920 -6.175 -4.718 1.00 0.00 O ATOM 0 H ASP A 59 15.872 -10.447 -2.492 1.00 0.00 H new ATOM 0 HA ASP A 59 16.936 -8.605 -4.549 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.330 -8.756 -4.396 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.520 -7.982 -2.836 1.00 0.00 H new ATOM 633 N THR A 60 17.534 -6.909 -2.580 1.00 0.00 N ATOM 634 CA THR A 60 18.280 -6.152 -1.583 1.00 0.00 C ATOM 635 C THR A 60 17.276 -5.478 -0.649 1.00 0.00 C ATOM 636 O THR A 60 16.620 -4.509 -1.049 1.00 0.00 O ATOM 637 CB THR A 60 19.163 -5.099 -2.274 1.00 0.00 C ATOM 638 OG1 THR A 60 19.660 -5.564 -3.513 1.00 0.00 O ATOM 639 CG2 THR A 60 20.342 -4.732 -1.372 1.00 0.00 C ATOM 0 H THR A 60 17.320 -6.351 -3.406 1.00 0.00 H new ATOM 0 HA THR A 60 18.930 -6.815 -1.012 1.00 0.00 H new ATOM 0 HB THR A 60 18.542 -4.223 -2.458 1.00 0.00 H new ATOM 0 HG1 THR A 60 20.215 -4.869 -3.924 1.00 0.00 H new ATOM 0 HG21 THR A 60 20.962 -3.986 -1.869 1.00 0.00 H new ATOM 0 HG22 THR A 60 19.968 -4.326 -0.432 1.00 0.00 H new ATOM 0 HG23 THR A 60 20.937 -5.623 -1.171 1.00 0.00 H new ATOM 647 N VAL A 61 17.096 -5.997 0.564 1.00 0.00 N ATOM 648 CA VAL A 61 16.004 -5.587 1.441 1.00 0.00 C ATOM 649 C VAL A 61 16.386 -5.724 2.923 1.00 0.00 C ATOM 650 O VAL A 61 17.215 -6.567 3.291 1.00 0.00 O ATOM 651 CB VAL A 61 14.740 -6.421 1.139 1.00 0.00 C ATOM 652 CG1 VAL A 61 14.024 -5.974 -0.147 1.00 0.00 C ATOM 653 CG2 VAL A 61 15.072 -7.920 1.064 1.00 0.00 C ATOM 0 H VAL A 61 17.703 -6.712 0.965 1.00 0.00 H new ATOM 0 HA VAL A 61 15.798 -4.534 1.247 1.00 0.00 H new ATOM 0 HB VAL A 61 14.055 -6.247 1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 61 13.143 -6.596 -0.308 1.00 0.00 H new ATOM 0 HG12 VAL A 61 13.720 -4.932 -0.051 1.00 0.00 H new ATOM 0 HG13 VAL A 61 14.701 -6.077 -0.995 1.00 0.00 H new ATOM 0 HG21 VAL A 61 14.164 -8.484 0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 61 15.801 -8.092 0.272 1.00 0.00 H new ATOM 0 HG23 VAL A 61 15.487 -8.249 2.017 1.00 0.00 H new ATOM 663 N PRO A 62 15.752 -4.936 3.808 1.00 0.00 N ATOM 664 CA PRO A 62 15.957 -5.044 5.243 1.00 0.00 C ATOM 665 C PRO A 62 15.366 -6.353 5.785 1.00 0.00 C ATOM 666 O PRO A 62 14.601 -7.041 5.104 1.00 0.00 O ATOM 667 CB PRO A 62 15.317 -3.786 5.836 1.00 0.00 C ATOM 668 CG PRO A 62 14.257 -3.379 4.815 1.00 0.00 C ATOM 669 CD PRO A 62 14.783 -3.900 3.487 1.00 0.00 C ATOM 0 HA PRO A 62 17.011 -5.092 5.518 1.00 0.00 H new ATOM 0 HB2 PRO A 62 14.873 -3.988 6.810 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.054 -2.996 5.980 1.00 0.00 H new ATOM 0 HG2 PRO A 62 13.287 -3.815 5.056 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.124 -2.297 4.792 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.972 -4.301 2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.247 -3.099 2.912 1.00 0.00 H new ATOM 677 N ALA A 63 15.724 -6.708 7.019 1.00 0.00 N ATOM 678 CA ALA A 63 15.350 -7.977 7.631 1.00 0.00 C ATOM 679 C ALA A 63 13.886 -7.941 8.090 1.00 0.00 C ATOM 680 O ALA A 63 13.401 -6.897 8.540 1.00 0.00 O ATOM 681 CB ALA A 63 16.289 -8.232 8.812 1.00 0.00 C ATOM 0 H ALA A 63 16.288 -6.114 7.626 1.00 0.00 H new ATOM 0 HA ALA A 63 15.443 -8.786 6.907 1.00 0.00 H new ATOM 0 HB1 ALA A 63 16.028 -9.178 9.287 1.00 0.00 H new ATOM 0 HB2 ALA A 63 17.318 -8.277 8.456 1.00 0.00 H new ATOM 0 HB3 ALA A 63 16.191 -7.423 9.536 1.00 0.00 H new ATOM 687 N GLY A 64 13.184 -9.073 8.036 1.00 0.00 N ATOM 688 CA GLY A 64 11.816 -9.179 8.535 1.00 0.00 C ATOM 689 C GLY A 64 10.765 -8.591 7.595 1.00 0.00 C ATOM 690 O GLY A 64 9.745 -8.082 8.061 1.00 0.00 O ATOM 0 H GLY A 64 13.549 -9.941 7.645 1.00 0.00 H new ATOM 0 HA2 GLY A 64 11.585 -10.230 8.711 1.00 0.00 H new ATOM 0 HA3 GLY A 64 11.751 -8.673 9.498 1.00 0.00 H new ATOM 694 N VAL A 65 10.972 -8.655 6.282 1.00 0.00 N ATOM 695 CA VAL A 65 9.959 -8.347 5.266 1.00 0.00 C ATOM 696 C VAL A 65 9.955 -9.437 4.190 1.00 0.00 C ATOM 697 O VAL A 65 9.614 -9.167 3.051 1.00 0.00 O ATOM 698 CB VAL A 65 10.119 -6.907 4.702 1.00 0.00 C ATOM 699 CG1 VAL A 65 9.594 -5.860 5.694 1.00 0.00 C ATOM 700 CG2 VAL A 65 11.556 -6.544 4.296 1.00 0.00 C ATOM 0 H VAL A 65 11.869 -8.929 5.882 1.00 0.00 H new ATOM 0 HA VAL A 65 8.973 -8.353 5.731 1.00 0.00 H new ATOM 0 HB VAL A 65 9.520 -6.897 3.791 1.00 0.00 H new ATOM 0 HG11 VAL A 65 9.720 -4.863 5.271 1.00 0.00 H new ATOM 0 HG12 VAL A 65 8.537 -6.041 5.889 1.00 0.00 H new ATOM 0 HG13 VAL A 65 10.152 -5.931 6.628 1.00 0.00 H new ATOM 0 HG21 VAL A 65 11.579 -5.524 3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 65 12.210 -6.621 5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.900 -7.230 3.522 1.00 0.00 H new ATOM 710 N ASP A 66 10.375 -10.667 4.519 1.00 0.00 N ATOM 711 CA ASP A 66 10.924 -11.643 3.566 1.00 0.00 C ATOM 712 C ASP A 66 9.995 -12.089 2.435 1.00 0.00 C ATOM 713 O ASP A 66 10.447 -12.573 1.401 1.00 0.00 O ATOM 714 CB ASP A 66 11.425 -12.856 4.365 1.00 0.00 C ATOM 715 CG ASP A 66 12.373 -13.749 3.562 1.00 0.00 C ATOM 716 OD1 ASP A 66 13.421 -13.204 3.119 1.00 0.00 O ATOM 717 OD2 ASP A 66 12.122 -14.969 3.471 1.00 0.00 O ATOM 0 H ASP A 66 10.342 -11.019 5.476 1.00 0.00 H new ATOM 0 HA ASP A 66 11.728 -11.130 3.039 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.936 -12.507 5.263 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.570 -13.446 4.694 1.00 0.00 H new ATOM 722 N ASP A 67 8.710 -11.824 2.603 1.00 0.00 N ATOM 723 CA ASP A 67 7.617 -12.100 1.669 1.00 0.00 C ATOM 724 C ASP A 67 6.553 -10.990 1.702 1.00 0.00 C ATOM 725 O ASP A 67 5.438 -11.165 1.206 1.00 0.00 O ATOM 726 CB ASP A 67 7.026 -13.491 1.959 1.00 0.00 C ATOM 727 CG ASP A 67 5.893 -13.472 2.986 1.00 0.00 C ATOM 728 OD1 ASP A 67 6.050 -12.854 4.066 1.00 0.00 O ATOM 729 OD2 ASP A 67 4.832 -14.077 2.709 1.00 0.00 O ATOM 0 H ASP A 67 8.373 -11.378 3.456 1.00 0.00 H new ATOM 0 HA ASP A 67 8.012 -12.108 0.653 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.655 -13.920 1.028 1.00 0.00 H new ATOM 0 HB3 ASP A 67 7.820 -14.146 2.318 1.00 0.00 H new ATOM 734 N TYR A 68 6.880 -9.836 2.291 1.00 0.00 N ATOM 735 CA TYR A 68 6.008 -8.667 2.306 1.00 0.00 C ATOM 736 C TYR A 68 5.864 -8.151 0.879 1.00 0.00 C ATOM 737 O TYR A 68 6.808 -8.182 0.081 1.00 0.00 O ATOM 738 CB TYR A 68 6.550 -7.570 3.235 1.00 0.00 C ATOM 739 CG TYR A 68 6.234 -7.750 4.717 1.00 0.00 C ATOM 740 CD1 TYR A 68 6.275 -9.020 5.330 1.00 0.00 C ATOM 741 CD2 TYR A 68 5.795 -6.642 5.475 1.00 0.00 C ATOM 742 CE1 TYR A 68 5.869 -9.182 6.664 1.00 0.00 C ATOM 743 CE2 TYR A 68 5.387 -6.803 6.815 1.00 0.00 C ATOM 744 CZ TYR A 68 5.417 -8.081 7.416 1.00 0.00 C ATOM 745 OH TYR A 68 5.025 -8.260 8.708 1.00 0.00 O ATOM 0 H TYR A 68 7.766 -9.690 2.774 1.00 0.00 H new ATOM 0 HA TYR A 68 5.031 -8.953 2.696 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.632 -7.519 3.116 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.148 -6.611 2.909 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.622 -9.875 4.768 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.772 -5.661 5.023 1.00 0.00 H new ATOM 0 HE1 TYR A 68 5.904 -10.161 7.118 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.051 -5.948 7.383 1.00 0.00 H new ATOM 0 HH TYR A 68 4.972 -7.391 9.157 1.00 0.00 H new ATOM 755 N SER A 69 4.684 -7.622 0.581 1.00 0.00 N ATOM 756 CA SER A 69 4.500 -6.791 -0.584 1.00 0.00 C ATOM 757 C SER A 69 5.137 -5.420 -0.359 1.00 0.00 C ATOM 758 O SER A 69 5.347 -4.982 0.776 1.00 0.00 O ATOM 759 CB SER A 69 3.014 -6.689 -0.951 1.00 0.00 C ATOM 760 OG SER A 69 2.144 -6.813 0.163 1.00 0.00 O ATOM 0 H SER A 69 3.841 -7.759 1.138 1.00 0.00 H new ATOM 0 HA SER A 69 5.004 -7.251 -1.434 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.833 -5.730 -1.437 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.774 -7.465 -1.677 1.00 0.00 H new ATOM 0 HG SER A 69 1.463 -6.109 0.126 1.00 0.00 H new ATOM 766 N TYR A 70 5.369 -4.702 -1.452 1.00 0.00 N ATOM 767 CA TYR A 70 5.681 -3.289 -1.472 1.00 0.00 C ATOM 768 C TYR A 70 4.876 -2.604 -2.566 1.00 0.00 C ATOM 769 O TYR A 70 4.212 -3.253 -3.379 1.00 0.00 O ATOM 770 CB TYR A 70 7.193 -3.061 -1.637 1.00 0.00 C ATOM 771 CG TYR A 70 7.822 -3.642 -2.892 1.00 0.00 C ATOM 772 CD1 TYR A 70 7.637 -3.015 -4.140 1.00 0.00 C ATOM 773 CD2 TYR A 70 8.639 -4.785 -2.802 1.00 0.00 C ATOM 774 CE1 TYR A 70 8.249 -3.529 -5.296 1.00 0.00 C ATOM 775 CE2 TYR A 70 9.280 -5.285 -3.947 1.00 0.00 C ATOM 776 CZ TYR A 70 9.079 -4.671 -5.203 1.00 0.00 C ATOM 777 OH TYR A 70 9.717 -5.149 -6.306 1.00 0.00 O ATOM 0 H TYR A 70 5.342 -5.112 -2.385 1.00 0.00 H new ATOM 0 HA TYR A 70 5.401 -2.845 -0.517 1.00 0.00 H new ATOM 0 HB2 TYR A 70 7.382 -1.988 -1.624 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.701 -3.485 -0.771 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.019 -2.132 -4.209 1.00 0.00 H new ATOM 0 HD2 TYR A 70 8.773 -5.278 -1.851 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.086 -3.054 -6.252 1.00 0.00 H new ATOM 0 HE2 TYR A 70 9.930 -6.144 -3.867 1.00 0.00 H new ATOM 0 HH TYR A 70 10.246 -5.937 -6.062 1.00 0.00 H new ATOM 787 N LEU A 71 4.956 -1.278 -2.577 1.00 0.00 N ATOM 788 CA LEU A 71 4.497 -0.401 -3.640 1.00 0.00 C ATOM 789 C LEU A 71 5.652 0.556 -3.931 1.00 0.00 C ATOM 790 O LEU A 71 6.246 1.038 -2.954 1.00 0.00 O ATOM 791 CB LEU A 71 3.258 0.375 -3.170 1.00 0.00 C ATOM 792 CG LEU A 71 1.967 -0.459 -3.232 1.00 0.00 C ATOM 793 CD1 LEU A 71 0.984 0.075 -2.196 1.00 0.00 C ATOM 794 CD2 LEU A 71 1.298 -0.448 -4.608 1.00 0.00 C ATOM 0 H LEU A 71 5.366 -0.761 -1.800 1.00 0.00 H new ATOM 0 HA LEU A 71 4.217 -0.958 -4.534 1.00 0.00 H new ATOM 0 HB2 LEU A 71 3.416 0.715 -2.146 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.138 1.266 -3.787 1.00 0.00 H new ATOM 0 HG LEU A 71 2.246 -1.492 -3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.065 -0.510 -2.232 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.425 -0.002 -1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.759 1.119 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.394 -1.056 -4.578 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.038 0.576 -4.878 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.985 -0.855 -5.350 1.00 0.00 H new ATOM 806 N VAL A 72 5.999 0.838 -5.197 1.00 0.00 N ATOM 807 CA VAL A 72 7.106 1.752 -5.469 1.00 0.00 C ATOM 808 C VAL A 72 6.876 2.508 -6.780 1.00 0.00 C ATOM 809 O VAL A 72 6.171 2.039 -7.671 1.00 0.00 O ATOM 810 CB VAL A 72 8.441 0.973 -5.405 1.00 0.00 C ATOM 811 CG1 VAL A 72 8.557 -0.287 -6.250 1.00 0.00 C ATOM 812 CG2 VAL A 72 9.630 1.837 -5.793 1.00 0.00 C ATOM 0 H VAL A 72 5.540 0.456 -6.024 1.00 0.00 H new ATOM 0 HA VAL A 72 7.161 2.526 -4.703 1.00 0.00 H new ATOM 0 HB VAL A 72 8.447 0.673 -4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 72 9.543 -0.730 -6.109 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.791 -1.001 -5.946 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.420 -0.034 -7.301 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.544 1.246 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.499 2.200 -6.812 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.701 2.685 -5.112 1.00 0.00 H new ATOM 822 N ALA A 73 7.441 3.711 -6.893 1.00 0.00 N ATOM 823 CA ALA A 73 7.437 4.476 -8.118 1.00 0.00 C ATOM 824 C ALA A 73 8.523 3.910 -9.040 1.00 0.00 C ATOM 825 O ALA A 73 9.714 4.037 -8.767 1.00 0.00 O ATOM 826 CB ALA A 73 7.693 5.928 -7.746 1.00 0.00 C ATOM 0 H ALA A 73 7.917 4.178 -6.121 1.00 0.00 H new ATOM 0 HA ALA A 73 6.487 4.416 -8.649 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.697 6.539 -8.648 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.907 6.276 -7.076 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.658 6.011 -7.247 1.00 0.00 H new ATOM 832 N ALA A 74 8.099 3.304 -10.140 1.00 0.00 N ATOM 833 CA ALA A 74 8.867 2.717 -11.232 1.00 0.00 C ATOM 834 C ALA A 74 9.705 3.714 -12.033 1.00 0.00 C ATOM 835 O ALA A 74 10.483 3.302 -12.895 1.00 0.00 O ATOM 836 CB ALA A 74 7.870 2.079 -12.205 1.00 0.00 C ATOM 0 H ALA A 74 7.098 3.200 -10.308 1.00 0.00 H new ATOM 0 HA ALA A 74 9.563 2.011 -10.778 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.411 1.629 -13.037 1.00 0.00 H new ATOM 0 HB2 ALA A 74 7.297 1.310 -11.687 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.192 2.843 -12.584 1.00 0.00 H new ATOM 842 N ASP A 75 9.510 5.004 -11.801 1.00 0.00 N ATOM 843 CA ASP A 75 10.380 6.049 -12.308 1.00 0.00 C ATOM 844 C ASP A 75 11.219 6.611 -11.176 1.00 0.00 C ATOM 845 O ASP A 75 12.402 6.889 -11.341 1.00 0.00 O ATOM 846 CB ASP A 75 9.570 7.181 -12.954 1.00 0.00 C ATOM 847 CG ASP A 75 10.423 8.452 -13.125 1.00 0.00 C ATOM 848 OD1 ASP A 75 11.315 8.440 -14.015 1.00 0.00 O ATOM 849 OD2 ASP A 75 10.193 9.425 -12.359 1.00 0.00 O ATOM 0 H ASP A 75 8.730 5.357 -11.246 1.00 0.00 H new ATOM 0 HA ASP A 75 11.027 5.612 -13.068 1.00 0.00 H new ATOM 0 HB2 ASP A 75 9.198 6.856 -13.926 1.00 0.00 H new ATOM 0 HB3 ASP A 75 8.699 7.405 -12.338 1.00 0.00 H new ATOM 854 N ASP A 76 10.615 6.762 -10.011 1.00 0.00 N ATOM 855 CA ASP A 76 11.230 7.441 -8.897 1.00 0.00 C ATOM 856 C ASP A 76 11.896 6.376 -8.023 1.00 0.00 C ATOM 857 O ASP A 76 11.614 6.232 -6.828 1.00 0.00 O ATOM 858 CB ASP A 76 10.161 8.267 -8.189 1.00 0.00 C ATOM 859 CG ASP A 76 10.715 9.482 -7.468 1.00 0.00 C ATOM 860 OD1 ASP A 76 11.565 10.197 -8.042 1.00 0.00 O ATOM 861 OD2 ASP A 76 10.238 9.743 -6.340 1.00 0.00 O ATOM 0 H ASP A 76 9.677 6.412 -9.815 1.00 0.00 H new ATOM 0 HA ASP A 76 12.008 8.144 -9.193 1.00 0.00 H new ATOM 0 HB2 ASP A 76 9.422 8.594 -8.920 1.00 0.00 H new ATOM 0 HB3 ASP A 76 9.640 7.634 -7.471 1.00 0.00 H new ATOM 866 N GLN A 77 12.706 5.521 -8.658 1.00 0.00 N ATOM 867 CA GLN A 77 13.204 4.288 -8.051 1.00 0.00 C ATOM 868 C GLN A 77 14.192 4.475 -6.884 1.00 0.00 C ATOM 869 O GLN A 77 14.543 3.474 -6.261 1.00 0.00 O ATOM 870 CB GLN A 77 13.743 3.344 -9.139 1.00 0.00 C ATOM 871 CG GLN A 77 12.606 2.587 -9.858 1.00 0.00 C ATOM 872 CD GLN A 77 13.103 1.314 -10.541 1.00 0.00 C ATOM 873 OE1 GLN A 77 13.280 1.263 -11.758 1.00 0.00 O ATOM 874 NE2 GLN A 77 13.342 0.252 -9.790 1.00 0.00 N ATOM 0 H GLN A 77 13.034 5.669 -9.612 1.00 0.00 H new ATOM 0 HA GLN A 77 12.344 3.824 -7.569 1.00 0.00 H new ATOM 0 HB2 GLN A 77 14.314 3.919 -9.868 1.00 0.00 H new ATOM 0 HB3 GLN A 77 14.430 2.627 -8.690 1.00 0.00 H new ATOM 0 HG2 GLN A 77 11.829 2.331 -9.137 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.149 3.241 -10.600 1.00 0.00 H new ATOM 0 HE21 GLN A 77 13.195 0.297 -8.782 1.00 0.00 H new ATOM 0 HE22 GLN A 77 13.674 -0.612 -10.219 1.00 0.00 H new ATOM 883 N ASP A 78 14.578 5.704 -6.528 1.00 0.00 N ATOM 884 CA ASP A 78 15.292 6.070 -5.284 1.00 0.00 C ATOM 885 C ASP A 78 14.531 7.156 -4.495 1.00 0.00 C ATOM 886 O ASP A 78 15.043 7.773 -3.559 1.00 0.00 O ATOM 887 CB ASP A 78 16.749 6.432 -5.601 1.00 0.00 C ATOM 888 CG ASP A 78 17.551 6.795 -4.350 1.00 0.00 C ATOM 889 OD1 ASP A 78 17.580 5.985 -3.396 1.00 0.00 O ATOM 890 OD2 ASP A 78 18.159 7.889 -4.339 1.00 0.00 O ATOM 0 H ASP A 78 14.397 6.514 -7.121 1.00 0.00 H new ATOM 0 HA ASP A 78 15.324 5.208 -4.617 1.00 0.00 H new ATOM 0 HB2 ASP A 78 17.227 5.591 -6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 78 16.768 7.271 -6.296 1.00 0.00 H new ATOM 895 N GLY A 79 13.268 7.381 -4.851 1.00 0.00 N ATOM 896 CA GLY A 79 12.378 8.289 -4.158 1.00 0.00 C ATOM 897 C GLY A 79 11.796 7.643 -2.910 1.00 0.00 C ATOM 898 O GLY A 79 12.371 7.792 -1.832 1.00 0.00 O ATOM 0 H GLY A 79 12.831 6.922 -5.650 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.919 9.194 -3.883 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.570 8.591 -4.825 1.00 0.00 H new ATOM 902 N THR A 80 10.672 6.942 -3.047 1.00 0.00 N ATOM 903 CA THR A 80 9.886 6.437 -1.922 1.00 0.00 C ATOM 904 C THR A 80 9.577 4.954 -2.146 1.00 0.00 C ATOM 905 O THR A 80 9.641 4.463 -3.278 1.00 0.00 O ATOM 906 CB THR A 80 8.598 7.277 -1.806 1.00 0.00 C ATOM 907 OG1 THR A 80 8.930 8.649 -1.929 1.00 0.00 O ATOM 908 CG2 THR A 80 7.853 7.110 -0.476 1.00 0.00 C ATOM 0 H THR A 80 10.275 6.705 -3.956 1.00 0.00 H new ATOM 0 HA THR A 80 10.441 6.524 -0.988 1.00 0.00 H new ATOM 0 HB THR A 80 7.941 6.923 -2.600 1.00 0.00 H new ATOM 0 HG1 THR A 80 8.116 9.190 -1.858 1.00 0.00 H new ATOM 0 HG21 THR A 80 6.960 7.735 -0.478 1.00 0.00 H new ATOM 0 HG22 THR A 80 7.565 6.066 -0.349 1.00 0.00 H new ATOM 0 HG23 THR A 80 8.504 7.410 0.346 1.00 0.00 H new ATOM 916 N ILE A 81 9.222 4.231 -1.082 1.00 0.00 N ATOM 917 CA ILE A 81 8.698 2.875 -1.151 1.00 0.00 C ATOM 918 C ILE A 81 7.838 2.630 0.091 1.00 0.00 C ATOM 919 O ILE A 81 8.115 3.218 1.142 1.00 0.00 O ATOM 920 CB ILE A 81 9.869 1.860 -1.243 1.00 0.00 C ATOM 921 CG1 ILE A 81 9.350 0.406 -1.210 1.00 0.00 C ATOM 922 CG2 ILE A 81 10.928 2.060 -0.138 1.00 0.00 C ATOM 923 CD1 ILE A 81 10.321 -0.604 -1.821 1.00 0.00 C ATOM 0 H ILE A 81 9.295 4.585 -0.128 1.00 0.00 H new ATOM 0 HA ILE A 81 8.083 2.744 -2.041 1.00 0.00 H new ATOM 0 HB ILE A 81 10.355 2.050 -2.200 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.148 0.124 -0.176 1.00 0.00 H new ATOM 0 HG13 ILE A 81 8.402 0.355 -1.745 1.00 0.00 H new ATOM 0 HG21 ILE A 81 11.721 1.321 -0.256 1.00 0.00 H new ATOM 0 HG22 ILE A 81 11.351 3.061 -0.217 1.00 0.00 H new ATOM 0 HG23 ILE A 81 10.461 1.939 0.840 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.890 -1.604 -1.763 1.00 0.00 H new ATOM 0 HD12 ILE A 81 10.504 -0.348 -2.864 1.00 0.00 H new ATOM 0 HD13 ILE A 81 11.262 -0.582 -1.272 1.00 0.00 H new ATOM 935 N ILE A 82 6.854 1.725 0.031 1.00 0.00 N ATOM 936 CA ILE A 82 5.979 1.417 1.163 1.00 0.00 C ATOM 937 C ILE A 82 5.728 -0.104 1.221 1.00 0.00 C ATOM 938 O ILE A 82 5.095 -0.647 0.317 1.00 0.00 O ATOM 939 CB ILE A 82 4.673 2.256 1.079 1.00 0.00 C ATOM 940 CG1 ILE A 82 4.892 3.732 0.642 1.00 0.00 C ATOM 941 CG2 ILE A 82 4.023 2.261 2.471 1.00 0.00 C ATOM 942 CD1 ILE A 82 3.606 4.546 0.500 1.00 0.00 C ATOM 0 H ILE A 82 6.643 1.185 -0.808 1.00 0.00 H new ATOM 0 HA ILE A 82 6.460 1.697 2.100 1.00 0.00 H new ATOM 0 HB ILE A 82 4.047 1.793 0.317 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.539 4.222 1.370 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.421 3.741 -0.311 1.00 0.00 H new ATOM 0 HG21 ILE A 82 3.103 2.844 2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 82 3.795 1.238 2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.710 2.705 3.192 1.00 0.00 H new ATOM 0 HD11 ILE A 82 3.851 5.563 0.192 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.964 4.084 -0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 82 3.084 4.572 1.457 1.00 0.00 H new ATOM 954 N PHE A 83 6.235 -0.814 2.243 1.00 0.00 N ATOM 955 CA PHE A 83 6.008 -2.256 2.435 1.00 0.00 C ATOM 956 C PHE A 83 4.709 -2.509 3.207 1.00 0.00 C ATOM 957 O PHE A 83 4.284 -1.675 4.014 1.00 0.00 O ATOM 958 CB PHE A 83 7.182 -2.915 3.186 1.00 0.00 C ATOM 959 CG PHE A 83 8.518 -2.811 2.487 1.00 0.00 C ATOM 960 CD1 PHE A 83 8.883 -3.753 1.512 1.00 0.00 C ATOM 961 CD2 PHE A 83 9.393 -1.756 2.798 1.00 0.00 C ATOM 962 CE1 PHE A 83 10.106 -3.612 0.836 1.00 0.00 C ATOM 963 CE2 PHE A 83 10.627 -1.633 2.136 1.00 0.00 C ATOM 964 CZ PHE A 83 10.986 -2.568 1.156 1.00 0.00 C ATOM 0 H PHE A 83 6.821 -0.398 2.967 1.00 0.00 H new ATOM 0 HA PHE A 83 5.930 -2.702 1.443 1.00 0.00 H new ATOM 0 HB2 PHE A 83 7.267 -2.458 4.172 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.950 -3.969 3.342 1.00 0.00 H new ATOM 0 HD1 PHE A 83 8.228 -4.580 1.283 1.00 0.00 H new ATOM 0 HD2 PHE A 83 9.115 -1.034 3.552 1.00 0.00 H new ATOM 0 HE1 PHE A 83 10.372 -4.316 0.061 1.00 0.00 H new ATOM 0 HE2 PHE A 83 11.296 -0.821 2.382 1.00 0.00 H new ATOM 0 HZ PHE A 83 11.936 -2.485 0.649 1.00 0.00 H new ATOM 974 N PHE A 84 4.091 -3.683 3.032 1.00 0.00 N ATOM 975 CA PHE A 84 2.933 -4.122 3.811 1.00 0.00 C ATOM 976 C PHE A 84 2.750 -5.629 3.655 1.00 0.00 C ATOM 977 O PHE A 84 3.124 -6.182 2.619 1.00 0.00 O ATOM 978 CB PHE A 84 1.647 -3.390 3.366 1.00 0.00 C ATOM 979 CG PHE A 84 1.217 -3.658 1.931 1.00 0.00 C ATOM 980 CD1 PHE A 84 1.926 -3.093 0.848 1.00 0.00 C ATOM 981 CD2 PHE A 84 0.107 -4.486 1.670 1.00 0.00 C ATOM 982 CE1 PHE A 84 1.537 -3.366 -0.474 1.00 0.00 C ATOM 983 CE2 PHE A 84 -0.290 -4.746 0.346 1.00 0.00 C ATOM 984 CZ PHE A 84 0.425 -4.187 -0.726 1.00 0.00 C ATOM 0 H PHE A 84 4.388 -4.364 2.333 1.00 0.00 H new ATOM 0 HA PHE A 84 3.115 -3.879 4.858 1.00 0.00 H new ATOM 0 HB2 PHE A 84 0.834 -3.678 4.033 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.796 -2.317 3.490 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.771 -2.448 1.037 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.442 -4.923 2.491 1.00 0.00 H new ATOM 0 HE1 PHE A 84 2.094 -2.944 -1.298 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.146 -5.376 0.153 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.120 -4.388 -1.742 1.00 0.00 H new ATOM 994 N LYS A 85 2.106 -6.279 4.626 1.00 0.00 N ATOM 995 CA LYS A 85 1.631 -7.653 4.511 1.00 0.00 C ATOM 996 C LYS A 85 0.305 -7.768 5.238 1.00 0.00 C ATOM 997 O LYS A 85 0.273 -7.544 6.449 1.00 0.00 O ATOM 998 CB LYS A 85 2.650 -8.638 5.070 1.00 0.00 C ATOM 999 CG LYS A 85 2.516 -9.942 4.281 1.00 0.00 C ATOM 1000 CD LYS A 85 2.906 -11.118 5.146 1.00 0.00 C ATOM 1001 CE LYS A 85 2.927 -12.366 4.270 1.00 0.00 C ATOM 1002 NZ LYS A 85 3.368 -13.560 5.010 1.00 0.00 N ATOM 0 H LYS A 85 1.898 -5.855 5.530 1.00 0.00 H new ATOM 0 HA LYS A 85 1.494 -7.903 3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 85 3.660 -8.237 4.978 1.00 0.00 H new ATOM 0 HB3 LYS A 85 2.471 -8.813 6.131 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.490 -10.061 3.933 1.00 0.00 H new ATOM 0 HG3 LYS A 85 3.150 -9.906 3.395 1.00 0.00 H new ATOM 0 HD2 LYS A 85 3.885 -10.952 5.595 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.197 -11.240 5.965 1.00 0.00 H new ATOM 0 HE2 LYS A 85 1.930 -12.540 3.865 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.591 -12.201 3.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 3.904 -14.184 4.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.974 -13.272 5.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 2.538 -14.069 5.375 1.00 0.00 H new ATOM 1016 N ALA A 86 -0.793 -8.013 4.518 1.00 0.00 N ATOM 1017 CA ALA A 86 -2.089 -8.206 5.151 1.00 0.00 C ATOM 1018 C ALA A 86 -2.185 -9.665 5.559 1.00 0.00 C ATOM 1019 O ALA A 86 -2.550 -10.525 4.758 1.00 0.00 O ATOM 1020 CB ALA A 86 -3.244 -7.716 4.276 1.00 0.00 C ATOM 0 H ALA A 86 -0.805 -8.081 3.500 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.177 -7.590 6.046 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.189 -7.883 4.794 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.123 -6.651 4.076 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.245 -8.264 3.334 1.00 0.00 H new ATOM 1026 N GLU A 87 -1.858 -9.942 6.817 1.00 0.00 N ATOM 1027 CA GLU A 87 -1.912 -11.293 7.386 1.00 0.00 C ATOM 1028 C GLU A 87 -3.348 -11.836 7.470 1.00 0.00 C ATOM 1029 O GLU A 87 -3.546 -12.974 7.888 1.00 0.00 O ATOM 1030 CB GLU A 87 -1.252 -11.334 8.776 1.00 0.00 C ATOM 1031 CG GLU A 87 0.262 -11.572 8.688 1.00 0.00 C ATOM 1032 CD GLU A 87 0.897 -12.003 10.017 1.00 0.00 C ATOM 1033 OE1 GLU A 87 0.187 -12.351 10.996 1.00 0.00 O ATOM 1034 OE2 GLU A 87 2.144 -11.994 10.094 1.00 0.00 O ATOM 0 H GLU A 87 -1.545 -9.232 7.479 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.354 -11.938 6.707 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.442 -10.394 9.295 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.709 -12.125 9.371 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.457 -12.337 7.937 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.745 -10.657 8.344 1.00 0.00 H new ATOM 1041 N GLY A 88 -4.358 -11.052 7.093 1.00 0.00 N ATOM 1042 CA GLY A 88 -5.751 -11.450 7.159 1.00 0.00 C ATOM 1043 C GLY A 88 -6.287 -11.007 8.506 1.00 0.00 C ATOM 1044 O GLY A 88 -5.656 -11.240 9.537 1.00 0.00 O ATOM 0 H GLY A 88 -4.222 -10.109 6.728 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.320 -10.991 6.350 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.847 -12.530 7.044 1.00 0.00 H new ATOM 1048 N GLN A 89 -7.404 -10.281 8.490 1.00 0.00 N ATOM 1049 CA GLN A 89 -7.911 -9.442 9.575 1.00 0.00 C ATOM 1050 C GLN A 89 -6.918 -8.418 10.131 1.00 0.00 C ATOM 1051 O GLN A 89 -7.381 -7.509 10.811 1.00 0.00 O ATOM 1052 CB GLN A 89 -8.500 -10.276 10.726 1.00 0.00 C ATOM 1053 CG GLN A 89 -9.669 -11.174 10.311 1.00 0.00 C ATOM 1054 CD GLN A 89 -10.807 -10.343 9.729 1.00 0.00 C ATOM 1055 OE1 GLN A 89 -11.426 -9.551 10.437 1.00 0.00 O ATOM 1056 NE2 GLN A 89 -11.065 -10.454 8.438 1.00 0.00 N ATOM 0 H GLN A 89 -8.014 -10.262 7.673 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.703 -8.864 9.098 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -7.712 -10.897 11.151 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -8.835 -9.602 11.514 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -9.331 -11.903 9.574 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -10.027 -11.736 11.174 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -10.540 -11.117 7.868 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -11.789 -9.876 8.011 1.00 0.00 H new ATOM 1065 N THR A 90 -5.615 -8.458 9.844 1.00 0.00 N ATOM 1066 CA THR A 90 -4.632 -7.462 10.261 1.00 0.00 C ATOM 1067 C THR A 90 -3.579 -7.281 9.154 1.00 0.00 C ATOM 1068 O THR A 90 -3.430 -8.161 8.305 1.00 0.00 O ATOM 1069 CB THR A 90 -4.073 -7.846 11.650 1.00 0.00 C ATOM 1070 OG1 THR A 90 -5.175 -7.969 12.539 1.00 0.00 O ATOM 1071 CG2 THR A 90 -3.123 -6.810 12.263 1.00 0.00 C ATOM 0 H THR A 90 -5.203 -9.213 9.295 1.00 0.00 H new ATOM 0 HA THR A 90 -5.083 -6.478 10.390 1.00 0.00 H new ATOM 0 HB THR A 90 -3.505 -8.766 11.511 1.00 0.00 H new ATOM 0 HG1 THR A 90 -4.850 -8.214 13.431 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.780 -7.162 13.236 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.266 -6.669 11.605 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.648 -5.862 12.384 1.00 0.00 H new ATOM 1079 N VAL A 91 -2.895 -6.132 9.115 1.00 0.00 N ATOM 1080 CA VAL A 91 -1.938 -5.766 8.078 1.00 0.00 C ATOM 1081 C VAL A 91 -0.818 -4.925 8.634 1.00 0.00 C ATOM 1082 O VAL A 91 -1.043 -3.761 8.938 1.00 0.00 O ATOM 1083 CB VAL A 91 -2.645 -5.084 6.898 1.00 0.00 C ATOM 1084 CG1 VAL A 91 -3.499 -3.858 7.117 1.00 0.00 C ATOM 1085 CG2 VAL A 91 -1.714 -4.741 5.721 1.00 0.00 C ATOM 0 H VAL A 91 -2.999 -5.412 9.830 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.483 -6.681 7.698 1.00 0.00 H new ATOM 0 HB VAL A 91 -3.336 -5.901 6.692 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.910 -3.526 6.164 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.314 -4.099 7.800 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.890 -3.062 7.546 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -2.290 -4.262 4.929 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.932 -4.063 6.062 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.260 -5.655 5.338 1.00 0.00 H new ATOM 1095 N ILE A 92 0.369 -5.504 8.763 1.00 0.00 N ATOM 1096 CA ILE A 92 1.551 -4.808 9.213 1.00 0.00 C ATOM 1097 C ILE A 92 2.067 -4.008 8.017 1.00 0.00 C ATOM 1098 O ILE A 92 2.563 -4.582 7.044 1.00 0.00 O ATOM 1099 CB ILE A 92 2.582 -5.805 9.779 1.00 0.00 C ATOM 1100 CG1 ILE A 92 2.027 -6.663 10.942 1.00 0.00 C ATOM 1101 CG2 ILE A 92 3.791 -5.022 10.319 1.00 0.00 C ATOM 1102 CD1 ILE A 92 1.111 -7.834 10.553 1.00 0.00 C ATOM 0 H ILE A 92 0.532 -6.489 8.552 1.00 0.00 H new ATOM 0 HA ILE A 92 1.339 -4.124 10.035 1.00 0.00 H new ATOM 0 HB ILE A 92 2.850 -6.474 8.961 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.871 -7.062 11.505 1.00 0.00 H new ATOM 0 HG13 ILE A 92 1.476 -6.008 11.616 1.00 0.00 H new ATOM 0 HG21 ILE A 92 4.526 -5.719 10.722 1.00 0.00 H new ATOM 0 HG22 ILE A 92 4.242 -4.446 9.511 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.463 -4.345 11.108 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.788 -8.357 11.453 1.00 0.00 H new ATOM 0 HD12 ILE A 92 0.239 -7.453 10.022 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.656 -8.523 9.908 1.00 0.00 H new ATOM 1114 N ILE A 93 1.910 -2.687 8.077 1.00 0.00 N ATOM 1115 CA ILE A 93 2.433 -1.731 7.109 1.00 0.00 C ATOM 1116 C ILE A 93 3.775 -1.200 7.634 1.00 0.00 C ATOM 1117 O ILE A 93 3.869 -0.674 8.748 1.00 0.00 O ATOM 1118 CB ILE A 93 1.408 -0.605 6.867 1.00 0.00 C ATOM 1119 CG1 ILE A 93 0.016 -1.203 6.556 1.00 0.00 C ATOM 1120 CG2 ILE A 93 1.895 0.292 5.717 1.00 0.00 C ATOM 1121 CD1 ILE A 93 -1.044 -0.151 6.268 1.00 0.00 C ATOM 0 H ILE A 93 1.394 -2.237 8.833 1.00 0.00 H new ATOM 0 HA ILE A 93 2.603 -2.209 6.144 1.00 0.00 H new ATOM 0 HB ILE A 93 1.315 0.002 7.768 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.099 -1.869 5.697 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.307 -1.811 7.401 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.171 1.088 5.545 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.859 0.728 5.979 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.001 -0.304 4.811 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -1.995 -0.641 6.058 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -1.155 0.501 7.135 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.743 0.442 5.404 1.00 0.00 H new ATOM 1133 N LYS A 94 4.824 -1.300 6.819 1.00 0.00 N ATOM 1134 CA LYS A 94 6.213 -0.989 7.160 1.00 0.00 C ATOM 1135 C LYS A 94 6.691 0.052 6.149 1.00 0.00 C ATOM 1136 O LYS A 94 6.958 -0.295 5.007 1.00 0.00 O ATOM 1137 CB LYS A 94 7.040 -2.296 7.135 1.00 0.00 C ATOM 1138 CG LYS A 94 6.977 -3.089 8.453 1.00 0.00 C ATOM 1139 CD LYS A 94 7.887 -4.330 8.447 1.00 0.00 C ATOM 1140 CE LYS A 94 7.834 -5.035 9.811 1.00 0.00 C ATOM 1141 NZ LYS A 94 8.758 -6.187 9.943 1.00 0.00 N ATOM 0 H LYS A 94 4.724 -1.616 5.854 1.00 0.00 H new ATOM 0 HA LYS A 94 6.325 -0.575 8.162 1.00 0.00 H new ATOM 0 HB2 LYS A 94 6.681 -2.928 6.323 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.080 -2.054 6.915 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.265 -2.437 9.278 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.948 -3.399 8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.571 -5.017 7.662 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.912 -4.037 8.221 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.065 -4.309 10.590 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.815 -5.380 9.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.368 -6.869 10.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.871 -6.649 9.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.684 -5.853 10.279 1.00 0.00 H new ATOM 1155 N TYR A 95 6.751 1.335 6.513 1.00 0.00 N ATOM 1156 CA TYR A 95 7.120 2.397 5.571 1.00 0.00 C ATOM 1157 C TYR A 95 8.412 3.099 5.987 1.00 0.00 C ATOM 1158 O TYR A 95 8.864 2.935 7.124 1.00 0.00 O ATOM 1159 CB TYR A 95 5.935 3.351 5.418 1.00 0.00 C ATOM 1160 CG TYR A 95 5.487 4.030 6.689 1.00 0.00 C ATOM 1161 CD1 TYR A 95 6.206 5.123 7.196 1.00 0.00 C ATOM 1162 CD2 TYR A 95 4.354 3.547 7.366 1.00 0.00 C ATOM 1163 CE1 TYR A 95 5.808 5.726 8.397 1.00 0.00 C ATOM 1164 CE2 TYR A 95 3.953 4.134 8.577 1.00 0.00 C ATOM 1165 CZ TYR A 95 4.680 5.239 9.091 1.00 0.00 C ATOM 1166 OH TYR A 95 4.300 5.850 10.242 1.00 0.00 O ATOM 0 H TYR A 95 6.548 1.665 7.456 1.00 0.00 H new ATOM 0 HA TYR A 95 7.337 1.966 4.594 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.198 4.118 4.689 1.00 0.00 H new ATOM 0 HB3 TYR A 95 5.093 2.795 5.006 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.065 5.499 6.661 1.00 0.00 H new ATOM 0 HD2 TYR A 95 3.791 2.723 6.954 1.00 0.00 H new ATOM 0 HE1 TYR A 95 6.365 6.563 8.791 1.00 0.00 H new ATOM 0 HE2 TYR A 95 3.098 3.748 9.113 1.00 0.00 H new ATOM 0 HH TYR A 95 3.507 5.402 10.603 1.00 0.00 H new ATOM 1176 N THR A 96 9.002 3.886 5.085 1.00 0.00 N ATOM 1177 CA THR A 96 10.161 4.731 5.341 1.00 0.00 C ATOM 1178 C THR A 96 10.076 5.989 4.466 1.00 0.00 C ATOM 1179 O THR A 96 9.249 6.074 3.557 1.00 0.00 O ATOM 1180 CB THR A 96 11.462 3.925 5.143 1.00 0.00 C ATOM 1181 OG1 THR A 96 12.555 4.726 5.549 1.00 0.00 O ATOM 1182 CG2 THR A 96 11.664 3.437 3.699 1.00 0.00 C ATOM 0 H THR A 96 8.671 3.952 4.123 1.00 0.00 H new ATOM 0 HA THR A 96 10.170 5.066 6.378 1.00 0.00 H new ATOM 0 HB THR A 96 11.391 3.025 5.754 1.00 0.00 H new ATOM 0 HG1 THR A 96 13.348 4.162 5.667 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.597 2.878 3.631 1.00 0.00 H new ATOM 0 HG22 THR A 96 10.833 2.792 3.413 1.00 0.00 H new ATOM 0 HG23 THR A 96 11.705 4.295 3.028 1.00 0.00 H new ATOM 1190 N SER A 97 10.946 6.956 4.756 1.00 0.00 N ATOM 1191 CA SER A 97 11.178 8.202 4.035 1.00 0.00 C ATOM 1192 C SER A 97 12.529 8.179 3.310 1.00 0.00 C ATOM 1193 O SER A 97 12.881 9.125 2.610 1.00 0.00 O ATOM 1194 CB SER A 97 11.097 9.362 5.037 1.00 0.00 C ATOM 1195 OG SER A 97 11.677 9.056 6.306 1.00 0.00 O ATOM 0 H SER A 97 11.556 6.879 5.570 1.00 0.00 H new ATOM 0 HA SER A 97 10.416 8.332 3.267 1.00 0.00 H new ATOM 0 HB2 SER A 97 11.601 10.232 4.616 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.052 9.637 5.180 1.00 0.00 H new ATOM 0 HG SER A 97 11.596 9.833 6.898 1.00 0.00 H new ATOM 1201 N GLN A 98 13.297 7.101 3.474 1.00 0.00 N ATOM 1202 CA GLN A 98 14.572 6.886 2.797 1.00 0.00 C ATOM 1203 C GLN A 98 14.622 5.461 2.288 1.00 0.00 C ATOM 1204 O GLN A 98 14.387 4.527 3.056 1.00 0.00 O ATOM 1205 CB GLN A 98 15.746 7.073 3.759 1.00 0.00 C ATOM 1206 CG GLN A 98 15.996 8.516 4.184 1.00 0.00 C ATOM 1207 CD GLN A 98 17.011 8.514 5.323 1.00 0.00 C ATOM 1208 OE1 GLN A 98 16.676 8.121 6.446 1.00 0.00 O ATOM 1209 NE2 GLN A 98 18.252 8.880 5.058 1.00 0.00 N ATOM 0 H GLN A 98 13.041 6.335 4.097 1.00 0.00 H new ATOM 0 HA GLN A 98 14.650 7.608 1.984 1.00 0.00 H new ATOM 0 HB2 GLN A 98 15.567 6.471 4.650 1.00 0.00 H new ATOM 0 HB3 GLN A 98 16.649 6.685 3.288 1.00 0.00 H new ATOM 0 HG2 GLN A 98 16.371 9.099 3.343 1.00 0.00 H new ATOM 0 HG3 GLN A 98 15.065 8.983 4.506 1.00 0.00 H new ATOM 0 HE21 GLN A 98 18.500 9.200 4.122 1.00 0.00 H new ATOM 0 HE22 GLN A 98 18.962 8.842 5.789 1.00 0.00 H new ATOM 1218 N ARG A 99 15.001 5.282 1.025 1.00 0.00 N ATOM 1219 CA ARG A 99 15.106 3.964 0.401 1.00 0.00 C ATOM 1220 C ARG A 99 16.033 3.016 1.152 1.00 0.00 C ATOM 1221 O ARG A 99 15.842 1.805 1.063 1.00 0.00 O ATOM 1222 CB ARG A 99 15.521 4.163 -1.070 1.00 0.00 C ATOM 1223 CG ARG A 99 14.281 4.581 -1.869 1.00 0.00 C ATOM 1224 CD ARG A 99 13.732 3.542 -2.847 1.00 0.00 C ATOM 1225 NE ARG A 99 13.888 2.123 -2.467 1.00 0.00 N ATOM 1226 CZ ARG A 99 13.327 1.140 -3.184 1.00 0.00 C ATOM 1227 NH1 ARG A 99 12.516 1.434 -4.186 1.00 0.00 N ATOM 1228 NH2 ARG A 99 13.554 -0.140 -2.920 1.00 0.00 N ATOM 0 H ARG A 99 15.245 6.051 0.401 1.00 0.00 H new ATOM 0 HA ARG A 99 14.135 3.472 0.443 1.00 0.00 H new ATOM 0 HB2 ARG A 99 16.296 4.926 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 99 15.940 3.241 -1.474 1.00 0.00 H new ATOM 0 HG2 ARG A 99 13.491 4.842 -1.165 1.00 0.00 H new ATOM 0 HG3 ARG A 99 14.521 5.486 -2.428 1.00 0.00 H new ATOM 0 HD2 ARG A 99 12.670 3.740 -2.993 1.00 0.00 H new ATOM 0 HD3 ARG A 99 14.219 3.691 -3.811 1.00 0.00 H new ATOM 0 HE ARG A 99 14.435 1.886 -1.640 1.00 0.00 H new ATOM 0 HH11 ARG A 99 12.318 2.409 -4.413 1.00 0.00 H new ATOM 0 HH12 ARG A 99 12.089 0.686 -4.732 1.00 0.00 H new ATOM 0 HH21 ARG A 99 14.172 -0.400 -2.151 1.00 0.00 H new ATOM 0 HH22 ARG A 99 13.111 -0.864 -3.486 1.00 0.00 H new ATOM 1242 N ASN A 100 16.983 3.538 1.930 1.00 0.00 N ATOM 1243 CA ASN A 100 18.096 2.787 2.508 1.00 0.00 C ATOM 1244 C ASN A 100 17.924 2.325 3.953 1.00 0.00 C ATOM 1245 O ASN A 100 18.798 1.639 4.477 1.00 0.00 O ATOM 1246 CB ASN A 100 19.446 3.498 2.311 1.00 0.00 C ATOM 1247 CG ASN A 100 19.384 4.976 2.634 1.00 0.00 C ATOM 1248 OD1 ASN A 100 19.685 5.436 3.728 1.00 0.00 O ATOM 1249 ND2 ASN A 100 18.910 5.736 1.667 1.00 0.00 N ATOM 0 H ASN A 100 16.998 4.526 2.182 1.00 0.00 H new ATOM 0 HA ASN A 100 18.091 1.864 1.928 1.00 0.00 H new ATOM 0 HB2 ASN A 100 20.197 3.024 2.943 1.00 0.00 H new ATOM 0 HB3 ASN A 100 19.772 3.370 1.279 1.00 0.00 H new ATOM 0 HD21 ASN A 100 18.785 6.737 1.820 1.00 0.00 H new ATOM 0 HD22 ASN A 100 18.668 5.323 0.766 1.00 0.00 H new ATOM 1256 N THR A 101 16.805 2.618 4.600 1.00 0.00 N ATOM 1257 CA THR A 101 16.696 2.485 6.065 1.00 0.00 C ATOM 1258 C THR A 101 15.666 1.439 6.519 1.00 0.00 C ATOM 1259 O THR A 101 14.874 0.935 5.717 1.00 0.00 O ATOM 1260 CB THR A 101 16.472 3.866 6.696 1.00 0.00 C ATOM 1261 OG1 THR A 101 15.285 4.448 6.208 1.00 0.00 O ATOM 1262 CG2 THR A 101 17.635 4.816 6.397 1.00 0.00 C ATOM 0 H THR A 101 15.955 2.950 4.144 1.00 0.00 H new ATOM 0 HA THR A 101 17.644 2.090 6.431 1.00 0.00 H new ATOM 0 HB THR A 101 16.401 3.715 7.773 1.00 0.00 H new ATOM 0 HG1 THR A 101 15.157 5.327 6.622 1.00 0.00 H new ATOM 0 HG21 THR A 101 17.442 5.784 6.859 1.00 0.00 H new ATOM 0 HG22 THR A 101 18.558 4.399 6.800 1.00 0.00 H new ATOM 0 HG23 THR A 101 17.734 4.942 5.319 1.00 0.00 H new ATOM 1270 N LYS A 102 15.690 1.067 7.808 1.00 0.00 N ATOM 1271 CA LYS A 102 14.715 0.140 8.394 1.00 0.00 C ATOM 1272 C LYS A 102 13.361 0.846 8.534 1.00 0.00 C ATOM 1273 O LYS A 102 13.314 2.074 8.652 1.00 0.00 O ATOM 1274 CB LYS A 102 15.263 -0.394 9.734 1.00 0.00 C ATOM 1275 CG LYS A 102 14.465 -1.588 10.291 1.00 0.00 C ATOM 1276 CD LYS A 102 13.565 -1.224 11.483 1.00 0.00 C ATOM 1277 CE LYS A 102 12.374 -2.189 11.527 1.00 0.00 C ATOM 1278 NZ LYS A 102 11.583 -2.111 12.767 1.00 0.00 N ATOM 0 H LYS A 102 16.388 1.402 8.473 1.00 0.00 H new ATOM 0 HA LYS A 102 14.557 -0.722 7.746 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.303 -0.693 9.599 1.00 0.00 H new ATOM 0 HB3 LYS A 102 15.256 0.412 10.468 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.848 -2.005 9.495 1.00 0.00 H new ATOM 0 HG3 LYS A 102 15.161 -2.369 10.597 1.00 0.00 H new ATOM 0 HD2 LYS A 102 14.131 -1.283 12.413 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.213 -0.197 11.388 1.00 0.00 H new ATOM 0 HE2 LYS A 102 11.721 -1.983 10.679 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.741 -3.208 11.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.798 -2.791 12.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.190 -2.337 13.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 11.202 -1.149 12.876 1.00 0.00 H new ATOM 1292 N LEU A 103 12.264 0.086 8.510 1.00 0.00 N ATOM 1293 CA LEU A 103 10.910 0.618 8.369 1.00 0.00 C ATOM 1294 C LEU A 103 10.302 0.979 9.729 1.00 0.00 C ATOM 1295 O LEU A 103 10.777 0.536 10.779 1.00 0.00 O ATOM 1296 CB LEU A 103 10.033 -0.414 7.624 1.00 0.00 C ATOM 1297 CG LEU A 103 10.428 -0.750 6.167 1.00 0.00 C ATOM 1298 CD1 LEU A 103 11.003 0.430 5.386 1.00 0.00 C ATOM 1299 CD2 LEU A 103 11.379 -1.941 6.059 1.00 0.00 C ATOM 0 H LEU A 103 12.293 -0.930 8.589 1.00 0.00 H new ATOM 0 HA LEU A 103 10.954 1.539 7.788 1.00 0.00 H new ATOM 0 HB2 LEU A 103 10.038 -1.340 8.198 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.007 -0.047 7.621 1.00 0.00 H new ATOM 0 HG LEU A 103 9.477 -1.019 5.707 1.00 0.00 H new ATOM 0 HD11 LEU A 103 11.254 0.109 4.375 1.00 0.00 H new ATOM 0 HD12 LEU A 103 10.265 1.230 5.340 1.00 0.00 H new ATOM 0 HD13 LEU A 103 11.902 0.793 5.885 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.616 -2.123 5.011 1.00 0.00 H new ATOM 0 HD22 LEU A 103 12.296 -1.725 6.606 1.00 0.00 H new ATOM 0 HD23 LEU A 103 10.904 -2.826 6.483 1.00 0.00 H new ATOM 1311 N LYS A 104 9.239 1.788 9.709 1.00 0.00 N ATOM 1312 CA LYS A 104 8.330 2.042 10.833 1.00 0.00 C ATOM 1313 C LYS A 104 7.436 0.802 11.046 1.00 0.00 C ATOM 1314 O LYS A 104 7.664 -0.234 10.419 1.00 0.00 O ATOM 1315 CB LYS A 104 7.519 3.333 10.556 1.00 0.00 C ATOM 1316 CG LYS A 104 8.281 4.639 10.842 1.00 0.00 C ATOM 1317 CD LYS A 104 9.333 5.006 9.787 1.00 0.00 C ATOM 1318 CE LYS A 104 9.972 6.370 10.085 1.00 0.00 C ATOM 1319 NZ LYS A 104 10.945 6.745 9.039 1.00 0.00 N ATOM 0 H LYS A 104 8.976 2.308 8.872 1.00 0.00 H new ATOM 0 HA LYS A 104 8.884 2.206 11.757 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.204 3.332 9.513 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.613 3.315 11.162 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.562 5.455 10.919 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.772 4.554 11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 104 10.106 4.238 9.759 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.870 5.027 8.801 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.195 7.131 10.152 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.470 6.337 11.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 11.360 7.671 9.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 11.698 6.029 8.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 10.462 6.799 8.119 1.00 0.00 H new ATOM 1333 N ALA A 105 6.446 0.870 11.946 1.00 0.00 N ATOM 1334 CA ALA A 105 5.524 -0.226 12.233 1.00 0.00 C ATOM 1335 C ALA A 105 4.107 0.302 12.507 1.00 0.00 C ATOM 1336 O ALA A 105 3.769 0.642 13.645 1.00 0.00 O ATOM 1337 CB ALA A 105 6.060 -1.037 13.422 1.00 0.00 C ATOM 0 H ALA A 105 6.264 1.705 12.503 1.00 0.00 H new ATOM 0 HA ALA A 105 5.457 -0.878 11.362 1.00 0.00 H new ATOM 0 HB1 ALA A 105 5.376 -1.857 13.641 1.00 0.00 H new ATOM 0 HB2 ALA A 105 7.042 -1.440 13.174 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.143 -0.390 14.296 1.00 0.00 H new ATOM 1343 N LYS A 106 3.246 0.358 11.490 1.00 0.00 N ATOM 1344 CA LYS A 106 1.793 0.499 11.650 1.00 0.00 C ATOM 1345 C LYS A 106 1.201 -0.889 11.398 1.00 0.00 C ATOM 1346 O LYS A 106 1.777 -1.652 10.624 1.00 0.00 O ATOM 1347 CB LYS A 106 1.319 1.569 10.644 1.00 0.00 C ATOM 1348 CG LYS A 106 -0.165 1.967 10.660 1.00 0.00 C ATOM 1349 CD LYS A 106 -0.524 3.163 11.559 1.00 0.00 C ATOM 1350 CE LYS A 106 -1.890 3.706 11.110 1.00 0.00 C ATOM 1351 NZ LYS A 106 -2.403 4.797 11.966 1.00 0.00 N ATOM 0 H LYS A 106 3.541 0.306 10.515 1.00 0.00 H new ATOM 0 HA LYS A 106 1.477 0.830 12.639 1.00 0.00 H new ATOM 0 HB2 LYS A 106 1.908 2.470 10.813 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.559 1.214 9.642 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -0.472 2.198 9.640 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -0.750 1.105 10.982 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -0.562 2.856 12.604 1.00 0.00 H new ATOM 0 HD3 LYS A 106 0.238 3.939 11.482 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.809 4.067 10.085 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.612 2.890 11.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -3.326 5.115 11.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.511 4.452 12.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.733 5.593 11.953 1.00 0.00 H new ATOM 1365 N ALA A 107 0.072 -1.255 12.005 1.00 0.00 N ATOM 1366 CA ALA A 107 -0.633 -2.499 11.769 1.00 0.00 C ATOM 1367 C ALA A 107 -2.126 -2.181 11.787 1.00 0.00 C ATOM 1368 O ALA A 107 -2.535 -1.578 12.789 1.00 0.00 O ATOM 1369 CB ALA A 107 -0.265 -3.557 12.822 1.00 0.00 C ATOM 0 H ALA A 107 -0.388 -0.666 12.699 1.00 0.00 H new ATOM 0 HA ALA A 107 -0.350 -2.923 10.806 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -0.810 -4.479 12.618 1.00 0.00 H new ATOM 0 HB2 ALA A 107 0.807 -3.753 12.782 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -0.530 -3.191 13.814 1.00 0.00 H new ATOM 1375 N LEU A 108 -2.937 -2.513 10.774 1.00 0.00 N ATOM 1376 CA LEU A 108 -4.360 -2.127 10.835 1.00 0.00 C ATOM 1377 C LEU A 108 -5.190 -3.371 10.738 1.00 0.00 C ATOM 1378 O LEU A 108 -4.690 -4.363 10.213 1.00 0.00 O ATOM 1379 CB LEU A 108 -4.729 -1.162 9.703 1.00 0.00 C ATOM 1380 CG LEU A 108 -4.328 0.317 9.864 1.00 0.00 C ATOM 1381 CD1 LEU A 108 -4.348 0.867 11.294 1.00 0.00 C ATOM 1382 CD2 LEU A 108 -2.954 0.548 9.238 1.00 0.00 C ATOM 0 H LEU A 108 -2.655 -3.024 9.938 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.549 -1.612 11.777 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -4.276 -1.534 8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -5.810 -1.204 9.566 1.00 0.00 H new ATOM 0 HG LEU A 108 -5.106 0.876 9.344 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -4.049 1.915 11.285 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -5.355 0.781 11.703 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -3.655 0.297 11.913 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.673 1.595 9.353 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.217 -0.082 9.735 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.990 0.297 8.178 1.00 0.00 H new ATOM 1394 N THR A 109 -6.451 -3.368 11.186 1.00 0.00 N ATOM 1395 CA THR A 109 -7.326 -4.460 10.814 1.00 0.00 C ATOM 1396 C THR A 109 -7.737 -4.304 9.350 1.00 0.00 C ATOM 1397 O THR A 109 -7.783 -3.185 8.834 1.00 0.00 O ATOM 1398 CB THR A 109 -8.524 -4.627 11.758 1.00 0.00 C ATOM 1399 OG1 THR A 109 -9.350 -3.480 11.821 1.00 0.00 O ATOM 1400 CG2 THR A 109 -8.052 -4.979 13.165 1.00 0.00 C ATOM 0 H THR A 109 -6.866 -2.650 11.781 1.00 0.00 H new ATOM 0 HA THR A 109 -6.771 -5.392 10.921 1.00 0.00 H new ATOM 0 HB THR A 109 -9.121 -5.439 11.343 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.286 -3.744 11.700 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.915 -5.093 13.820 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.491 -5.913 13.138 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.412 -4.182 13.544 1.00 0.00 H new ATOM 1408 N LEU A 110 -8.126 -5.398 8.682 1.00 0.00 N ATOM 1409 CA LEU A 110 -8.781 -5.263 7.385 1.00 0.00 C ATOM 1410 C LEU A 110 -10.058 -4.438 7.526 1.00 0.00 C ATOM 1411 O LEU A 110 -10.423 -3.670 6.638 1.00 0.00 O ATOM 1412 CB LEU A 110 -9.149 -6.643 6.846 1.00 0.00 C ATOM 1413 CG LEU A 110 -7.977 -7.456 6.284 1.00 0.00 C ATOM 1414 CD1 LEU A 110 -8.544 -8.781 5.779 1.00 0.00 C ATOM 1415 CD2 LEU A 110 -7.255 -6.748 5.133 1.00 0.00 C ATOM 0 H LEU A 110 -8.002 -6.356 9.009 1.00 0.00 H new ATOM 0 HA LEU A 110 -8.095 -4.765 6.700 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -9.617 -7.216 7.647 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.896 -6.522 6.062 1.00 0.00 H new ATOM 0 HG LEU A 110 -7.241 -7.594 7.076 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -7.737 -9.390 5.370 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.017 -9.313 6.605 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.283 -8.588 5.001 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -6.436 -7.373 4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -7.956 -6.571 4.317 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -6.859 -5.795 5.484 1.00 0.00 H new ATOM 1427 N SER A 111 -10.752 -4.612 8.651 1.00 0.00 N ATOM 1428 CA SER A 111 -11.998 -3.921 8.875 1.00 0.00 C ATOM 1429 C SER A 111 -11.766 -2.411 9.015 1.00 0.00 C ATOM 1430 O SER A 111 -12.571 -1.650 8.470 1.00 0.00 O ATOM 1431 CB SER A 111 -12.720 -4.555 10.064 1.00 0.00 C ATOM 1432 OG SER A 111 -14.117 -4.453 9.875 1.00 0.00 O ATOM 0 H SER A 111 -10.464 -5.226 9.413 1.00 0.00 H new ATOM 0 HA SER A 111 -12.655 -4.030 8.012 1.00 0.00 H new ATOM 0 HB2 SER A 111 -12.431 -5.601 10.163 1.00 0.00 H new ATOM 0 HB3 SER A 111 -12.430 -4.055 10.988 1.00 0.00 H new ATOM 0 HG SER A 111 -14.581 -4.861 10.636 1.00 0.00 H new ATOM 1438 N GLN A 112 -10.651 -1.991 9.643 1.00 0.00 N ATOM 1439 CA GLN A 112 -10.219 -0.599 9.697 1.00 0.00 C ATOM 1440 C GLN A 112 -10.202 -0.024 8.280 1.00 0.00 C ATOM 1441 O GLN A 112 -10.932 0.924 7.998 1.00 0.00 O ATOM 1442 CB GLN A 112 -8.836 -0.419 10.369 1.00 0.00 C ATOM 1443 CG GLN A 112 -8.864 0.210 11.774 1.00 0.00 C ATOM 1444 CD GLN A 112 -8.379 -0.745 12.861 1.00 0.00 C ATOM 1445 OE1 GLN A 112 -7.221 -1.160 12.888 1.00 0.00 O ATOM 1446 NE2 GLN A 112 -9.273 -1.180 13.731 1.00 0.00 N ATOM 0 H GLN A 112 -10.021 -2.627 10.132 1.00 0.00 H new ATOM 0 HA GLN A 112 -10.932 -0.057 10.318 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -8.353 -1.394 10.435 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -8.215 0.202 9.723 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -8.241 1.105 11.779 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -9.881 0.528 12.004 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -10.230 -0.828 13.698 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -9.006 -1.868 14.436 1.00 0.00 H new ATOM 1455 N LEU A 113 -9.416 -0.625 7.378 1.00 0.00 N ATOM 1456 CA LEU A 113 -9.227 -0.118 6.021 1.00 0.00 C ATOM 1457 C LEU A 113 -10.549 0.039 5.279 1.00 0.00 C ATOM 1458 O LEU A 113 -10.744 1.011 4.550 1.00 0.00 O ATOM 1459 CB LEU A 113 -8.306 -1.045 5.202 1.00 0.00 C ATOM 1460 CG LEU A 113 -6.787 -0.860 5.338 1.00 0.00 C ATOM 1461 CD1 LEU A 113 -6.369 0.603 5.221 1.00 0.00 C ATOM 1462 CD2 LEU A 113 -6.247 -1.436 6.641 1.00 0.00 C ATOM 0 H LEU A 113 -8.893 -1.479 7.573 1.00 0.00 H new ATOM 0 HA LEU A 113 -8.763 0.863 6.124 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -8.542 -2.074 5.473 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -8.564 -0.926 4.150 1.00 0.00 H new ATOM 0 HG LEU A 113 -6.353 -1.415 4.506 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -5.287 0.682 5.324 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -6.670 0.991 4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.851 1.183 6.008 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.169 -1.280 6.689 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.724 -0.937 7.485 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.461 -2.504 6.683 1.00 0.00 H new ATOM 1474 N LYS A 114 -11.472 -0.910 5.447 1.00 0.00 N ATOM 1475 CA LYS A 114 -12.772 -0.844 4.790 1.00 0.00 C ATOM 1476 C LYS A 114 -13.545 0.369 5.286 1.00 0.00 C ATOM 1477 O LYS A 114 -14.212 1.030 4.492 1.00 0.00 O ATOM 1478 CB LYS A 114 -13.531 -2.155 5.025 1.00 0.00 C ATOM 1479 CG LYS A 114 -14.923 -2.209 4.368 1.00 0.00 C ATOM 1480 CD LYS A 114 -16.061 -1.648 5.244 1.00 0.00 C ATOM 1481 CE LYS A 114 -17.433 -1.898 4.614 1.00 0.00 C ATOM 1482 NZ LYS A 114 -17.835 -0.826 3.683 1.00 0.00 N ATOM 0 H LYS A 114 -11.340 -1.733 6.034 1.00 0.00 H new ATOM 0 HA LYS A 114 -12.643 -0.725 3.714 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -12.931 -2.982 4.645 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -13.643 -2.309 6.098 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -14.892 -1.651 3.432 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -15.152 -3.244 4.114 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -16.023 -2.110 6.230 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -15.916 -0.577 5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -17.416 -2.849 4.081 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -18.180 -1.988 5.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -18.388 -1.234 2.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -18.414 -0.126 4.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -16.986 -0.362 3.301 1.00 0.00 H new ATOM 1496 N LYS A 115 -13.559 0.597 6.596 1.00 0.00 N ATOM 1497 CA LYS A 115 -14.315 1.687 7.189 1.00 0.00 C ATOM 1498 C LYS A 115 -13.684 3.032 6.829 1.00 0.00 C ATOM 1499 O LYS A 115 -14.409 4.005 6.649 1.00 0.00 O ATOM 1500 CB LYS A 115 -14.353 1.490 8.708 1.00 0.00 C ATOM 1501 CG LYS A 115 -15.764 1.512 9.303 1.00 0.00 C ATOM 1502 CD LYS A 115 -16.415 0.121 9.407 1.00 0.00 C ATOM 1503 CE LYS A 115 -17.160 -0.335 8.152 1.00 0.00 C ATOM 1504 NZ LYS A 115 -18.540 0.192 8.116 1.00 0.00 N ATOM 0 H LYS A 115 -13.047 0.031 7.272 1.00 0.00 H new ATOM 0 HA LYS A 115 -15.333 1.686 6.799 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -13.881 0.538 8.953 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -13.758 2.272 9.181 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.723 1.959 10.296 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.397 2.154 8.691 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -15.641 -0.610 9.638 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -17.112 0.123 10.245 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.619 -0.001 7.266 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -17.185 -1.424 8.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -19.015 -0.137 7.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -19.063 -0.147 8.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -18.515 1.232 8.122 1.00 0.00 H new ATOM 1518 N GLU A 116 -12.357 3.091 6.732 1.00 0.00 N ATOM 1519 CA GLU A 116 -11.636 4.293 6.346 1.00 0.00 C ATOM 1520 C GLU A 116 -11.943 4.617 4.883 1.00 0.00 C ATOM 1521 O GLU A 116 -12.469 5.690 4.591 1.00 0.00 O ATOM 1522 CB GLU A 116 -10.130 4.097 6.578 1.00 0.00 C ATOM 1523 CG GLU A 116 -9.740 3.901 8.053 1.00 0.00 C ATOM 1524 CD GLU A 116 -8.746 4.912 8.641 1.00 0.00 C ATOM 1525 OE1 GLU A 116 -7.536 4.935 8.304 1.00 0.00 O ATOM 1526 OE2 GLU A 116 -9.140 5.569 9.624 1.00 0.00 O ATOM 0 H GLU A 116 -11.749 2.294 6.922 1.00 0.00 H new ATOM 0 HA GLU A 116 -11.958 5.135 6.958 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.795 3.231 6.007 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -9.597 4.963 6.185 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.650 3.929 8.653 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.316 2.903 8.164 1.00 0.00 H new ATOM 1533 N PHE A 117 -11.645 3.692 3.962 1.00 0.00 N ATOM 1534 CA PHE A 117 -11.509 4.004 2.539 1.00 0.00 C ATOM 1535 C PHE A 117 -12.228 3.016 1.623 1.00 0.00 C ATOM 1536 O PHE A 117 -11.899 2.945 0.442 1.00 0.00 O ATOM 1537 CB PHE A 117 -10.032 4.090 2.131 1.00 0.00 C ATOM 1538 CG PHE A 117 -9.077 4.713 3.121 1.00 0.00 C ATOM 1539 CD1 PHE A 117 -9.121 6.094 3.378 1.00 0.00 C ATOM 1540 CD2 PHE A 117 -8.132 3.905 3.779 1.00 0.00 C ATOM 1541 CE1 PHE A 117 -8.229 6.671 4.297 1.00 0.00 C ATOM 1542 CE2 PHE A 117 -7.256 4.478 4.715 1.00 0.00 C ATOM 1543 CZ PHE A 117 -7.303 5.860 4.972 1.00 0.00 C ATOM 0 H PHE A 117 -11.492 2.708 4.185 1.00 0.00 H new ATOM 0 HA PHE A 117 -11.990 4.974 2.410 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.682 3.081 1.914 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -9.971 4.655 1.201 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.843 6.714 2.867 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.080 2.848 3.565 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.255 7.734 4.484 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -6.545 3.856 5.239 1.00 0.00 H new ATOM 0 HZ PHE A 117 -6.625 6.298 5.690 1.00 0.00 H new ATOM 1553 N TYR A 118 -13.195 2.229 2.107 1.00 0.00 N ATOM 1554 CA TYR A 118 -14.007 1.406 1.202 1.00 0.00 C ATOM 1555 C TYR A 118 -15.487 1.350 1.612 1.00 0.00 C ATOM 1556 O TYR A 118 -16.020 0.293 1.959 1.00 0.00 O ATOM 1557 CB TYR A 118 -13.380 0.021 0.950 1.00 0.00 C ATOM 1558 CG TYR A 118 -13.459 -0.444 -0.502 1.00 0.00 C ATOM 1559 CD1 TYR A 118 -12.894 0.331 -1.544 1.00 0.00 C ATOM 1560 CD2 TYR A 118 -14.046 -1.689 -0.809 1.00 0.00 C ATOM 1561 CE1 TYR A 118 -12.858 -0.160 -2.865 1.00 0.00 C ATOM 1562 CE2 TYR A 118 -14.022 -2.182 -2.126 1.00 0.00 C ATOM 1563 CZ TYR A 118 -13.391 -1.437 -3.147 1.00 0.00 C ATOM 1564 OH TYR A 118 -13.284 -1.959 -4.401 1.00 0.00 O ATOM 0 H TYR A 118 -13.432 2.144 3.096 1.00 0.00 H new ATOM 0 HA TYR A 118 -14.003 1.909 0.235 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -12.334 0.046 1.256 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.879 -0.713 1.583 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.487 1.307 -1.325 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -14.517 -2.267 -0.028 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -12.426 0.436 -3.655 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -14.486 -3.130 -2.357 1.00 0.00 H new ATOM 0 HH TYR A 118 -13.702 -2.845 -4.423 1.00 0.00 H new ATOM 1574 N GLN A 119 -16.200 2.480 1.539 1.00 0.00 N ATOM 1575 CA GLN A 119 -17.523 2.663 2.126 1.00 0.00 C ATOM 1576 C GLN A 119 -18.681 2.998 1.172 1.00 0.00 C ATOM 1577 O GLN A 119 -19.821 2.667 1.499 1.00 0.00 O ATOM 1578 CB GLN A 119 -17.395 3.704 3.247 1.00 0.00 C ATOM 1579 CG GLN A 119 -17.123 5.123 2.723 1.00 0.00 C ATOM 1580 CD GLN A 119 -16.119 5.852 3.598 1.00 0.00 C ATOM 1581 OE1 GLN A 119 -16.461 6.293 4.696 1.00 0.00 O ATOM 1582 NE2 GLN A 119 -14.895 5.994 3.104 1.00 0.00 N ATOM 0 H GLN A 119 -15.859 3.311 1.056 1.00 0.00 H new ATOM 0 HA GLN A 119 -17.824 1.684 2.498 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -18.312 3.710 3.836 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -16.588 3.410 3.918 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -16.747 5.070 1.701 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -18.056 5.686 2.690 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -14.667 5.608 2.188 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -14.183 6.489 3.641 1.00 0.00 H new ATOM 1591 N THR A 120 -18.443 3.599 0.007 1.00 0.00 N ATOM 1592 CA THR A 120 -19.469 4.098 -0.916 1.00 0.00 C ATOM 1593 C THR A 120 -19.035 3.775 -2.354 1.00 0.00 C ATOM 1594 O THR A 120 -17.844 3.666 -2.638 1.00 0.00 O ATOM 1595 CB THR A 120 -19.684 5.609 -0.643 1.00 0.00 C ATOM 1596 OG1 THR A 120 -20.600 6.195 -1.550 1.00 0.00 O ATOM 1597 CG2 THR A 120 -18.398 6.443 -0.671 1.00 0.00 C ATOM 0 H THR A 120 -17.496 3.759 -0.335 1.00 0.00 H new ATOM 0 HA THR A 120 -20.433 3.613 -0.766 1.00 0.00 H new ATOM 0 HB THR A 120 -20.085 5.629 0.370 1.00 0.00 H new ATOM 0 HG1 THR A 120 -20.706 7.146 -1.339 1.00 0.00 H new ATOM 0 HG21 THR A 120 -18.637 7.487 -0.471 1.00 0.00 H new ATOM 0 HG22 THR A 120 -17.710 6.076 0.090 1.00 0.00 H new ATOM 0 HG23 THR A 120 -17.931 6.359 -1.653 1.00 0.00 H new ATOM 1605 N ARG A 121 -19.965 3.610 -3.302 1.00 0.00 N ATOM 1606 CA ARG A 121 -19.599 3.224 -4.677 1.00 0.00 C ATOM 1607 C ARG A 121 -18.659 4.205 -5.341 1.00 0.00 C ATOM 1608 O ARG A 121 -17.869 3.795 -6.181 1.00 0.00 O ATOM 1609 CB ARG A 121 -20.813 3.200 -5.593 1.00 0.00 C ATOM 1610 CG ARG A 121 -21.700 1.964 -5.431 1.00 0.00 C ATOM 1611 CD ARG A 121 -23.084 2.389 -4.970 1.00 0.00 C ATOM 1612 NE ARG A 121 -24.072 1.337 -5.225 1.00 0.00 N ATOM 1613 CZ ARG A 121 -25.040 0.976 -4.387 1.00 0.00 C ATOM 1614 NH1 ARG A 121 -24.970 1.278 -3.089 1.00 0.00 N ATOM 1615 NH2 ARG A 121 -26.078 0.302 -4.860 1.00 0.00 N ATOM 0 H ARG A 121 -20.966 3.735 -3.149 1.00 0.00 H new ATOM 0 HA ARG A 121 -19.134 2.245 -4.558 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -21.413 4.090 -5.405 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -20.474 3.256 -6.627 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -21.769 1.427 -6.377 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -21.259 1.279 -4.707 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -23.061 2.620 -3.905 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -23.379 3.302 -5.488 1.00 0.00 H new ATOM 0 HE ARG A 121 -24.013 0.843 -6.115 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -24.167 1.792 -2.728 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -25.720 0.995 -2.458 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -26.125 0.068 -5.852 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -26.830 0.017 -4.232 1.00 0.00 H new ATOM 1629 N SER A 122 -18.753 5.478 -4.980 1.00 0.00 N ATOM 1630 CA SER A 122 -17.903 6.507 -5.522 1.00 0.00 C ATOM 1631 C SER A 122 -16.436 6.119 -5.370 1.00 0.00 C ATOM 1632 O SER A 122 -15.719 6.126 -6.367 1.00 0.00 O ATOM 1633 CB SER A 122 -18.232 7.796 -4.796 1.00 0.00 C ATOM 1634 OG SER A 122 -19.537 8.223 -5.130 1.00 0.00 O ATOM 0 H SER A 122 -19.429 5.819 -4.297 1.00 0.00 H new ATOM 0 HA SER A 122 -18.076 6.639 -6.590 1.00 0.00 H new ATOM 0 HB2 SER A 122 -18.155 7.646 -3.719 1.00 0.00 H new ATOM 0 HB3 SER A 122 -17.509 8.567 -5.063 1.00 0.00 H new ATOM 0 HG SER A 122 -19.741 9.055 -4.655 1.00 0.00 H new ATOM 1640 N GLN A 123 -15.997 5.677 -4.179 1.00 0.00 N ATOM 1641 CA GLN A 123 -14.578 5.346 -4.072 1.00 0.00 C ATOM 1642 C GLN A 123 -14.344 4.032 -4.822 1.00 0.00 C ATOM 1643 O GLN A 123 -13.308 3.853 -5.439 1.00 0.00 O ATOM 1644 CB GLN A 123 -14.035 5.342 -2.627 1.00 0.00 C ATOM 1645 CG GLN A 123 -13.934 4.001 -1.890 1.00 0.00 C ATOM 1646 CD GLN A 123 -15.229 3.593 -1.244 1.00 0.00 C ATOM 1647 OE1 GLN A 123 -15.836 4.368 -0.515 1.00 0.00 O ATOM 1648 NE2 GLN A 123 -15.667 2.352 -1.395 1.00 0.00 N ATOM 0 H GLN A 123 -16.560 5.549 -3.338 1.00 0.00 H new ATOM 0 HA GLN A 123 -13.994 6.140 -4.539 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -13.040 5.787 -2.645 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -14.668 6.001 -2.033 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -13.624 3.228 -2.593 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -13.158 4.068 -1.127 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -15.164 1.704 -2.001 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -16.507 2.045 -0.905 1.00 0.00 H new ATOM 1657 N LYS A 124 -15.318 3.111 -4.833 1.00 0.00 N ATOM 1658 CA LYS A 124 -15.233 1.877 -5.620 1.00 0.00 C ATOM 1659 C LYS A 124 -15.159 2.101 -7.135 1.00 0.00 C ATOM 1660 O LYS A 124 -15.088 1.109 -7.864 1.00 0.00 O ATOM 1661 CB LYS A 124 -16.408 0.936 -5.336 1.00 0.00 C ATOM 1662 CG LYS A 124 -16.543 0.502 -3.869 1.00 0.00 C ATOM 1663 CD LYS A 124 -17.400 -0.756 -3.666 1.00 0.00 C ATOM 1664 CE LYS A 124 -16.828 -1.919 -4.486 1.00 0.00 C ATOM 1665 NZ LYS A 124 -17.488 -3.217 -4.270 1.00 0.00 N ATOM 0 H LYS A 124 -16.182 3.201 -4.299 1.00 0.00 H new ATOM 0 HA LYS A 124 -14.294 1.426 -5.299 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -17.332 1.428 -5.642 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -16.301 0.046 -5.956 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -15.548 0.321 -3.461 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -16.978 1.322 -3.297 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -17.424 -1.023 -2.609 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -18.428 -0.558 -3.969 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -16.896 -1.666 -5.544 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -15.769 -2.023 -4.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -17.035 -3.940 -4.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -17.402 -3.488 -3.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -18.494 -3.141 -4.523 1.00 0.00 H new ATOM 1679 N ARG A 125 -15.241 3.325 -7.652 1.00 0.00 N ATOM 1680 CA ARG A 125 -14.667 3.610 -8.961 1.00 0.00 C ATOM 1681 C ARG A 125 -13.173 3.708 -8.731 1.00 0.00 C ATOM 1682 O ARG A 125 -12.465 2.733 -8.933 1.00 0.00 O ATOM 1683 CB ARG A 125 -15.259 4.879 -9.594 1.00 0.00 C ATOM 1684 CG ARG A 125 -16.531 4.595 -10.389 1.00 0.00 C ATOM 1685 CD ARG A 125 -17.638 3.919 -9.576 1.00 0.00 C ATOM 1686 NE ARG A 125 -18.873 3.852 -10.362 1.00 0.00 N ATOM 1687 CZ ARG A 125 -19.993 3.192 -10.074 1.00 0.00 C ATOM 1688 NH1 ARG A 125 -20.036 2.249 -9.134 1.00 0.00 N ATOM 1689 NH2 ARG A 125 -21.084 3.494 -10.760 1.00 0.00 N ATOM 0 H ARG A 125 -15.690 4.119 -7.195 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.901 2.826 -9.681 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -15.478 5.604 -8.810 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.517 5.334 -10.251 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -16.912 5.533 -10.792 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.281 3.961 -11.240 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -17.327 2.915 -9.288 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -17.814 4.475 -8.655 1.00 0.00 H new ATOM 0 HE ARG A 125 -18.875 4.375 -11.237 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -19.194 2.013 -8.609 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -20.911 1.763 -8.939 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -21.049 4.213 -11.483 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -21.959 3.008 -10.566 1.00 0.00 H new ATOM 1703 N GLU A 126 -12.711 4.865 -8.274 1.00 0.00 N ATOM 1704 CA GLU A 126 -11.308 5.251 -8.331 1.00 0.00 C ATOM 1705 C GLU A 126 -10.386 4.267 -7.622 1.00 0.00 C ATOM 1706 O GLU A 126 -9.395 3.835 -8.196 1.00 0.00 O ATOM 1707 CB GLU A 126 -11.170 6.661 -7.746 1.00 0.00 C ATOM 1708 CG GLU A 126 -10.747 7.654 -8.833 1.00 0.00 C ATOM 1709 CD GLU A 126 -11.445 8.992 -8.641 1.00 0.00 C ATOM 1710 OE1 GLU A 126 -12.649 9.047 -9.003 1.00 0.00 O ATOM 1711 OE2 GLU A 126 -10.819 9.921 -8.084 1.00 0.00 O ATOM 0 H GLU A 126 -13.310 5.572 -7.847 1.00 0.00 H new ATOM 0 HA GLU A 126 -10.992 5.240 -9.374 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -12.118 6.974 -7.308 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.434 6.657 -6.942 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -9.666 7.794 -8.803 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -10.989 7.250 -9.816 1.00 0.00 H new ATOM 1718 N VAL A 127 -10.729 3.911 -6.389 1.00 0.00 N ATOM 1719 CA VAL A 127 -9.992 2.976 -5.544 1.00 0.00 C ATOM 1720 C VAL A 127 -9.836 1.620 -6.243 1.00 0.00 C ATOM 1721 O VAL A 127 -8.805 0.967 -6.100 1.00 0.00 O ATOM 1722 CB VAL A 127 -10.649 2.862 -4.154 1.00 0.00 C ATOM 1723 CG1 VAL A 127 -9.846 1.999 -3.181 1.00 0.00 C ATOM 1724 CG2 VAL A 127 -10.789 4.222 -3.447 1.00 0.00 C ATOM 0 H VAL A 127 -11.562 4.281 -5.931 1.00 0.00 H new ATOM 0 HA VAL A 127 -8.985 3.362 -5.383 1.00 0.00 H new ATOM 0 HB VAL A 127 -11.620 2.419 -4.373 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -10.361 1.958 -2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -9.749 0.991 -3.584 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -8.855 2.432 -3.043 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -11.258 4.079 -2.473 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -9.802 4.666 -3.313 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -11.406 4.885 -4.053 1.00 0.00 H new ATOM 1734 N ASP A 128 -10.855 1.158 -6.964 1.00 0.00 N ATOM 1735 CA ASP A 128 -10.803 -0.085 -7.736 1.00 0.00 C ATOM 1736 C ASP A 128 -10.049 0.123 -9.058 1.00 0.00 C ATOM 1737 O ASP A 128 -9.329 -0.767 -9.506 1.00 0.00 O ATOM 1738 CB ASP A 128 -12.236 -0.606 -7.923 1.00 0.00 C ATOM 1739 CG ASP A 128 -12.369 -2.111 -8.230 1.00 0.00 C ATOM 1740 OD1 ASP A 128 -11.371 -2.858 -8.344 1.00 0.00 O ATOM 1741 OD2 ASP A 128 -13.527 -2.575 -8.340 1.00 0.00 O ATOM 0 H ASP A 128 -11.751 1.641 -7.031 1.00 0.00 H new ATOM 0 HA ASP A 128 -10.239 -0.847 -7.198 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -12.803 -0.388 -7.018 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -12.703 -0.047 -8.734 1.00 0.00 H new ATOM 1746 N ASP A 129 -10.132 1.307 -9.665 1.00 0.00 N ATOM 1747 CA ASP A 129 -9.383 1.660 -10.874 1.00 0.00 C ATOM 1748 C ASP A 129 -7.886 1.790 -10.587 1.00 0.00 C ATOM 1749 O ASP A 129 -7.077 1.446 -11.442 1.00 0.00 O ATOM 1750 CB ASP A 129 -9.905 2.961 -11.513 1.00 0.00 C ATOM 1751 CG ASP A 129 -11.033 2.724 -12.520 1.00 0.00 C ATOM 1752 OD1 ASP A 129 -10.881 1.838 -13.393 1.00 0.00 O ATOM 1753 OD2 ASP A 129 -12.055 3.446 -12.461 1.00 0.00 O ATOM 0 H ASP A 129 -10.730 2.060 -9.326 1.00 0.00 H new ATOM 0 HA ASP A 129 -9.535 0.845 -11.582 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -10.261 3.627 -10.727 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -9.081 3.470 -12.013 1.00 0.00 H new ATOM 1758 N TYR A 130 -7.469 2.209 -9.388 1.00 0.00 N ATOM 1759 CA TYR A 130 -6.059 2.214 -8.987 1.00 0.00 C ATOM 1760 C TYR A 130 -5.486 0.794 -8.956 1.00 0.00 C ATOM 1761 O TYR A 130 -4.279 0.620 -9.105 1.00 0.00 O ATOM 1762 CB TYR A 130 -5.892 2.838 -7.603 1.00 0.00 C ATOM 1763 CG TYR A 130 -6.462 4.227 -7.372 1.00 0.00 C ATOM 1764 CD1 TYR A 130 -6.519 5.227 -8.366 1.00 0.00 C ATOM 1765 CD2 TYR A 130 -6.965 4.506 -6.097 1.00 0.00 C ATOM 1766 CE1 TYR A 130 -7.039 6.500 -8.060 1.00 0.00 C ATOM 1767 CE2 TYR A 130 -7.526 5.751 -5.789 1.00 0.00 C ATOM 1768 CZ TYR A 130 -7.546 6.759 -6.767 1.00 0.00 C ATOM 1769 OH TYR A 130 -8.056 7.967 -6.435 1.00 0.00 O ATOM 0 H TYR A 130 -8.102 2.555 -8.667 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.518 2.805 -9.726 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -6.348 2.165 -6.877 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -4.826 2.873 -7.379 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -6.163 5.016 -9.364 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -6.920 3.744 -5.333 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -7.050 7.276 -8.812 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -7.940 5.935 -4.808 1.00 0.00 H new ATOM 0 HH TYR A 130 -8.564 7.889 -5.601 1.00 0.00 H new ATOM 1779 N VAL A 131 -6.330 -0.225 -8.778 1.00 0.00 N ATOM 1780 CA VAL A 131 -5.914 -1.621 -8.849 1.00 0.00 C ATOM 1781 C VAL A 131 -5.761 -2.062 -10.314 1.00 0.00 C ATOM 1782 O VAL A 131 -5.201 -3.126 -10.575 1.00 0.00 O ATOM 1783 CB VAL A 131 -6.896 -2.508 -8.049 1.00 0.00 C ATOM 1784 CG1 VAL A 131 -6.431 -3.964 -7.998 1.00 0.00 C ATOM 1785 CG2 VAL A 131 -7.026 -2.049 -6.591 1.00 0.00 C ATOM 0 H VAL A 131 -7.323 -0.101 -8.580 1.00 0.00 H new ATOM 0 HA VAL A 131 -4.934 -1.737 -8.387 1.00 0.00 H new ATOM 0 HB VAL A 131 -7.850 -2.420 -8.570 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.147 -4.555 -7.427 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -6.360 -4.359 -9.011 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -5.453 -4.017 -7.519 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.725 -2.700 -6.066 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -6.051 -2.097 -6.106 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -7.394 -1.023 -6.564 1.00 0.00 H new ATOM 1795 N ALA A 132 -6.233 -1.275 -11.283 1.00 0.00 N ATOM 1796 CA ALA A 132 -6.016 -1.500 -12.705 1.00 0.00 C ATOM 1797 C ALA A 132 -4.975 -0.536 -13.286 1.00 0.00 C ATOM 1798 O ALA A 132 -4.436 -0.805 -14.354 1.00 0.00 O ATOM 1799 CB ALA A 132 -7.348 -1.363 -13.436 1.00 0.00 C ATOM 0 H ALA A 132 -6.791 -0.443 -11.090 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.620 -2.506 -12.842 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.197 -1.530 -14.502 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -8.052 -2.100 -13.050 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -7.748 -0.361 -13.279 1.00 0.00 H new ATOM 1805 N GLY A 133 -4.659 0.561 -12.599 1.00 0.00 N ATOM 1806 CA GLY A 133 -3.681 1.567 -13.001 1.00 0.00 C ATOM 1807 C GLY A 133 -2.312 1.360 -12.357 1.00 0.00 C ATOM 1808 O GLY A 133 -1.530 2.311 -12.280 1.00 0.00 O ATOM 0 H GLY A 133 -5.099 0.781 -11.706 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -3.573 1.547 -14.085 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -4.055 2.556 -12.736 1.00 0.00 H new ATOM 1812 N LEU A 134 -2.039 0.160 -11.835 1.00 0.00 N ATOM 1813 CA LEU A 134 -0.765 -0.197 -11.232 1.00 0.00 C ATOM 1814 C LEU A 134 0.016 -1.126 -12.157 1.00 0.00 C ATOM 1815 O LEU A 134 -0.544 -1.914 -12.921 1.00 0.00 O ATOM 1816 CB LEU A 134 -0.935 -0.739 -9.795 1.00 0.00 C ATOM 1817 CG LEU A 134 -1.899 -1.924 -9.550 1.00 0.00 C ATOM 1818 CD1 LEU A 134 -1.354 -3.301 -9.943 1.00 0.00 C ATOM 1819 CD2 LEU A 134 -2.229 -1.993 -8.050 1.00 0.00 C ATOM 0 H LEU A 134 -2.717 -0.602 -11.823 1.00 0.00 H new ATOM 0 HA LEU A 134 -0.165 0.706 -11.117 1.00 0.00 H new ATOM 0 HB2 LEU A 134 0.050 -1.037 -9.437 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -1.265 0.089 -9.168 1.00 0.00 H new ATOM 0 HG LEU A 134 -2.763 -1.723 -10.184 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -2.104 -4.063 -9.732 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.118 -3.309 -11.007 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -0.451 -3.512 -9.370 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -2.908 -2.825 -7.865 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -1.311 -2.141 -7.482 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -2.702 -1.062 -7.738 1.00 0.00 H new ATOM 1831 N ARG A 135 1.336 -1.001 -12.064 1.00 0.00 N ATOM 1832 CA ARG A 135 2.342 -1.939 -12.532 1.00 0.00 C ATOM 1833 C ARG A 135 2.379 -3.118 -11.549 1.00 0.00 C ATOM 1834 O ARG A 135 1.880 -3.017 -10.425 1.00 0.00 O ATOM 1835 CB ARG A 135 3.691 -1.182 -12.611 1.00 0.00 C ATOM 1836 CG ARG A 135 3.761 -0.198 -13.778 1.00 0.00 C ATOM 1837 CD ARG A 135 5.072 0.600 -13.717 1.00 0.00 C ATOM 1838 NE ARG A 135 5.747 0.652 -15.022 1.00 0.00 N ATOM 1839 CZ ARG A 135 6.753 -0.126 -15.440 1.00 0.00 C ATOM 1840 NH1 ARG A 135 7.347 -1.002 -14.641 1.00 0.00 N ATOM 1841 NH2 ARG A 135 7.173 -0.035 -16.693 1.00 0.00 N ATOM 0 H ARG A 135 1.758 -0.181 -11.628 1.00 0.00 H new ATOM 0 HA ARG A 135 2.122 -2.337 -13.522 1.00 0.00 H new ATOM 0 HB2 ARG A 135 3.852 -0.642 -11.678 1.00 0.00 H new ATOM 0 HB3 ARG A 135 4.501 -1.905 -12.705 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.698 -0.737 -14.723 1.00 0.00 H new ATOM 0 HG3 ARG A 135 2.910 0.482 -13.742 1.00 0.00 H new ATOM 0 HD2 ARG A 135 4.863 1.614 -13.376 1.00 0.00 H new ATOM 0 HD3 ARG A 135 5.738 0.147 -12.982 1.00 0.00 H new ATOM 0 HE ARG A 135 5.413 1.357 -15.680 1.00 0.00 H new ATOM 0 HH11 ARG A 135 7.040 -1.099 -13.673 1.00 0.00 H new ATOM 0 HH12 ARG A 135 8.111 -1.578 -14.994 1.00 0.00 H new ATOM 0 HH21 ARG A 135 6.730 0.625 -17.333 1.00 0.00 H new ATOM 0 HH22 ARG A 135 7.939 -0.625 -17.018 1.00 0.00 H new ATOM 1855 N THR A 136 3.077 -4.190 -11.909 1.00 0.00 N ATOM 1856 CA THR A 136 3.255 -5.383 -11.070 1.00 0.00 C ATOM 1857 C THR A 136 4.709 -5.895 -11.051 1.00 0.00 C ATOM 1858 O THR A 136 5.039 -6.861 -10.363 1.00 0.00 O ATOM 1859 CB THR A 136 2.268 -6.494 -11.487 1.00 0.00 C ATOM 1860 OG1 THR A 136 1.580 -6.243 -12.706 1.00 0.00 O ATOM 1861 CG2 THR A 136 1.202 -6.748 -10.429 1.00 0.00 C ATOM 0 H THR A 136 3.548 -4.261 -12.811 1.00 0.00 H new ATOM 0 HA THR A 136 3.029 -5.086 -10.046 1.00 0.00 H new ATOM 0 HB THR A 136 2.915 -7.362 -11.615 1.00 0.00 H new ATOM 0 HG1 THR A 136 0.977 -6.991 -12.901 1.00 0.00 H new ATOM 0 HG21 THR A 136 0.532 -7.538 -10.769 1.00 0.00 H new ATOM 0 HG22 THR A 136 1.679 -7.053 -9.498 1.00 0.00 H new ATOM 0 HG23 THR A 136 0.631 -5.835 -10.262 1.00 0.00 H new ATOM 1869 N GLU A 137 5.562 -5.255 -11.837 1.00 0.00 N ATOM 1870 CA GLU A 137 6.997 -5.422 -12.033 1.00 0.00 C ATOM 1871 C GLU A 137 7.454 -4.314 -12.978 1.00 0.00 C ATOM 1872 O GLU A 137 8.674 -4.090 -13.086 1.00 0.00 O ATOM 1873 CB GLU A 137 7.323 -6.804 -12.628 1.00 0.00 C ATOM 1874 CG GLU A 137 6.615 -7.048 -13.968 1.00 0.00 C ATOM 1875 CD GLU A 137 6.883 -8.451 -14.480 1.00 0.00 C ATOM 1876 OE1 GLU A 137 6.087 -9.360 -14.136 1.00 0.00 O ATOM 1877 OE2 GLU A 137 7.828 -8.626 -15.285 1.00 0.00 O ATOM 0 H GLU A 137 5.216 -4.504 -12.434 1.00 0.00 H new ATOM 0 HA GLU A 137 7.516 -5.359 -11.077 1.00 0.00 H new ATOM 0 HB2 GLU A 137 8.400 -6.891 -12.769 1.00 0.00 H new ATOM 0 HB3 GLU A 137 7.031 -7.579 -11.920 1.00 0.00 H new ATOM 0 HG2 GLU A 137 5.542 -6.900 -13.848 1.00 0.00 H new ATOM 0 HG3 GLU A 137 6.957 -6.318 -14.702 1.00 0.00 H new