USER MOD reduce.3.24.130724 H: found=0, std=0, add=937, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 939 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot -91:sc= 0.719 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.66 K(o=1.4,f=0.84) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 81 THR OG1 : rot 95:sc= 0.274 USER MOD Set 2.2: A 93 THR OG1 : rot 40:sc= 0.0236 USER MOD Set 3.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.521) USER MOD Single : A 7 TYR OH : rot -15:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.104 X(o=0.1,f=-0.11) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0877 K(o=-0.088,f=-0.78) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 19 MET CE :methyl -148:sc= 0 (180deg=-0.0533) USER MOD Single : A 20 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.658) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 34:sc= 0.158 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -7:sc= 0.284 USER MOD Single : A 53 THR OG1 : rot 112:sc= 0.545 USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 69 CYS SG : rot -3:sc= -1.28! USER MOD Single : A 78 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.332) USER MOD Single : A 80 LYS NZ :NH3+ -133:sc= 0.0256 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.63) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 90 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.161) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 99 LYS NZ :NH3+ 146:sc= 0.00878 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= 0.05 X(o=0.05,f=0.0033) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 28:sc= 0.303 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N PHE A 3 9.957 -9.486 -1.576 1.00 0.00 N ATOM 13 CA PHE A 3 8.735 -8.804 -1.050 1.00 0.00 C ATOM 14 C PHE A 3 8.624 -8.642 0.500 1.00 0.00 C ATOM 15 O PHE A 3 7.916 -7.730 0.932 1.00 0.00 O ATOM 16 CB PHE A 3 7.456 -9.495 -1.599 1.00 0.00 C ATOM 17 CG PHE A 3 7.088 -9.193 -3.062 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.338 -8.052 -3.376 1.00 0.00 C ATOM 19 CD2 PHE A 3 7.420 -10.095 -4.077 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.926 -7.823 -4.685 1.00 0.00 C ATOM 21 CE2 PHE A 3 7.006 -9.861 -5.385 1.00 0.00 C ATOM 22 CZ PHE A 3 6.253 -8.729 -5.687 1.00 0.00 C ATOM 0 HA PHE A 3 8.833 -7.783 -1.418 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.578 -10.573 -1.493 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.615 -9.206 -0.969 1.00 0.00 H new ATOM 0 HD1 PHE A 3 6.079 -7.348 -2.599 1.00 0.00 H new ATOM 0 HD2 PHE A 3 8.000 -10.976 -3.845 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.351 -6.940 -4.923 1.00 0.00 H new ATOM 0 HE2 PHE A 3 7.269 -10.558 -6.167 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.923 -8.555 -6.701 1.00 0.00 H new ATOM 32 N SER A 4 9.295 -9.472 1.331 1.00 0.00 N ATOM 33 CA SER A 4 9.297 -9.307 2.810 1.00 0.00 C ATOM 34 C SER A 4 10.178 -8.091 3.226 1.00 0.00 C ATOM 35 O SER A 4 11.405 -8.121 3.079 1.00 0.00 O ATOM 36 CB SER A 4 9.759 -10.614 3.490 1.00 0.00 C ATOM 37 OG SER A 4 8.830 -11.669 3.258 1.00 0.00 O ATOM 0 H SER A 4 9.845 -10.267 1.005 1.00 0.00 H new ATOM 0 HA SER A 4 8.282 -9.099 3.147 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.740 -10.899 3.109 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.868 -10.451 4.562 1.00 0.00 H new ATOM 0 HG SER A 4 9.146 -12.486 3.697 1.00 0.00 H new ATOM 43 N GLY A 5 9.522 -7.014 3.691 1.00 0.00 N ATOM 44 CA GLY A 5 10.198 -5.727 3.955 1.00 0.00 C ATOM 45 C GLY A 5 9.236 -4.563 4.277 1.00 0.00 C ATOM 46 O GLY A 5 8.041 -4.589 3.966 1.00 0.00 O ATOM 0 H GLY A 5 8.522 -7.007 3.893 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.887 -5.856 4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.797 -5.459 3.085 1.00 0.00 H new ATOM 50 N LYS A 6 9.818 -3.512 4.875 1.00 0.00 N ATOM 51 CA LYS A 6 9.104 -2.240 5.187 1.00 0.00 C ATOM 52 C LYS A 6 9.400 -1.216 4.058 1.00 0.00 C ATOM 53 O LYS A 6 10.568 -0.962 3.758 1.00 0.00 O ATOM 54 CB LYS A 6 9.570 -1.658 6.549 1.00 0.00 C ATOM 55 CG LYS A 6 9.299 -2.534 7.794 1.00 0.00 C ATOM 56 CD LYS A 6 9.507 -1.835 9.157 1.00 0.00 C ATOM 57 CE LYS A 6 10.964 -1.603 9.608 1.00 0.00 C ATOM 58 NZ LYS A 6 11.635 -0.486 8.916 1.00 0.00 N ATOM 0 H LYS A 6 10.797 -3.509 5.161 1.00 0.00 H new ATOM 0 HA LYS A 6 8.035 -2.440 5.252 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.642 -1.467 6.491 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.082 -0.695 6.695 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.273 -2.897 7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.949 -3.408 7.750 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.005 -0.868 9.122 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.005 -2.428 9.922 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.975 -1.412 10.681 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.535 -2.516 9.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.388 -0.104 9.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.048 -0.828 8.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.942 0.262 8.712 1.00 0.00 H new ATOM 72 N TYR A 7 8.362 -0.637 3.433 1.00 0.00 N ATOM 73 CA TYR A 7 8.531 0.226 2.226 1.00 0.00 C ATOM 74 C TYR A 7 7.941 1.623 2.550 1.00 0.00 C ATOM 75 O TYR A 7 6.717 1.790 2.570 1.00 0.00 O ATOM 76 CB TYR A 7 7.853 -0.397 0.968 1.00 0.00 C ATOM 77 CG TYR A 7 8.387 -1.766 0.505 1.00 0.00 C ATOM 78 CD1 TYR A 7 7.829 -2.944 1.021 1.00 0.00 C ATOM 79 CD2 TYR A 7 9.419 -1.851 -0.434 1.00 0.00 C ATOM 80 CE1 TYR A 7 8.315 -4.184 0.616 1.00 0.00 C ATOM 81 CE2 TYR A 7 9.883 -3.095 -0.856 1.00 0.00 C ATOM 82 CZ TYR A 7 9.338 -4.259 -0.323 1.00 0.00 C ATOM 83 OH TYR A 7 9.827 -5.476 -0.711 1.00 0.00 O ATOM 0 H TYR A 7 7.393 -0.744 3.734 1.00 0.00 H new ATOM 0 HA TYR A 7 9.591 0.313 1.986 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.787 -0.498 1.170 1.00 0.00 H new ATOM 0 HB3 TYR A 7 7.956 0.306 0.142 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.020 -2.889 1.734 1.00 0.00 H new ATOM 0 HD2 TYR A 7 9.858 -0.949 -0.834 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.897 -5.089 1.032 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.666 -3.156 -1.597 1.00 0.00 H new ATOM 0 HH TYR A 7 9.533 -6.164 -0.078 1.00 0.00 H new ATOM 93 N GLN A 8 8.810 2.624 2.800 1.00 0.00 N ATOM 94 CA GLN A 8 8.370 4.002 3.150 1.00 0.00 C ATOM 95 C GLN A 8 8.337 4.909 1.891 1.00 0.00 C ATOM 96 O GLN A 8 9.258 4.896 1.072 1.00 0.00 O ATOM 97 CB GLN A 8 9.260 4.581 4.280 1.00 0.00 C ATOM 98 CG GLN A 8 8.742 5.931 4.836 1.00 0.00 C ATOM 99 CD GLN A 8 9.445 6.462 6.091 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.542 6.053 6.473 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.805 7.412 6.754 1.00 0.00 N ATOM 0 H GLN A 8 9.823 2.509 2.767 1.00 0.00 H new ATOM 0 HA GLN A 8 7.350 3.964 3.532 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.317 3.859 5.094 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.273 4.716 3.902 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.831 6.681 4.050 1.00 0.00 H new ATOM 0 HG3 GLN A 8 7.680 5.825 5.057 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.897 7.740 6.425 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.220 7.816 7.594 1.00 0.00 H new ATOM 110 N LEU A 9 7.274 5.726 1.790 1.00 0.00 N ATOM 111 CA LEU A 9 6.984 6.573 0.603 1.00 0.00 C ATOM 112 C LEU A 9 8.042 7.692 0.382 1.00 0.00 C ATOM 113 O LEU A 9 8.395 8.430 1.306 1.00 0.00 O ATOM 114 CB LEU A 9 5.553 7.148 0.792 1.00 0.00 C ATOM 115 CG LEU A 9 4.928 7.921 -0.403 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.602 7.012 -1.605 1.00 0.00 C ATOM 117 CD2 LEU A 9 3.666 8.669 0.069 1.00 0.00 C ATOM 0 H LEU A 9 6.582 5.823 2.533 1.00 0.00 H new ATOM 0 HA LEU A 9 7.037 5.968 -0.302 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.888 6.321 1.043 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.570 7.816 1.653 1.00 0.00 H new ATOM 0 HG LEU A 9 5.674 8.635 -0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.168 7.610 -2.406 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.516 6.537 -1.961 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.890 6.245 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.229 9.211 -0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.941 7.952 0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.934 9.374 0.856 1.00 0.00 H new ATOM 129 N GLN A 10 8.527 7.780 -0.865 1.00 0.00 N ATOM 130 CA GLN A 10 9.606 8.720 -1.269 1.00 0.00 C ATOM 131 C GLN A 10 9.047 9.766 -2.273 1.00 0.00 C ATOM 132 O GLN A 10 9.016 10.957 -1.949 1.00 0.00 O ATOM 133 CB GLN A 10 10.839 7.960 -1.835 1.00 0.00 C ATOM 134 CG GLN A 10 11.394 6.795 -0.996 1.00 0.00 C ATOM 135 CD GLN A 10 12.003 7.171 0.365 1.00 0.00 C ATOM 136 OE1 GLN A 10 11.309 7.224 1.380 1.00 0.00 O ATOM 137 NE2 GLN A 10 13.300 7.430 0.418 1.00 0.00 N ATOM 0 H GLN A 10 8.186 7.202 -1.633 1.00 0.00 H new ATOM 0 HA GLN A 10 9.956 9.255 -0.386 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.574 7.572 -2.818 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.642 8.682 -1.983 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.588 6.081 -0.826 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.156 6.282 -1.583 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.865 7.383 -0.430 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.735 7.677 1.307 1.00 0.00 H new ATOM 146 N SER A 11 8.622 9.314 -3.474 1.00 0.00 N ATOM 147 CA SER A 11 8.123 10.198 -4.558 1.00 0.00 C ATOM 148 C SER A 11 6.715 9.710 -4.982 1.00 0.00 C ATOM 149 O SER A 11 6.563 8.626 -5.559 1.00 0.00 O ATOM 150 CB SER A 11 9.102 10.191 -5.754 1.00 0.00 C ATOM 151 OG SER A 11 10.352 10.770 -5.395 1.00 0.00 O ATOM 0 H SER A 11 8.614 8.325 -3.722 1.00 0.00 H new ATOM 0 HA SER A 11 8.055 11.226 -4.201 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.256 9.168 -6.096 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.667 10.743 -6.587 1.00 0.00 H new ATOM 0 HG SER A 11 10.955 10.752 -6.168 1.00 0.00 H new ATOM 157 N GLN A 12 5.695 10.535 -4.685 1.00 0.00 N ATOM 158 CA GLN A 12 4.276 10.218 -4.985 1.00 0.00 C ATOM 159 C GLN A 12 3.816 11.077 -6.195 1.00 0.00 C ATOM 160 O GLN A 12 3.657 12.297 -6.089 1.00 0.00 O ATOM 161 CB GLN A 12 3.435 10.459 -3.706 1.00 0.00 C ATOM 162 CG GLN A 12 1.958 10.014 -3.815 1.00 0.00 C ATOM 163 CD GLN A 12 1.184 9.980 -2.485 1.00 0.00 C ATOM 164 OE1 GLN A 12 0.679 8.936 -2.070 1.00 0.00 O ATOM 165 NE2 GLN A 12 1.058 11.102 -1.791 1.00 0.00 N ATOM 0 H GLN A 12 5.824 11.439 -4.231 1.00 0.00 H new ATOM 0 HA GLN A 12 4.143 9.173 -5.267 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.900 9.929 -2.875 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.464 11.521 -3.462 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.442 10.687 -4.500 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.927 9.020 -4.261 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.477 11.965 -2.137 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.542 11.102 -0.911 1.00 0.00 H new ATOM 174 N GLU A 13 3.595 10.400 -7.332 1.00 0.00 N ATOM 175 CA GLU A 13 3.076 11.025 -8.574 1.00 0.00 C ATOM 176 C GLU A 13 1.543 10.789 -8.648 1.00 0.00 C ATOM 177 O GLU A 13 1.082 9.649 -8.569 1.00 0.00 O ATOM 178 CB GLU A 13 3.838 10.406 -9.781 1.00 0.00 C ATOM 179 CG GLU A 13 3.453 10.897 -11.196 1.00 0.00 C ATOM 180 CD GLU A 13 3.733 12.381 -11.459 1.00 0.00 C ATOM 181 OE1 GLU A 13 4.881 12.727 -11.817 1.00 0.00 O ATOM 182 OE2 GLU A 13 2.806 13.206 -11.310 1.00 0.00 O ATOM 0 H GLU A 13 3.770 9.399 -7.424 1.00 0.00 H new ATOM 0 HA GLU A 13 3.240 12.102 -8.589 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.902 10.593 -9.638 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.697 9.326 -9.750 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.996 10.303 -11.932 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.391 10.708 -11.355 1.00 0.00 H new ATOM 189 N ASN A 14 0.774 11.878 -8.838 1.00 0.00 N ATOM 190 CA ASN A 14 -0.701 11.830 -9.084 1.00 0.00 C ATOM 191 C ASN A 14 -1.572 11.338 -7.880 1.00 0.00 C ATOM 192 O ASN A 14 -2.434 10.468 -8.038 1.00 0.00 O ATOM 193 CB ASN A 14 -1.049 11.143 -10.448 1.00 0.00 C ATOM 194 CG ASN A 14 -0.635 11.888 -11.738 1.00 0.00 C ATOM 195 OD1 ASN A 14 -0.224 13.049 -11.735 1.00 0.00 O ATOM 196 ND2 ASN A 14 -0.751 11.228 -12.879 1.00 0.00 N ATOM 0 H ASN A 14 1.150 12.826 -8.827 1.00 0.00 H new ATOM 0 HA ASN A 14 -1.001 12.874 -9.175 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.580 10.159 -10.460 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.127 10.983 -10.481 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.500 11.681 -13.758 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.092 10.267 -12.880 1.00 0.00 H new ATOM 203 N PHE A 15 -1.396 11.954 -6.693 1.00 0.00 N ATOM 204 CA PHE A 15 -2.319 11.778 -5.532 1.00 0.00 C ATOM 205 C PHE A 15 -3.633 12.608 -5.641 1.00 0.00 C ATOM 206 O PHE A 15 -4.701 12.078 -5.331 1.00 0.00 O ATOM 207 CB PHE A 15 -1.555 12.093 -4.214 1.00 0.00 C ATOM 208 CG PHE A 15 -2.192 11.642 -2.880 1.00 0.00 C ATOM 209 CD1 PHE A 15 -2.512 10.296 -2.672 1.00 0.00 C ATOM 210 CD2 PHE A 15 -2.318 12.540 -1.813 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.924 9.847 -1.420 1.00 0.00 C ATOM 212 CE2 PHE A 15 -2.732 12.088 -0.561 1.00 0.00 C ATOM 213 CZ PHE A 15 -3.032 10.745 -0.364 1.00 0.00 C ATOM 0 H PHE A 15 -0.618 12.586 -6.504 1.00 0.00 H new ATOM 0 HA PHE A 15 -2.643 10.737 -5.532 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -0.567 11.637 -4.283 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.405 13.172 -4.165 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.439 9.597 -3.492 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.094 13.586 -1.961 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.159 8.804 -1.270 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -2.820 12.784 0.260 1.00 0.00 H new ATOM 0 HZ PHE A 15 -3.349 10.399 0.609 1.00 0.00 H new ATOM 223 N GLU A 16 -3.550 13.889 -6.052 1.00 0.00 N ATOM 224 CA GLU A 16 -4.705 14.825 -6.107 1.00 0.00 C ATOM 225 C GLU A 16 -5.766 14.478 -7.192 1.00 0.00 C ATOM 226 O GLU A 16 -6.948 14.371 -6.857 1.00 0.00 O ATOM 227 CB GLU A 16 -4.195 16.291 -6.236 1.00 0.00 C ATOM 228 CG GLU A 16 -3.482 16.902 -5.005 1.00 0.00 C ATOM 229 CD GLU A 16 -2.077 16.377 -4.685 1.00 0.00 C ATOM 230 OE1 GLU A 16 -1.145 16.606 -5.487 1.00 0.00 O ATOM 231 OE2 GLU A 16 -1.900 15.730 -3.629 1.00 0.00 O ATOM 0 H GLU A 16 -2.674 14.313 -6.359 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.241 14.712 -5.165 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.509 16.337 -7.081 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.047 16.925 -6.482 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.416 17.980 -5.152 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -4.113 16.737 -4.131 1.00 0.00 H new ATOM 238 N ALA A 17 -5.350 14.262 -8.457 1.00 0.00 N ATOM 239 CA ALA A 17 -6.239 13.719 -9.523 1.00 0.00 C ATOM 240 C ALA A 17 -6.875 12.317 -9.250 1.00 0.00 C ATOM 241 O ALA A 17 -8.057 12.135 -9.550 1.00 0.00 O ATOM 242 CB ALA A 17 -5.464 13.711 -10.854 1.00 0.00 C ATOM 0 H ALA A 17 -4.400 14.454 -8.773 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.100 14.387 -9.555 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.102 13.316 -11.644 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.162 14.728 -11.106 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.578 13.084 -10.755 1.00 0.00 H new ATOM 248 N PHE A 18 -6.118 11.356 -8.676 1.00 0.00 N ATOM 249 CA PHE A 18 -6.631 9.999 -8.337 1.00 0.00 C ATOM 250 C PHE A 18 -7.659 10.001 -7.162 1.00 0.00 C ATOM 251 O PHE A 18 -8.773 9.509 -7.358 1.00 0.00 O ATOM 252 CB PHE A 18 -5.413 9.060 -8.104 1.00 0.00 C ATOM 253 CG PHE A 18 -5.725 7.557 -7.956 1.00 0.00 C ATOM 254 CD1 PHE A 18 -6.105 7.044 -6.711 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.555 6.679 -9.033 1.00 0.00 C ATOM 256 CE1 PHE A 18 -6.298 5.678 -6.539 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.735 5.309 -8.855 1.00 0.00 C ATOM 258 CZ PHE A 18 -6.112 4.813 -7.609 1.00 0.00 C ATOM 0 H PHE A 18 -5.137 11.493 -8.433 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.213 9.616 -9.175 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.721 9.185 -8.937 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.893 9.391 -7.205 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.250 7.715 -5.877 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.284 7.065 -10.005 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.592 5.290 -5.575 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.582 4.632 -9.682 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.260 3.752 -7.475 1.00 0.00 H new ATOM 268 N MET A 19 -7.292 10.532 -5.975 1.00 0.00 N ATOM 269 CA MET A 19 -8.173 10.585 -4.776 1.00 0.00 C ATOM 270 C MET A 19 -9.496 11.393 -4.952 1.00 0.00 C ATOM 271 O MET A 19 -10.545 10.889 -4.545 1.00 0.00 O ATOM 272 CB MET A 19 -7.363 11.085 -3.551 1.00 0.00 C ATOM 273 CG MET A 19 -6.542 10.024 -2.799 1.00 0.00 C ATOM 274 SD MET A 19 -5.421 9.117 -3.883 1.00 0.00 S ATOM 275 CE MET A 19 -5.407 7.504 -3.072 1.00 0.00 C ATOM 0 H MET A 19 -6.371 10.940 -5.816 1.00 0.00 H new ATOM 0 HA MET A 19 -8.511 9.562 -4.613 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.684 11.869 -3.886 1.00 0.00 H new ATOM 0 HB3 MET A 19 -8.056 11.544 -2.846 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.966 10.508 -2.010 1.00 0.00 H new ATOM 0 HG3 MET A 19 -7.220 9.322 -2.314 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.432 7.036 -3.209 1.00 0.00 H new ATOM 0 HE2 MET A 19 -5.602 7.630 -2.007 1.00 0.00 H new ATOM 0 HE3 MET A 19 -6.178 6.870 -3.510 1.00 0.00 H new ATOM 285 N LYS A 20 -9.472 12.594 -5.572 1.00 0.00 N ATOM 286 CA LYS A 20 -10.714 13.332 -5.958 1.00 0.00 C ATOM 287 C LYS A 20 -11.633 12.595 -6.988 1.00 0.00 C ATOM 288 O LYS A 20 -12.856 12.661 -6.842 1.00 0.00 O ATOM 289 CB LYS A 20 -10.392 14.761 -6.481 1.00 0.00 C ATOM 290 CG LYS A 20 -9.735 15.725 -5.465 1.00 0.00 C ATOM 291 CD LYS A 20 -9.384 17.131 -6.004 1.00 0.00 C ATOM 292 CE LYS A 20 -10.550 18.131 -6.148 1.00 0.00 C ATOM 293 NZ LYS A 20 -11.366 17.919 -7.359 1.00 0.00 N ATOM 0 H LYS A 20 -8.610 13.080 -5.819 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.282 13.390 -5.029 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.732 14.670 -7.344 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.318 15.214 -6.834 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -10.407 15.840 -4.614 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.822 15.262 -5.090 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.638 17.572 -5.343 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.915 17.013 -6.981 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.192 18.056 -5.270 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -10.148 19.144 -6.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.816 18.815 -7.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.758 17.583 -8.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -12.101 17.209 -7.163 1.00 0.00 H new ATOM 307 N ALA A 21 -11.064 11.890 -7.994 1.00 0.00 N ATOM 308 CA ALA A 21 -11.845 11.023 -8.921 1.00 0.00 C ATOM 309 C ALA A 21 -12.574 9.793 -8.290 1.00 0.00 C ATOM 310 O ALA A 21 -13.665 9.452 -8.756 1.00 0.00 O ATOM 311 CB ALA A 21 -10.913 10.575 -10.064 1.00 0.00 C ATOM 0 H ALA A 21 -10.063 11.902 -8.188 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.670 11.641 -9.275 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.465 9.938 -10.755 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.542 11.451 -10.595 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.072 10.018 -9.651 1.00 0.00 H new ATOM 317 N ILE A 22 -12.001 9.145 -7.252 1.00 0.00 N ATOM 318 CA ILE A 22 -12.647 8.004 -6.529 1.00 0.00 C ATOM 319 C ILE A 22 -13.666 8.486 -5.446 1.00 0.00 C ATOM 320 O ILE A 22 -14.824 8.059 -5.489 1.00 0.00 O ATOM 321 CB ILE A 22 -11.611 6.930 -6.028 1.00 0.00 C ATOM 322 CG1 ILE A 22 -10.515 7.477 -5.064 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.994 6.174 -7.230 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.504 6.468 -4.498 1.00 0.00 C ATOM 0 H ILE A 22 -11.081 9.390 -6.885 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.252 7.467 -7.259 1.00 0.00 H new ATOM 0 HB ILE A 22 -12.181 6.230 -5.416 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.958 8.252 -5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -11.015 7.960 -4.224 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -10.280 5.435 -6.867 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.784 5.672 -7.788 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.483 6.883 -7.882 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.801 6.985 -3.844 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -10.033 5.703 -3.930 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.960 5.999 -5.318 1.00 0.00 H new ATOM 336 N GLY A 23 -13.258 9.366 -4.510 1.00 0.00 N ATOM 337 CA GLY A 23 -14.177 10.002 -3.542 1.00 0.00 C ATOM 338 C GLY A 23 -13.494 10.350 -2.208 1.00 0.00 C ATOM 339 O GLY A 23 -13.832 9.752 -1.182 1.00 0.00 O ATOM 0 H GLY A 23 -12.286 9.656 -4.403 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.588 10.911 -3.982 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.016 9.333 -3.351 1.00 0.00 H new ATOM 343 N LEU A 24 -12.573 11.332 -2.225 1.00 0.00 N ATOM 344 CA LEU A 24 -11.894 11.844 -1.002 1.00 0.00 C ATOM 345 C LEU A 24 -11.921 13.412 -0.933 1.00 0.00 C ATOM 346 O LEU A 24 -11.931 14.064 -1.985 1.00 0.00 O ATOM 347 CB LEU A 24 -10.429 11.311 -0.924 1.00 0.00 C ATOM 348 CG LEU A 24 -10.188 10.184 0.122 1.00 0.00 C ATOM 349 CD1 LEU A 24 -10.306 8.782 -0.504 1.00 0.00 C ATOM 350 CD2 LEU A 24 -8.837 10.354 0.838 1.00 0.00 C ATOM 0 H LEU A 24 -12.273 11.797 -3.082 1.00 0.00 H new ATOM 0 HA LEU A 24 -12.446 11.472 -0.139 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -10.142 10.939 -1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.767 12.146 -0.693 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.976 10.276 0.869 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.131 8.026 0.261 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.305 8.652 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.566 8.674 -1.297 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.704 9.549 1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.030 10.321 0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.818 11.313 1.356 1.00 0.00 H new ATOM 362 N PRO A 25 -11.872 14.063 0.274 1.00 0.00 N ATOM 363 CA PRO A 25 -11.799 15.541 0.400 1.00 0.00 C ATOM 364 C PRO A 25 -10.377 16.113 0.157 1.00 0.00 C ATOM 365 O PRO A 25 -9.373 15.468 0.472 1.00 0.00 O ATOM 366 CB PRO A 25 -12.221 15.762 1.865 1.00 0.00 C ATOM 367 CG PRO A 25 -11.795 14.502 2.619 1.00 0.00 C ATOM 368 CD PRO A 25 -11.806 13.377 1.583 1.00 0.00 C ATOM 0 HA PRO A 25 -12.419 16.046 -0.341 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.740 16.647 2.281 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -13.297 15.918 1.942 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.803 14.623 3.055 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -12.480 14.286 3.439 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.911 12.760 1.661 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.661 12.717 1.726 1.00 0.00 H new ATOM 376 N GLU A 26 -10.309 17.372 -0.299 1.00 0.00 N ATOM 377 CA GLU A 26 -9.039 18.145 -0.350 1.00 0.00 C ATOM 378 C GLU A 26 -8.293 18.363 1.008 1.00 0.00 C ATOM 379 O GLU A 26 -7.064 18.439 0.986 1.00 0.00 O ATOM 380 CB GLU A 26 -9.310 19.474 -1.099 1.00 0.00 C ATOM 381 CG GLU A 26 -9.088 19.390 -2.626 1.00 0.00 C ATOM 382 CD GLU A 26 -9.394 20.704 -3.345 1.00 0.00 C ATOM 383 OE1 GLU A 26 -8.485 21.556 -3.461 1.00 0.00 O ATOM 384 OE2 GLU A 26 -10.546 20.892 -3.798 1.00 0.00 O ATOM 0 H GLU A 26 -11.119 17.888 -0.642 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.324 17.526 -0.893 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.337 19.784 -0.908 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.662 20.249 -0.690 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.054 19.106 -2.823 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.719 18.601 -3.037 1.00 0.00 H new ATOM 391 N GLU A 27 -8.982 18.413 2.170 1.00 0.00 N ATOM 392 CA GLU A 27 -8.322 18.422 3.507 1.00 0.00 C ATOM 393 C GLU A 27 -7.501 17.127 3.822 1.00 0.00 C ATOM 394 O GLU A 27 -6.326 17.262 4.175 1.00 0.00 O ATOM 395 CB GLU A 27 -9.388 18.742 4.591 1.00 0.00 C ATOM 396 CG GLU A 27 -8.816 19.021 5.999 1.00 0.00 C ATOM 397 CD GLU A 27 -9.906 19.279 7.041 1.00 0.00 C ATOM 398 OE1 GLU A 27 -10.440 18.300 7.611 1.00 0.00 O ATOM 399 OE2 GLU A 27 -10.232 20.459 7.302 1.00 0.00 O ATOM 0 H GLU A 27 -10.000 18.448 2.215 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.566 19.207 3.504 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.964 19.610 4.269 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.083 17.905 4.656 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -8.211 18.171 6.315 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -8.153 19.885 5.952 1.00 0.00 H new ATOM 406 N LEU A 28 -8.075 15.909 3.685 1.00 0.00 N ATOM 407 CA LEU A 28 -7.298 14.636 3.834 1.00 0.00 C ATOM 408 C LEU A 28 -6.229 14.334 2.731 1.00 0.00 C ATOM 409 O LEU A 28 -5.237 13.666 3.030 1.00 0.00 O ATOM 410 CB LEU A 28 -8.242 13.410 3.997 1.00 0.00 C ATOM 411 CG LEU A 28 -9.132 13.350 5.273 1.00 0.00 C ATOM 412 CD1 LEU A 28 -10.125 12.173 5.174 1.00 0.00 C ATOM 413 CD2 LEU A 28 -8.317 13.237 6.581 1.00 0.00 C ATOM 0 H LEU A 28 -9.063 15.771 3.474 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.723 14.807 4.744 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.898 13.374 3.128 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.629 12.509 3.972 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.672 14.296 5.317 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.742 12.141 6.072 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.763 12.307 4.300 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.573 11.238 5.080 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.998 13.200 7.432 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.715 12.328 6.557 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.662 14.103 6.678 1.00 0.00 H new ATOM 425 N ILE A 29 -6.409 14.820 1.487 1.00 0.00 N ATOM 426 CA ILE A 29 -5.396 14.725 0.390 1.00 0.00 C ATOM 427 C ILE A 29 -4.164 15.654 0.660 1.00 0.00 C ATOM 428 O ILE A 29 -3.025 15.189 0.581 1.00 0.00 O ATOM 429 CB ILE A 29 -6.085 14.979 -0.999 1.00 0.00 C ATOM 430 CG1 ILE A 29 -7.231 13.968 -1.303 1.00 0.00 C ATOM 431 CG2 ILE A 29 -5.094 14.967 -2.187 1.00 0.00 C ATOM 432 CD1 ILE A 29 -8.176 14.365 -2.449 1.00 0.00 C ATOM 0 H ILE A 29 -7.265 15.296 1.202 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.989 13.714 0.363 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.505 15.980 -0.902 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.786 13.002 -1.540 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.823 13.833 -0.398 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.636 15.149 -3.115 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.346 15.747 -2.045 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.600 13.997 -2.239 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.936 13.594 -2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.658 15.313 -2.211 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.605 14.469 -3.372 1.00 0.00 H new ATOM 444 N GLN A 30 -4.384 16.943 0.984 1.00 0.00 N ATOM 445 CA GLN A 30 -3.303 17.860 1.450 1.00 0.00 C ATOM 446 C GLN A 30 -2.619 17.493 2.817 1.00 0.00 C ATOM 447 O GLN A 30 -1.473 17.893 3.035 1.00 0.00 O ATOM 448 CB GLN A 30 -3.819 19.330 1.456 1.00 0.00 C ATOM 449 CG GLN A 30 -3.824 20.075 0.098 1.00 0.00 C ATOM 450 CD GLN A 30 -4.930 19.730 -0.916 1.00 0.00 C ATOM 451 OE1 GLN A 30 -5.997 20.342 -0.924 1.00 0.00 O ATOM 452 NE2 GLN A 30 -4.699 18.785 -1.816 1.00 0.00 N ATOM 0 H GLN A 30 -5.303 17.383 0.934 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.500 17.736 0.724 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.836 19.331 1.848 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.208 19.902 2.155 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -3.883 21.144 0.305 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -2.863 19.896 -0.384 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -3.814 18.279 -1.808 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -5.407 18.564 -2.517 1.00 0.00 H new ATOM 461 N LYS A 31 -3.283 16.718 3.700 1.00 0.00 N ATOM 462 CA LYS A 31 -2.653 16.095 4.897 1.00 0.00 C ATOM 463 C LYS A 31 -1.722 14.900 4.506 1.00 0.00 C ATOM 464 O LYS A 31 -0.530 14.938 4.821 1.00 0.00 O ATOM 465 CB LYS A 31 -3.793 15.706 5.881 1.00 0.00 C ATOM 466 CG LYS A 31 -3.330 15.217 7.270 1.00 0.00 C ATOM 467 CD LYS A 31 -4.484 14.651 8.120 1.00 0.00 C ATOM 468 CE LYS A 31 -4.015 14.176 9.508 1.00 0.00 C ATOM 469 NZ LYS A 31 -5.118 13.564 10.270 1.00 0.00 N ATOM 0 H LYS A 31 -4.276 16.502 3.608 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.989 16.801 5.396 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -4.443 16.570 6.017 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.396 14.923 5.421 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -2.567 14.449 7.144 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.863 16.045 7.804 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.251 15.416 8.241 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.946 13.817 7.591 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.206 13.454 9.393 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.611 15.021 10.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -4.768 13.255 11.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.879 14.261 10.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.487 12.743 9.749 1.00 0.00 H new ATOM 483 N GLY A 32 -2.260 13.871 3.819 1.00 0.00 N ATOM 484 CA GLY A 32 -1.492 12.683 3.383 1.00 0.00 C ATOM 485 C GLY A 32 -0.344 12.826 2.354 1.00 0.00 C ATOM 486 O GLY A 32 0.529 11.955 2.334 1.00 0.00 O ATOM 0 H GLY A 32 -3.243 13.839 3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.068 12.228 4.278 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.207 11.971 2.971 1.00 0.00 H new ATOM 490 N LYS A 33 -0.317 13.893 1.527 1.00 0.00 N ATOM 491 CA LYS A 33 0.854 14.216 0.660 1.00 0.00 C ATOM 492 C LYS A 33 2.160 14.588 1.439 1.00 0.00 C ATOM 493 O LYS A 33 3.234 14.082 1.105 1.00 0.00 O ATOM 494 CB LYS A 33 0.446 15.239 -0.437 1.00 0.00 C ATOM 495 CG LYS A 33 0.220 16.704 0.003 1.00 0.00 C ATOM 496 CD LYS A 33 -0.314 17.641 -1.097 1.00 0.00 C ATOM 497 CE LYS A 33 0.643 17.918 -2.274 1.00 0.00 C ATOM 498 NZ LYS A 33 1.847 18.683 -1.897 1.00 0.00 N ATOM 0 H LYS A 33 -1.091 14.551 1.436 1.00 0.00 H new ATOM 0 HA LYS A 33 1.143 13.295 0.154 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.219 15.234 -1.206 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.472 14.883 -0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.481 16.712 0.838 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.163 17.105 0.374 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.234 17.213 -1.496 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.578 18.594 -0.638 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.950 16.968 -2.711 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.104 18.465 -3.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.442 18.831 -2.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.565 19.605 -1.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.385 18.154 -1.181 1.00 0.00 H new ATOM 512 N ASP A 34 2.045 15.418 2.498 1.00 0.00 N ATOM 513 CA ASP A 34 3.142 15.675 3.475 1.00 0.00 C ATOM 514 C ASP A 34 3.551 14.462 4.378 1.00 0.00 C ATOM 515 O ASP A 34 4.711 14.417 4.798 1.00 0.00 O ATOM 516 CB ASP A 34 2.769 16.889 4.372 1.00 0.00 C ATOM 517 CG ASP A 34 2.661 18.243 3.647 1.00 0.00 C ATOM 518 OD1 ASP A 34 3.701 18.909 3.455 1.00 0.00 O ATOM 519 OD2 ASP A 34 1.537 18.637 3.265 1.00 0.00 O ATOM 0 H ASP A 34 1.190 15.933 2.706 1.00 0.00 H new ATOM 0 HA ASP A 34 4.020 15.879 2.863 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.816 16.680 4.857 1.00 0.00 H new ATOM 0 HB3 ASP A 34 3.516 16.978 5.161 1.00 0.00 H new ATOM 524 N ILE A 35 2.645 13.503 4.679 1.00 0.00 N ATOM 525 CA ILE A 35 2.961 12.300 5.506 1.00 0.00 C ATOM 526 C ILE A 35 3.609 11.238 4.562 1.00 0.00 C ATOM 527 O ILE A 35 2.989 10.786 3.593 1.00 0.00 O ATOM 528 CB ILE A 35 1.691 11.745 6.253 1.00 0.00 C ATOM 529 CG1 ILE A 35 0.990 12.803 7.163 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.022 10.485 7.103 1.00 0.00 C ATOM 531 CD1 ILE A 35 -0.443 12.450 7.580 1.00 0.00 C ATOM 0 H ILE A 35 1.677 13.535 4.360 1.00 0.00 H new ATOM 0 HA ILE A 35 3.661 12.563 6.299 1.00 0.00 H new ATOM 0 HB ILE A 35 0.997 11.477 5.456 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.590 12.942 8.062 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.975 13.759 6.639 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.118 10.135 7.601 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.406 9.699 6.453 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.774 10.738 7.851 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.845 13.244 8.209 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.064 12.342 6.691 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.440 11.513 8.136 1.00 0.00 H new ATOM 543 N LYS A 36 4.844 10.822 4.903 1.00 0.00 N ATOM 544 CA LYS A 36 5.551 9.722 4.197 1.00 0.00 C ATOM 545 C LYS A 36 5.222 8.393 4.934 1.00 0.00 C ATOM 546 O LYS A 36 5.743 8.122 6.022 1.00 0.00 O ATOM 547 CB LYS A 36 7.074 10.001 4.119 1.00 0.00 C ATOM 548 CG LYS A 36 7.517 10.988 3.012 1.00 0.00 C ATOM 549 CD LYS A 36 7.194 12.492 3.184 1.00 0.00 C ATOM 550 CE LYS A 36 7.743 13.194 4.445 1.00 0.00 C ATOM 551 NZ LYS A 36 9.216 13.231 4.509 1.00 0.00 N ATOM 0 H LYS A 36 5.381 11.231 5.668 1.00 0.00 H new ATOM 0 HA LYS A 36 5.212 9.647 3.164 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.404 10.391 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.591 9.054 3.965 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.597 10.893 2.897 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.067 10.658 2.076 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.575 13.021 2.310 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.110 12.607 3.179 1.00 0.00 H new ATOM 0 HE2 LYS A 36 7.361 14.214 4.477 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.362 12.683 5.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.514 13.716 5.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.588 12.260 4.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.587 13.744 3.684 1.00 0.00 H new ATOM 565 N GLY A 37 4.308 7.603 4.347 1.00 0.00 N ATOM 566 CA GLY A 37 3.696 6.446 5.034 1.00 0.00 C ATOM 567 C GLY A 37 4.462 5.120 4.859 1.00 0.00 C ATOM 568 O GLY A 37 4.809 4.736 3.737 1.00 0.00 O ATOM 0 H GLY A 37 3.973 7.743 3.394 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.621 6.670 6.098 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.679 6.315 4.663 1.00 0.00 H new ATOM 572 N VAL A 38 4.672 4.409 5.983 1.00 0.00 N ATOM 573 CA VAL A 38 5.364 3.087 5.996 1.00 0.00 C ATOM 574 C VAL A 38 4.293 1.995 5.691 1.00 0.00 C ATOM 575 O VAL A 38 3.413 1.709 6.509 1.00 0.00 O ATOM 576 CB VAL A 38 6.135 2.804 7.332 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.981 1.507 7.263 1.00 0.00 C ATOM 578 CG2 VAL A 38 7.077 3.943 7.792 1.00 0.00 C ATOM 0 H VAL A 38 4.373 4.724 6.906 1.00 0.00 H new ATOM 0 HA VAL A 38 6.141 3.081 5.232 1.00 0.00 H new ATOM 0 HB VAL A 38 5.330 2.707 8.060 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.495 1.357 8.213 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.328 0.657 7.065 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.716 1.594 6.463 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.566 3.657 8.723 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.832 4.123 7.026 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.498 4.853 7.951 1.00 0.00 H new ATOM 588 N SER A 39 4.412 1.402 4.496 1.00 0.00 N ATOM 589 CA SER A 39 3.531 0.311 4.018 1.00 0.00 C ATOM 590 C SER A 39 4.349 -0.999 3.981 1.00 0.00 C ATOM 591 O SER A 39 5.280 -1.151 3.183 1.00 0.00 O ATOM 592 CB SER A 39 2.924 0.663 2.645 1.00 0.00 C ATOM 593 OG SER A 39 3.905 0.985 1.660 1.00 0.00 O ATOM 0 H SER A 39 5.130 1.665 3.820 1.00 0.00 H new ATOM 0 HA SER A 39 2.690 0.177 4.699 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.328 -0.179 2.292 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.245 1.508 2.761 1.00 0.00 H new ATOM 0 HG SER A 39 4.709 0.445 1.810 1.00 0.00 H new ATOM 599 N GLU A 40 3.988 -1.933 4.870 1.00 0.00 N ATOM 600 CA GLU A 40 4.702 -3.223 5.019 1.00 0.00 C ATOM 601 C GLU A 40 4.100 -4.305 4.083 1.00 0.00 C ATOM 602 O GLU A 40 2.918 -4.273 3.734 1.00 0.00 O ATOM 603 CB GLU A 40 4.651 -3.690 6.497 1.00 0.00 C ATOM 604 CG GLU A 40 5.447 -2.851 7.516 1.00 0.00 C ATOM 605 CD GLU A 40 4.606 -1.906 8.379 1.00 0.00 C ATOM 606 OE1 GLU A 40 4.371 -0.749 7.965 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.170 -2.321 9.475 1.00 0.00 O ATOM 0 H GLU A 40 3.198 -1.824 5.506 1.00 0.00 H new ATOM 0 HA GLU A 40 5.743 -3.076 4.731 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.608 -3.708 6.812 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.016 -4.716 6.542 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.993 -3.528 8.173 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.189 -2.262 6.977 1.00 0.00 H new ATOM 614 N ILE A 41 4.951 -5.267 3.695 1.00 0.00 N ATOM 615 CA ILE A 41 4.536 -6.463 2.906 1.00 0.00 C ATOM 616 C ILE A 41 5.265 -7.673 3.571 1.00 0.00 C ATOM 617 O ILE A 41 6.473 -7.623 3.821 1.00 0.00 O ATOM 618 CB ILE A 41 4.825 -6.334 1.363 1.00 0.00 C ATOM 619 CG1 ILE A 41 4.178 -5.079 0.696 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.388 -7.613 0.598 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.610 -4.778 -0.747 1.00 0.00 C ATOM 0 H ILE A 41 5.947 -5.249 3.913 1.00 0.00 H new ATOM 0 HA ILE A 41 3.454 -6.590 2.935 1.00 0.00 H new ATOM 0 HB ILE A 41 5.905 -6.209 1.289 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.095 -5.204 0.710 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.407 -4.208 1.311 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.601 -7.492 -0.464 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.937 -8.472 0.983 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.319 -7.773 0.738 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.095 -3.885 -1.102 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.687 -4.612 -0.777 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.355 -5.623 -1.387 1.00 0.00 H new ATOM 633 N VAL A 42 4.518 -8.764 3.824 1.00 0.00 N ATOM 634 CA VAL A 42 5.079 -10.034 4.372 1.00 0.00 C ATOM 635 C VAL A 42 4.616 -11.146 3.386 1.00 0.00 C ATOM 636 O VAL A 42 3.466 -11.596 3.440 1.00 0.00 O ATOM 637 CB VAL A 42 4.653 -10.303 5.861 1.00 0.00 C ATOM 638 CG1 VAL A 42 5.236 -11.622 6.422 1.00 0.00 C ATOM 639 CG2 VAL A 42 5.020 -9.160 6.838 1.00 0.00 C ATOM 0 H VAL A 42 3.512 -8.800 3.659 1.00 0.00 H new ATOM 0 HA VAL A 42 6.167 -9.994 4.433 1.00 0.00 H new ATOM 0 HB VAL A 42 3.567 -10.373 5.804 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.909 -11.755 7.453 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.886 -12.460 5.819 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.325 -11.581 6.390 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.693 -9.422 7.844 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.100 -9.011 6.835 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.526 -8.240 6.524 1.00 0.00 H new ATOM 649 N GLN A 43 5.532 -11.607 2.514 1.00 0.00 N ATOM 650 CA GLN A 43 5.264 -12.722 1.568 1.00 0.00 C ATOM 651 C GLN A 43 5.396 -14.088 2.299 1.00 0.00 C ATOM 652 O GLN A 43 6.469 -14.431 2.806 1.00 0.00 O ATOM 653 CB GLN A 43 6.249 -12.598 0.375 1.00 0.00 C ATOM 654 CG GLN A 43 6.100 -13.669 -0.734 1.00 0.00 C ATOM 655 CD GLN A 43 7.079 -13.513 -1.915 1.00 0.00 C ATOM 656 OE1 GLN A 43 8.223 -13.079 -1.772 1.00 0.00 O ATOM 657 NE2 GLN A 43 6.663 -13.905 -3.108 1.00 0.00 N ATOM 0 H GLN A 43 6.475 -11.224 2.440 1.00 0.00 H new ATOM 0 HA GLN A 43 4.245 -12.667 1.185 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.122 -11.614 -0.076 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.267 -12.642 0.762 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.241 -14.654 -0.290 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.080 -13.636 -1.118 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.716 -14.264 -3.225 1.00 0.00 H new ATOM 0 HE22 GLN A 43 7.290 -13.848 -3.911 1.00 0.00 H new ATOM 666 N ASN A 44 4.300 -14.867 2.298 1.00 0.00 N ATOM 667 CA ASN A 44 4.318 -16.290 2.739 1.00 0.00 C ATOM 668 C ASN A 44 3.788 -17.161 1.559 1.00 0.00 C ATOM 669 O ASN A 44 2.653 -17.654 1.588 1.00 0.00 O ATOM 670 CB ASN A 44 3.503 -16.478 4.055 1.00 0.00 C ATOM 671 CG ASN A 44 4.008 -15.694 5.287 1.00 0.00 C ATOM 672 OD1 ASN A 44 5.159 -15.823 5.706 1.00 0.00 O ATOM 673 ND2 ASN A 44 3.163 -14.866 5.883 1.00 0.00 N ATOM 0 H ASN A 44 3.382 -14.541 1.997 1.00 0.00 H new ATOM 0 HA ASN A 44 5.332 -16.610 2.981 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.470 -16.187 3.863 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.494 -17.539 4.304 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.464 -14.329 6.696 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.212 -14.766 5.529 1.00 0.00 H new ATOM 680 N GLY A 45 4.615 -17.321 0.501 1.00 0.00 N ATOM 681 CA GLY A 45 4.218 -18.034 -0.737 1.00 0.00 C ATOM 682 C GLY A 45 3.170 -17.274 -1.582 1.00 0.00 C ATOM 683 O GLY A 45 3.420 -16.153 -2.037 1.00 0.00 O ATOM 0 H GLY A 45 5.570 -16.963 0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.105 -18.209 -1.346 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.817 -19.012 -0.470 1.00 0.00 H new ATOM 687 N LYS A 46 1.988 -17.892 -1.740 1.00 0.00 N ATOM 688 CA LYS A 46 0.786 -17.226 -2.318 1.00 0.00 C ATOM 689 C LYS A 46 0.046 -16.254 -1.343 1.00 0.00 C ATOM 690 O LYS A 46 -0.485 -15.248 -1.816 1.00 0.00 O ATOM 691 CB LYS A 46 -0.205 -18.292 -2.859 1.00 0.00 C ATOM 692 CG LYS A 46 0.279 -19.082 -4.098 1.00 0.00 C ATOM 693 CD LYS A 46 -0.791 -20.054 -4.641 1.00 0.00 C ATOM 694 CE LYS A 46 -0.416 -20.762 -5.959 1.00 0.00 C ATOM 695 NZ LYS A 46 0.644 -21.776 -5.796 1.00 0.00 N ATOM 0 H LYS A 46 1.828 -18.864 -1.475 1.00 0.00 H new ATOM 0 HA LYS A 46 1.159 -16.601 -3.129 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.422 -19.001 -2.060 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.143 -17.797 -3.109 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.559 -18.381 -4.884 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.176 -19.644 -3.838 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.991 -20.811 -3.883 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.719 -19.502 -4.793 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.305 -21.239 -6.373 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.088 -20.016 -6.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.850 -22.214 -6.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.505 -21.322 -5.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 0.326 -22.507 -5.128 1.00 0.00 H new ATOM 709 N HIS A 47 -0.004 -16.533 -0.021 1.00 0.00 N ATOM 710 CA HIS A 47 -0.654 -15.647 0.982 1.00 0.00 C ATOM 711 C HIS A 47 0.282 -14.465 1.362 1.00 0.00 C ATOM 712 O HIS A 47 1.323 -14.654 1.996 1.00 0.00 O ATOM 713 CB HIS A 47 -1.032 -16.465 2.251 1.00 0.00 C ATOM 714 CG HIS A 47 -2.326 -17.277 2.126 1.00 0.00 C ATOM 715 ND1 HIS A 47 -2.426 -18.532 1.549 1.00 0.00 N ATOM 716 CD2 HIS A 47 -3.593 -16.855 2.570 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.770 -18.751 1.695 1.00 0.00 C ATOM 718 NE2 HIS A 47 -4.564 -17.811 2.305 1.00 0.00 N ATOM 0 H HIS A 47 0.403 -17.376 0.384 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.562 -15.235 0.542 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.213 -17.145 2.486 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.129 -15.780 3.093 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.785 -15.909 3.055 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.208 -19.668 1.329 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.565 -17.814 2.503 1.00 0.00 H new ATOM 726 N PHE A 48 -0.133 -13.249 0.979 1.00 0.00 N ATOM 727 CA PHE A 48 0.587 -11.992 1.303 1.00 0.00 C ATOM 728 C PHE A 48 -0.209 -11.254 2.410 1.00 0.00 C ATOM 729 O PHE A 48 -1.355 -10.840 2.201 1.00 0.00 O ATOM 730 CB PHE A 48 0.703 -11.094 0.043 1.00 0.00 C ATOM 731 CG PHE A 48 1.820 -11.443 -0.963 1.00 0.00 C ATOM 732 CD1 PHE A 48 1.763 -12.592 -1.759 1.00 0.00 C ATOM 733 CD2 PHE A 48 2.841 -10.515 -1.184 1.00 0.00 C ATOM 734 CE1 PHE A 48 2.710 -12.805 -2.760 1.00 0.00 C ATOM 735 CE2 PHE A 48 3.781 -10.724 -2.185 1.00 0.00 C ATOM 736 CZ PHE A 48 3.715 -11.865 -2.975 1.00 0.00 C ATOM 0 H PHE A 48 -0.981 -13.101 0.432 1.00 0.00 H new ATOM 0 HA PHE A 48 1.596 -12.219 1.648 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.250 -11.125 -0.485 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.852 -10.066 0.372 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.981 -13.319 -1.597 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.900 -9.628 -0.571 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.664 -13.697 -3.367 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.564 -9.999 -2.349 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.444 -12.023 -3.756 1.00 0.00 H new ATOM 746 N LYS A 49 0.438 -11.075 3.569 1.00 0.00 N ATOM 747 CA LYS A 49 -0.126 -10.321 4.719 1.00 0.00 C ATOM 748 C LYS A 49 0.578 -8.943 4.754 1.00 0.00 C ATOM 749 O LYS A 49 1.749 -8.838 5.127 1.00 0.00 O ATOM 750 CB LYS A 49 0.102 -11.121 6.029 1.00 0.00 C ATOM 751 CG LYS A 49 -0.894 -12.284 6.233 1.00 0.00 C ATOM 752 CD LYS A 49 -0.529 -13.262 7.373 1.00 0.00 C ATOM 753 CE LYS A 49 -0.374 -12.667 8.789 1.00 0.00 C ATOM 754 NZ LYS A 49 -1.651 -12.205 9.370 1.00 0.00 N ATOM 0 H LYS A 49 1.371 -11.447 3.746 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.201 -10.176 4.617 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.116 -11.520 6.028 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.029 -10.440 6.877 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.881 -11.867 6.434 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.969 -12.846 5.302 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -1.296 -14.035 7.413 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.407 -13.755 7.109 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.065 -13.418 9.445 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.324 -11.830 8.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.480 -11.817 10.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.062 -11.467 8.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.312 -13.005 9.437 1.00 0.00 H new ATOM 768 N PHE A 50 -0.145 -7.900 4.318 1.00 0.00 N ATOM 769 CA PHE A 50 0.454 -6.572 4.019 1.00 0.00 C ATOM 770 C PHE A 50 -0.395 -5.445 4.654 1.00 0.00 C ATOM 771 O PHE A 50 -1.616 -5.410 4.478 1.00 0.00 O ATOM 772 CB PHE A 50 0.660 -6.392 2.481 1.00 0.00 C ATOM 773 CG PHE A 50 -0.560 -6.045 1.600 1.00 0.00 C ATOM 774 CD1 PHE A 50 -1.551 -6.993 1.335 1.00 0.00 C ATOM 775 CD2 PHE A 50 -0.721 -4.733 1.134 1.00 0.00 C ATOM 776 CE1 PHE A 50 -2.700 -6.629 0.638 1.00 0.00 C ATOM 777 CE2 PHE A 50 -1.858 -4.378 0.414 1.00 0.00 C ATOM 778 CZ PHE A 50 -2.844 -5.327 0.163 1.00 0.00 C ATOM 0 H PHE A 50 -1.152 -7.943 4.161 1.00 0.00 H new ATOM 0 HA PHE A 50 1.445 -6.512 4.470 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.404 -5.608 2.338 1.00 0.00 H new ATOM 0 HB3 PHE A 50 1.092 -7.316 2.096 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.426 -8.011 1.672 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.041 -3.994 1.335 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.480 -7.356 0.465 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.975 -3.368 0.051 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.723 -5.054 -0.401 1.00 0.00 H new ATOM 788 N THR A 51 0.269 -4.479 5.311 1.00 0.00 N ATOM 789 CA THR A 51 -0.381 -3.194 5.697 1.00 0.00 C ATOM 790 C THR A 51 -0.122 -2.116 4.604 1.00 0.00 C ATOM 791 O THR A 51 0.932 -2.086 3.959 1.00 0.00 O ATOM 792 CB THR A 51 -0.033 -2.778 7.162 1.00 0.00 C ATOM 793 OG1 THR A 51 -1.147 -2.100 7.726 1.00 0.00 O ATOM 794 CG2 THR A 51 1.191 -1.876 7.365 1.00 0.00 C ATOM 0 H THR A 51 1.248 -4.553 5.589 1.00 0.00 H new ATOM 0 HA THR A 51 -1.463 -3.321 5.727 1.00 0.00 H new ATOM 0 HB THR A 51 0.214 -3.723 7.645 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.824 -1.951 7.033 1.00 0.00 H new ATOM 0 HG21 THR A 51 1.316 -1.666 8.427 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.081 -2.380 6.988 1.00 0.00 H new ATOM 0 HG23 THR A 51 1.047 -0.940 6.825 1.00 0.00 H new ATOM 802 N ILE A 52 -1.104 -1.218 4.438 1.00 0.00 N ATOM 803 CA ILE A 52 -1.021 -0.087 3.475 1.00 0.00 C ATOM 804 C ILE A 52 -1.417 1.219 4.219 1.00 0.00 C ATOM 805 O ILE A 52 -2.532 1.349 4.734 1.00 0.00 O ATOM 806 CB ILE A 52 -1.828 -0.370 2.154 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.697 0.726 1.054 1.00 0.00 C ATOM 808 CG2 ILE A 52 -3.333 -0.690 2.361 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.278 0.954 0.511 1.00 0.00 C ATOM 0 H ILE A 52 -1.979 -1.246 4.961 1.00 0.00 H new ATOM 0 HA ILE A 52 0.002 0.037 3.119 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.331 -1.273 1.798 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.347 0.459 0.221 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.068 1.668 1.459 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.803 -0.870 1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.434 -1.578 2.985 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -3.820 0.154 2.850 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.300 1.736 -0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.379 1.258 1.326 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.095 0.030 0.069 1.00 0.00 H new ATOM 821 N THR A 53 -0.487 2.191 4.218 1.00 0.00 N ATOM 822 CA THR A 53 -0.743 3.560 4.740 1.00 0.00 C ATOM 823 C THR A 53 -1.175 4.444 3.535 1.00 0.00 C ATOM 824 O THR A 53 -0.338 4.842 2.716 1.00 0.00 O ATOM 825 CB THR A 53 0.497 4.126 5.497 1.00 0.00 C ATOM 826 OG1 THR A 53 0.919 3.226 6.516 1.00 0.00 O ATOM 827 CG2 THR A 53 0.229 5.480 6.181 1.00 0.00 C ATOM 0 H THR A 53 0.459 2.059 3.860 1.00 0.00 H new ATOM 0 HA THR A 53 -1.542 3.547 5.481 1.00 0.00 H new ATOM 0 HB THR A 53 1.261 4.258 4.731 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.789 2.844 6.276 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.133 5.816 6.689 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.061 6.216 5.431 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.575 5.367 6.908 1.00 0.00 H new ATOM 901 N ILE A 59 -4.193 0.665 7.434 1.00 0.00 N ATOM 902 CA ILE A 59 -5.133 -0.490 7.508 1.00 0.00 C ATOM 903 C ILE A 59 -4.410 -1.778 7.007 1.00 0.00 C ATOM 904 O ILE A 59 -3.633 -1.758 6.046 1.00 0.00 O ATOM 905 CB ILE A 59 -6.484 -0.175 6.775 1.00 0.00 C ATOM 906 CG1 ILE A 59 -7.604 -1.182 7.164 1.00 0.00 C ATOM 907 CG2 ILE A 59 -6.346 -0.060 5.237 1.00 0.00 C ATOM 908 CD1 ILE A 59 -9.034 -0.689 6.917 1.00 0.00 C ATOM 0 HA ILE A 59 -5.421 -0.675 8.543 1.00 0.00 H new ATOM 0 HB ILE A 59 -6.778 0.814 7.128 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.452 -2.105 6.604 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.498 -1.429 8.220 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.320 0.159 4.800 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.650 0.743 4.993 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -5.970 -1.001 4.834 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -9.742 -1.461 7.219 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -9.213 0.215 7.499 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -9.166 -0.471 5.857 1.00 0.00 H new ATOM 920 N GLN A 60 -4.731 -2.903 7.663 1.00 0.00 N ATOM 921 CA GLN A 60 -4.144 -4.232 7.345 1.00 0.00 C ATOM 922 C GLN A 60 -5.079 -5.000 6.371 1.00 0.00 C ATOM 923 O GLN A 60 -6.271 -5.189 6.638 1.00 0.00 O ATOM 924 CB GLN A 60 -3.891 -5.061 8.633 1.00 0.00 C ATOM 925 CG GLN A 60 -2.732 -4.542 9.516 1.00 0.00 C ATOM 926 CD GLN A 60 -2.420 -5.381 10.770 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.005 -6.431 11.042 1.00 0.00 O ATOM 928 NE2 GLN A 60 -1.466 -4.924 11.566 1.00 0.00 N ATOM 0 H GLN A 60 -5.403 -2.927 8.430 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.179 -4.076 6.863 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -4.805 -5.073 9.227 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -3.681 -6.092 8.350 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.831 -4.487 8.905 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -2.967 -3.525 9.831 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.984 -4.055 11.337 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -1.213 -5.441 12.408 1.00 0.00 H new ATOM 937 N ASN A 61 -4.498 -5.431 5.242 1.00 0.00 N ATOM 938 CA ASN A 61 -5.222 -6.148 4.152 1.00 0.00 C ATOM 939 C ASN A 61 -4.489 -7.484 3.803 1.00 0.00 C ATOM 940 O ASN A 61 -3.298 -7.662 4.083 1.00 0.00 O ATOM 941 CB ASN A 61 -5.331 -5.218 2.909 1.00 0.00 C ATOM 942 CG ASN A 61 -6.224 -3.961 3.017 1.00 0.00 C ATOM 943 OD1 ASN A 61 -6.958 -3.737 3.981 1.00 0.00 O ATOM 944 ND2 ASN A 61 -6.182 -3.114 2.001 1.00 0.00 N ATOM 0 H ASN A 61 -3.506 -5.297 5.047 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.229 -6.403 4.484 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -4.325 -4.891 2.648 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -5.698 -5.817 2.075 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -6.758 -2.273 2.014 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -5.573 -3.303 1.205 1.00 0.00 H new ATOM 951 N GLU A 62 -5.216 -8.432 3.175 1.00 0.00 N ATOM 952 CA GLU A 62 -4.655 -9.759 2.785 1.00 0.00 C ATOM 953 C GLU A 62 -5.172 -10.169 1.376 1.00 0.00 C ATOM 954 O GLU A 62 -6.371 -10.069 1.085 1.00 0.00 O ATOM 955 CB GLU A 62 -5.006 -10.825 3.863 1.00 0.00 C ATOM 956 CG GLU A 62 -4.227 -12.155 3.733 1.00 0.00 C ATOM 957 CD GLU A 62 -4.695 -13.229 4.717 1.00 0.00 C ATOM 958 OE1 GLU A 62 -4.169 -13.285 5.849 1.00 0.00 O ATOM 959 OE2 GLU A 62 -5.590 -14.025 4.358 1.00 0.00 O ATOM 0 H GLU A 62 -6.197 -8.310 2.923 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.569 -9.690 2.729 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.814 -10.402 4.849 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.074 -11.038 3.810 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.334 -12.533 2.716 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.166 -11.964 3.892 1.00 0.00 H new ATOM 966 N PHE A 63 -4.256 -10.696 0.540 1.00 0.00 N ATOM 967 CA PHE A 63 -4.613 -11.391 -0.730 1.00 0.00 C ATOM 968 C PHE A 63 -3.976 -12.807 -0.828 1.00 0.00 C ATOM 969 O PHE A 63 -2.950 -13.107 -0.211 1.00 0.00 O ATOM 970 CB PHE A 63 -4.313 -10.515 -1.982 1.00 0.00 C ATOM 971 CG PHE A 63 -2.849 -10.172 -2.313 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.030 -11.105 -2.961 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.353 -8.893 -2.050 1.00 0.00 C ATOM 974 CE1 PHE A 63 -0.730 -10.769 -3.316 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.043 -8.563 -2.387 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.235 -9.504 -3.019 1.00 0.00 C ATOM 0 H PHE A 63 -3.252 -10.657 0.717 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.692 -11.543 -0.710 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.737 -11.022 -2.849 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -4.854 -9.576 -1.865 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.411 -12.090 -3.186 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -2.989 -8.156 -1.583 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.104 -11.489 -3.822 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.655 -7.581 -2.159 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.782 -9.250 -3.280 1.00 0.00 H new ATOM 986 N THR A 64 -4.575 -13.636 -1.701 1.00 0.00 N ATOM 987 CA THR A 64 -3.951 -14.884 -2.214 1.00 0.00 C ATOM 988 C THR A 64 -3.751 -14.717 -3.753 1.00 0.00 C ATOM 989 O THR A 64 -4.626 -14.219 -4.473 1.00 0.00 O ATOM 990 CB THR A 64 -4.839 -16.105 -1.832 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.953 -16.194 -0.416 1.00 0.00 O ATOM 992 CG2 THR A 64 -4.335 -17.468 -2.338 1.00 0.00 C ATOM 0 H THR A 64 -5.508 -13.465 -2.076 1.00 0.00 H new ATOM 0 HA THR A 64 -2.975 -15.068 -1.766 1.00 0.00 H new ATOM 0 HB THR A 64 -5.793 -15.913 -2.323 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.513 -16.963 -0.181 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.023 -18.251 -2.019 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.280 -17.454 -3.427 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.345 -17.665 -1.927 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.594 -15.196 -4.253 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.269 -15.210 -5.710 1.00 0.00 C ATOM 1002 C VAL A 65 -3.082 -16.367 -6.383 1.00 0.00 C ATOM 1003 O VAL A 65 -2.997 -17.530 -5.973 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.723 -15.325 -5.948 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.331 -15.400 -7.442 1.00 0.00 C ATOM 1006 CG2 VAL A 65 0.093 -14.169 -5.317 1.00 0.00 C ATOM 0 H VAL A 65 -1.855 -15.585 -3.667 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.561 -14.268 -6.173 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.473 -16.263 -5.453 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.753 -15.478 -7.530 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.796 -16.275 -7.897 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.673 -14.500 -7.953 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.153 -14.317 -5.523 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.231 -13.220 -5.744 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.069 -14.156 -4.239 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.882 -16.008 -7.399 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.900 -16.913 -7.987 1.00 0.00 C ATOM 1018 C GLY A 66 -6.268 -16.998 -7.265 1.00 0.00 C ATOM 1019 O GLY A 66 -6.885 -18.066 -7.266 1.00 0.00 O ATOM 0 H GLY A 66 -3.847 -15.088 -7.839 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.079 -16.599 -9.015 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.477 -17.917 -8.030 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.736 -15.881 -6.677 1.00 0.00 N ATOM 1024 CA GLU A 67 -8.004 -15.825 -5.907 1.00 0.00 C ATOM 1025 C GLU A 67 -8.606 -14.396 -6.037 1.00 0.00 C ATOM 1026 O GLU A 67 -7.904 -13.393 -5.869 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.716 -16.174 -4.418 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.963 -16.429 -3.544 1.00 0.00 C ATOM 1029 CD GLU A 67 -8.613 -16.668 -2.073 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.353 -17.831 -1.695 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -8.587 -15.692 -1.290 1.00 0.00 O ATOM 0 H GLU A 67 -6.248 -14.987 -6.720 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.722 -16.547 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.084 -17.061 -4.386 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.144 -15.359 -3.976 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.636 -15.575 -3.619 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.502 -17.294 -3.930 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.941 -14.324 -6.215 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.728 -13.088 -5.936 1.00 0.00 C ATOM 1040 C GLU A 68 -10.770 -12.819 -4.400 1.00 0.00 C ATOM 1041 O GLU A 68 -11.404 -13.555 -3.640 1.00 0.00 O ATOM 1042 CB GLU A 68 -12.120 -13.096 -6.624 1.00 0.00 C ATOM 1043 CG GLU A 68 -13.053 -14.275 -6.288 1.00 0.00 C ATOM 1044 CD GLU A 68 -14.441 -14.149 -6.920 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -14.614 -14.568 -8.086 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -15.365 -13.632 -6.254 1.00 0.00 O ATOM 0 H GLU A 68 -10.505 -15.105 -6.551 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.219 -12.238 -6.392 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.634 -12.171 -6.363 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.966 -13.081 -7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.591 -15.203 -6.626 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -13.160 -14.348 -5.206 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.995 -11.812 -3.962 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.617 -11.637 -2.538 1.00 0.00 C ATOM 1055 C CYS A 69 -9.911 -10.196 -2.070 1.00 0.00 C ATOM 1056 O CYS A 69 -9.548 -9.204 -2.712 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.139 -12.004 -2.328 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.066 -11.312 -3.632 1.00 0.00 S ATOM 0 H CYS A 69 -9.611 -11.096 -4.578 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.220 -12.311 -1.930 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.810 -11.637 -1.356 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.034 -13.089 -2.311 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.796 -10.694 -4.512 1.00 0.00 H new ATOM 1064 N GLU A 70 -10.573 -10.126 -0.909 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.181 -8.877 -0.390 1.00 0.00 C ATOM 1066 C GLU A 70 -10.136 -7.935 0.281 1.00 0.00 C ATOM 1067 O GLU A 70 -9.409 -8.335 1.198 1.00 0.00 O ATOM 1068 CB GLU A 70 -12.428 -9.220 0.463 1.00 0.00 C ATOM 1069 CG GLU A 70 -12.168 -9.889 1.822 1.00 0.00 C ATOM 1070 CD GLU A 70 -13.450 -10.233 2.583 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -14.066 -11.281 2.286 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -13.846 -9.461 3.483 1.00 0.00 O ATOM 0 H GLU A 70 -10.707 -10.930 -0.296 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.544 -8.272 -1.221 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.985 -8.300 0.637 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.072 -9.877 -0.123 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.591 -10.800 1.666 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.557 -9.226 2.435 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.071 -6.692 -0.223 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.113 -5.657 0.245 1.00 0.00 C ATOM 1081 C LEU A 71 -9.946 -4.477 0.803 1.00 0.00 C ATOM 1082 O LEU A 71 -10.727 -3.862 0.067 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.189 -5.174 -0.914 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.280 -6.224 -1.619 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.469 -5.564 -2.750 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.326 -6.949 -0.653 1.00 0.00 C ATOM 0 H LEU A 71 -10.683 -6.367 -0.972 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.462 -6.071 1.015 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.821 -4.717 -1.675 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.545 -4.388 -0.520 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.951 -6.977 -2.032 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.840 -6.313 -3.231 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.151 -5.136 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.842 -4.775 -2.335 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.722 -7.666 -1.208 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.673 -6.221 -0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.906 -7.474 0.106 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.758 -2.295 0.618 1.00 0.00 N ATOM 1181 CA LYS A 78 -14.382 -3.707 0.353 1.00 0.00 C ATOM 1182 C LYS A 78 -14.472 -4.023 -1.166 1.00 0.00 C ATOM 1183 O LYS A 78 -15.523 -3.846 -1.793 1.00 0.00 O ATOM 1184 CB LYS A 78 -15.263 -4.646 1.226 1.00 0.00 C ATOM 1185 CG LYS A 78 -14.598 -5.999 1.561 1.00 0.00 C ATOM 1186 CD LYS A 78 -13.494 -5.960 2.652 1.00 0.00 C ATOM 1187 CE LYS A 78 -13.971 -6.070 4.115 1.00 0.00 C ATOM 1188 NZ LYS A 78 -14.635 -4.859 4.630 1.00 0.00 N ATOM 0 HA LYS A 78 -13.343 -3.877 0.635 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.510 -4.134 2.156 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -16.202 -4.833 0.706 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -15.374 -6.694 1.882 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -14.164 -6.405 0.647 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.794 -6.773 2.459 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.939 -5.028 2.543 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.660 -6.911 4.198 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.113 -6.297 4.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.711 -4.919 5.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.077 -4.020 4.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.586 -4.782 4.217 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.337 -4.463 -1.736 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.154 -4.598 -3.206 1.00 0.00 C ATOM 1204 C VAL A 79 -12.360 -5.912 -3.478 1.00 0.00 C ATOM 1205 O VAL A 79 -11.237 -6.083 -2.994 1.00 0.00 O ATOM 1206 CB VAL A 79 -12.531 -3.286 -3.805 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -11.118 -2.901 -3.304 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -12.556 -3.286 -5.345 1.00 0.00 C ATOM 0 H VAL A 79 -12.516 -4.737 -1.197 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.104 -4.699 -3.731 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.192 -2.511 -3.415 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.798 -1.979 -3.790 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.143 -2.753 -2.224 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.417 -3.700 -3.544 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.116 -2.360 -5.716 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.984 -4.135 -5.718 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.586 -3.362 -5.692 1.00 0.00 H new ATOM 1218 N LYS A 80 -12.959 -6.834 -4.259 1.00 0.00 N ATOM 1219 CA LYS A 80 -12.368 -8.174 -4.540 1.00 0.00 C ATOM 1220 C LYS A 80 -11.532 -8.122 -5.850 1.00 0.00 C ATOM 1221 O LYS A 80 -12.033 -7.713 -6.904 1.00 0.00 O ATOM 1222 CB LYS A 80 -13.457 -9.277 -4.600 1.00 0.00 C ATOM 1223 CG LYS A 80 -14.196 -9.520 -3.261 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.189 -10.703 -3.262 1.00 0.00 C ATOM 1225 CE LYS A 80 -14.566 -12.113 -3.217 1.00 0.00 C ATOM 1226 NZ LYS A 80 -13.916 -12.421 -1.928 1.00 0.00 N ATOM 0 H LYS A 80 -13.859 -6.680 -4.713 1.00 0.00 H new ATOM 0 HA LYS A 80 -11.702 -8.436 -3.718 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.189 -9.007 -5.361 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -12.994 -10.210 -4.920 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -13.454 -9.690 -2.481 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.737 -8.613 -2.994 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.853 -10.594 -2.405 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.808 -10.630 -4.156 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -15.343 -12.853 -3.411 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -13.832 -12.205 -4.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -12.977 -12.833 -2.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -13.813 -11.547 -1.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -14.499 -13.100 -1.398 1.00 0.00 H new ATOM 1240 N THR A 81 -10.244 -8.501 -5.749 1.00 0.00 N ATOM 1241 CA THR A 81 -9.218 -8.196 -6.790 1.00 0.00 C ATOM 1242 C THR A 81 -8.422 -9.506 -7.081 1.00 0.00 C ATOM 1243 O THR A 81 -7.920 -10.145 -6.149 1.00 0.00 O ATOM 1244 CB THR A 81 -8.296 -6.989 -6.389 1.00 0.00 C ATOM 1245 OG1 THR A 81 -7.235 -7.396 -5.527 1.00 0.00 O ATOM 1246 CG2 THR A 81 -8.972 -5.788 -5.708 1.00 0.00 C ATOM 0 H THR A 81 -9.877 -9.024 -4.954 1.00 0.00 H new ATOM 0 HA THR A 81 -9.708 -7.866 -7.706 1.00 0.00 H new ATOM 0 HB THR A 81 -7.947 -6.653 -7.366 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.434 -7.584 -6.060 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.224 -5.028 -5.485 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.727 -5.370 -6.374 1.00 0.00 H new ATOM 0 HG23 THR A 81 -9.445 -6.114 -4.782 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.291 -9.903 -8.364 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.634 -11.192 -8.747 1.00 0.00 C ATOM 1256 C VAL A 82 -6.130 -10.899 -9.035 1.00 0.00 C ATOM 1257 O VAL A 82 -5.801 -10.290 -10.057 1.00 0.00 O ATOM 1258 CB VAL A 82 -8.357 -11.911 -9.941 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -7.703 -13.277 -10.267 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.864 -12.170 -9.712 1.00 0.00 C ATOM 0 H VAL A 82 -8.627 -9.358 -9.158 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.712 -11.900 -7.922 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.248 -11.210 -10.769 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.231 -13.744 -11.098 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.659 -13.125 -10.540 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.758 -13.925 -9.392 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.284 -12.669 -10.585 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.995 -12.802 -8.834 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.377 -11.221 -9.555 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.234 -11.354 -8.136 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.782 -11.013 -8.188 1.00 0.00 C ATOM 1272 C VAL A 83 -3.013 -12.163 -8.907 1.00 0.00 C ATOM 1273 O VAL A 83 -3.101 -13.323 -8.499 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.171 -10.718 -6.768 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.746 -10.120 -6.873 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.011 -9.776 -5.870 1.00 0.00 C ATOM 0 H VAL A 83 -5.485 -11.963 -7.357 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.673 -10.088 -8.754 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.158 -11.699 -6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.357 -9.930 -5.873 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.093 -10.824 -7.389 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.784 -9.185 -7.432 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.505 -9.636 -4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.127 -8.811 -6.363 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.993 -10.217 -5.699 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.224 -11.815 -9.940 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.243 -12.743 -10.573 1.00 0.00 C ATOM 1288 C GLN A 84 0.179 -12.177 -10.331 1.00 0.00 C ATOM 1289 O GLN A 84 0.461 -11.003 -10.588 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.488 -12.920 -12.096 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.536 -13.973 -12.523 1.00 0.00 C ATOM 1292 CD GLN A 84 -3.979 -13.747 -12.039 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.587 -12.704 -12.286 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.550 -14.717 -11.342 1.00 0.00 N ATOM 0 H GLN A 84 -2.241 -10.888 -10.365 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.358 -13.728 -10.121 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.792 -11.956 -12.504 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.538 -13.179 -12.564 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.546 -14.021 -13.612 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.205 -14.947 -12.164 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.035 -15.575 -11.145 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.505 -14.606 -11.002 1.00 0.00 H new ATOM 1303 N LEU A 85 1.079 -13.064 -9.879 1.00 0.00 N ATOM 1304 CA LEU A 85 2.501 -12.736 -9.645 1.00 0.00 C ATOM 1305 C LEU A 85 3.327 -13.215 -10.870 1.00 0.00 C ATOM 1306 O LEU A 85 3.527 -14.418 -11.069 1.00 0.00 O ATOM 1307 CB LEU A 85 2.944 -13.352 -8.289 1.00 0.00 C ATOM 1308 CG LEU A 85 4.441 -13.198 -7.912 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.956 -11.745 -7.966 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.729 -13.817 -6.530 1.00 0.00 C ATOM 0 H LEU A 85 0.844 -14.033 -9.664 1.00 0.00 H new ATOM 0 HA LEU A 85 2.669 -11.663 -9.559 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.345 -12.900 -7.498 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.704 -14.415 -8.303 1.00 0.00 H new ATOM 0 HG LEU A 85 4.991 -13.744 -8.678 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.010 -11.722 -7.689 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.838 -11.354 -8.977 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.385 -11.130 -7.270 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.785 -13.696 -6.290 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.125 -13.316 -5.774 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.481 -14.878 -6.548 1.00 0.00 H new ATOM 1322 N GLU A 86 3.807 -12.241 -11.664 1.00 0.00 N ATOM 1323 CA GLU A 86 4.650 -12.498 -12.858 1.00 0.00 C ATOM 1324 C GLU A 86 6.132 -12.184 -12.513 1.00 0.00 C ATOM 1325 O GLU A 86 6.479 -11.081 -12.074 1.00 0.00 O ATOM 1326 CB GLU A 86 4.143 -11.629 -14.034 1.00 0.00 C ATOM 1327 CG GLU A 86 4.721 -11.992 -15.417 1.00 0.00 C ATOM 1328 CD GLU A 86 4.152 -11.111 -16.533 1.00 0.00 C ATOM 1329 OE1 GLU A 86 4.695 -10.010 -16.772 1.00 0.00 O ATOM 1330 OE2 GLU A 86 3.155 -11.515 -17.173 1.00 0.00 O ATOM 0 H GLU A 86 3.624 -11.251 -11.500 1.00 0.00 H new ATOM 0 HA GLU A 86 4.585 -13.544 -13.156 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.057 -11.707 -14.080 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.379 -10.586 -13.822 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.806 -11.889 -15.393 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.504 -13.038 -15.636 1.00 0.00 H new ATOM 1337 N GLY A 87 6.991 -13.182 -12.749 1.00 0.00 N ATOM 1338 CA GLY A 87 8.464 -13.053 -12.575 1.00 0.00 C ATOM 1339 C GLY A 87 9.097 -12.927 -11.167 1.00 0.00 C ATOM 1340 O GLY A 87 10.277 -12.580 -11.068 1.00 0.00 O ATOM 0 H GLY A 87 6.697 -14.106 -13.066 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.918 -13.922 -13.052 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.776 -12.177 -13.144 1.00 0.00 H new ATOM 1344 N ASP A 88 8.316 -13.164 -10.101 1.00 0.00 N ATOM 1345 CA ASP A 88 8.677 -12.811 -8.692 1.00 0.00 C ATOM 1346 C ASP A 88 8.982 -11.290 -8.446 1.00 0.00 C ATOM 1347 O ASP A 88 9.931 -10.936 -7.739 1.00 0.00 O ATOM 1348 CB ASP A 88 9.730 -13.784 -8.079 1.00 0.00 C ATOM 1349 CG ASP A 88 9.280 -15.251 -7.976 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.490 -15.578 -7.062 1.00 0.00 O ATOM 1351 OD2 ASP A 88 9.707 -16.076 -8.814 1.00 0.00 O ATOM 0 H ASP A 88 7.402 -13.611 -10.180 1.00 0.00 H new ATOM 0 HA ASP A 88 7.762 -12.969 -8.122 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.637 -13.740 -8.682 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.992 -13.430 -7.082 1.00 0.00 H new ATOM 1356 N ASN A 89 8.148 -10.396 -9.021 1.00 0.00 N ATOM 1357 CA ASN A 89 8.293 -8.920 -8.898 1.00 0.00 C ATOM 1358 C ASN A 89 6.979 -8.128 -9.178 1.00 0.00 C ATOM 1359 O ASN A 89 6.753 -7.131 -8.491 1.00 0.00 O ATOM 1360 CB ASN A 89 9.507 -8.339 -9.682 1.00 0.00 C ATOM 1361 CG ASN A 89 9.487 -8.401 -11.228 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.043 -9.372 -11.840 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.985 -7.367 -11.887 1.00 0.00 N ATOM 0 H ASN A 89 7.348 -10.676 -9.589 1.00 0.00 H new ATOM 0 HA ASN A 89 8.515 -8.767 -7.842 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.618 -7.294 -9.394 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.402 -8.860 -9.341 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.002 -7.372 -12.907 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.352 -6.565 -11.375 1.00 0.00 H new ATOM 1370 N LYS A 90 6.140 -8.519 -10.163 1.00 0.00 N ATOM 1371 CA LYS A 90 4.955 -7.726 -10.598 1.00 0.00 C ATOM 1372 C LYS A 90 3.651 -8.357 -10.048 1.00 0.00 C ATOM 1373 O LYS A 90 3.314 -9.490 -10.406 1.00 0.00 O ATOM 1374 CB LYS A 90 4.883 -7.673 -12.153 1.00 0.00 C ATOM 1375 CG LYS A 90 6.016 -6.895 -12.857 1.00 0.00 C ATOM 1376 CD LYS A 90 6.124 -7.099 -14.385 1.00 0.00 C ATOM 1377 CE LYS A 90 5.066 -6.393 -15.259 1.00 0.00 C ATOM 1378 NZ LYS A 90 3.789 -7.123 -15.338 1.00 0.00 N ATOM 0 H LYS A 90 6.260 -9.389 -10.681 1.00 0.00 H new ATOM 0 HA LYS A 90 5.059 -6.715 -10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.881 -8.695 -12.532 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.931 -7.226 -12.438 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.878 -5.832 -12.660 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.965 -7.182 -12.403 1.00 0.00 H new ATOM 0 HD2 LYS A 90 7.109 -6.759 -14.704 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.074 -8.169 -14.589 1.00 0.00 H new ATOM 0 HE2 LYS A 90 4.882 -5.396 -14.859 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.465 -6.264 -16.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.250 -6.792 -16.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.977 -8.141 -15.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.237 -6.952 -14.473 1.00 0.00 H new ATOM 1392 N LEU A 91 2.896 -7.601 -9.231 1.00 0.00 N ATOM 1393 CA LEU A 91 1.560 -8.037 -8.733 1.00 0.00 C ATOM 1394 C LEU A 91 0.476 -7.319 -9.582 1.00 0.00 C ATOM 1395 O LEU A 91 0.169 -6.145 -9.359 1.00 0.00 O ATOM 1396 CB LEU A 91 1.384 -7.732 -7.222 1.00 0.00 C ATOM 1397 CG LEU A 91 2.377 -8.414 -6.242 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.388 -7.673 -4.891 1.00 0.00 C ATOM 1399 CD2 LEU A 91 2.081 -9.916 -6.066 1.00 0.00 C ATOM 0 H LEU A 91 3.181 -6.681 -8.896 1.00 0.00 H new ATOM 0 HA LEU A 91 1.464 -9.118 -8.839 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.459 -6.653 -7.084 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.373 -8.020 -6.934 1.00 0.00 H new ATOM 0 HG LEU A 91 3.374 -8.348 -6.677 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.088 -8.162 -4.214 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.695 -6.639 -5.046 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.389 -7.694 -4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.801 -10.350 -5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.073 -10.044 -5.671 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.159 -10.418 -7.031 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.069 -8.043 -10.572 1.00 0.00 N ATOM 1412 CA VAL A 92 -0.965 -7.472 -11.618 1.00 0.00 C ATOM 1413 C VAL A 92 -2.417 -7.833 -11.196 1.00 0.00 C ATOM 1414 O VAL A 92 -2.795 -9.010 -11.220 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.596 -8.017 -13.042 1.00 0.00 C ATOM 1416 CG1 VAL A 92 -1.458 -7.382 -14.159 1.00 0.00 C ATOM 1417 CG2 VAL A 92 0.893 -7.846 -13.432 1.00 0.00 C ATOM 0 H VAL A 92 0.093 -9.044 -10.679 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.855 -6.390 -11.691 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.804 -9.084 -12.961 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.163 -7.793 -15.124 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.510 -7.603 -13.977 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.310 -6.302 -14.164 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.056 -8.250 -14.431 1.00 0.00 H new ATOM 0 HG22 VAL A 92 1.152 -6.787 -13.422 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.520 -8.380 -12.718 1.00 0.00 H new ATOM 1427 N THR A 93 -3.209 -6.820 -10.789 1.00 0.00 N ATOM 1428 CA THR A 93 -4.518 -7.055 -10.114 1.00 0.00 C ATOM 1429 C THR A 93 -5.660 -6.117 -10.619 1.00 0.00 C ATOM 1430 O THR A 93 -5.443 -5.067 -11.232 1.00 0.00 O ATOM 1431 CB THR A 93 -4.321 -7.123 -8.569 1.00 0.00 C ATOM 1432 OG1 THR A 93 -5.508 -7.613 -7.956 1.00 0.00 O ATOM 1433 CG2 THR A 93 -3.918 -5.823 -7.864 1.00 0.00 C ATOM 0 H THR A 93 -2.974 -5.835 -10.911 1.00 0.00 H new ATOM 0 HA THR A 93 -4.892 -8.035 -10.409 1.00 0.00 H new ATOM 0 HB THR A 93 -3.469 -7.792 -8.447 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.884 -8.335 -8.502 1.00 0.00 H new ATOM 0 HG21 THR A 93 -3.814 -6.006 -6.795 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.968 -5.470 -8.266 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.685 -5.067 -8.029 1.00 0.00 H new ATOM 1441 N THR A 94 -6.898 -6.578 -10.364 1.00 0.00 N ATOM 1442 CA THR A 94 -8.128 -6.105 -11.051 1.00 0.00 C ATOM 1443 C THR A 94 -8.648 -4.761 -10.454 1.00 0.00 C ATOM 1444 O THR A 94 -8.449 -3.727 -11.098 1.00 0.00 O ATOM 1445 CB THR A 94 -9.158 -7.286 -11.084 1.00 0.00 C ATOM 1446 OG1 THR A 94 -8.585 -8.436 -11.705 1.00 0.00 O ATOM 1447 CG2 THR A 94 -10.471 -6.987 -11.828 1.00 0.00 C ATOM 0 H THR A 94 -7.082 -7.299 -9.667 1.00 0.00 H new ATOM 0 HA THR A 94 -7.923 -5.840 -12.088 1.00 0.00 H new ATOM 0 HB THR A 94 -9.398 -7.452 -10.034 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.241 -9.164 -11.715 1.00 0.00 H new ATOM 0 HG21 THR A 94 -11.116 -7.865 -11.795 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.976 -6.147 -11.351 1.00 0.00 H new ATOM 0 HG23 THR A 94 -10.252 -6.737 -12.866 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.341 -4.769 -9.285 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.079 -3.586 -8.734 1.00 0.00 C ATOM 1457 C PHE A 95 -11.293 -3.128 -9.621 1.00 0.00 C ATOM 1458 O PHE A 95 -11.466 -3.576 -10.761 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.144 -2.397 -8.352 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.142 -2.542 -7.196 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -8.520 -2.147 -5.906 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -6.819 -2.933 -7.431 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -7.593 -2.156 -4.866 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -5.892 -2.932 -6.390 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.280 -2.547 -5.109 1.00 0.00 C ATOM 0 H PHE A 95 -9.408 -5.596 -8.691 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.513 -3.945 -7.801 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -8.574 -2.135 -9.243 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.783 -1.545 -8.121 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.536 -1.834 -5.717 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -6.515 -3.236 -8.422 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.893 -1.860 -3.872 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -4.871 -3.230 -6.577 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.561 -2.552 -4.303 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.116 -2.185 -9.106 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.108 -1.434 -9.928 1.00 0.00 C ATOM 1477 C LYS A 96 -12.360 -0.304 -10.699 1.00 0.00 C ATOM 1478 O LYS A 96 -12.114 0.780 -10.158 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.252 -0.911 -9.012 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.547 -0.424 -9.715 1.00 0.00 C ATOM 1481 CD LYS A 96 -15.501 0.900 -10.521 1.00 0.00 C ATOM 1482 CE LYS A 96 -15.173 2.190 -9.739 1.00 0.00 C ATOM 1483 NZ LYS A 96 -16.236 2.586 -8.797 1.00 0.00 N ATOM 0 H LYS A 96 -12.116 -1.922 -8.121 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.580 -2.076 -10.672 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.522 -1.707 -8.318 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.859 -0.087 -8.416 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.872 -1.213 -10.393 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.319 -0.321 -8.952 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.761 0.788 -11.313 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -16.468 1.035 -11.005 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.244 2.046 -9.188 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.002 3.002 -10.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.956 3.458 -8.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.119 2.753 -9.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.384 1.827 -8.101 1.00 0.00 H new ATOM 1497 N ASN A 97 -11.977 -0.601 -11.958 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.169 0.298 -12.839 1.00 0.00 C ATOM 1499 C ASN A 97 -9.891 0.949 -12.201 1.00 0.00 C ATOM 1500 O ASN A 97 -9.670 2.152 -12.340 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.124 1.296 -13.569 1.00 0.00 C ATOM 1502 CG ASN A 97 -11.530 2.002 -14.809 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -10.915 1.382 -15.675 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -11.705 3.310 -14.924 1.00 0.00 N ATOM 0 H ASN A 97 -12.219 -1.484 -12.408 1.00 0.00 H new ATOM 0 HA ASN A 97 -10.693 -0.340 -13.584 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.020 0.756 -13.875 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.439 2.057 -12.856 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -11.329 3.806 -15.732 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -12.216 3.821 -14.204 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.054 0.155 -11.509 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.753 0.623 -10.949 1.00 0.00 C ATOM 1513 C ILE A 98 -6.792 -0.556 -11.270 1.00 0.00 C ATOM 1514 O ILE A 98 -6.633 -1.467 -10.448 1.00 0.00 O ATOM 1515 CB ILE A 98 -7.832 0.999 -9.418 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.794 2.181 -9.096 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.432 1.297 -8.827 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.212 2.311 -7.622 1.00 0.00 C ATOM 0 H ILE A 98 -9.251 -0.827 -11.317 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.411 1.561 -11.386 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.251 0.112 -8.943 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.315 3.111 -9.403 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.693 2.070 -9.702 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.529 1.552 -7.772 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.798 0.416 -8.931 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.982 2.133 -9.362 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -9.881 3.164 -7.507 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -9.726 1.402 -7.308 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.326 2.459 -7.004 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.151 -0.555 -12.457 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.317 -1.712 -12.890 1.00 0.00 C ATOM 1532 C LYS A 99 -3.891 -1.566 -12.284 1.00 0.00 C ATOM 1533 O LYS A 99 -3.062 -0.794 -12.776 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.343 -1.886 -14.435 1.00 0.00 C ATOM 1535 CG LYS A 99 -5.088 -3.333 -14.923 1.00 0.00 C ATOM 1536 CD LYS A 99 -6.301 -4.280 -14.746 1.00 0.00 C ATOM 1537 CE LYS A 99 -6.072 -5.736 -15.197 1.00 0.00 C ATOM 1538 NZ LYS A 99 -5.178 -6.487 -14.296 1.00 0.00 N ATOM 0 H LYS A 99 -6.188 0.214 -13.126 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.734 -2.642 -12.505 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.312 -1.556 -14.809 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.591 -1.230 -14.874 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.811 -3.307 -15.977 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.237 -3.744 -14.380 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.588 -4.284 -13.694 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.144 -3.872 -15.305 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.033 -6.247 -15.255 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -5.649 -5.737 -16.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.479 -7.482 -14.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -4.202 -6.434 -14.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -5.221 -6.076 -13.342 1.00 0.00 H new ATOM 1552 N SER A 100 -3.662 -2.279 -11.166 1.00 0.00 N ATOM 1553 CA SER A 100 -2.497 -2.043 -10.281 1.00 0.00 C ATOM 1554 C SER A 100 -1.363 -3.031 -10.629 1.00 0.00 C ATOM 1555 O SER A 100 -1.532 -4.244 -10.494 1.00 0.00 O ATOM 1556 CB SER A 100 -2.952 -2.184 -8.814 1.00 0.00 C ATOM 1557 OG SER A 100 -1.929 -1.762 -7.921 1.00 0.00 O ATOM 0 H SER A 100 -4.273 -3.032 -10.848 1.00 0.00 H new ATOM 0 HA SER A 100 -2.105 -1.036 -10.426 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.851 -1.590 -8.650 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.214 -3.222 -8.609 1.00 0.00 H new ATOM 0 HG SER A 100 -2.241 -1.859 -6.997 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.218 -2.486 -11.065 1.00 0.00 N ATOM 1564 CA VAL A 101 0.996 -3.281 -11.395 1.00 0.00 C ATOM 1565 C VAL A 101 2.046 -2.867 -10.325 1.00 0.00 C ATOM 1566 O VAL A 101 2.663 -1.801 -10.438 1.00 0.00 O ATOM 1567 CB VAL A 101 1.450 -3.011 -12.873 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.842 -3.597 -13.209 1.00 0.00 C ATOM 1569 CG2 VAL A 101 0.434 -3.539 -13.914 1.00 0.00 C ATOM 0 H VAL A 101 -0.097 -1.482 -11.202 1.00 0.00 H new ATOM 0 HA VAL A 101 0.831 -4.358 -11.360 1.00 0.00 H new ATOM 0 HB VAL A 101 1.506 -1.924 -12.936 1.00 0.00 H new ATOM 0 HG11 VAL A 101 3.091 -3.372 -14.246 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.591 -3.155 -12.552 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.826 -4.677 -13.065 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.798 -3.325 -14.919 1.00 0.00 H new ATOM 0 HG22 VAL A 101 0.315 -4.616 -13.792 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -0.528 -3.048 -13.765 1.00 0.00 H new ATOM 1579 N THR A 102 2.250 -3.717 -9.304 1.00 0.00 N ATOM 1580 CA THR A 102 3.159 -3.400 -8.167 1.00 0.00 C ATOM 1581 C THR A 102 4.531 -4.089 -8.429 1.00 0.00 C ATOM 1582 O THR A 102 4.789 -5.195 -7.946 1.00 0.00 O ATOM 1583 CB THR A 102 2.470 -3.761 -6.815 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.138 -3.254 -6.762 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.202 -3.228 -5.579 1.00 0.00 C ATOM 0 H THR A 102 1.802 -4.631 -9.234 1.00 0.00 H new ATOM 0 HA THR A 102 3.365 -2.332 -8.089 1.00 0.00 H new ATOM 0 HB THR A 102 2.487 -4.851 -6.788 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.145 -2.356 -6.369 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.660 -3.521 -4.680 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.210 -3.642 -5.546 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.258 -2.141 -5.630 1.00 0.00 H new ATOM 1593 N GLU A 103 5.388 -3.410 -9.220 1.00 0.00 N ATOM 1594 CA GLU A 103 6.674 -3.961 -9.714 1.00 0.00 C ATOM 1595 C GLU A 103 7.810 -3.641 -8.717 1.00 0.00 C ATOM 1596 O GLU A 103 8.008 -2.492 -8.316 1.00 0.00 O ATOM 1597 CB GLU A 103 6.988 -3.346 -11.100 1.00 0.00 C ATOM 1598 CG GLU A 103 8.167 -4.002 -11.855 1.00 0.00 C ATOM 1599 CD GLU A 103 8.335 -3.450 -13.271 1.00 0.00 C ATOM 1600 OE1 GLU A 103 9.027 -2.423 -13.444 1.00 0.00 O ATOM 1601 OE2 GLU A 103 7.770 -4.037 -14.221 1.00 0.00 O ATOM 0 H GLU A 103 5.209 -2.457 -9.538 1.00 0.00 H new ATOM 0 HA GLU A 103 6.595 -5.044 -9.806 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.095 -3.415 -11.722 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.205 -2.286 -10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.088 -3.841 -11.294 1.00 0.00 H new ATOM 0 HG3 GLU A 103 8.008 -5.079 -11.905 1.00 0.00 H new ATOM 1608 N LEU A 104 8.581 -4.675 -8.377 1.00 0.00 N ATOM 1609 CA LEU A 104 9.681 -4.573 -7.390 1.00 0.00 C ATOM 1610 C LEU A 104 11.024 -4.481 -8.168 1.00 0.00 C ATOM 1611 O LEU A 104 11.456 -5.452 -8.799 1.00 0.00 O ATOM 1612 CB LEU A 104 9.596 -5.775 -6.406 1.00 0.00 C ATOM 1613 CG LEU A 104 10.129 -5.513 -4.972 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.966 -6.776 -4.115 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.582 -5.016 -4.897 1.00 0.00 C ATOM 0 H LEU A 104 8.469 -5.609 -8.771 1.00 0.00 H new ATOM 0 HA LEU A 104 9.605 -3.675 -6.777 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.555 -6.089 -6.334 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.152 -6.610 -6.833 1.00 0.00 H new ATOM 0 HG LEU A 104 9.522 -4.695 -4.584 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.342 -6.585 -3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.911 -7.046 -4.062 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.529 -7.595 -4.563 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.861 -4.862 -3.854 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.244 -5.758 -5.344 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.673 -4.075 -5.439 1.00 0.00 H new ATOM 1627 N ASN A 105 11.658 -3.294 -8.119 1.00 0.00 N ATOM 1628 CA ASN A 105 12.887 -2.998 -8.907 1.00 0.00 C ATOM 1629 C ASN A 105 14.097 -2.876 -7.934 1.00 0.00 C ATOM 1630 O ASN A 105 14.451 -1.779 -7.491 1.00 0.00 O ATOM 1631 CB ASN A 105 12.672 -1.718 -9.770 1.00 0.00 C ATOM 1632 CG ASN A 105 11.574 -1.815 -10.852 1.00 0.00 C ATOM 1633 OD1 ASN A 105 10.414 -1.475 -10.617 1.00 0.00 O ATOM 1634 ND2 ASN A 105 11.913 -2.286 -12.042 1.00 0.00 N ATOM 0 H ASN A 105 11.343 -2.515 -7.541 1.00 0.00 H new ATOM 0 HA ASN A 105 13.102 -3.810 -9.602 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.428 -0.890 -9.104 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.615 -1.468 -10.257 1.00 0.00 H new ATOM 0 HD21 ASN A 105 11.210 -2.370 -12.776 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.877 -2.564 -12.225 1.00 0.00 H new ATOM 1641 N GLY A 106 14.723 -4.021 -7.595 1.00 0.00 N ATOM 1642 CA GLY A 106 15.885 -4.058 -6.675 1.00 0.00 C ATOM 1643 C GLY A 106 15.479 -3.975 -5.190 1.00 0.00 C ATOM 1644 O GLY A 106 14.913 -4.931 -4.649 1.00 0.00 O ATOM 0 H GLY A 106 14.444 -4.938 -7.945 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.445 -4.978 -6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.554 -3.230 -6.910 1.00 0.00 H new ATOM 1648 N ASP A 107 15.757 -2.821 -4.557 1.00 0.00 N ATOM 1649 CA ASP A 107 15.217 -2.491 -3.203 1.00 0.00 C ATOM 1650 C ASP A 107 14.380 -1.173 -3.235 1.00 0.00 C ATOM 1651 O ASP A 107 14.613 -0.245 -2.454 1.00 0.00 O ATOM 1652 CB ASP A 107 16.370 -2.476 -2.157 1.00 0.00 C ATOM 1653 CG ASP A 107 16.919 -3.862 -1.783 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.318 -4.536 -0.917 1.00 0.00 O ATOM 1655 OD2 ASP A 107 17.947 -4.283 -2.360 1.00 0.00 O ATOM 0 H ASP A 107 16.352 -2.093 -4.953 1.00 0.00 H new ATOM 0 HA ASP A 107 14.521 -3.269 -2.890 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.188 -1.870 -2.547 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.014 -1.985 -1.251 1.00 0.00 H new ATOM 1660 N ILE A 108 13.346 -1.133 -4.100 1.00 0.00 N ATOM 1661 CA ILE A 108 12.214 -0.171 -4.011 1.00 0.00 C ATOM 1662 C ILE A 108 10.870 -0.969 -4.146 1.00 0.00 C ATOM 1663 O ILE A 108 10.844 -2.200 -4.064 1.00 0.00 O ATOM 1664 CB ILE A 108 12.371 1.038 -5.003 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.361 0.642 -6.506 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.554 1.980 -4.678 1.00 0.00 C ATOM 1667 CD1 ILE A 108 11.756 1.706 -7.427 1.00 0.00 C ATOM 0 H ILE A 108 13.267 -1.772 -4.891 1.00 0.00 H new ATOM 0 HA ILE A 108 12.209 0.314 -3.035 1.00 0.00 H new ATOM 0 HB ILE A 108 11.461 1.612 -4.829 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.384 0.440 -6.825 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.801 -0.286 -6.623 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.589 2.786 -5.411 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.420 2.401 -3.682 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.487 1.417 -4.712 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.786 1.354 -8.458 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.722 1.893 -7.137 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.329 2.629 -7.342 1.00 0.00 H new ATOM 1679 N ILE A 109 9.733 -0.280 -4.378 1.00 0.00 N ATOM 1680 CA ILE A 109 8.530 -0.908 -4.980 1.00 0.00 C ATOM 1681 C ILE A 109 7.693 0.201 -5.687 1.00 0.00 C ATOM 1682 O ILE A 109 7.281 1.186 -5.065 1.00 0.00 O ATOM 1683 CB ILE A 109 7.738 -1.828 -3.984 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.882 -2.875 -4.744 1.00 0.00 C ATOM 1685 CG2 ILE A 109 6.925 -1.072 -2.901 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.426 -4.067 -3.892 1.00 0.00 C ATOM 0 H ILE A 109 9.619 0.710 -4.159 1.00 0.00 H new ATOM 0 HA ILE A 109 8.831 -1.624 -5.745 1.00 0.00 H new ATOM 0 HB ILE A 109 8.501 -2.360 -3.416 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.001 -2.378 -5.151 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.457 -3.249 -5.591 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.413 -1.792 -2.262 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.600 -0.466 -2.297 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.190 -0.427 -3.382 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.834 -4.747 -4.505 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.299 -4.593 -3.506 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.821 -3.709 -3.059 1.00 0.00 H new ATOM 1698 N THR A 110 7.448 0.005 -6.993 1.00 0.00 N ATOM 1699 CA THR A 110 6.735 0.984 -7.858 1.00 0.00 C ATOM 1700 C THR A 110 5.269 0.490 -8.041 1.00 0.00 C ATOM 1701 O THR A 110 5.009 -0.427 -8.824 1.00 0.00 O ATOM 1702 CB THR A 110 7.502 1.129 -9.208 1.00 0.00 C ATOM 1703 OG1 THR A 110 8.865 1.473 -8.981 1.00 0.00 O ATOM 1704 CG2 THR A 110 6.931 2.206 -10.143 1.00 0.00 C ATOM 0 H THR A 110 7.737 -0.838 -7.489 1.00 0.00 H new ATOM 0 HA THR A 110 6.701 1.975 -7.406 1.00 0.00 H new ATOM 0 HB THR A 110 7.395 0.155 -9.685 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.329 1.557 -9.840 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.521 2.243 -11.059 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.897 1.965 -10.387 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.970 3.176 -9.647 1.00 0.00 H new ATOM 1712 N ASN A 111 4.321 1.117 -7.321 1.00 0.00 N ATOM 1713 CA ASN A 111 2.882 0.736 -7.355 1.00 0.00 C ATOM 1714 C ASN A 111 2.151 1.595 -8.421 1.00 0.00 C ATOM 1715 O ASN A 111 1.783 2.741 -8.153 1.00 0.00 O ATOM 1716 CB ASN A 111 2.316 0.904 -5.922 1.00 0.00 C ATOM 1717 CG ASN A 111 0.837 0.520 -5.727 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.462 -0.651 -5.760 1.00 0.00 O ATOM 1719 ND2 ASN A 111 -0.029 1.499 -5.518 1.00 0.00 N ATOM 0 H ASN A 111 4.521 1.900 -6.699 1.00 0.00 H new ATOM 0 HA ASN A 111 2.735 -0.303 -7.650 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.919 0.302 -5.242 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.442 1.945 -5.623 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.017 1.286 -5.383 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.292 2.467 -5.492 1.00 0.00 H new ATOM 1726 N THR A 112 1.952 1.021 -9.620 1.00 0.00 N ATOM 1727 CA THR A 112 1.441 1.766 -10.806 1.00 0.00 C ATOM 1728 C THR A 112 -0.087 1.493 -10.958 1.00 0.00 C ATOM 1729 O THR A 112 -0.515 0.586 -11.679 1.00 0.00 O ATOM 1730 CB THR A 112 2.287 1.380 -12.056 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.679 1.544 -11.797 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.975 2.205 -13.315 1.00 0.00 C ATOM 0 H THR A 112 2.136 0.035 -9.804 1.00 0.00 H new ATOM 0 HA THR A 112 1.551 2.844 -10.684 1.00 0.00 H new ATOM 0 HB THR A 112 2.020 0.340 -12.247 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.192 1.295 -12.594 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.609 1.870 -14.136 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.928 2.072 -13.587 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.167 3.259 -13.116 1.00 0.00 H new ATOM 1740 N MET A 113 -0.890 2.315 -10.262 1.00 0.00 N ATOM 1741 CA MET A 113 -2.372 2.201 -10.227 1.00 0.00 C ATOM 1742 C MET A 113 -2.991 3.095 -11.331 1.00 0.00 C ATOM 1743 O MET A 113 -3.031 4.323 -11.211 1.00 0.00 O ATOM 1744 CB MET A 113 -2.889 2.604 -8.821 1.00 0.00 C ATOM 1745 CG MET A 113 -2.795 1.498 -7.763 1.00 0.00 C ATOM 1746 SD MET A 113 -3.459 2.095 -6.194 1.00 0.00 S ATOM 1747 CE MET A 113 -3.751 0.534 -5.338 1.00 0.00 C ATOM 0 H MET A 113 -0.533 3.087 -9.700 1.00 0.00 H new ATOM 0 HA MET A 113 -2.670 1.170 -10.419 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.323 3.469 -8.475 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.929 2.918 -8.907 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.349 0.619 -8.092 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.757 1.191 -7.636 1.00 0.00 H new ATOM 0 HE1 MET A 113 -4.163 0.733 -4.349 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.456 -0.068 -5.910 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.810 -0.007 -5.237 1.00 0.00 H new ATOM 1757 N THR A 114 -3.469 2.452 -12.408 1.00 0.00 N ATOM 1758 CA THR A 114 -3.952 3.157 -13.626 1.00 0.00 C ATOM 1759 C THR A 114 -5.504 3.252 -13.577 1.00 0.00 C ATOM 1760 O THR A 114 -6.211 2.283 -13.877 1.00 0.00 O ATOM 1761 CB THR A 114 -3.420 2.495 -14.932 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.863 1.148 -15.055 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.889 2.509 -15.088 1.00 0.00 C ATOM 0 H THR A 114 -3.535 1.436 -12.468 1.00 0.00 H new ATOM 0 HA THR A 114 -3.551 4.170 -13.640 1.00 0.00 H new ATOM 0 HB THR A 114 -3.836 3.118 -15.723 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.715 1.039 -14.583 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.614 2.027 -16.026 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.533 3.539 -15.092 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.434 1.971 -14.257 1.00 0.00 H new ATOM 1771 N LEU A 115 -6.018 4.437 -13.198 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.478 4.724 -13.153 1.00 0.00 C ATOM 1773 C LEU A 115 -7.890 5.410 -14.484 1.00 0.00 C ATOM 1774 O LEU A 115 -7.929 6.641 -14.576 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.742 5.567 -11.868 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.146 6.189 -11.619 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.273 5.150 -11.468 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.097 7.105 -10.381 1.00 0.00 C ATOM 0 H LEU A 115 -5.439 5.227 -12.913 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.097 3.830 -13.081 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.512 4.933 -11.012 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.020 6.384 -11.863 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.390 6.766 -12.511 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.220 5.662 -11.297 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.342 4.554 -12.378 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -10.056 4.498 -10.622 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.082 7.539 -10.210 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.801 6.522 -9.509 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.373 7.903 -10.547 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.152 4.592 -15.526 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.386 5.094 -16.900 1.00 0.00 C ATOM 1792 C GLY A 116 -7.095 5.602 -17.576 1.00 0.00 C ATOM 1793 O GLY A 116 -6.304 4.810 -18.095 1.00 0.00 O ATOM 0 H GLY A 116 -8.207 3.577 -15.442 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.819 4.297 -17.505 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.117 5.902 -16.868 1.00 0.00 H new ATOM 1797 N ASP A 117 -6.901 6.929 -17.516 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.624 7.600 -17.906 1.00 0.00 C ATOM 1799 C ASP A 117 -4.761 8.145 -16.714 1.00 0.00 C ATOM 1800 O ASP A 117 -3.622 8.553 -16.960 1.00 0.00 O ATOM 1801 CB ASP A 117 -5.939 8.752 -18.904 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.406 8.298 -20.296 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -5.547 7.995 -21.153 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -7.633 8.240 -20.533 1.00 0.00 O ATOM 0 H ASP A 117 -7.619 7.579 -17.197 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.009 6.826 -18.366 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.709 9.388 -18.469 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.046 9.366 -19.020 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.258 8.168 -15.455 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.565 8.802 -14.295 1.00 0.00 C ATOM 1811 C ILE A 118 -3.584 7.740 -13.711 1.00 0.00 C ATOM 1812 O ILE A 118 -4.018 6.777 -13.069 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.608 9.325 -13.238 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.631 10.361 -13.807 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.910 9.933 -11.991 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.915 10.529 -12.977 1.00 0.00 C ATOM 0 H ILE A 118 -6.154 7.747 -15.208 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.999 9.682 -14.601 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.171 8.437 -12.952 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.138 11.330 -13.886 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -6.906 10.060 -14.818 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.664 10.282 -11.286 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.291 9.173 -11.514 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.284 10.771 -12.297 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.561 11.268 -13.452 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.438 9.574 -12.918 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.658 10.864 -11.972 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.272 7.938 -13.934 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.230 6.945 -13.543 1.00 0.00 C ATOM 1830 C VAL A 119 -0.691 7.364 -12.138 1.00 0.00 C ATOM 1831 O VAL A 119 0.211 8.200 -12.024 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.114 6.794 -14.637 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.873 5.656 -14.287 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.644 6.527 -16.069 1.00 0.00 C ATOM 0 H VAL A 119 -1.898 8.774 -14.383 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.657 5.944 -13.472 1.00 0.00 H new ATOM 0 HB VAL A 119 0.382 7.765 -14.636 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.632 5.580 -15.066 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.353 5.872 -13.332 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.331 4.713 -14.216 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.197 6.437 -16.757 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.220 5.602 -16.077 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.281 7.354 -16.381 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.258 6.751 -11.083 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.869 7.002 -9.671 1.00 0.00 C ATOM 1846 C PHE A 120 0.316 6.078 -9.296 1.00 0.00 C ATOM 1847 O PHE A 120 0.126 4.893 -9.014 1.00 0.00 O ATOM 1848 CB PHE A 120 -2.125 6.809 -8.777 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.957 6.856 -7.243 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -1.231 7.878 -6.618 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.568 5.878 -6.450 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -1.124 7.923 -5.234 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -2.467 5.928 -5.064 1.00 0.00 C ATOM 1854 CZ PHE A 120 -1.752 6.956 -4.457 1.00 0.00 C ATOM 0 H PHE A 120 -2.004 6.062 -11.180 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.519 8.023 -9.519 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.849 7.575 -9.054 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.567 5.846 -9.032 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -0.751 8.637 -7.217 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -3.122 5.078 -6.918 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -0.553 8.709 -4.762 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.943 5.170 -4.459 1.00 0.00 H new ATOM 0 HZ PHE A 120 -1.685 7.003 -3.380 1.00 0.00 H new ATOM 1864 N LYS A 121 1.528 6.656 -9.307 1.00 0.00 N ATOM 1865 CA LYS A 121 2.787 5.888 -9.137 1.00 0.00 C ATOM 1866 C LYS A 121 3.438 6.242 -7.771 1.00 0.00 C ATOM 1867 O LYS A 121 3.991 7.333 -7.599 1.00 0.00 O ATOM 1868 CB LYS A 121 3.690 6.139 -10.372 1.00 0.00 C ATOM 1869 CG LYS A 121 4.911 5.198 -10.459 1.00 0.00 C ATOM 1870 CD LYS A 121 5.773 5.384 -11.724 1.00 0.00 C ATOM 1871 CE LYS A 121 5.138 4.820 -13.011 1.00 0.00 C ATOM 1872 NZ LYS A 121 6.035 4.977 -14.169 1.00 0.00 N ATOM 0 H LYS A 121 1.670 7.658 -9.432 1.00 0.00 H new ATOM 0 HA LYS A 121 2.606 4.814 -9.099 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.092 6.025 -11.276 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.040 7.171 -10.349 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.538 5.355 -9.581 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.562 4.166 -10.421 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.968 6.447 -11.864 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.738 4.901 -11.567 1.00 0.00 H new ATOM 0 HE2 LYS A 121 4.905 3.765 -12.871 1.00 0.00 H new ATOM 0 HE3 LYS A 121 4.196 5.331 -13.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.577 4.587 -15.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.237 5.986 -14.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 6.924 4.468 -13.991 1.00 0.00 H new ATOM 1886 N ARG A 122 3.376 5.293 -6.817 1.00 0.00 N ATOM 1887 CA ARG A 122 3.998 5.439 -5.472 1.00 0.00 C ATOM 1888 C ARG A 122 5.348 4.679 -5.458 1.00 0.00 C ATOM 1889 O ARG A 122 5.383 3.448 -5.561 1.00 0.00 O ATOM 1890 CB ARG A 122 3.063 4.907 -4.351 1.00 0.00 C ATOM 1891 CG ARG A 122 1.855 5.817 -4.052 1.00 0.00 C ATOM 1892 CD ARG A 122 1.009 5.399 -2.833 1.00 0.00 C ATOM 1893 NE ARG A 122 0.129 4.239 -3.119 1.00 0.00 N ATOM 1894 CZ ARG A 122 -0.918 3.870 -2.353 1.00 0.00 C ATOM 1895 NH1 ARG A 122 -1.257 4.474 -1.213 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -1.654 2.853 -2.756 1.00 0.00 N ATOM 0 H ARG A 122 2.896 4.403 -6.949 1.00 0.00 H new ATOM 0 HA ARG A 122 4.166 6.498 -5.276 1.00 0.00 H new ATOM 0 HB2 ARG A 122 2.699 3.920 -4.635 1.00 0.00 H new ATOM 0 HB3 ARG A 122 3.644 4.781 -3.437 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.216 6.833 -3.893 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.211 5.841 -4.931 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.671 5.152 -2.003 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.398 6.243 -2.513 1.00 0.00 H new ATOM 0 HE ARG A 122 0.329 3.683 -3.951 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -0.711 5.266 -0.873 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -2.062 4.144 -0.681 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.425 2.370 -3.625 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -2.453 2.549 -2.199 1.00 0.00 H new ATOM 1910 N ILE A 123 6.451 5.434 -5.317 1.00 0.00 N ATOM 1911 CA ILE A 123 7.833 4.877 -5.332 1.00 0.00 C ATOM 1912 C ILE A 123 8.261 4.850 -3.838 1.00 0.00 C ATOM 1913 O ILE A 123 8.580 5.895 -3.265 1.00 0.00 O ATOM 1914 CB ILE A 123 8.773 5.716 -6.272 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.311 5.672 -7.763 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.257 5.270 -6.172 1.00 0.00 C ATOM 1917 CD1 ILE A 123 8.909 6.754 -8.675 1.00 0.00 C ATOM 0 H ILE A 123 6.420 6.445 -5.189 1.00 0.00 H new ATOM 0 HA ILE A 123 7.894 3.873 -5.753 1.00 0.00 H new ATOM 0 HB ILE A 123 8.698 6.744 -5.918 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.564 4.695 -8.174 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.225 5.758 -7.791 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.866 5.879 -6.840 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.606 5.395 -5.147 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.342 4.222 -6.459 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.522 6.632 -9.687 1.00 0.00 H new ATOM 0 HD12 ILE A 123 8.635 7.739 -8.298 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.995 6.660 -8.688 1.00 0.00 H new ATOM 1929 N SER A 124 8.233 3.653 -3.226 1.00 0.00 N ATOM 1930 CA SER A 124 8.430 3.489 -1.764 1.00 0.00 C ATOM 1931 C SER A 124 9.659 2.576 -1.521 1.00 0.00 C ATOM 1932 O SER A 124 9.648 1.399 -1.888 1.00 0.00 O ATOM 1933 CB SER A 124 7.148 2.895 -1.133 1.00 0.00 C ATOM 1934 OG SER A 124 6.032 3.765 -1.287 1.00 0.00 O ATOM 0 H SER A 124 8.075 2.775 -3.721 1.00 0.00 H new ATOM 0 HA SER A 124 8.618 4.454 -1.294 1.00 0.00 H new ATOM 0 HB2 SER A 124 6.926 1.934 -1.597 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.318 2.706 -0.073 1.00 0.00 H new ATOM 0 HG SER A 124 5.240 3.357 -0.878 1.00 0.00 H new ATOM 1940 N LYS A 125 10.726 3.130 -0.914 1.00 0.00 N ATOM 1941 CA LYS A 125 12.046 2.463 -0.827 1.00 0.00 C ATOM 1942 C LYS A 125 12.127 1.479 0.370 1.00 0.00 C ATOM 1943 O LYS A 125 11.725 1.809 1.492 1.00 0.00 O ATOM 1944 CB LYS A 125 13.148 3.554 -0.814 1.00 0.00 C ATOM 1945 CG LYS A 125 14.584 3.007 -0.931 1.00 0.00 C ATOM 1946 CD LYS A 125 15.634 4.063 -1.332 1.00 0.00 C ATOM 1947 CE LYS A 125 16.987 3.471 -1.775 1.00 0.00 C ATOM 1948 NZ LYS A 125 17.760 2.874 -0.667 1.00 0.00 N ATOM 0 H LYS A 125 10.701 4.048 -0.471 1.00 0.00 H new ATOM 0 HA LYS A 125 12.202 1.832 -1.702 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.967 4.246 -1.636 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.064 4.127 0.109 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.873 2.569 0.025 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.595 2.203 -1.667 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.232 4.669 -2.144 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.801 4.732 -0.488 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.810 2.710 -2.535 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.583 4.256 -2.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.657 2.496 -1.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 17.958 3.601 0.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.210 2.104 -0.235 1.00 0.00 H new ATOM 1962 N ARG A 126 12.694 0.282 0.111 1.00 0.00 N ATOM 1963 CA ARG A 126 12.824 -0.786 1.127 1.00 0.00 C ATOM 1964 C ARG A 126 13.862 -0.426 2.228 1.00 0.00 C ATOM 1965 O ARG A 126 14.970 0.048 1.954 1.00 0.00 O ATOM 1966 CB ARG A 126 13.157 -2.126 0.421 1.00 0.00 C ATOM 1967 CG ARG A 126 12.848 -3.381 1.269 1.00 0.00 C ATOM 1968 CD ARG A 126 14.042 -3.925 2.076 1.00 0.00 C ATOM 1969 NE ARG A 126 13.625 -5.034 2.967 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.418 -5.604 3.893 1.00 0.00 C ATOM 1971 NH1 ARG A 126 15.685 -5.253 4.108 1.00 0.00 N ATOM 1972 NH2 ARG A 126 13.911 -6.571 4.633 1.00 0.00 N ATOM 0 H ARG A 126 13.073 0.029 -0.802 1.00 0.00 H new ATOM 0 HA ARG A 126 11.872 -0.893 1.647 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.594 -2.183 -0.511 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.214 -2.131 0.156 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.038 -3.145 1.959 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.485 -4.168 0.608 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.817 -4.275 1.394 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.479 -3.122 2.670 1.00 0.00 H new ATOM 0 HE ARG A 126 12.673 -5.389 2.872 1.00 0.00 H new ATOM 0 HH11 ARG A 126 16.110 -4.510 3.553 1.00 0.00 H new ATOM 0 HH12 ARG A 126 16.231 -5.727 4.828 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.944 -6.866 4.494 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.485 -7.024 5.344 1.00 0.00 H new ATOM 1986 N ILE A 127 13.435 -0.655 3.475 1.00 0.00 N ATOM 1987 CA ILE A 127 14.171 -0.243 4.695 1.00 0.00 C ATOM 1988 C ILE A 127 13.924 -1.349 5.731 1.00 0.00 C ATOM 1989 O ILE A 127 14.593 -2.383 5.735 1.00 0.00 O ATOM 1990 CB ILE A 127 13.781 1.180 5.237 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.254 1.404 5.478 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.376 2.301 4.348 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.882 2.621 6.340 1.00 0.00 C ATOM 0 H ILE A 127 12.559 -1.137 3.677 1.00 0.00 H new ATOM 0 HA ILE A 127 15.231 -0.134 4.464 1.00 0.00 H new ATOM 0 HB ILE A 127 14.229 1.230 6.229 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.764 1.506 4.510 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.845 0.510 5.950 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.089 3.273 4.748 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.463 2.219 4.338 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.995 2.200 3.332 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.798 2.678 6.441 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.333 2.519 7.327 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.251 3.530 5.865 1.00 0.00 H new