USER MOD reduce.3.24.130724 H: found=0, std=0, add=1344, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1348 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 460 ASN : amide:sc= -1.93 K(o=-8,f=-10!) USER MOD Set 1.2: A 461 LYS NZ :NH3+ 145:sc= -6.1! (180deg=-9.15!) USER MOD Set 2.1: A 136 ASN : amide:sc= -6.56! C(o=-10!,f=-18!) USER MOD Set 2.2: A 139 GLN :FLIP amide:sc= -3.52 F(o=-12!,f=-10) USER MOD Set 3.1: A 2 SER OG : rot 0:sc= -1.59 USER MOD Set 3.2: A 73 SER OG : rot -30:sc= 1.35 USER MOD Set 4.1: A 8 GLN : amide:sc=-0.00351 K(o=-0.88,f=-1.8) USER MOD Set 4.2: A 456 LYS NZ :NH3+ -115:sc= -0.872 (180deg=-2.6!) USER MOD Single : A 0 GLY N :NH3+ -127:sc= 0.0887 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= -0.157 USER MOD Single : A 3 ASN : amide:sc= -0.165 X(o=-0.16,f=-0.052) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -131:sc= 0.128 (180deg=0) USER MOD Single : A 23 ASN :FLIP amide:sc= -0.843 F(o=-2!,f=-0.84) USER MOD Single : A 24 ASN : amide:sc= 0.0526 K(o=0.053,f=-8.6!) USER MOD Single : A 26 SER OG : rot -58:sc= 0.113! USER MOD Single : A 28 SER OG : rot 180:sc= -1.17 USER MOD Single : A 29 SER OG : rot 150:sc= -3.4! USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl -165:sc= -9.61! (180deg=-11.6!) USER MOD Single : A 38 SER OG : rot 59:sc= 0.971 USER MOD Single : A 42 SER OG : rot 69:sc= 1.16 USER MOD Single : A 44 SER OG : rot 180:sc= 0.0131 USER MOD Single : A 49 ASN :FLIP amide:sc= -1.18 F(o=-5.1!,f=-1.2) USER MOD Single : A 52 MET CE :methyl 168:sc= -1.58! (180deg=-2.94!) USER MOD Single : A 53 ASN : amide:sc= 0.819 K(o=0.82,f=-0.035) USER MOD Single : A 60 ASN : amide:sc= -5.94! C(o=-5.9!,f=-14!) USER MOD Single : A 61 HIS :FLIP no HE2:sc= -2.13! C(o=-3.5!,f=-2.1!) USER MOD Single : A 62 GLN : amide:sc= -4.39! C(o=-4.4!,f=-7.6!) USER MOD Single : A 66 SER OG : rot -108:sc= 0.117 USER MOD Single : A 72 MET CE :methyl -164:sc= -10! (180deg=-12.2!) USER MOD Single : A 75 GLN : amide:sc= -4.44! C(o=-4.4!,f=-9.7!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN :FLIP amide:sc= -1.36 F(o=-3!,f=-1.4) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN :FLIP amide:sc= -0.814 F(o=-1.5,f=-0.81) USER MOD Single : A 90 LYS NZ :NH3+ -178:sc= -2.77! (180deg=-2.82!) USER MOD Single : A 94 LYS NZ :NH3+ 143:sc= 0.922 (180deg=-0.406) USER MOD Single : A 95 ASN : amide:sc= -3.8! C(o=-3.8!,f=-3.9!) USER MOD Single : A 101 SER OG : rot 180:sc= -0.282 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -4.21! C(o=-6.3!,f=-4.2!) USER MOD Single : A 110 THR OG1 : rot 82:sc= 0.102 USER MOD Single : A 111 SER OG : rot -102:sc= 0.841 USER MOD Single : A 115 LYS NZ :NH3+ 152:sc= -0.545 (180deg=-1.87!) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.138 USER MOD Single : A 124 MET CE :methyl 148:sc= -6.71! (180deg=-8.82!) USER MOD Single : A 129 SER OG : rot 180:sc= -1.26 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN :FLIP amide:sc= -0.941 F(o=-4.7!,f=-0.94) USER MOD Single : A 145 SER OG : rot -8:sc= 0.998 USER MOD Single : A 146 LYS NZ :NH3+ 149:sc= -0.425 (180deg=-2.07!) USER MOD Single : A 148 SER OG : rot -171:sc= -2.91! USER MOD Single : A 149 SER OG : rot -60:sc= 0.0914 USER MOD Single : A 150 THR OG1 : rot 8:sc= 1.03 USER MOD Single : A 453 THR OG1 : rot 180:sc= 0 USER MOD Single : A 467 LYS NZ :NH3+ -153:sc= -0.864! (180deg=-1.27!) USER MOD Single : A 469 SER OG : rot -150:sc= 0 USER MOD Single : A 471 MET CE :methyl 151:sc= -2.94! (180deg=-4.87!) USER MOD Single : A 473 SER OG : rot -40:sc= 0.0643 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 -1.783 1.449 4.068 1.00 53.41 N ATOM 2 CA GLY A 0 -1.544 0.314 3.194 1.00 63.33 C ATOM 3 C GLY A 0 -0.887 -0.838 3.958 1.00 3.40 C ATOM 4 O GLY A 0 -0.950 -0.888 5.185 1.00 23.34 O ATOM 0 H1 GLY A 0 -2.781 1.733 4.003 1.00 53.41 H new ATOM 0 H2 GLY A 0 -1.562 1.184 5.049 1.00 53.41 H new ATOM 0 H3 GLY A 0 -1.177 2.243 3.779 1.00 53.41 H new ATOM 0 HA2 GLY A 0 -2.487 -0.022 2.762 1.00 63.33 H new ATOM 0 HA3 GLY A 0 -0.904 0.617 2.365 1.00 63.33 H new ATOM 8 N SER A 1 -0.271 -1.733 3.200 1.00 33.55 N ATOM 9 CA SER A 1 0.397 -2.881 3.791 1.00 14.21 C ATOM 10 C SER A 1 1.481 -3.400 2.844 1.00 11.44 C ATOM 11 O SER A 1 1.176 -3.947 1.786 1.00 31.10 O ATOM 12 CB SER A 1 -0.602 -3.993 4.114 1.00 35.54 C ATOM 13 OG SER A 1 -1.650 -3.539 4.968 1.00 65.42 O ATOM 0 H SER A 1 -0.220 -1.687 2.182 1.00 33.55 H new ATOM 0 HA SER A 1 0.861 -2.564 4.725 1.00 14.21 H new ATOM 0 HB2 SER A 1 -1.030 -4.376 3.188 1.00 35.54 H new ATOM 0 HB3 SER A 1 -0.080 -4.822 4.591 1.00 35.54 H new ATOM 0 HG SER A 1 -2.268 -4.278 5.149 1.00 65.42 H new ATOM 19 N SER A 2 2.725 -3.209 3.260 1.00 74.14 N ATOM 20 CA SER A 2 3.856 -3.651 2.462 1.00 52.11 C ATOM 21 C SER A 2 4.097 -5.146 2.679 1.00 71.22 C ATOM 22 O SER A 2 5.055 -5.707 2.150 1.00 71.45 O ATOM 23 CB SER A 2 5.116 -2.855 2.805 1.00 3.23 C ATOM 24 OG SER A 2 6.229 -3.246 2.006 1.00 24.42 O ATOM 0 H SER A 2 2.974 -2.755 4.139 1.00 74.14 H new ATOM 0 HA SER A 2 3.623 -3.476 1.412 1.00 52.11 H new ATOM 0 HB2 SER A 2 4.923 -1.792 2.662 1.00 3.23 H new ATOM 0 HB3 SER A 2 5.358 -2.996 3.858 1.00 3.23 H new ATOM 0 HG SER A 2 5.955 -3.957 1.389 1.00 24.42 H new ATOM 30 N ASN A 3 3.211 -5.749 3.458 1.00 0.22 N ATOM 31 CA ASN A 3 3.315 -7.168 3.752 1.00 64.03 C ATOM 32 C ASN A 3 4.540 -7.413 4.636 1.00 14.22 C ATOM 33 O ASN A 3 5.070 -8.522 4.675 1.00 43.23 O ATOM 34 CB ASN A 3 3.488 -7.984 2.469 1.00 32.44 C ATOM 35 CG ASN A 3 3.007 -9.424 2.667 1.00 42.53 C ATOM 36 OD1 ASN A 3 3.764 -10.376 2.575 1.00 73.23 O ATOM 37 ND2 ASN A 3 1.710 -9.528 2.942 1.00 3.35 N ATOM 0 H ASN A 3 2.417 -5.280 3.895 1.00 0.22 H new ATOM 0 HA ASN A 3 2.399 -7.476 4.256 1.00 64.03 H new ATOM 0 HB2 ASN A 3 2.928 -7.518 1.659 1.00 32.44 H new ATOM 0 HB3 ASN A 3 4.537 -7.984 2.172 1.00 32.44 H new ATOM 0 HD21 ASN A 3 1.292 -10.447 3.090 1.00 3.35 H new ATOM 0 HD22 ASN A 3 1.133 -8.689 3.004 1.00 3.35 H new ATOM 44 N LEU A 4 4.952 -6.359 5.325 1.00 23.11 N ATOM 45 CA LEU A 4 6.104 -6.446 6.207 1.00 41.43 C ATOM 46 C LEU A 4 5.677 -6.093 7.633 1.00 41.52 C ATOM 47 O LEU A 4 4.803 -5.250 7.832 1.00 4.04 O ATOM 48 CB LEU A 4 7.251 -5.582 5.677 1.00 73.35 C ATOM 49 CG LEU A 4 7.258 -5.330 4.167 1.00 21.24 C ATOM 50 CD1 LEU A 4 8.232 -4.208 3.804 1.00 40.21 C ATOM 51 CD2 LEU A 4 7.555 -6.619 3.398 1.00 43.33 C ATOM 0 H LEU A 4 4.509 -5.441 5.291 1.00 23.11 H new ATOM 0 HA LEU A 4 6.488 -7.466 6.232 1.00 41.43 H new ATOM 0 HB2 LEU A 4 7.219 -4.619 6.186 1.00 73.35 H new ATOM 0 HB3 LEU A 4 8.193 -6.056 5.951 1.00 73.35 H new ATOM 0 HG LEU A 4 6.262 -5.000 3.870 1.00 21.24 H new ATOM 0 HD11 LEU A 4 8.218 -4.049 2.726 1.00 40.21 H new ATOM 0 HD12 LEU A 4 7.934 -3.290 4.310 1.00 40.21 H new ATOM 0 HD13 LEU A 4 9.239 -4.485 4.117 1.00 40.21 H new ATOM 0 HD21 LEU A 4 7.554 -6.413 2.328 1.00 43.33 H new ATOM 0 HD22 LEU A 4 8.532 -7.002 3.693 1.00 43.33 H new ATOM 0 HD23 LEU A 4 6.791 -7.362 3.625 1.00 43.33 H new ATOM 63 N THR A 5 6.313 -6.755 8.588 1.00 42.40 N ATOM 64 CA THR A 5 6.010 -6.521 9.990 1.00 61.32 C ATOM 65 C THR A 5 7.005 -5.527 10.592 1.00 14.20 C ATOM 66 O THR A 5 8.087 -5.318 10.046 1.00 54.42 O ATOM 67 CB THR A 5 5.997 -7.875 10.702 1.00 24.04 C ATOM 68 OG1 THR A 5 7.376 -8.200 10.856 1.00 44.42 O ATOM 69 CG2 THR A 5 5.447 -8.997 9.819 1.00 14.44 C ATOM 0 H THR A 5 7.037 -7.453 8.419 1.00 42.40 H new ATOM 0 HA THR A 5 5.028 -6.063 10.112 1.00 61.32 H new ATOM 0 HB THR A 5 5.398 -7.801 11.610 1.00 24.04 H new ATOM 0 HG1 THR A 5 7.460 -9.064 11.311 1.00 44.42 H new ATOM 0 HG21 THR A 5 5.460 -9.936 10.373 1.00 14.44 H new ATOM 0 HG22 THR A 5 4.423 -8.762 9.528 1.00 14.44 H new ATOM 0 HG23 THR A 5 6.065 -9.094 8.927 1.00 14.44 H new ATOM 77 N GLU A 6 6.602 -4.940 11.710 1.00 63.13 N ATOM 78 CA GLU A 6 7.445 -3.973 12.392 1.00 13.42 C ATOM 79 C GLU A 6 8.900 -4.445 12.395 1.00 0.33 C ATOM 80 O GLU A 6 9.819 -3.635 12.286 1.00 3.23 O ATOM 81 CB GLU A 6 6.947 -3.721 13.817 1.00 50.32 C ATOM 82 CG GLU A 6 7.346 -4.867 14.748 1.00 63.21 C ATOM 83 CD GLU A 6 6.958 -4.558 16.195 1.00 23.54 C ATOM 84 OE1 GLU A 6 7.826 -4.207 17.008 1.00 2.23 O ATOM 85 OE2 GLU A 6 5.704 -4.694 16.464 1.00 30.04 O ATOM 0 H GLU A 6 5.704 -5.116 12.160 1.00 63.13 H new ATOM 0 HA GLU A 6 7.392 -3.028 11.851 1.00 13.42 H new ATOM 0 HB2 GLU A 6 7.360 -2.784 14.190 1.00 50.32 H new ATOM 0 HB3 GLU A 6 5.862 -3.612 13.813 1.00 50.32 H new ATOM 0 HG2 GLU A 6 6.860 -5.788 14.426 1.00 63.21 H new ATOM 0 HG3 GLU A 6 8.421 -5.035 14.684 1.00 63.21 H new ATOM 93 N GLU A 7 9.064 -5.753 12.521 1.00 31.44 N ATOM 94 CA GLU A 7 10.392 -6.343 12.540 1.00 11.01 C ATOM 95 C GLU A 7 11.056 -6.200 11.169 1.00 13.41 C ATOM 96 O GLU A 7 12.216 -5.802 11.076 1.00 60.21 O ATOM 97 CB GLU A 7 10.334 -7.810 12.971 1.00 44.13 C ATOM 98 CG GLU A 7 11.729 -8.440 12.958 1.00 74.23 C ATOM 99 CD GLU A 7 11.656 -9.925 12.595 1.00 13.12 C ATOM 100 OE1 GLU A 7 12.300 -10.359 11.629 1.00 71.42 O ATOM 101 OE2 GLU A 7 10.897 -10.636 13.359 1.00 41.02 O ATOM 0 H GLU A 7 8.299 -6.422 12.611 1.00 31.44 H new ATOM 0 HA GLU A 7 10.996 -5.807 13.272 1.00 11.01 H new ATOM 0 HB2 GLU A 7 9.907 -7.882 13.971 1.00 44.13 H new ATOM 0 HB3 GLU A 7 9.675 -8.364 12.303 1.00 44.13 H new ATOM 0 HG2 GLU A 7 12.362 -7.917 12.241 1.00 74.23 H new ATOM 0 HG3 GLU A 7 12.194 -8.324 13.937 1.00 74.23 H new ATOM 109 N GLN A 8 10.291 -6.531 10.139 1.00 31.02 N ATOM 110 CA GLN A 8 10.790 -6.444 8.778 1.00 65.25 C ATOM 111 C GLN A 8 11.265 -5.021 8.476 1.00 71.20 C ATOM 112 O GLN A 8 12.245 -4.829 7.758 1.00 52.13 O ATOM 113 CB GLN A 8 9.726 -6.892 7.774 1.00 43.45 C ATOM 114 CG GLN A 8 9.431 -8.386 7.917 1.00 60.01 C ATOM 115 CD GLN A 8 10.398 -9.219 7.073 1.00 32.31 C ATOM 116 OE1 GLN A 8 11.540 -9.449 7.436 1.00 33.01 O ATOM 117 NE2 GLN A 8 9.878 -9.658 5.930 1.00 43.31 N ATOM 0 H GLN A 8 9.329 -6.860 10.220 1.00 31.02 H new ATOM 0 HA GLN A 8 11.641 -7.118 8.680 1.00 65.25 H new ATOM 0 HB2 GLN A 8 8.811 -6.321 7.929 1.00 43.45 H new ATOM 0 HB3 GLN A 8 10.066 -6.680 6.760 1.00 43.45 H new ATOM 0 HG2 GLN A 8 9.512 -8.678 8.964 1.00 60.01 H new ATOM 0 HG3 GLN A 8 8.406 -8.589 7.608 1.00 60.01 H new ATOM 0 HE21 GLN A 8 8.914 -9.429 5.687 1.00 43.31 H new ATOM 0 HE22 GLN A 8 10.443 -10.224 5.297 1.00 43.31 H new ATOM 126 N ILE A 9 10.548 -4.060 9.040 1.00 72.51 N ATOM 127 CA ILE A 9 10.883 -2.661 8.840 1.00 3.23 C ATOM 128 C ILE A 9 12.242 -2.370 9.481 1.00 70.21 C ATOM 129 O ILE A 9 12.911 -1.405 9.115 1.00 62.33 O ATOM 130 CB ILE A 9 9.757 -1.761 9.353 1.00 34.50 C ATOM 131 CG1 ILE A 9 8.388 -2.392 9.087 1.00 50.51 C ATOM 132 CG2 ILE A 9 9.865 -0.355 8.761 1.00 42.05 C ATOM 133 CD1 ILE A 9 8.352 -3.066 7.714 1.00 43.41 C ATOM 0 H ILE A 9 9.736 -4.223 9.636 1.00 72.51 H new ATOM 0 HA ILE A 9 10.977 -2.441 7.777 1.00 3.23 H new ATOM 0 HB ILE A 9 9.863 -1.663 10.433 1.00 34.50 H new ATOM 0 HG12 ILE A 9 8.165 -3.125 9.862 1.00 50.51 H new ATOM 0 HG13 ILE A 9 7.614 -1.626 9.141 1.00 50.51 H new ATOM 0 HG21 ILE A 9 9.053 0.264 9.142 1.00 42.05 H new ATOM 0 HG22 ILE A 9 10.821 0.086 9.044 1.00 42.05 H new ATOM 0 HG23 ILE A 9 9.799 -0.412 7.674 1.00 42.05 H new ATOM 0 HD11 ILE A 9 7.368 -3.506 7.550 1.00 43.41 H new ATOM 0 HD12 ILE A 9 8.551 -2.325 6.940 1.00 43.41 H new ATOM 0 HD13 ILE A 9 9.111 -3.848 7.672 1.00 43.41 H new ATOM 145 N ALA A 10 12.609 -3.223 10.426 1.00 1.34 N ATOM 146 CA ALA A 10 13.876 -3.069 11.121 1.00 31.53 C ATOM 147 C ALA A 10 14.992 -3.692 10.281 1.00 63.51 C ATOM 148 O ALA A 10 16.173 -3.485 10.558 1.00 14.22 O ATOM 149 CB ALA A 10 13.774 -3.697 12.513 1.00 62.21 C ATOM 0 H ALA A 10 12.052 -4.023 10.727 1.00 1.34 H new ATOM 0 HA ALA A 10 14.114 -2.014 11.256 1.00 31.53 H new ATOM 0 HB1 ALA A 10 14.724 -3.582 13.035 1.00 62.21 H new ATOM 0 HB2 ALA A 10 12.986 -3.200 13.079 1.00 62.21 H new ATOM 0 HB3 ALA A 10 13.539 -4.757 12.418 1.00 62.21 H new ATOM 155 N GLU A 11 14.580 -4.444 9.271 1.00 52.24 N ATOM 156 CA GLU A 11 15.530 -5.098 8.388 1.00 64.51 C ATOM 157 C GLU A 11 16.038 -4.115 7.332 1.00 44.13 C ATOM 158 O GLU A 11 17.225 -3.791 7.299 1.00 33.43 O ATOM 159 CB GLU A 11 14.909 -6.334 7.733 1.00 45.11 C ATOM 160 CG GLU A 11 14.135 -7.166 8.757 1.00 70.44 C ATOM 161 CD GLU A 11 15.087 -7.991 9.626 1.00 51.50 C ATOM 162 OE1 GLU A 11 16.155 -8.407 9.153 1.00 75.52 O ATOM 163 OE2 GLU A 11 14.684 -8.193 10.835 1.00 42.23 O ATOM 0 H GLU A 11 13.600 -4.615 9.045 1.00 52.24 H new ATOM 0 HA GLU A 11 16.380 -5.431 8.984 1.00 64.51 H new ATOM 0 HB2 GLU A 11 14.241 -6.027 6.929 1.00 45.11 H new ATOM 0 HB3 GLU A 11 15.692 -6.943 7.281 1.00 45.11 H new ATOM 0 HG2 GLU A 11 13.538 -6.508 9.389 1.00 70.44 H new ATOM 0 HG3 GLU A 11 13.440 -7.829 8.242 1.00 70.44 H new ATOM 171 N PHE A 12 15.115 -3.667 6.494 1.00 42.13 N ATOM 172 CA PHE A 12 15.455 -2.727 5.439 1.00 13.31 C ATOM 173 C PHE A 12 16.244 -1.540 5.996 1.00 53.24 C ATOM 174 O PHE A 12 16.990 -0.889 5.266 1.00 50.01 O ATOM 175 CB PHE A 12 14.137 -2.218 4.852 1.00 14.44 C ATOM 176 CG PHE A 12 13.166 -3.329 4.447 1.00 52.51 C ATOM 177 CD1 PHE A 12 13.298 -3.940 3.239 1.00 11.31 C ATOM 178 CD2 PHE A 12 12.171 -3.705 5.294 1.00 13.31 C ATOM 179 CE1 PHE A 12 12.397 -4.971 2.863 1.00 51.43 C ATOM 180 CE2 PHE A 12 11.270 -4.736 4.918 1.00 54.33 C ATOM 181 CZ PHE A 12 11.402 -5.347 3.710 1.00 53.21 C ATOM 0 H PHE A 12 14.132 -3.937 6.524 1.00 42.13 H new ATOM 0 HA PHE A 12 16.072 -3.218 4.687 1.00 13.31 H new ATOM 0 HB2 PHE A 12 13.650 -1.573 5.584 1.00 14.44 H new ATOM 0 HB3 PHE A 12 14.354 -1.603 3.979 1.00 14.44 H new ATOM 0 HD1 PHE A 12 14.088 -3.641 2.566 1.00 11.31 H new ATOM 0 HD2 PHE A 12 12.066 -3.219 6.253 1.00 13.31 H new ATOM 0 HE1 PHE A 12 12.502 -5.457 1.904 1.00 51.43 H new ATOM 0 HE2 PHE A 12 10.480 -5.035 5.591 1.00 54.33 H new ATOM 0 HZ PHE A 12 10.716 -6.131 3.424 1.00 53.21 H new ATOM 191 N LYS A 13 16.052 -1.294 7.283 1.00 33.23 N ATOM 192 CA LYS A 13 16.736 -0.197 7.946 1.00 21.11 C ATOM 193 C LYS A 13 18.246 -0.358 7.761 1.00 3.31 C ATOM 194 O LYS A 13 18.959 0.625 7.559 1.00 35.33 O ATOM 195 CB LYS A 13 16.303 -0.102 9.410 1.00 14.34 C ATOM 196 CG LYS A 13 15.141 0.880 9.575 1.00 12.24 C ATOM 197 CD LYS A 13 15.236 1.623 10.910 1.00 72.42 C ATOM 198 CE LYS A 13 14.523 0.848 12.020 1.00 22.11 C ATOM 199 NZ LYS A 13 14.921 1.364 13.349 1.00 35.22 N ATOM 0 H LYS A 13 15.432 -1.836 7.885 1.00 33.23 H new ATOM 0 HA LYS A 13 16.458 0.755 7.493 1.00 21.11 H new ATOM 0 HB2 LYS A 13 16.005 -1.087 9.770 1.00 14.34 H new ATOM 0 HB3 LYS A 13 17.146 0.220 10.022 1.00 14.34 H new ATOM 0 HG2 LYS A 13 15.147 1.597 8.754 1.00 12.24 H new ATOM 0 HG3 LYS A 13 14.195 0.342 9.521 1.00 12.24 H new ATOM 0 HD2 LYS A 13 16.283 1.767 11.177 1.00 72.42 H new ATOM 0 HD3 LYS A 13 14.793 2.614 10.811 1.00 72.42 H new ATOM 0 HE2 LYS A 13 13.443 0.936 11.897 1.00 22.11 H new ATOM 0 HE3 LYS A 13 14.767 -0.212 11.947 1.00 22.11 H new ATOM 0 HZ1 LYS A 13 14.428 0.828 14.091 1.00 35.22 H new ATOM 0 HZ2 LYS A 13 15.949 1.258 13.469 1.00 35.22 H new ATOM 0 HZ3 LYS A 13 14.666 2.370 13.422 1.00 35.22 H new ATOM 212 N GLU A 14 18.690 -1.604 7.836 1.00 3.34 N ATOM 213 CA GLU A 14 20.103 -1.906 7.680 1.00 40.43 C ATOM 214 C GLU A 14 20.534 -1.692 6.227 1.00 35.11 C ATOM 215 O GLU A 14 21.574 -1.090 5.966 1.00 12.24 O ATOM 216 CB GLU A 14 20.413 -3.331 8.140 1.00 63.44 C ATOM 217 CG GLU A 14 19.618 -3.687 9.397 1.00 31.23 C ATOM 218 CD GLU A 14 19.654 -2.542 10.411 1.00 13.20 C ATOM 219 OE1 GLU A 14 20.701 -2.290 11.025 1.00 42.21 O ATOM 220 OE2 GLU A 14 18.542 -1.902 10.550 1.00 3.03 O ATOM 0 H GLU A 14 18.096 -2.416 8.003 1.00 3.34 H new ATOM 0 HA GLU A 14 20.672 -1.224 8.312 1.00 40.43 H new ATOM 0 HB2 GLU A 14 20.173 -4.034 7.343 1.00 63.44 H new ATOM 0 HB3 GLU A 14 21.480 -3.428 8.341 1.00 63.44 H new ATOM 0 HG2 GLU A 14 18.585 -3.907 9.128 1.00 31.23 H new ATOM 0 HG3 GLU A 14 20.029 -4.590 9.848 1.00 31.23 H new ATOM 228 N ALA A 15 19.711 -2.198 5.319 1.00 4.34 N ATOM 229 CA ALA A 15 19.994 -2.070 3.900 1.00 41.11 C ATOM 230 C ALA A 15 20.019 -0.588 3.521 1.00 44.23 C ATOM 231 O ALA A 15 20.510 -0.225 2.453 1.00 54.05 O ATOM 232 CB ALA A 15 18.956 -2.859 3.099 1.00 1.14 C ATOM 0 H ALA A 15 18.849 -2.697 5.539 1.00 4.34 H new ATOM 0 HA ALA A 15 20.973 -2.487 3.665 1.00 41.11 H new ATOM 0 HB1 ALA A 15 19.168 -2.763 2.034 1.00 1.14 H new ATOM 0 HB2 ALA A 15 18.999 -3.910 3.384 1.00 1.14 H new ATOM 0 HB3 ALA A 15 17.961 -2.467 3.307 1.00 1.14 H new ATOM 238 N PHE A 16 19.485 0.229 4.417 1.00 60.41 N ATOM 239 CA PHE A 16 19.440 1.663 4.190 1.00 41.12 C ATOM 240 C PHE A 16 20.765 2.322 4.578 1.00 24.54 C ATOM 241 O PHE A 16 21.209 3.265 3.925 1.00 22.51 O ATOM 242 CB PHE A 16 18.327 2.222 5.078 1.00 31.11 C ATOM 243 CG PHE A 16 17.857 3.622 4.680 1.00 53.34 C ATOM 244 CD1 PHE A 16 17.633 3.918 3.371 1.00 34.31 C ATOM 245 CD2 PHE A 16 17.663 4.572 5.634 1.00 72.31 C ATOM 246 CE1 PHE A 16 17.196 5.217 3.001 1.00 2.43 C ATOM 247 CE2 PHE A 16 17.226 5.871 5.264 1.00 4.41 C ATOM 248 CZ PHE A 16 17.002 6.167 3.956 1.00 63.24 C ATOM 0 H PHE A 16 19.080 -0.075 5.302 1.00 60.41 H new ATOM 0 HA PHE A 16 19.259 1.867 3.135 1.00 41.12 H new ATOM 0 HB2 PHE A 16 17.476 1.542 5.047 1.00 31.11 H new ATOM 0 HB3 PHE A 16 18.678 2.247 6.110 1.00 31.11 H new ATOM 0 HD1 PHE A 16 17.788 3.164 2.613 1.00 34.31 H new ATOM 0 HD2 PHE A 16 17.841 4.338 6.673 1.00 72.31 H new ATOM 0 HE1 PHE A 16 17.018 5.451 1.962 1.00 2.43 H new ATOM 0 HE2 PHE A 16 17.071 6.625 6.022 1.00 4.41 H new ATOM 0 HZ PHE A 16 16.670 7.156 3.675 1.00 63.24 H new ATOM 258 N ALA A 17 21.360 1.798 5.640 1.00 3.54 N ATOM 259 CA ALA A 17 22.626 2.324 6.124 1.00 71.32 C ATOM 260 C ALA A 17 23.705 2.098 5.063 1.00 23.02 C ATOM 261 O ALA A 17 24.680 2.845 4.996 1.00 63.12 O ATOM 262 CB ALA A 17 22.975 1.666 7.460 1.00 30.52 C ATOM 0 H ALA A 17 20.989 1.015 6.179 1.00 3.54 H new ATOM 0 HA ALA A 17 22.555 3.398 6.299 1.00 71.32 H new ATOM 0 HB1 ALA A 17 23.924 2.060 7.823 1.00 30.52 H new ATOM 0 HB2 ALA A 17 22.191 1.880 8.187 1.00 30.52 H new ATOM 0 HB3 ALA A 17 23.058 0.588 7.324 1.00 30.52 H new ATOM 268 N LEU A 18 23.495 1.065 4.261 1.00 34.30 N ATOM 269 CA LEU A 18 24.437 0.731 3.207 1.00 45.21 C ATOM 270 C LEU A 18 24.910 2.017 2.526 1.00 43.21 C ATOM 271 O LEU A 18 26.059 2.110 2.097 1.00 43.23 O ATOM 272 CB LEU A 18 23.825 -0.286 2.242 1.00 33.12 C ATOM 273 CG LEU A 18 23.350 -1.600 2.866 1.00 64.44 C ATOM 274 CD1 LEU A 18 22.619 -2.463 1.836 1.00 73.14 C ATOM 275 CD2 LEU A 18 24.514 -2.349 3.518 1.00 63.44 C ATOM 0 H LEU A 18 22.685 0.448 4.320 1.00 34.30 H new ATOM 0 HA LEU A 18 25.320 0.247 3.625 1.00 45.21 H new ATOM 0 HB2 LEU A 18 22.978 0.182 1.741 1.00 33.12 H new ATOM 0 HB3 LEU A 18 24.562 -0.517 1.473 1.00 33.12 H new ATOM 0 HG LEU A 18 22.635 -1.365 3.655 1.00 64.44 H new ATOM 0 HD11 LEU A 18 22.292 -3.391 2.305 1.00 73.14 H new ATOM 0 HD12 LEU A 18 21.751 -1.922 1.458 1.00 73.14 H new ATOM 0 HD13 LEU A 18 23.292 -2.692 1.010 1.00 73.14 H new ATOM 0 HD21 LEU A 18 24.150 -3.279 3.954 1.00 63.44 H new ATOM 0 HD22 LEU A 18 25.270 -2.573 2.765 1.00 63.44 H new ATOM 0 HD23 LEU A 18 24.953 -1.729 4.300 1.00 63.44 H new ATOM 287 N PHE A 19 24.000 2.977 2.448 1.00 22.22 N ATOM 288 CA PHE A 19 24.310 4.253 1.827 1.00 53.33 C ATOM 289 C PHE A 19 24.230 5.393 2.845 1.00 60.51 C ATOM 290 O PHE A 19 25.184 6.152 3.008 1.00 72.01 O ATOM 291 CB PHE A 19 23.262 4.486 0.736 1.00 30.53 C ATOM 292 CG PHE A 19 22.932 3.238 -0.085 1.00 72.33 C ATOM 293 CD1 PHE A 19 21.975 2.373 0.347 1.00 63.44 C ATOM 294 CD2 PHE A 19 23.595 2.994 -1.247 1.00 72.44 C ATOM 295 CE1 PHE A 19 21.669 1.215 -0.416 1.00 30.42 C ATOM 296 CE2 PHE A 19 23.288 1.835 -2.010 1.00 5.42 C ATOM 297 CZ PHE A 19 22.332 0.970 -1.578 1.00 10.41 C ATOM 0 H PHE A 19 23.048 2.896 2.805 1.00 22.22 H new ATOM 0 HA PHE A 19 25.322 4.233 1.422 1.00 53.33 H new ATOM 0 HB2 PHE A 19 22.347 4.857 1.198 1.00 30.53 H new ATOM 0 HB3 PHE A 19 23.619 5.267 0.064 1.00 30.53 H new ATOM 0 HD1 PHE A 19 21.448 2.567 1.270 1.00 63.44 H new ATOM 0 HD2 PHE A 19 24.355 3.681 -1.590 1.00 72.44 H new ATOM 0 HE1 PHE A 19 20.909 0.528 -0.073 1.00 30.42 H new ATOM 0 HE2 PHE A 19 23.814 1.641 -2.933 1.00 5.42 H new ATOM 0 HZ PHE A 19 22.099 0.089 -2.157 1.00 10.41 H new ATOM 307 N ASP A 20 23.083 5.476 3.504 1.00 64.35 N ATOM 308 CA ASP A 20 22.867 6.509 4.501 1.00 12.54 C ATOM 309 C ASP A 20 24.035 6.512 5.489 1.00 22.31 C ATOM 310 O ASP A 20 24.019 5.778 6.476 1.00 5.24 O ATOM 311 CB ASP A 20 21.581 6.253 5.290 1.00 24.33 C ATOM 312 CG ASP A 20 20.659 7.465 5.436 1.00 21.21 C ATOM 313 OD1 ASP A 20 21.121 8.599 5.631 1.00 31.15 O ATOM 314 OD2 ASP A 20 19.399 7.206 5.340 1.00 20.31 O ATOM 0 H ASP A 20 22.294 4.844 3.366 1.00 64.35 H new ATOM 0 HA ASP A 20 22.789 7.465 3.983 1.00 12.54 H new ATOM 0 HB2 ASP A 20 21.027 5.451 4.802 1.00 24.33 H new ATOM 0 HB3 ASP A 20 21.848 5.897 6.285 1.00 24.33 H new ATOM 320 N LYS A 21 25.021 7.345 5.189 1.00 72.53 N ATOM 321 CA LYS A 21 26.195 7.452 6.038 1.00 61.12 C ATOM 322 C LYS A 21 25.822 8.188 7.326 1.00 11.11 C ATOM 323 O LYS A 21 25.813 7.664 8.422 1.00 30.14 O ATOM 324 CB LYS A 21 27.352 8.098 5.273 1.00 10.22 C ATOM 325 CG LYS A 21 27.572 7.408 3.925 1.00 15.52 C ATOM 326 CD LYS A 21 27.641 5.889 4.092 1.00 50.14 C ATOM 327 CE LYS A 21 27.931 5.204 2.755 1.00 65.11 C ATOM 328 NZ LYS A 21 28.570 3.887 2.976 1.00 45.35 N ATOM 0 H LYS A 21 25.031 7.952 4.369 1.00 72.53 H new ATOM 0 HA LYS A 21 26.548 6.462 6.327 1.00 61.12 H new ATOM 0 HB2 LYS A 21 27.142 9.156 5.114 1.00 10.22 H new ATOM 0 HB3 LYS A 21 28.263 8.040 5.868 1.00 10.22 H new ATOM 0 HG2 LYS A 21 26.761 7.666 3.244 1.00 15.52 H new ATOM 0 HG3 LYS A 21 28.496 7.770 3.473 1.00 15.52 H new ATOM 0 HD2 LYS A 21 28.418 5.633 4.812 1.00 50.14 H new ATOM 0 HD3 LYS A 21 26.698 5.521 4.497 1.00 50.14 H new ATOM 0 HE2 LYS A 21 27.004 5.076 2.196 1.00 65.11 H new ATOM 0 HE3 LYS A 21 28.583 5.834 2.150 1.00 65.11 H new ATOM 0 HZ1 LYS A 21 29.413 3.805 2.373 1.00 45.35 H new ATOM 0 HZ2 LYS A 21 28.849 3.799 3.974 1.00 45.35 H new ATOM 0 HZ3 LYS A 21 27.898 3.130 2.737 1.00 45.35 H new ATOM 341 N ASP A 22 25.506 9.444 7.171 1.00 0.24 N ATOM 342 CA ASP A 22 25.118 10.269 8.350 1.00 54.10 C ATOM 343 C ASP A 22 23.734 9.845 8.853 1.00 53.03 C ATOM 344 O ASP A 22 23.296 10.393 9.863 1.00 35.21 O ATOM 345 CB ASP A 22 25.083 11.707 7.832 1.00 4.43 C ATOM 346 CG ASP A 22 23.963 11.854 6.801 1.00 24.41 C ATOM 347 OD1 ASP A 22 22.826 11.580 7.147 1.00 75.03 O ATOM 348 OD2 ASP A 22 24.261 12.239 5.682 1.00 60.52 O ATOM 0 H ASP A 22 25.500 9.936 6.277 1.00 0.24 H new ATOM 0 HA ASP A 22 25.810 10.154 9.184 1.00 54.10 H new ATOM 0 HB2 ASP A 22 24.922 12.398 8.659 1.00 4.43 H new ATOM 0 HB3 ASP A 22 26.042 11.966 7.382 1.00 4.43 H new ATOM 353 N ASN A 23 23.089 8.915 8.164 1.00 61.30 N ATOM 354 CA ASN A 23 21.770 8.461 8.571 1.00 1.15 C ATOM 355 C ASN A 23 20.911 9.672 8.941 1.00 31.13 C ATOM 356 O ASN A 23 20.497 9.816 10.091 1.00 71.15 O ATOM 357 CB ASN A 23 21.856 7.550 9.797 1.00 35.14 C ATOM 358 CG ASN A 23 23.128 6.701 9.762 1.00 2.34 C ATOM 359 OD1 ASN A 23 23.114 5.743 8.840 1.00 11.15 O flip ATOM 360 ND2 ASN A 23 24.061 6.903 10.522 1.00 44.41 N flip ATOM 0 H ASN A 23 23.456 8.463 7.326 1.00 61.30 H new ATOM 0 HA ASN A 23 21.332 7.908 7.740 1.00 1.15 H new ATOM 0 HB2 ASN A 23 21.842 8.154 10.704 1.00 35.14 H new ATOM 0 HB3 ASN A 23 20.982 6.900 9.833 1.00 35.14 H new ATOM 0 HD21 ASN A 23 24.007 7.656 11.207 1.00 44.41 H new ATOM 0 HD22 ASN A 23 24.895 6.318 10.472 1.00 44.41 H new ATOM 367 N ASN A 24 20.668 10.511 7.945 1.00 4.44 N ATOM 368 CA ASN A 24 19.866 11.705 8.152 1.00 50.24 C ATOM 369 C ASN A 24 18.419 11.419 7.744 1.00 23.41 C ATOM 370 O ASN A 24 17.494 12.070 8.226 1.00 2.23 O ATOM 371 CB ASN A 24 20.377 12.867 7.297 1.00 73.54 C ATOM 372 CG ASN A 24 20.423 12.479 5.817 1.00 0.42 C ATOM 373 OD1 ASN A 24 20.546 11.321 5.456 1.00 62.34 O ATOM 374 ND2 ASN A 24 20.318 13.511 4.984 1.00 12.05 N ATOM 0 H ASN A 24 21.012 10.388 6.993 1.00 4.44 H new ATOM 0 HA ASN A 24 19.931 11.976 9.206 1.00 50.24 H new ATOM 0 HB2 ASN A 24 19.729 13.733 7.430 1.00 73.54 H new ATOM 0 HB3 ASN A 24 21.372 13.159 7.631 1.00 73.54 H new ATOM 0 HD21 ASN A 24 20.338 13.357 3.976 1.00 12.05 H new ATOM 0 HD22 ASN A 24 20.217 14.456 5.353 1.00 12.05 H new ATOM 381 N GLY A 25 18.269 10.443 6.860 1.00 3.03 N ATOM 382 CA GLY A 25 16.951 10.062 6.382 1.00 10.25 C ATOM 383 C GLY A 25 16.782 10.412 4.903 1.00 61.35 C ATOM 384 O GLY A 25 15.672 10.682 4.448 1.00 74.34 O ATOM 0 H GLY A 25 19.039 9.905 6.462 1.00 3.03 H new ATOM 0 HA2 GLY A 25 16.804 8.992 6.525 1.00 10.25 H new ATOM 0 HA3 GLY A 25 16.186 10.570 6.969 1.00 10.25 H new ATOM 388 N SER A 26 17.900 10.395 4.192 1.00 3.31 N ATOM 389 CA SER A 26 17.890 10.707 2.773 1.00 41.20 C ATOM 390 C SER A 26 19.240 10.349 2.149 1.00 44.32 C ATOM 391 O SER A 26 20.250 10.990 2.436 1.00 43.35 O ATOM 392 CB SER A 26 17.571 12.184 2.536 1.00 13.50 C ATOM 393 OG SER A 26 16.786 12.737 3.589 1.00 35.44 O ATOM 0 H SER A 26 18.819 10.170 4.572 1.00 3.31 H new ATOM 0 HA SER A 26 17.109 10.114 2.298 1.00 41.20 H new ATOM 0 HB2 SER A 26 18.501 12.745 2.444 1.00 13.50 H new ATOM 0 HB3 SER A 26 17.038 12.293 1.591 1.00 13.50 H new ATOM 0 HG SER A 26 15.951 12.231 3.675 1.00 35.44 H new ATOM 399 N ILE A 27 19.215 9.327 1.307 1.00 34.50 N ATOM 400 CA ILE A 27 20.424 8.876 0.640 1.00 61.41 C ATOM 401 C ILE A 27 20.648 9.713 -0.621 1.00 22.20 C ATOM 402 O ILE A 27 19.907 9.586 -1.594 1.00 52.53 O ATOM 403 CB ILE A 27 20.360 7.370 0.375 1.00 4.01 C ATOM 404 CG1 ILE A 27 20.521 6.578 1.674 1.00 33.41 C ATOM 405 CG2 ILE A 27 21.388 6.955 -0.680 1.00 72.00 C ATOM 406 CD1 ILE A 27 20.003 5.147 1.511 1.00 2.01 C ATOM 0 H ILE A 27 18.376 8.798 1.071 1.00 34.50 H new ATOM 0 HA ILE A 27 21.292 9.027 1.282 1.00 61.41 H new ATOM 0 HB ILE A 27 19.374 7.135 -0.026 1.00 4.01 H new ATOM 0 HG12 ILE A 27 21.572 6.558 1.964 1.00 33.41 H new ATOM 0 HG13 ILE A 27 19.978 7.076 2.477 1.00 33.41 H new ATOM 0 HG21 ILE A 27 21.322 5.880 -0.850 1.00 72.00 H new ATOM 0 HG22 ILE A 27 21.186 7.483 -1.612 1.00 72.00 H new ATOM 0 HG23 ILE A 27 22.390 7.206 -0.331 1.00 72.00 H new ATOM 0 HD11 ILE A 27 20.129 4.605 2.449 1.00 2.01 H new ATOM 0 HD12 ILE A 27 18.946 5.171 1.245 1.00 2.01 H new ATOM 0 HD13 ILE A 27 20.564 4.644 0.723 1.00 2.01 H new ATOM 418 N SER A 28 21.674 10.549 -0.563 1.00 11.45 N ATOM 419 CA SER A 28 22.005 11.407 -1.688 1.00 0.34 C ATOM 420 C SER A 28 22.505 10.562 -2.861 1.00 32.11 C ATOM 421 O SER A 28 22.785 9.375 -2.701 1.00 34.13 O ATOM 422 CB SER A 28 23.057 12.447 -1.297 1.00 21.05 C ATOM 423 OG SER A 28 24.378 12.012 -1.605 1.00 64.32 O ATOM 0 H SER A 28 22.287 10.651 0.246 1.00 11.45 H new ATOM 0 HA SER A 28 21.102 11.938 -1.990 1.00 0.34 H new ATOM 0 HB2 SER A 28 22.853 13.383 -1.818 1.00 21.05 H new ATOM 0 HB3 SER A 28 22.983 12.654 -0.229 1.00 21.05 H new ATOM 0 HG SER A 28 25.020 12.704 -1.342 1.00 64.32 H new ATOM 429 N SER A 29 22.602 11.207 -4.014 1.00 75.33 N ATOM 430 CA SER A 29 23.063 10.529 -5.214 1.00 54.11 C ATOM 431 C SER A 29 24.546 10.179 -5.080 1.00 41.43 C ATOM 432 O SER A 29 24.995 9.156 -5.594 1.00 22.23 O ATOM 433 CB SER A 29 22.830 11.391 -6.457 1.00 24.41 C ATOM 434 OG SER A 29 23.772 11.105 -7.488 1.00 0.32 O ATOM 0 H SER A 29 22.369 12.192 -4.143 1.00 75.33 H new ATOM 0 HA SER A 29 22.489 9.610 -5.330 1.00 54.11 H new ATOM 0 HB2 SER A 29 21.820 11.222 -6.831 1.00 24.41 H new ATOM 0 HB3 SER A 29 22.898 12.445 -6.186 1.00 24.41 H new ATOM 0 HG SER A 29 23.359 11.266 -8.362 1.00 0.32 H new ATOM 440 N SER A 30 25.266 11.050 -4.388 1.00 21.34 N ATOM 441 CA SER A 30 26.690 10.846 -4.180 1.00 33.23 C ATOM 442 C SER A 30 26.915 9.737 -3.150 1.00 14.13 C ATOM 443 O SER A 30 27.991 9.145 -3.095 1.00 61.51 O ATOM 444 CB SER A 30 27.371 12.138 -3.725 1.00 54.45 C ATOM 445 OG SER A 30 28.701 12.244 -4.224 1.00 5.42 O ATOM 0 H SER A 30 24.890 11.898 -3.964 1.00 21.34 H new ATOM 0 HA SER A 30 27.135 10.547 -5.129 1.00 33.23 H new ATOM 0 HB2 SER A 30 26.787 12.994 -4.063 1.00 54.45 H new ATOM 0 HB3 SER A 30 27.388 12.175 -2.636 1.00 54.45 H new ATOM 0 HG SER A 30 29.101 13.083 -3.913 1.00 5.42 H new ATOM 451 N GLU A 31 25.881 9.490 -2.358 1.00 41.13 N ATOM 452 CA GLU A 31 25.952 8.463 -1.333 1.00 3.01 C ATOM 453 C GLU A 31 25.472 7.122 -1.891 1.00 25.30 C ATOM 454 O GLU A 31 26.053 6.079 -1.595 1.00 24.30 O ATOM 455 CB GLU A 31 25.143 8.864 -0.098 1.00 50.10 C ATOM 456 CG GLU A 31 25.668 10.170 0.501 1.00 2.14 C ATOM 457 CD GLU A 31 24.746 10.673 1.614 1.00 21.52 C ATOM 458 OE1 GLU A 31 23.623 11.117 1.335 1.00 53.21 O ATOM 459 OE2 GLU A 31 25.233 10.588 2.806 1.00 42.03 O ATOM 0 H GLU A 31 24.990 9.984 -2.406 1.00 41.13 H new ATOM 0 HA GLU A 31 26.992 8.355 -1.026 1.00 3.01 H new ATOM 0 HB2 GLU A 31 24.093 8.980 -0.368 1.00 50.10 H new ATOM 0 HB3 GLU A 31 25.194 8.071 0.648 1.00 50.10 H new ATOM 0 HG2 GLU A 31 26.671 10.015 0.898 1.00 2.14 H new ATOM 0 HG3 GLU A 31 25.747 10.926 -0.280 1.00 2.14 H new ATOM 467 N LEU A 32 24.417 7.192 -2.689 1.00 11.44 N ATOM 468 CA LEU A 32 23.852 5.996 -3.291 1.00 5.52 C ATOM 469 C LEU A 32 24.886 5.365 -4.225 1.00 61.24 C ATOM 470 O LEU A 32 25.174 4.173 -4.123 1.00 44.43 O ATOM 471 CB LEU A 32 22.521 6.317 -3.973 1.00 43.53 C ATOM 472 CG LEU A 32 21.994 5.261 -4.946 1.00 64.32 C ATOM 473 CD1 LEU A 32 20.465 5.273 -4.994 1.00 43.30 C ATOM 474 CD2 LEU A 32 22.613 5.437 -6.335 1.00 33.34 C ATOM 0 H LEU A 32 23.938 8.059 -2.933 1.00 11.44 H new ATOM 0 HA LEU A 32 23.620 5.256 -2.525 1.00 5.52 H new ATOM 0 HB2 LEU A 32 21.769 6.478 -3.200 1.00 43.53 H new ATOM 0 HB3 LEU A 32 22.630 7.258 -4.513 1.00 43.53 H new ATOM 0 HG LEU A 32 22.296 4.280 -4.581 1.00 64.32 H new ATOM 0 HD11 LEU A 32 20.117 4.513 -5.693 1.00 43.30 H new ATOM 0 HD12 LEU A 32 20.068 5.062 -4.001 1.00 43.30 H new ATOM 0 HD13 LEU A 32 20.119 6.253 -5.322 1.00 43.30 H new ATOM 0 HD21 LEU A 32 22.221 4.674 -7.007 1.00 33.34 H new ATOM 0 HD22 LEU A 32 22.363 6.425 -6.722 1.00 33.34 H new ATOM 0 HD23 LEU A 32 23.696 5.338 -6.266 1.00 33.34 H new ATOM 486 N ALA A 33 25.416 6.191 -5.115 1.00 54.41 N ATOM 487 CA ALA A 33 26.411 5.729 -6.067 1.00 61.41 C ATOM 488 C ALA A 33 27.683 5.330 -5.315 1.00 74.25 C ATOM 489 O ALA A 33 28.575 4.705 -5.886 1.00 61.32 O ATOM 490 CB ALA A 33 26.667 6.819 -7.109 1.00 4.52 C ATOM 0 H ALA A 33 25.175 7.179 -5.197 1.00 54.41 H new ATOM 0 HA ALA A 33 26.052 4.848 -6.599 1.00 61.41 H new ATOM 0 HB1 ALA A 33 27.414 6.472 -7.823 1.00 4.52 H new ATOM 0 HB2 ALA A 33 25.739 7.045 -7.635 1.00 4.52 H new ATOM 0 HB3 ALA A 33 27.031 7.719 -6.613 1.00 4.52 H new ATOM 496 N THR A 34 27.725 5.708 -4.046 1.00 73.33 N ATOM 497 CA THR A 34 28.872 5.397 -3.211 1.00 1.34 C ATOM 498 C THR A 34 28.926 3.897 -2.915 1.00 44.22 C ATOM 499 O THR A 34 30.005 3.337 -2.723 1.00 13.31 O ATOM 500 CB THR A 34 28.787 6.262 -1.951 1.00 65.12 C ATOM 501 OG1 THR A 34 30.136 6.655 -1.708 1.00 74.45 O ATOM 502 CG2 THR A 34 28.406 5.453 -0.710 1.00 32.20 C ATOM 0 H THR A 34 26.983 6.227 -3.576 1.00 73.33 H new ATOM 0 HA THR A 34 29.807 5.629 -3.721 1.00 1.34 H new ATOM 0 HB THR A 34 28.057 7.056 -2.105 1.00 65.12 H new ATOM 0 HG1 THR A 34 30.173 7.221 -0.909 1.00 74.45 H new ATOM 0 HG21 THR A 34 28.360 6.114 0.155 1.00 32.20 H new ATOM 0 HG22 THR A 34 27.432 4.988 -0.864 1.00 32.20 H new ATOM 0 HG23 THR A 34 29.154 4.680 -0.536 1.00 32.20 H new ATOM 510 N VAL A 35 27.750 3.289 -2.888 1.00 73.15 N ATOM 511 CA VAL A 35 27.650 1.864 -2.620 1.00 14.42 C ATOM 512 C VAL A 35 27.890 1.087 -3.915 1.00 44.25 C ATOM 513 O VAL A 35 28.874 0.358 -4.032 1.00 72.33 O ATOM 514 CB VAL A 35 26.299 1.547 -1.975 1.00 11.23 C ATOM 515 CG1 VAL A 35 25.797 0.168 -2.405 1.00 35.44 C ATOM 516 CG2 VAL A 35 26.382 1.650 -0.450 1.00 53.34 C ATOM 0 H VAL A 35 26.858 3.757 -3.047 1.00 73.15 H new ATOM 0 HA VAL A 35 28.416 1.555 -1.909 1.00 14.42 H new ATOM 0 HB VAL A 35 25.579 2.289 -2.322 1.00 11.23 H new ATOM 0 HG11 VAL A 35 24.835 -0.033 -1.933 1.00 35.44 H new ATOM 0 HG12 VAL A 35 25.681 0.145 -3.489 1.00 35.44 H new ATOM 0 HG13 VAL A 35 26.516 -0.592 -2.101 1.00 35.44 H new ATOM 0 HG21 VAL A 35 25.409 1.420 -0.016 1.00 53.34 H new ATOM 0 HG22 VAL A 35 27.122 0.942 -0.077 1.00 53.34 H new ATOM 0 HG23 VAL A 35 26.674 2.662 -0.169 1.00 53.34 H new ATOM 526 N MET A 36 26.976 1.270 -4.856 1.00 53.13 N ATOM 527 CA MET A 36 27.076 0.595 -6.139 1.00 43.22 C ATOM 528 C MET A 36 28.521 0.586 -6.642 1.00 64.20 C ATOM 529 O MET A 36 29.032 -0.454 -7.054 1.00 62.51 O ATOM 530 CB MET A 36 26.185 1.304 -7.161 1.00 12.25 C ATOM 531 CG MET A 36 24.731 0.843 -7.033 1.00 44.22 C ATOM 532 SD MET A 36 23.700 1.756 -8.168 1.00 54.11 S ATOM 533 CE MET A 36 24.212 1.022 -9.712 1.00 45.12 C ATOM 0 H MET A 36 26.162 1.876 -4.756 1.00 53.13 H new ATOM 0 HA MET A 36 26.748 -0.437 -6.012 1.00 43.22 H new ATOM 0 HB2 MET A 36 26.243 2.382 -7.013 1.00 12.25 H new ATOM 0 HB3 MET A 36 26.548 1.100 -8.169 1.00 12.25 H new ATOM 0 HG2 MET A 36 24.659 -0.224 -7.242 1.00 44.22 H new ATOM 0 HG3 MET A 36 24.382 0.992 -6.011 1.00 44.22 H new ATOM 0 HE1 MET A 36 23.874 1.644 -10.541 1.00 45.12 H new ATOM 0 HE2 MET A 36 25.299 0.945 -9.736 1.00 45.12 H new ATOM 0 HE3 MET A 36 23.776 0.027 -9.804 1.00 45.12 H new ATOM 543 N ARG A 37 29.139 1.757 -6.592 1.00 23.34 N ATOM 544 CA ARG A 37 30.515 1.896 -7.037 1.00 4.41 C ATOM 545 C ARG A 37 31.442 1.034 -6.177 1.00 74.45 C ATOM 546 O ARG A 37 32.379 0.423 -6.689 1.00 41.41 O ATOM 547 CB ARG A 37 30.973 3.354 -6.962 1.00 41.41 C ATOM 548 CG ARG A 37 31.297 3.754 -5.521 1.00 42.12 C ATOM 549 CD ARG A 37 31.735 5.218 -5.444 1.00 11.15 C ATOM 550 NE ARG A 37 32.975 5.418 -6.226 1.00 62.30 N ATOM 551 CZ ARG A 37 33.651 6.585 -6.288 1.00 63.54 C ATOM 552 NH1 ARG A 37 33.212 7.668 -5.614 1.00 14.04 N ATOM 553 NH2 ARG A 37 34.749 6.650 -7.019 1.00 54.21 N ATOM 0 H ARG A 37 28.712 2.618 -6.250 1.00 23.34 H new ATOM 0 HA ARG A 37 30.563 1.564 -8.074 1.00 4.41 H new ATOM 0 HB2 ARG A 37 31.853 3.495 -7.589 1.00 41.41 H new ATOM 0 HB3 ARG A 37 30.193 4.005 -7.357 1.00 41.41 H new ATOM 0 HG2 ARG A 37 30.421 3.599 -4.891 1.00 42.12 H new ATOM 0 HG3 ARG A 37 32.088 3.113 -5.131 1.00 42.12 H new ATOM 0 HD2 ARG A 37 30.945 5.863 -5.829 1.00 11.15 H new ATOM 0 HD3 ARG A 37 31.901 5.502 -4.405 1.00 11.15 H new ATOM 0 HE ARG A 37 33.342 4.624 -6.751 1.00 62.30 H new ATOM 0 HH11 ARG A 37 32.363 7.609 -5.052 1.00 14.04 H new ATOM 0 HH12 ARG A 37 33.729 8.546 -5.667 1.00 14.04 H new ATOM 0 HH21 ARG A 37 35.074 5.826 -7.526 1.00 54.21 H new ATOM 0 HH22 ARG A 37 35.272 7.524 -7.077 1.00 54.21 H new ATOM 566 N SER A 38 31.147 1.010 -4.886 1.00 54.21 N ATOM 567 CA SER A 38 31.941 0.232 -3.951 1.00 2.32 C ATOM 568 C SER A 38 31.885 -1.251 -4.324 1.00 4.52 C ATOM 569 O SER A 38 32.700 -2.044 -3.854 1.00 14.33 O ATOM 570 CB SER A 38 31.457 0.437 -2.514 1.00 22.31 C ATOM 571 OG SER A 38 31.696 1.764 -2.054 1.00 12.20 O ATOM 0 H SER A 38 30.369 1.517 -4.465 1.00 54.21 H new ATOM 0 HA SER A 38 32.974 0.576 -4.010 1.00 2.32 H new ATOM 0 HB2 SER A 38 30.390 0.220 -2.456 1.00 22.31 H new ATOM 0 HB3 SER A 38 31.962 -0.271 -1.857 1.00 22.31 H new ATOM 0 HG SER A 38 31.235 2.401 -2.639 1.00 12.20 H new ATOM 577 N LEU A 39 30.917 -1.580 -5.165 1.00 73.04 N ATOM 578 CA LEU A 39 30.744 -2.954 -5.607 1.00 51.50 C ATOM 579 C LEU A 39 31.537 -3.174 -6.896 1.00 44.25 C ATOM 580 O LEU A 39 31.828 -4.311 -7.264 1.00 42.01 O ATOM 581 CB LEU A 39 29.257 -3.292 -5.734 1.00 63.43 C ATOM 582 CG LEU A 39 28.343 -2.716 -4.652 1.00 12.34 C ATOM 583 CD1 LEU A 39 26.901 -3.191 -4.842 1.00 0.24 C ATOM 584 CD2 LEU A 39 28.874 -3.041 -3.254 1.00 63.53 C ATOM 0 H LEU A 39 30.244 -0.919 -5.553 1.00 73.04 H new ATOM 0 HA LEU A 39 31.143 -3.646 -4.865 1.00 51.50 H new ATOM 0 HB2 LEU A 39 28.906 -2.939 -6.704 1.00 63.43 H new ATOM 0 HB3 LEU A 39 29.150 -4.377 -5.732 1.00 63.43 H new ATOM 0 HG LEU A 39 28.340 -1.630 -4.751 1.00 12.34 H new ATOM 0 HD11 LEU A 39 26.272 -2.767 -4.059 1.00 0.24 H new ATOM 0 HD12 LEU A 39 26.536 -2.866 -5.816 1.00 0.24 H new ATOM 0 HD13 LEU A 39 26.866 -4.279 -4.786 1.00 0.24 H new ATOM 0 HD21 LEU A 39 28.205 -2.620 -2.504 1.00 63.53 H new ATOM 0 HD22 LEU A 39 28.927 -4.122 -3.127 1.00 63.53 H new ATOM 0 HD23 LEU A 39 29.869 -2.613 -3.134 1.00 63.53 H new ATOM 596 N GLY A 40 31.865 -2.068 -7.548 1.00 3.30 N ATOM 597 CA GLY A 40 32.620 -2.126 -8.789 1.00 15.54 C ATOM 598 C GLY A 40 31.878 -1.404 -9.915 1.00 53.15 C ATOM 599 O GLY A 40 32.391 -1.288 -11.027 1.00 44.01 O ATOM 0 H GLY A 40 31.622 -1.126 -7.240 1.00 3.30 H new ATOM 0 HA2 GLY A 40 33.600 -1.672 -8.644 1.00 15.54 H new ATOM 0 HA3 GLY A 40 32.789 -3.166 -9.068 1.00 15.54 H new ATOM 603 N LEU A 41 30.681 -0.938 -9.589 1.00 42.44 N ATOM 604 CA LEU A 41 29.863 -0.230 -10.560 1.00 65.43 C ATOM 605 C LEU A 41 30.449 1.163 -10.795 1.00 43.35 C ATOM 606 O LEU A 41 31.481 1.512 -10.223 1.00 33.31 O ATOM 607 CB LEU A 41 28.399 -0.215 -10.118 1.00 30.23 C ATOM 608 CG LEU A 41 27.718 -1.581 -10.005 1.00 41.22 C ATOM 609 CD1 LEU A 41 26.501 -1.512 -9.081 1.00 72.01 C ATOM 610 CD2 LEU A 41 27.358 -2.130 -11.387 1.00 42.53 C ATOM 0 H LEU A 41 30.258 -1.037 -8.666 1.00 42.44 H new ATOM 0 HA LEU A 41 29.877 -0.748 -11.519 1.00 65.43 H new ATOM 0 HB2 LEU A 41 28.338 0.281 -9.149 1.00 30.23 H new ATOM 0 HB3 LEU A 41 27.833 0.394 -10.824 1.00 30.23 H new ATOM 0 HG LEU A 41 28.424 -2.279 -9.555 1.00 41.22 H new ATOM 0 HD11 LEU A 41 26.036 -2.496 -9.018 1.00 72.01 H new ATOM 0 HD12 LEU A 41 26.817 -1.196 -8.087 1.00 72.01 H new ATOM 0 HD13 LEU A 41 25.782 -0.795 -9.479 1.00 72.01 H new ATOM 0 HD21 LEU A 41 26.876 -3.101 -11.278 1.00 42.53 H new ATOM 0 HD22 LEU A 41 26.677 -1.441 -11.886 1.00 42.53 H new ATOM 0 HD23 LEU A 41 28.264 -2.240 -11.982 1.00 42.53 H new ATOM 622 N SER A 42 29.766 1.923 -11.639 1.00 20.20 N ATOM 623 CA SER A 42 30.206 3.271 -11.957 1.00 32.21 C ATOM 624 C SER A 42 29.038 4.083 -12.519 1.00 53.33 C ATOM 625 O SER A 42 29.099 4.565 -13.649 1.00 71.14 O ATOM 626 CB SER A 42 31.367 3.251 -12.953 1.00 73.33 C ATOM 627 OG SER A 42 30.913 3.128 -14.299 1.00 24.23 O ATOM 0 H SER A 42 28.911 1.631 -12.112 1.00 20.20 H new ATOM 0 HA SER A 42 30.559 3.741 -11.039 1.00 32.21 H new ATOM 0 HB2 SER A 42 31.950 4.166 -12.849 1.00 73.33 H new ATOM 0 HB3 SER A 42 32.033 2.421 -12.717 1.00 73.33 H new ATOM 0 HG SER A 42 30.450 3.950 -14.564 1.00 24.23 H new ATOM 633 N PRO A 43 27.973 4.214 -11.683 1.00 23.01 N ATOM 634 CA PRO A 43 26.793 4.960 -12.085 1.00 31.22 C ATOM 635 C PRO A 43 27.055 6.467 -12.042 1.00 64.42 C ATOM 636 O PRO A 43 27.293 7.029 -10.974 1.00 54.03 O ATOM 637 CB PRO A 43 25.702 4.519 -11.122 1.00 4.42 C ATOM 638 CG PRO A 43 26.421 3.901 -9.934 1.00 33.44 C ATOM 639 CD PRO A 43 27.866 3.657 -10.338 1.00 14.24 C ATOM 0 HA PRO A 43 26.501 4.761 -13.116 1.00 31.22 H new ATOM 0 HB2 PRO A 43 25.090 5.365 -10.811 1.00 4.42 H new ATOM 0 HB3 PRO A 43 25.034 3.798 -11.592 1.00 4.42 H new ATOM 0 HG2 PRO A 43 26.373 4.565 -9.071 1.00 33.44 H new ATOM 0 HG3 PRO A 43 25.943 2.966 -9.643 1.00 33.44 H new ATOM 0 HD2 PRO A 43 28.557 4.145 -9.651 1.00 14.24 H new ATOM 0 HD3 PRO A 43 28.106 2.594 -10.329 1.00 14.24 H new ATOM 647 N SER A 44 27.004 7.077 -13.217 1.00 10.32 N ATOM 648 CA SER A 44 27.233 8.508 -13.327 1.00 61.01 C ATOM 649 C SER A 44 26.097 9.274 -12.646 1.00 23.12 C ATOM 650 O SER A 44 24.933 8.894 -12.758 1.00 53.23 O ATOM 651 CB SER A 44 27.358 8.934 -14.791 1.00 54.51 C ATOM 652 OG SER A 44 27.977 7.929 -15.589 1.00 42.41 O ATOM 0 H SER A 44 26.808 6.607 -14.101 1.00 10.32 H new ATOM 0 HA SER A 44 28.172 8.744 -12.826 1.00 61.01 H new ATOM 0 HB2 SER A 44 26.368 9.155 -15.190 1.00 54.51 H new ATOM 0 HB3 SER A 44 27.939 9.854 -14.852 1.00 54.51 H new ATOM 0 HG SER A 44 28.037 8.239 -16.517 1.00 42.41 H new ATOM 658 N GLU A 45 26.476 10.339 -11.954 1.00 71.51 N ATOM 659 CA GLU A 45 25.504 11.161 -11.255 1.00 13.34 C ATOM 660 C GLU A 45 24.275 11.396 -12.136 1.00 31.44 C ATOM 661 O GLU A 45 23.142 11.306 -11.664 1.00 4.51 O ATOM 662 CB GLU A 45 26.124 12.489 -10.815 1.00 21.33 C ATOM 663 CG GLU A 45 25.254 13.178 -9.761 1.00 65.02 C ATOM 664 CD GLU A 45 26.007 14.335 -9.100 1.00 62.44 C ATOM 665 OE1 GLU A 45 26.180 15.396 -9.718 1.00 74.45 O ATOM 666 OE2 GLU A 45 26.419 14.102 -7.900 1.00 53.20 O ATOM 0 H GLU A 45 27.443 10.651 -11.863 1.00 71.51 H new ATOM 0 HA GLU A 45 25.187 10.630 -10.357 1.00 13.34 H new ATOM 0 HB2 GLU A 45 27.121 12.313 -10.410 1.00 21.33 H new ATOM 0 HB3 GLU A 45 26.242 13.143 -11.679 1.00 21.33 H new ATOM 0 HG2 GLU A 45 24.341 13.551 -10.225 1.00 65.02 H new ATOM 0 HG3 GLU A 45 24.953 12.455 -9.003 1.00 65.02 H new ATOM 674 N ALA A 46 24.540 11.691 -13.400 1.00 22.33 N ATOM 675 CA ALA A 46 23.470 11.939 -14.351 1.00 21.41 C ATOM 676 C ALA A 46 22.410 10.843 -14.216 1.00 43.35 C ATOM 677 O ALA A 46 21.223 11.136 -14.087 1.00 53.11 O ATOM 678 CB ALA A 46 24.051 12.017 -15.764 1.00 41.51 C ATOM 0 H ALA A 46 25.481 11.764 -13.788 1.00 22.33 H new ATOM 0 HA ALA A 46 22.986 12.894 -14.144 1.00 21.41 H new ATOM 0 HB1 ALA A 46 23.248 12.203 -16.478 1.00 41.51 H new ATOM 0 HB2 ALA A 46 24.777 12.829 -15.815 1.00 41.51 H new ATOM 0 HB3 ALA A 46 24.542 11.075 -16.008 1.00 41.51 H new ATOM 684 N GLU A 47 22.878 9.604 -14.252 1.00 2.23 N ATOM 685 CA GLU A 47 21.985 8.464 -14.135 1.00 65.45 C ATOM 686 C GLU A 47 21.489 8.323 -12.695 1.00 53.02 C ATOM 687 O GLU A 47 20.292 8.164 -12.460 1.00 72.24 O ATOM 688 CB GLU A 47 22.672 7.180 -14.606 1.00 72.14 C ATOM 689 CG GLU A 47 23.683 7.474 -15.716 1.00 41.32 C ATOM 690 CD GLU A 47 23.859 6.262 -16.633 1.00 42.11 C ATOM 691 OE1 GLU A 47 23.160 5.252 -16.467 1.00 34.05 O ATOM 692 OE2 GLU A 47 24.761 6.396 -17.546 1.00 74.52 O ATOM 0 H GLU A 47 23.864 9.365 -14.360 1.00 2.23 H new ATOM 0 HA GLU A 47 21.123 8.635 -14.780 1.00 65.45 H new ATOM 0 HB2 GLU A 47 23.178 6.705 -13.765 1.00 72.14 H new ATOM 0 HB3 GLU A 47 21.924 6.475 -14.968 1.00 72.14 H new ATOM 0 HG2 GLU A 47 23.348 8.331 -16.300 1.00 41.32 H new ATOM 0 HG3 GLU A 47 24.643 7.744 -15.276 1.00 41.32 H new ATOM 700 N VAL A 48 22.433 8.387 -11.768 1.00 42.03 N ATOM 701 CA VAL A 48 22.106 8.269 -10.357 1.00 64.24 C ATOM 702 C VAL A 48 20.854 9.095 -10.057 1.00 44.44 C ATOM 703 O VAL A 48 20.064 8.737 -9.186 1.00 74.11 O ATOM 704 CB VAL A 48 23.310 8.676 -9.505 1.00 42.45 C ATOM 705 CG1 VAL A 48 22.963 8.646 -8.016 1.00 11.42 C ATOM 706 CG2 VAL A 48 24.520 7.788 -9.805 1.00 15.32 C ATOM 0 H VAL A 48 23.425 8.519 -11.966 1.00 42.03 H new ATOM 0 HA VAL A 48 21.880 7.233 -10.103 1.00 64.24 H new ATOM 0 HB VAL A 48 23.574 9.701 -9.766 1.00 42.45 H new ATOM 0 HG11 VAL A 48 23.836 8.939 -7.433 1.00 11.42 H new ATOM 0 HG12 VAL A 48 22.145 9.339 -7.819 1.00 11.42 H new ATOM 0 HG13 VAL A 48 22.660 7.638 -7.733 1.00 11.42 H new ATOM 0 HG21 VAL A 48 25.362 8.099 -9.186 1.00 15.32 H new ATOM 0 HG22 VAL A 48 24.272 6.749 -9.586 1.00 15.32 H new ATOM 0 HG23 VAL A 48 24.789 7.883 -10.857 1.00 15.32 H new ATOM 716 N ASN A 49 20.713 10.186 -10.796 1.00 3.20 N ATOM 717 CA ASN A 49 19.571 11.067 -10.620 1.00 31.30 C ATOM 718 C ASN A 49 18.293 10.322 -11.013 1.00 23.05 C ATOM 719 O ASN A 49 17.422 10.093 -10.175 1.00 53.13 O ATOM 720 CB ASN A 49 19.688 12.306 -11.510 1.00 22.33 C ATOM 721 CG ASN A 49 20.682 13.310 -10.923 1.00 11.23 C ATOM 722 OD1 ASN A 49 21.696 12.749 -10.271 1.00 62.53 O flip ATOM 723 ND2 ASN A 49 20.537 14.515 -11.053 1.00 4.43 N flip ATOM 0 H ASN A 49 21.371 10.480 -11.518 1.00 3.20 H new ATOM 0 HA ASN A 49 19.541 11.375 -9.575 1.00 31.30 H new ATOM 0 HB2 ASN A 49 20.010 12.012 -12.509 1.00 22.33 H new ATOM 0 HB3 ASN A 49 18.710 12.776 -11.616 1.00 22.33 H new ATOM 0 HD21 ASN A 49 19.735 14.880 -11.566 1.00 4.43 H new ATOM 0 HD22 ASN A 49 21.218 15.157 -10.648 1.00 4.43 H new ATOM 730 N ASP A 50 18.223 9.964 -12.286 1.00 54.53 N ATOM 731 CA ASP A 50 17.066 9.250 -12.800 1.00 41.31 C ATOM 732 C ASP A 50 16.950 7.899 -12.091 1.00 50.53 C ATOM 733 O ASP A 50 15.917 7.237 -12.176 1.00 22.22 O ATOM 734 CB ASP A 50 17.204 8.986 -14.301 1.00 12.52 C ATOM 735 CG ASP A 50 15.882 8.791 -15.047 1.00 4.10 C ATOM 736 OD1 ASP A 50 15.259 9.760 -15.505 1.00 74.24 O ATOM 737 OD2 ASP A 50 15.491 7.566 -15.151 1.00 41.31 O ATOM 0 H ASP A 50 18.948 10.155 -12.977 1.00 54.53 H new ATOM 0 HA ASP A 50 16.184 9.864 -12.622 1.00 41.31 H new ATOM 0 HB2 ASP A 50 17.740 9.820 -14.754 1.00 12.52 H new ATOM 0 HB3 ASP A 50 17.819 8.097 -14.443 1.00 12.52 H new ATOM 743 N LEU A 51 18.024 7.531 -11.408 1.00 50.43 N ATOM 744 CA LEU A 51 18.056 6.271 -10.685 1.00 55.42 C ATOM 745 C LEU A 51 17.302 6.428 -9.363 1.00 53.20 C ATOM 746 O LEU A 51 16.396 5.651 -9.065 1.00 53.50 O ATOM 747 CB LEU A 51 19.497 5.786 -10.518 1.00 33.24 C ATOM 748 CG LEU A 51 19.670 4.411 -9.868 1.00 2.41 C ATOM 749 CD1 LEU A 51 18.982 4.360 -8.503 1.00 34.52 C ATOM 750 CD2 LEU A 51 19.182 3.300 -10.799 1.00 22.53 C ATOM 0 H LEU A 51 18.879 8.083 -11.340 1.00 50.43 H new ATOM 0 HA LEU A 51 17.546 5.492 -11.252 1.00 55.42 H new ATOM 0 HB2 LEU A 51 19.968 5.763 -11.501 1.00 33.24 H new ATOM 0 HB3 LEU A 51 20.039 6.519 -9.921 1.00 33.24 H new ATOM 0 HG LEU A 51 20.734 4.244 -9.698 1.00 2.41 H new ATOM 0 HD11 LEU A 51 19.120 3.372 -8.063 1.00 34.52 H new ATOM 0 HD12 LEU A 51 19.418 5.114 -7.847 1.00 34.52 H new ATOM 0 HD13 LEU A 51 17.917 4.557 -8.625 1.00 34.52 H new ATOM 0 HD21 LEU A 51 19.316 2.333 -10.313 1.00 22.53 H new ATOM 0 HD22 LEU A 51 18.126 3.450 -11.023 1.00 22.53 H new ATOM 0 HD23 LEU A 51 19.756 3.323 -11.725 1.00 22.53 H new ATOM 762 N MET A 52 17.704 7.438 -8.606 1.00 11.15 N ATOM 763 CA MET A 52 17.078 7.707 -7.322 1.00 72.41 C ATOM 764 C MET A 52 15.717 8.381 -7.506 1.00 51.25 C ATOM 765 O MET A 52 14.872 8.336 -6.614 1.00 12.32 O ATOM 766 CB MET A 52 17.988 8.612 -6.489 1.00 72.24 C ATOM 767 CG MET A 52 18.090 10.007 -7.110 1.00 33.32 C ATOM 768 SD MET A 52 18.521 11.202 -5.856 1.00 43.15 S ATOM 769 CE MET A 52 19.521 10.182 -4.786 1.00 31.20 C ATOM 0 H MET A 52 18.456 8.080 -8.857 1.00 11.15 H new ATOM 0 HA MET A 52 16.926 6.758 -6.808 1.00 72.41 H new ATOM 0 HB2 MET A 52 17.599 8.689 -5.474 1.00 72.24 H new ATOM 0 HB3 MET A 52 18.981 8.168 -6.417 1.00 72.24 H new ATOM 0 HG2 MET A 52 18.841 10.009 -7.900 1.00 33.32 H new ATOM 0 HG3 MET A 52 17.141 10.279 -7.572 1.00 33.32 H new ATOM 0 HE1 MET A 52 20.046 10.813 -4.069 1.00 31.20 H new ATOM 0 HE2 MET A 52 18.882 9.479 -4.252 1.00 31.20 H new ATOM 0 HE3 MET A 52 20.247 9.630 -5.383 1.00 31.20 H new ATOM 779 N ASN A 53 15.547 8.991 -8.670 1.00 62.25 N ATOM 780 CA ASN A 53 14.303 9.674 -8.983 1.00 64.23 C ATOM 781 C ASN A 53 13.246 8.642 -9.381 1.00 20.02 C ATOM 782 O ASN A 53 12.075 8.980 -9.547 1.00 42.23 O ATOM 783 CB ASN A 53 14.485 10.640 -10.156 1.00 24.14 C ATOM 784 CG ASN A 53 14.739 12.064 -9.658 1.00 5.31 C ATOM 785 OD1 ASN A 53 13.827 12.834 -9.406 1.00 33.52 O ATOM 786 ND2 ASN A 53 16.027 12.371 -9.531 1.00 42.32 N ATOM 0 H ASN A 53 16.250 9.026 -9.408 1.00 62.25 H new ATOM 0 HA ASN A 53 13.994 10.233 -8.100 1.00 64.23 H new ATOM 0 HB2 ASN A 53 15.320 10.313 -10.775 1.00 24.14 H new ATOM 0 HB3 ASN A 53 13.596 10.624 -10.786 1.00 24.14 H new ATOM 0 HD21 ASN A 53 16.301 13.298 -9.206 1.00 42.32 H new ATOM 0 HD22 ASN A 53 16.741 11.679 -9.759 1.00 42.32 H new ATOM 793 N GLU A 54 13.697 7.404 -9.521 1.00 53.15 N ATOM 794 CA GLU A 54 12.804 6.321 -9.896 1.00 60.43 C ATOM 795 C GLU A 54 12.123 5.740 -8.655 1.00 43.21 C ATOM 796 O GLU A 54 11.149 4.998 -8.767 1.00 61.31 O ATOM 797 CB GLU A 54 13.555 5.234 -10.669 1.00 33.04 C ATOM 798 CG GLU A 54 13.589 5.549 -12.165 1.00 55.14 C ATOM 799 CD GLU A 54 12.287 5.119 -12.846 1.00 2.22 C ATOM 800 OE1 GLU A 54 11.726 4.068 -12.502 1.00 13.50 O ATOM 801 OE2 GLU A 54 11.860 5.921 -13.762 1.00 23.12 O ATOM 0 H GLU A 54 14.669 7.127 -9.382 1.00 53.15 H new ATOM 0 HA GLU A 54 12.034 6.723 -10.554 1.00 60.43 H new ATOM 0 HB2 GLU A 54 14.573 5.150 -10.288 1.00 33.04 H new ATOM 0 HB3 GLU A 54 13.073 4.270 -10.508 1.00 33.04 H new ATOM 0 HG2 GLU A 54 13.745 6.618 -12.312 1.00 55.14 H new ATOM 0 HG3 GLU A 54 14.432 5.037 -12.629 1.00 55.14 H new ATOM 809 N ILE A 55 12.663 6.101 -7.500 1.00 63.42 N ATOM 810 CA ILE A 55 12.120 5.625 -6.239 1.00 62.12 C ATOM 811 C ILE A 55 11.629 6.819 -5.418 1.00 23.55 C ATOM 812 O ILE A 55 10.576 6.751 -4.786 1.00 52.03 O ATOM 813 CB ILE A 55 13.145 4.755 -5.509 1.00 1.15 C ATOM 814 CG1 ILE A 55 14.097 4.080 -6.499 1.00 12.45 C ATOM 815 CG2 ILE A 55 12.452 3.740 -4.597 1.00 3.11 C ATOM 816 CD1 ILE A 55 13.346 3.092 -7.394 1.00 5.23 C ATOM 0 H ILE A 55 13.471 6.717 -7.411 1.00 63.42 H new ATOM 0 HA ILE A 55 11.258 4.982 -6.413 1.00 62.12 H new ATOM 0 HB ILE A 55 13.749 5.401 -4.872 1.00 1.15 H new ATOM 0 HG12 ILE A 55 14.584 4.836 -7.115 1.00 12.45 H new ATOM 0 HG13 ILE A 55 14.884 3.558 -5.954 1.00 12.45 H new ATOM 0 HG21 ILE A 55 13.203 3.134 -4.090 1.00 3.11 H new ATOM 0 HG22 ILE A 55 11.851 4.267 -3.856 1.00 3.11 H new ATOM 0 HG23 ILE A 55 11.808 3.094 -5.194 1.00 3.11 H new ATOM 0 HD11 ILE A 55 14.045 2.626 -8.088 1.00 5.23 H new ATOM 0 HD12 ILE A 55 12.881 2.323 -6.777 1.00 5.23 H new ATOM 0 HD13 ILE A 55 12.576 3.622 -7.955 1.00 5.23 H new ATOM 828 N ASP A 56 12.416 7.884 -5.452 1.00 65.31 N ATOM 829 CA ASP A 56 12.075 9.091 -4.718 1.00 62.45 C ATOM 830 C ASP A 56 10.565 9.324 -4.803 1.00 65.01 C ATOM 831 O ASP A 56 10.031 9.564 -5.884 1.00 54.34 O ATOM 832 CB ASP A 56 12.777 10.313 -5.313 1.00 13.41 C ATOM 833 CG ASP A 56 13.258 11.344 -4.290 1.00 31.14 C ATOM 834 OD1 ASP A 56 13.236 11.096 -3.075 1.00 12.12 O ATOM 835 OD2 ASP A 56 13.675 12.457 -4.791 1.00 73.13 O ATOM 0 H ASP A 56 13.289 7.936 -5.977 1.00 65.31 H new ATOM 0 HA ASP A 56 12.394 8.960 -3.684 1.00 62.45 H new ATOM 0 HB2 ASP A 56 13.634 9.974 -5.895 1.00 13.41 H new ATOM 0 HB3 ASP A 56 12.094 10.803 -6.007 1.00 13.41 H new ATOM 841 N VAL A 57 9.921 9.245 -3.648 1.00 61.02 N ATOM 842 CA VAL A 57 8.484 9.445 -3.578 1.00 75.41 C ATOM 843 C VAL A 57 8.192 10.904 -3.223 1.00 44.12 C ATOM 844 O VAL A 57 7.077 11.387 -3.221 1.00 61.34 O ATOM 845 CB VAL A 57 7.865 8.454 -2.589 1.00 42.14 C ATOM 846 CG1 VAL A 57 6.363 8.699 -2.435 1.00 11.20 C ATOM 847 CG2 VAL A 57 8.145 7.011 -3.012 1.00 72.54 C ATOM 0 H VAL A 57 10.368 9.045 -2.753 1.00 61.02 H new ATOM 0 HA VAL A 57 8.024 9.248 -4.546 1.00 75.41 H new ATOM 0 HB VAL A 57 8.332 8.615 -1.617 1.00 42.14 H new ATOM 0 HG11 VAL A 57 5.948 7.982 -1.727 1.00 11.20 H new ATOM 0 HG12 VAL A 57 6.195 9.711 -2.066 1.00 11.20 H new ATOM 0 HG13 VAL A 57 5.874 8.579 -3.402 1.00 11.20 H new ATOM 0 HG21 VAL A 57 7.695 6.327 -2.293 1.00 72.54 H new ATOM 0 HG22 VAL A 57 7.719 6.832 -3.999 1.00 72.54 H new ATOM 0 HG23 VAL A 57 9.222 6.844 -3.046 1.00 72.54 H new ATOM 857 N ASP A 58 9.241 11.616 -2.915 1.00 11.12 N ATOM 858 CA ASP A 58 9.090 13.054 -2.556 1.00 11.51 C ATOM 859 C ASP A 58 9.890 13.924 -3.531 1.00 50.22 C ATOM 860 O ASP A 58 9.717 15.141 -3.492 1.00 55.45 O ATOM 861 CB ASP A 58 9.659 13.171 -1.141 1.00 51.25 C ATOM 862 CG ASP A 58 11.165 12.905 -1.172 1.00 74.31 C ATOM 863 OD1 ASP A 58 11.680 12.645 -2.247 1.00 50.02 O ATOM 864 OD2 ASP A 58 11.779 12.966 -0.120 1.00 4.25 O ATOM 0 H ASP A 58 10.198 11.263 -2.897 1.00 11.12 H new ATOM 0 HA ASP A 58 8.054 13.388 -2.606 1.00 11.51 H new ATOM 0 HB2 ASP A 58 9.463 14.165 -0.740 1.00 51.25 H new ATOM 0 HB3 ASP A 58 9.167 12.458 -0.480 1.00 51.25 H new ATOM 869 N GLY A 59 10.726 13.311 -4.356 1.00 51.24 N ATOM 870 CA GLY A 59 11.525 14.064 -5.308 1.00 0.40 C ATOM 871 C GLY A 59 12.515 14.982 -4.588 1.00 0.03 C ATOM 872 O GLY A 59 12.768 16.100 -5.033 1.00 54.34 O ATOM 0 H GLY A 59 10.867 12.301 -4.385 1.00 51.24 H new ATOM 0 HA2 GLY A 59 12.067 13.377 -5.957 1.00 0.40 H new ATOM 0 HA3 GLY A 59 10.872 14.658 -5.947 1.00 0.40 H new ATOM 876 N ASN A 60 13.049 14.475 -3.486 1.00 52.11 N ATOM 877 CA ASN A 60 14.005 15.235 -2.700 1.00 5.22 C ATOM 878 C ASN A 60 15.425 14.819 -3.091 1.00 1.43 C ATOM 879 O ASN A 60 16.332 14.837 -2.260 1.00 10.41 O ATOM 880 CB ASN A 60 13.828 14.964 -1.205 1.00 3.15 C ATOM 881 CG ASN A 60 14.368 13.582 -0.830 1.00 40.30 C ATOM 882 OD1 ASN A 60 14.480 12.687 -1.652 1.00 14.34 O ATOM 883 ND2 ASN A 60 14.696 13.459 0.453 1.00 14.00 N ATOM 0 H ASN A 60 12.837 13.547 -3.119 1.00 52.11 H new ATOM 0 HA ASN A 60 13.837 16.294 -2.897 1.00 5.22 H new ATOM 0 HB2 ASN A 60 14.348 15.730 -0.629 1.00 3.15 H new ATOM 0 HB3 ASN A 60 12.772 15.029 -0.943 1.00 3.15 H new ATOM 0 HD21 ASN A 60 15.067 12.575 0.802 1.00 14.00 H new ATOM 0 HD22 ASN A 60 14.577 14.248 1.088 1.00 14.00 H new ATOM 890 N HIS A 61 15.573 14.455 -4.356 1.00 24.33 N ATOM 891 CA HIS A 61 16.867 14.035 -4.867 1.00 2.11 C ATOM 892 C HIS A 61 17.574 13.167 -3.824 1.00 2.31 C ATOM 893 O HIS A 61 18.787 13.268 -3.646 1.00 62.25 O ATOM 894 CB HIS A 61 17.700 15.245 -5.295 1.00 64.20 C ATOM 895 CG HIS A 61 19.172 14.949 -5.462 1.00 11.05 C ATOM 896 ND1 HIS A 61 20.218 15.118 -4.603 1.00 74.22 N flip ATOM 897 CD2 HIS A 61 19.703 14.416 -6.623 1.00 12.34 C flip ATOM 898 CE1 HIS A 61 21.327 14.709 -5.206 1.00 74.12 C flip ATOM 899 NE2 HIS A 61 21.010 14.274 -6.459 1.00 51.31 N flip ATOM 0 H HIS A 61 14.819 14.442 -5.042 1.00 24.33 H new ATOM 0 HA HIS A 61 16.729 13.427 -5.761 1.00 2.11 H new ATOM 0 HB2 HIS A 61 17.308 15.628 -6.237 1.00 64.20 H new ATOM 0 HB3 HIS A 61 17.581 16.036 -4.554 1.00 64.20 H new ATOM 0 HD1 HIS A 61 20.158 15.495 -3.657 1.00 74.22 H new ATOM 0 HD2 HIS A 61 19.146 14.159 -7.512 1.00 12.34 H new ATOM 0 HE1 HIS A 61 22.317 14.719 -4.775 1.00 74.12 H new ATOM 907 N GLN A 62 16.785 12.335 -3.161 1.00 23.41 N ATOM 908 CA GLN A 62 17.320 11.450 -2.140 1.00 63.41 C ATOM 909 C GLN A 62 16.387 10.256 -1.930 1.00 71.45 C ATOM 910 O GLN A 62 15.329 10.173 -2.553 1.00 65.03 O ATOM 911 CB GLN A 62 17.551 12.202 -0.828 1.00 40.22 C ATOM 912 CG GLN A 62 18.650 13.255 -0.986 1.00 20.11 C ATOM 913 CD GLN A 62 19.265 13.613 0.369 1.00 70.33 C ATOM 914 OE1 GLN A 62 20.070 12.885 0.926 1.00 61.43 O ATOM 915 NE2 GLN A 62 18.842 14.772 0.866 1.00 62.43 N ATOM 0 H GLN A 62 15.779 12.255 -3.311 1.00 23.41 H new ATOM 0 HA GLN A 62 18.285 11.076 -2.481 1.00 63.41 H new ATOM 0 HB2 GLN A 62 16.625 12.682 -0.512 1.00 40.22 H new ATOM 0 HB3 GLN A 62 17.828 11.497 -0.044 1.00 40.22 H new ATOM 0 HG2 GLN A 62 19.425 12.879 -1.654 1.00 20.11 H new ATOM 0 HG3 GLN A 62 18.237 14.151 -1.450 1.00 20.11 H new ATOM 0 HE21 GLN A 62 18.166 15.333 0.347 1.00 62.43 H new ATOM 0 HE22 GLN A 62 19.193 15.100 1.766 1.00 62.43 H new ATOM 924 N ILE A 63 16.812 9.360 -1.051 1.00 50.22 N ATOM 925 CA ILE A 63 16.027 8.174 -0.752 1.00 3.53 C ATOM 926 C ILE A 63 15.843 8.059 0.763 1.00 51.42 C ATOM 927 O ILE A 63 16.815 8.105 1.515 1.00 32.43 O ATOM 928 CB ILE A 63 16.662 6.937 -1.390 1.00 33.02 C ATOM 929 CG1 ILE A 63 17.326 7.287 -2.723 1.00 72.10 C ATOM 930 CG2 ILE A 63 15.637 5.810 -1.538 1.00 2.31 C ATOM 931 CD1 ILE A 63 17.251 6.110 -3.698 1.00 52.44 C ATOM 0 H ILE A 63 17.690 9.431 -0.536 1.00 50.22 H new ATOM 0 HA ILE A 63 15.032 8.255 -1.190 1.00 3.53 H new ATOM 0 HB ILE A 63 17.446 6.574 -0.726 1.00 33.02 H new ATOM 0 HG12 ILE A 63 16.837 8.158 -3.160 1.00 72.10 H new ATOM 0 HG13 ILE A 63 18.368 7.558 -2.554 1.00 72.10 H new ATOM 0 HG21 ILE A 63 16.114 4.942 -1.994 1.00 2.31 H new ATOM 0 HG22 ILE A 63 15.251 5.538 -0.556 1.00 2.31 H new ATOM 0 HG23 ILE A 63 14.815 6.146 -2.170 1.00 2.31 H new ATOM 0 HD11 ILE A 63 17.730 6.385 -4.638 1.00 52.44 H new ATOM 0 HD12 ILE A 63 17.762 5.249 -3.268 1.00 52.44 H new ATOM 0 HD13 ILE A 63 16.207 5.857 -3.883 1.00 52.44 H new ATOM 943 N GLU A 64 14.589 7.913 1.165 1.00 71.15 N ATOM 944 CA GLU A 64 14.265 7.791 2.576 1.00 74.03 C ATOM 945 C GLU A 64 14.154 6.317 2.970 1.00 61.35 C ATOM 946 O GLU A 64 14.115 5.441 2.106 1.00 3.24 O ATOM 947 CB GLU A 64 12.976 8.546 2.909 1.00 21.43 C ATOM 948 CG GLU A 64 13.108 9.296 4.236 1.00 20.11 C ATOM 949 CD GLU A 64 11.746 9.452 4.915 1.00 11.43 C ATOM 950 OE1 GLU A 64 10.706 9.217 4.281 1.00 5.23 O ATOM 951 OE2 GLU A 64 11.791 9.832 6.147 1.00 4.13 O ATOM 0 H GLU A 64 13.785 7.876 0.538 1.00 71.15 H new ATOM 0 HA GLU A 64 15.072 8.241 3.154 1.00 74.03 H new ATOM 0 HB2 GLU A 64 12.746 9.251 2.110 1.00 21.43 H new ATOM 0 HB3 GLU A 64 12.143 7.845 2.965 1.00 21.43 H new ATOM 0 HG2 GLU A 64 13.788 8.758 4.896 1.00 20.11 H new ATOM 0 HG3 GLU A 64 13.546 10.279 4.061 1.00 20.11 H new ATOM 959 N PHE A 65 14.107 6.087 4.274 1.00 54.54 N ATOM 960 CA PHE A 65 14.001 4.734 4.792 1.00 4.23 C ATOM 961 C PHE A 65 12.626 4.136 4.489 1.00 63.03 C ATOM 962 O PHE A 65 12.425 2.931 4.629 1.00 62.44 O ATOM 963 CB PHE A 65 14.183 4.821 6.309 1.00 40.21 C ATOM 964 CG PHE A 65 13.569 3.649 7.077 1.00 3.14 C ATOM 965 CD1 PHE A 65 13.823 2.372 6.686 1.00 63.33 C ATOM 966 CD2 PHE A 65 12.770 3.885 8.152 1.00 73.41 C ATOM 967 CE1 PHE A 65 13.254 1.284 7.399 1.00 74.12 C ATOM 968 CE2 PHE A 65 12.200 2.797 8.865 1.00 30.20 C ATOM 969 CZ PHE A 65 12.454 1.519 8.473 1.00 0.44 C ATOM 0 H PHE A 65 14.140 6.815 4.987 1.00 54.54 H new ATOM 0 HA PHE A 65 14.754 4.098 4.327 1.00 4.23 H new ATOM 0 HB2 PHE A 65 15.248 4.872 6.535 1.00 40.21 H new ATOM 0 HB3 PHE A 65 13.737 5.749 6.666 1.00 40.21 H new ATOM 0 HD1 PHE A 65 14.458 2.185 5.833 1.00 63.33 H new ATOM 0 HD2 PHE A 65 12.569 4.899 8.463 1.00 73.41 H new ATOM 0 HE1 PHE A 65 13.457 0.270 7.088 1.00 74.12 H new ATOM 0 HE2 PHE A 65 11.565 2.984 9.718 1.00 30.20 H new ATOM 0 HZ PHE A 65 12.020 0.692 9.015 1.00 0.44 H new ATOM 979 N SER A 66 11.715 5.006 4.079 1.00 43.23 N ATOM 980 CA SER A 66 10.365 4.579 3.754 1.00 31.11 C ATOM 981 C SER A 66 10.294 4.135 2.291 1.00 13.45 C ATOM 982 O SER A 66 9.741 3.080 1.985 1.00 1.03 O ATOM 983 CB SER A 66 9.355 5.697 4.019 1.00 32.05 C ATOM 984 OG SER A 66 9.406 6.711 3.020 1.00 51.14 O ATOM 0 H SER A 66 11.885 6.005 3.964 1.00 43.23 H new ATOM 0 HA SER A 66 10.109 3.736 4.396 1.00 31.11 H new ATOM 0 HB2 SER A 66 8.350 5.276 4.057 1.00 32.05 H new ATOM 0 HB3 SER A 66 9.552 6.140 4.995 1.00 32.05 H new ATOM 0 HG SER A 66 9.814 7.519 3.395 1.00 51.14 H new ATOM 990 N GLU A 67 10.861 4.964 1.427 1.00 31.10 N ATOM 991 CA GLU A 67 10.869 4.670 0.004 1.00 53.51 C ATOM 992 C GLU A 67 11.790 3.484 -0.288 1.00 50.44 C ATOM 993 O GLU A 67 11.399 2.547 -0.982 1.00 65.13 O ATOM 994 CB GLU A 67 11.283 5.900 -0.807 1.00 64.31 C ATOM 995 CG GLU A 67 10.431 7.115 -0.436 1.00 22.24 C ATOM 996 CD GLU A 67 11.198 8.417 -0.677 1.00 30.32 C ATOM 997 OE1 GLU A 67 10.936 9.424 -0.003 1.00 42.31 O ATOM 998 OE2 GLU A 67 12.095 8.358 -1.602 1.00 23.43 O ATOM 0 H GLU A 67 11.318 5.839 1.685 1.00 31.10 H new ATOM 0 HA GLU A 67 9.857 4.401 -0.298 1.00 53.51 H new ATOM 0 HB2 GLU A 67 12.335 6.121 -0.627 1.00 64.31 H new ATOM 0 HB3 GLU A 67 11.179 5.690 -1.871 1.00 64.31 H new ATOM 0 HG2 GLU A 67 9.514 7.114 -1.026 1.00 22.24 H new ATOM 0 HG3 GLU A 67 10.136 7.051 0.611 1.00 22.24 H new ATOM 1006 N PHE A 68 12.995 3.564 0.256 1.00 43.23 N ATOM 1007 CA PHE A 68 13.975 2.509 0.062 1.00 62.10 C ATOM 1008 C PHE A 68 13.400 1.147 0.457 1.00 2.34 C ATOM 1009 O PHE A 68 13.593 0.159 -0.249 1.00 50.12 O ATOM 1010 CB PHE A 68 15.164 2.830 0.970 1.00 40.32 C ATOM 1011 CG PHE A 68 16.317 1.830 0.863 1.00 40.12 C ATOM 1012 CD1 PHE A 68 17.143 1.858 -0.217 1.00 4.11 C ATOM 1013 CD2 PHE A 68 16.515 0.913 1.847 1.00 4.24 C ATOM 1014 CE1 PHE A 68 18.214 0.930 -0.316 1.00 75.02 C ATOM 1015 CE2 PHE A 68 17.585 -0.015 1.748 1.00 4.11 C ATOM 1016 CZ PHE A 68 18.412 0.013 0.668 1.00 11.04 C ATOM 0 H PHE A 68 13.315 4.343 0.831 1.00 43.23 H new ATOM 0 HA PHE A 68 14.266 2.460 -0.987 1.00 62.10 H new ATOM 0 HB2 PHE A 68 15.536 3.825 0.726 1.00 40.32 H new ATOM 0 HB3 PHE A 68 14.820 2.863 2.004 1.00 40.32 H new ATOM 0 HD1 PHE A 68 16.985 2.586 -0.999 1.00 4.11 H new ATOM 0 HD2 PHE A 68 15.858 0.890 2.704 1.00 4.24 H new ATOM 0 HE1 PHE A 68 18.871 0.953 -1.173 1.00 75.02 H new ATOM 0 HE2 PHE A 68 17.742 -0.743 2.530 1.00 4.11 H new ATOM 0 HZ PHE A 68 19.226 -0.693 0.592 1.00 11.04 H new ATOM 1026 N LEU A 69 12.706 1.139 1.586 1.00 55.14 N ATOM 1027 CA LEU A 69 12.101 -0.085 2.084 1.00 42.15 C ATOM 1028 C LEU A 69 10.898 -0.446 1.211 1.00 73.15 C ATOM 1029 O LEU A 69 10.620 -1.623 0.986 1.00 63.21 O ATOM 1030 CB LEU A 69 11.764 0.050 3.570 1.00 43.11 C ATOM 1031 CG LEU A 69 10.299 0.340 3.902 1.00 41.21 C ATOM 1032 CD1 LEU A 69 9.410 -0.853 3.547 1.00 51.03 C ATOM 1033 CD2 LEU A 69 10.141 0.757 5.365 1.00 12.44 C ATOM 0 H LEU A 69 12.549 1.961 2.170 1.00 55.14 H new ATOM 0 HA LEU A 69 12.806 -0.914 2.015 1.00 42.15 H new ATOM 0 HB2 LEU A 69 12.054 -0.872 4.073 1.00 43.11 H new ATOM 0 HB3 LEU A 69 12.376 0.848 3.990 1.00 43.11 H new ATOM 0 HG LEU A 69 9.970 1.180 3.290 1.00 41.21 H new ATOM 0 HD11 LEU A 69 8.374 -0.621 3.793 1.00 51.03 H new ATOM 0 HD12 LEU A 69 9.492 -1.063 2.481 1.00 51.03 H new ATOM 0 HD13 LEU A 69 9.730 -1.727 4.114 1.00 51.03 H new ATOM 0 HD21 LEU A 69 9.090 0.957 5.575 1.00 12.44 H new ATOM 0 HD22 LEU A 69 10.494 -0.046 6.012 1.00 12.44 H new ATOM 0 HD23 LEU A 69 10.726 1.657 5.552 1.00 12.44 H new ATOM 1045 N ALA A 70 10.215 0.588 0.742 1.00 43.41 N ATOM 1046 CA ALA A 70 9.048 0.395 -0.101 1.00 60.25 C ATOM 1047 C ALA A 70 9.498 -0.058 -1.492 1.00 22.22 C ATOM 1048 O ALA A 70 8.693 -0.557 -2.277 1.00 25.42 O ATOM 1049 CB ALA A 70 8.230 1.687 -0.146 1.00 1.02 C ATOM 0 H ALA A 70 10.448 1.563 0.930 1.00 43.41 H new ATOM 0 HA ALA A 70 8.405 -0.384 0.308 1.00 60.25 H new ATOM 0 HB1 ALA A 70 7.354 1.541 -0.779 1.00 1.02 H new ATOM 0 HB2 ALA A 70 7.910 1.950 0.862 1.00 1.02 H new ATOM 0 HB3 ALA A 70 8.842 2.491 -0.553 1.00 1.02 H new ATOM 1055 N LEU A 71 10.783 0.132 -1.754 1.00 11.10 N ATOM 1056 CA LEU A 71 11.350 -0.251 -3.036 1.00 11.31 C ATOM 1057 C LEU A 71 11.467 -1.775 -3.102 1.00 51.32 C ATOM 1058 O LEU A 71 11.085 -2.387 -4.098 1.00 33.50 O ATOM 1059 CB LEU A 71 12.673 0.479 -3.276 1.00 22.32 C ATOM 1060 CG LEU A 71 13.483 0.018 -4.490 1.00 33.14 C ATOM 1061 CD1 LEU A 71 12.618 0.002 -5.751 1.00 74.53 C ATOM 1062 CD2 LEU A 71 14.739 0.873 -4.667 1.00 63.53 C ATOM 0 H LEU A 71 11.448 0.546 -1.100 1.00 11.10 H new ATOM 0 HA LEU A 71 10.692 0.054 -3.850 1.00 11.31 H new ATOM 0 HB2 LEU A 71 12.463 1.543 -3.387 1.00 22.32 H new ATOM 0 HB3 LEU A 71 13.293 0.367 -2.387 1.00 22.32 H new ATOM 0 HG LEU A 71 13.813 -1.006 -4.313 1.00 33.14 H new ATOM 0 HD11 LEU A 71 13.217 -0.329 -6.599 1.00 74.53 H new ATOM 0 HD12 LEU A 71 11.781 -0.682 -5.609 1.00 74.53 H new ATOM 0 HD13 LEU A 71 12.238 1.005 -5.945 1.00 74.53 H new ATOM 0 HD21 LEU A 71 15.297 0.525 -5.536 1.00 63.53 H new ATOM 0 HD22 LEU A 71 14.453 1.915 -4.813 1.00 63.53 H new ATOM 0 HD23 LEU A 71 15.364 0.790 -3.778 1.00 63.53 H new ATOM 1074 N MET A 72 11.997 -2.343 -2.029 1.00 13.10 N ATOM 1075 CA MET A 72 12.169 -3.784 -1.953 1.00 12.33 C ATOM 1076 C MET A 72 10.820 -4.502 -2.034 1.00 23.05 C ATOM 1077 O MET A 72 10.703 -5.537 -2.687 1.00 74.32 O ATOM 1078 CB MET A 72 12.863 -4.146 -0.638 1.00 74.22 C ATOM 1079 CG MET A 72 14.237 -3.480 -0.542 1.00 32.23 C ATOM 1080 SD MET A 72 15.522 -4.713 -0.661 1.00 3.13 S ATOM 1081 CE MET A 72 16.604 -3.920 -1.839 1.00 0.15 C ATOM 0 H MET A 72 12.313 -1.832 -1.205 1.00 13.10 H new ATOM 0 HA MET A 72 12.780 -4.104 -2.797 1.00 12.33 H new ATOM 0 HB2 MET A 72 12.244 -3.833 0.202 1.00 74.22 H new ATOM 0 HB3 MET A 72 12.974 -5.228 -0.567 1.00 74.22 H new ATOM 0 HG2 MET A 72 14.351 -2.746 -1.340 1.00 32.23 H new ATOM 0 HG3 MET A 72 14.324 -2.942 0.402 1.00 32.23 H new ATOM 0 HE1 MET A 72 17.301 -4.653 -2.244 1.00 0.15 H new ATOM 0 HE2 MET A 72 16.011 -3.497 -2.650 1.00 0.15 H new ATOM 0 HE3 MET A 72 17.161 -3.125 -1.344 1.00 0.15 H new ATOM 1091 N SER A 73 9.837 -3.924 -1.360 1.00 33.02 N ATOM 1092 CA SER A 73 8.501 -4.496 -1.347 1.00 61.11 C ATOM 1093 C SER A 73 7.833 -4.296 -2.709 1.00 41.20 C ATOM 1094 O SER A 73 6.773 -4.860 -2.973 1.00 72.44 O ATOM 1095 CB SER A 73 7.647 -3.875 -0.240 1.00 75.34 C ATOM 1096 OG SER A 73 6.309 -4.367 -0.259 1.00 62.21 O ATOM 0 H SER A 73 9.939 -3.065 -0.819 1.00 33.02 H new ATOM 0 HA SER A 73 8.588 -5.564 -1.146 1.00 61.11 H new ATOM 0 HB2 SER A 73 8.098 -4.088 0.729 1.00 75.34 H new ATOM 0 HB3 SER A 73 7.637 -2.791 -0.355 1.00 75.34 H new ATOM 0 HG SER A 73 6.057 -4.594 -1.178 1.00 62.21 H new ATOM 1102 N ARG A 74 8.481 -3.490 -3.537 1.00 63.34 N ATOM 1103 CA ARG A 74 7.963 -3.208 -4.865 1.00 64.55 C ATOM 1104 C ARG A 74 9.034 -3.486 -5.923 1.00 30.33 C ATOM 1105 O ARG A 74 9.161 -2.742 -6.894 1.00 14.45 O ATOM 1106 CB ARG A 74 7.508 -1.753 -4.981 1.00 53.54 C ATOM 1107 CG ARG A 74 6.939 -1.465 -6.373 1.00 3.05 C ATOM 1108 CD ARG A 74 7.703 -0.326 -7.052 1.00 72.51 C ATOM 1109 NE ARG A 74 6.852 0.309 -8.083 1.00 60.32 N ATOM 1110 CZ ARG A 74 7.079 1.534 -8.602 1.00 62.03 C ATOM 1111 NH1 ARG A 74 8.135 2.268 -8.190 1.00 34.11 N ATOM 1112 NH2 ARG A 74 6.254 2.004 -9.519 1.00 71.21 N ATOM 0 H ARG A 74 9.360 -3.023 -3.314 1.00 63.34 H new ATOM 0 HA ARG A 74 7.105 -3.860 -5.031 1.00 64.55 H new ATOM 0 HB2 ARG A 74 6.752 -1.543 -4.225 1.00 53.54 H new ATOM 0 HB3 ARG A 74 8.349 -1.088 -4.783 1.00 53.54 H new ATOM 0 HG2 ARG A 74 6.997 -2.364 -6.987 1.00 3.05 H new ATOM 0 HG3 ARG A 74 5.884 -1.203 -6.292 1.00 3.05 H new ATOM 0 HD2 ARG A 74 8.004 0.414 -6.310 1.00 72.51 H new ATOM 0 HD3 ARG A 74 8.616 -0.710 -7.508 1.00 72.51 H new ATOM 0 HE ARG A 74 6.043 -0.212 -8.423 1.00 60.32 H new ATOM 0 HH11 ARG A 74 8.768 1.897 -7.481 1.00 34.11 H new ATOM 0 HH12 ARG A 74 8.299 3.193 -8.587 1.00 34.11 H new ATOM 0 HH21 ARG A 74 5.459 1.443 -9.825 1.00 71.21 H new ATOM 0 HH22 ARG A 74 6.412 2.928 -9.921 1.00 71.21 H new ATOM 1125 N GLN A 75 9.777 -4.560 -5.698 1.00 41.05 N ATOM 1126 CA GLN A 75 10.833 -4.945 -6.620 1.00 33.33 C ATOM 1127 C GLN A 75 10.894 -6.469 -6.749 1.00 41.55 C ATOM 1128 O GLN A 75 11.959 -7.031 -6.997 1.00 62.55 O ATOM 1129 CB GLN A 75 12.182 -4.378 -6.175 1.00 63.13 C ATOM 1130 CG GLN A 75 12.485 -3.059 -6.890 1.00 20.51 C ATOM 1131 CD GLN A 75 13.500 -3.267 -8.016 1.00 3.53 C ATOM 1132 OE1 GLN A 75 13.300 -4.048 -8.931 1.00 42.22 O ATOM 1133 NE2 GLN A 75 14.598 -2.525 -7.897 1.00 40.14 N ATOM 0 H GLN A 75 9.669 -5.175 -4.892 1.00 41.05 H new ATOM 0 HA GLN A 75 10.605 -4.525 -7.600 1.00 33.33 H new ATOM 0 HB2 GLN A 75 12.176 -4.218 -5.097 1.00 63.13 H new ATOM 0 HB3 GLN A 75 12.971 -5.100 -6.386 1.00 63.13 H new ATOM 0 HG2 GLN A 75 11.564 -2.642 -7.298 1.00 20.51 H new ATOM 0 HG3 GLN A 75 12.873 -2.334 -6.175 1.00 20.51 H new ATOM 0 HE21 GLN A 75 14.701 -1.891 -7.105 1.00 40.14 H new ATOM 0 HE22 GLN A 75 15.336 -2.591 -8.598 1.00 40.14 H new ATOM 1142 N LEU A 76 9.738 -7.092 -6.576 1.00 22.30 N ATOM 1143 CA LEU A 76 9.647 -8.539 -6.671 1.00 21.54 C ATOM 1144 C LEU A 76 8.340 -8.919 -7.369 1.00 32.31 C ATOM 1145 O LEU A 76 7.256 -8.616 -6.873 1.00 10.04 O ATOM 1146 CB LEU A 76 9.815 -9.178 -5.291 1.00 24.34 C ATOM 1147 CG LEU A 76 10.722 -8.430 -4.311 1.00 51.01 C ATOM 1148 CD1 LEU A 76 10.246 -8.620 -2.869 1.00 43.25 C ATOM 1149 CD2 LEU A 76 12.184 -8.844 -4.492 1.00 12.34 C ATOM 0 H LEU A 76 8.857 -6.622 -6.371 1.00 22.30 H new ATOM 0 HA LEU A 76 10.460 -8.932 -7.281 1.00 21.54 H new ATOM 0 HB2 LEU A 76 8.829 -9.280 -4.837 1.00 24.34 H new ATOM 0 HB3 LEU A 76 10.210 -10.185 -5.425 1.00 24.34 H new ATOM 0 HG LEU A 76 10.660 -7.365 -4.533 1.00 51.01 H new ATOM 0 HD11 LEU A 76 10.908 -8.078 -2.193 1.00 43.25 H new ATOM 0 HD12 LEU A 76 9.231 -8.237 -2.767 1.00 43.25 H new ATOM 0 HD13 LEU A 76 10.260 -9.681 -2.618 1.00 43.25 H new ATOM 0 HD21 LEU A 76 12.807 -8.298 -3.784 1.00 12.34 H new ATOM 0 HD22 LEU A 76 12.284 -9.915 -4.313 1.00 12.34 H new ATOM 0 HD23 LEU A 76 12.504 -8.615 -5.508 1.00 12.34 H new ATOM 1161 N LYS A 77 8.485 -9.578 -8.509 1.00 50.44 N ATOM 1162 CA LYS A 77 7.329 -10.002 -9.281 1.00 21.11 C ATOM 1163 C LYS A 77 7.534 -11.445 -9.747 1.00 3.12 C ATOM 1164 O LYS A 77 7.151 -12.385 -9.053 1.00 71.51 O ATOM 1165 CB LYS A 77 7.057 -9.020 -10.422 1.00 73.12 C ATOM 1166 CG LYS A 77 6.621 -7.657 -9.880 1.00 73.25 C ATOM 1167 CD LYS A 77 5.146 -7.391 -10.188 1.00 33.30 C ATOM 1168 CE LYS A 77 4.969 -6.864 -11.613 1.00 63.45 C ATOM 1169 NZ LYS A 77 3.540 -6.601 -11.896 1.00 24.34 N ATOM 0 H LYS A 77 9.386 -9.829 -8.917 1.00 50.44 H new ATOM 0 HA LYS A 77 6.432 -9.991 -8.662 1.00 21.11 H new ATOM 0 HB2 LYS A 77 7.955 -8.904 -11.028 1.00 73.12 H new ATOM 0 HB3 LYS A 77 6.281 -9.421 -11.075 1.00 73.12 H new ATOM 0 HG2 LYS A 77 6.784 -7.621 -8.803 1.00 73.25 H new ATOM 0 HG3 LYS A 77 7.236 -6.873 -10.321 1.00 73.25 H new ATOM 0 HD2 LYS A 77 4.573 -8.310 -10.063 1.00 33.30 H new ATOM 0 HD3 LYS A 77 4.747 -6.668 -9.477 1.00 33.30 H new ATOM 0 HE2 LYS A 77 5.546 -5.948 -11.742 1.00 63.45 H new ATOM 0 HE3 LYS A 77 5.359 -7.590 -12.326 1.00 63.45 H new ATOM 0 HZ1 LYS A 77 3.438 -6.244 -12.867 1.00 24.34 H new ATOM 0 HZ2 LYS A 77 2.998 -7.482 -11.793 1.00 24.34 H new ATOM 0 HZ3 LYS A 77 3.178 -5.892 -11.227 1.00 24.34 H new ATOM 1182 N SER A 78 8.139 -11.574 -10.919 1.00 34.32 N ATOM 1183 CA SER A 78 8.399 -12.887 -11.486 1.00 3.44 C ATOM 1184 C SER A 78 9.777 -13.383 -11.044 1.00 24.14 C ATOM 1185 O SER A 78 9.890 -14.128 -10.072 1.00 23.53 O ATOM 1186 CB SER A 78 8.311 -12.854 -13.013 1.00 24.34 C ATOM 1187 OG SER A 78 6.966 -12.742 -13.468 1.00 34.24 O ATOM 0 H SER A 78 8.456 -10.792 -11.491 1.00 34.32 H new ATOM 0 HA SER A 78 7.637 -13.576 -11.120 1.00 3.44 H new ATOM 0 HB2 SER A 78 8.893 -12.014 -13.392 1.00 24.34 H new ATOM 0 HB3 SER A 78 8.758 -13.761 -13.421 1.00 24.34 H new ATOM 0 HG SER A 78 6.953 -12.722 -14.448 1.00 34.24 H new ATOM 1193 N ASN A 79 10.791 -12.950 -11.779 1.00 12.33 N ATOM 1194 CA ASN A 79 12.157 -13.341 -11.475 1.00 11.32 C ATOM 1195 C ASN A 79 12.710 -12.432 -10.375 1.00 62.21 C ATOM 1196 O ASN A 79 13.821 -11.918 -10.491 1.00 4.33 O ATOM 1197 CB ASN A 79 13.057 -13.198 -12.704 1.00 0.34 C ATOM 1198 CG ASN A 79 12.701 -11.941 -13.501 1.00 72.51 C ATOM 1199 OD1 ASN A 79 12.924 -10.805 -12.848 1.00 70.54 O flip ATOM 1200 ND2 ASN A 79 12.253 -12.000 -14.634 1.00 11.32 N flip ATOM 0 H ASN A 79 10.694 -12.332 -12.585 1.00 12.33 H new ATOM 0 HA ASN A 79 12.147 -14.383 -11.155 1.00 11.32 H new ATOM 0 HB2 ASN A 79 14.100 -13.152 -12.392 1.00 0.34 H new ATOM 0 HB3 ASN A 79 12.953 -14.077 -13.340 1.00 0.34 H new ATOM 0 HD21 ASN A 79 12.106 -12.907 -15.078 1.00 11.32 H new ATOM 0 HD22 ASN A 79 12.026 -11.143 -15.138 1.00 11.32 H new ATOM 1207 N ASP A 80 11.909 -12.263 -9.333 1.00 45.33 N ATOM 1208 CA ASP A 80 12.305 -11.425 -8.214 1.00 21.23 C ATOM 1209 C ASP A 80 13.673 -11.880 -7.701 1.00 2.40 C ATOM 1210 O ASP A 80 14.706 -11.468 -8.228 1.00 14.12 O ATOM 1211 CB ASP A 80 11.306 -11.539 -7.060 1.00 63.45 C ATOM 1212 CG ASP A 80 10.640 -12.909 -6.916 1.00 13.05 C ATOM 1213 OD1 ASP A 80 9.792 -13.297 -7.734 1.00 4.44 O ATOM 1214 OD2 ASP A 80 11.028 -13.599 -5.897 1.00 62.34 O ATOM 0 H ASP A 80 10.988 -12.692 -9.240 1.00 45.33 H new ATOM 0 HA ASP A 80 12.339 -10.392 -8.561 1.00 21.23 H new ATOM 0 HB2 ASP A 80 11.821 -11.302 -6.129 1.00 63.45 H new ATOM 0 HB3 ASP A 80 10.529 -10.786 -7.196 1.00 63.45 H new ATOM 1220 N SER A 81 13.637 -12.723 -6.679 1.00 55.54 N ATOM 1221 CA SER A 81 14.861 -13.237 -6.090 1.00 33.34 C ATOM 1222 C SER A 81 15.906 -13.479 -7.181 1.00 12.14 C ATOM 1223 O SER A 81 17.002 -12.923 -7.129 1.00 60.21 O ATOM 1224 CB SER A 81 14.597 -14.528 -5.312 1.00 71.31 C ATOM 1225 OG SER A 81 15.806 -15.190 -4.950 1.00 70.14 O ATOM 0 H SER A 81 12.779 -13.063 -6.244 1.00 55.54 H new ATOM 0 HA SER A 81 15.242 -12.494 -5.390 1.00 33.34 H new ATOM 0 HB2 SER A 81 14.026 -14.299 -4.412 1.00 71.31 H new ATOM 0 HB3 SER A 81 13.984 -15.197 -5.917 1.00 71.31 H new ATOM 0 HG SER A 81 15.595 -16.008 -4.454 1.00 70.14 H new ATOM 1231 N GLU A 82 15.529 -14.308 -8.143 1.00 25.54 N ATOM 1232 CA GLU A 82 16.421 -14.630 -9.244 1.00 74.52 C ATOM 1233 C GLU A 82 17.195 -13.386 -9.682 1.00 53.50 C ATOM 1234 O GLU A 82 18.420 -13.415 -9.781 1.00 25.33 O ATOM 1235 CB GLU A 82 15.646 -15.235 -10.417 1.00 62.10 C ATOM 1236 CG GLU A 82 15.975 -16.720 -10.584 1.00 41.00 C ATOM 1237 CD GLU A 82 15.776 -17.166 -12.034 1.00 51.00 C ATOM 1238 OE1 GLU A 82 15.523 -18.353 -12.288 1.00 54.13 O ATOM 1239 OE2 GLU A 82 15.892 -16.229 -12.913 1.00 74.34 O ATOM 0 H GLU A 82 14.619 -14.766 -8.183 1.00 25.54 H new ATOM 0 HA GLU A 82 17.137 -15.376 -8.900 1.00 74.52 H new ATOM 0 HB2 GLU A 82 14.576 -15.112 -10.252 1.00 62.10 H new ATOM 0 HB3 GLU A 82 15.891 -14.699 -11.334 1.00 62.10 H new ATOM 0 HG2 GLU A 82 17.006 -16.904 -10.281 1.00 41.00 H new ATOM 0 HG3 GLU A 82 15.339 -17.313 -9.927 1.00 41.00 H new ATOM 1247 N GLN A 83 16.447 -12.321 -9.933 1.00 3.32 N ATOM 1248 CA GLN A 83 17.048 -11.068 -10.358 1.00 2.23 C ATOM 1249 C GLN A 83 18.109 -10.619 -9.350 1.00 73.13 C ATOM 1250 O GLN A 83 19.291 -10.542 -9.681 1.00 31.31 O ATOM 1251 CB GLN A 83 15.983 -9.987 -10.551 1.00 1.43 C ATOM 1252 CG GLN A 83 15.600 -9.851 -12.026 1.00 20.32 C ATOM 1253 CD GLN A 83 16.612 -8.984 -12.778 1.00 15.24 C ATOM 1254 OE1 GLN A 83 17.637 -9.663 -13.283 1.00 62.32 O flip ATOM 1255 NE2 GLN A 83 16.470 -7.777 -12.891 1.00 21.30 N flip ATOM 0 H GLN A 83 15.431 -12.300 -9.850 1.00 3.32 H new ATOM 0 HA GLN A 83 17.534 -11.229 -11.320 1.00 2.23 H new ATOM 0 HB2 GLN A 83 15.099 -10.234 -9.963 1.00 1.43 H new ATOM 0 HB3 GLN A 83 16.357 -9.033 -10.179 1.00 1.43 H new ATOM 0 HG2 GLN A 83 15.550 -10.838 -12.485 1.00 20.32 H new ATOM 0 HG3 GLN A 83 14.606 -9.410 -12.108 1.00 20.32 H new ATOM 0 HE21 GLN A 83 15.658 -7.318 -12.478 1.00 21.30 H new ATOM 0 HE22 GLN A 83 17.163 -7.227 -13.398 1.00 21.30 H new ATOM 1264 N GLU A 84 17.648 -10.334 -8.141 1.00 74.53 N ATOM 1265 CA GLU A 84 18.542 -9.895 -7.083 1.00 72.44 C ATOM 1266 C GLU A 84 19.612 -10.956 -6.819 1.00 22.11 C ATOM 1267 O GLU A 84 20.613 -10.682 -6.159 1.00 2.22 O ATOM 1268 CB GLU A 84 17.763 -9.572 -5.807 1.00 4.33 C ATOM 1269 CG GLU A 84 16.871 -10.745 -5.396 1.00 4.10 C ATOM 1270 CD GLU A 84 16.279 -10.522 -4.003 1.00 55.42 C ATOM 1271 OE1 GLU A 84 15.165 -10.989 -3.721 1.00 63.21 O ATOM 1272 OE2 GLU A 84 17.018 -9.835 -3.199 1.00 62.44 O ATOM 0 H GLU A 84 16.667 -10.399 -7.871 1.00 74.53 H new ATOM 0 HA GLU A 84 19.038 -8.980 -7.408 1.00 72.44 H new ATOM 0 HB2 GLU A 84 18.459 -9.340 -5.001 1.00 4.33 H new ATOM 0 HB3 GLU A 84 17.151 -8.684 -5.965 1.00 4.33 H new ATOM 0 HG2 GLU A 84 16.067 -10.867 -6.122 1.00 4.10 H new ATOM 0 HG3 GLU A 84 17.451 -11.668 -5.405 1.00 4.10 H new ATOM 1280 N LEU A 85 19.365 -12.145 -7.348 1.00 33.42 N ATOM 1281 CA LEU A 85 20.295 -13.249 -7.177 1.00 51.41 C ATOM 1282 C LEU A 85 21.451 -13.093 -8.167 1.00 3.33 C ATOM 1283 O LEU A 85 22.609 -12.989 -7.763 1.00 54.01 O ATOM 1284 CB LEU A 85 19.564 -14.588 -7.291 1.00 63.11 C ATOM 1285 CG LEU A 85 19.801 -15.580 -6.151 1.00 33.34 C ATOM 1286 CD1 LEU A 85 21.245 -16.084 -6.153 1.00 62.43 C ATOM 1287 CD2 LEU A 85 19.409 -14.970 -4.803 1.00 70.52 C ATOM 0 H LEU A 85 18.534 -12.369 -7.896 1.00 33.42 H new ATOM 0 HA LEU A 85 20.727 -13.233 -6.176 1.00 51.41 H new ATOM 0 HB2 LEU A 85 18.494 -14.391 -7.358 1.00 63.11 H new ATOM 0 HB3 LEU A 85 19.860 -15.063 -8.227 1.00 63.11 H new ATOM 0 HG LEU A 85 19.158 -16.445 -6.313 1.00 33.34 H new ATOM 0 HD11 LEU A 85 21.386 -16.788 -5.332 1.00 62.43 H new ATOM 0 HD12 LEU A 85 21.455 -16.583 -7.099 1.00 62.43 H new ATOM 0 HD13 LEU A 85 21.925 -15.241 -6.029 1.00 62.43 H new ATOM 0 HD21 LEU A 85 19.587 -15.696 -4.010 1.00 70.52 H new ATOM 0 HD22 LEU A 85 20.007 -14.078 -4.620 1.00 70.52 H new ATOM 0 HD23 LEU A 85 18.353 -14.702 -4.819 1.00 70.52 H new ATOM 1299 N LEU A 86 21.098 -13.081 -9.443 1.00 71.15 N ATOM 1300 CA LEU A 86 22.092 -12.940 -10.494 1.00 11.31 C ATOM 1301 C LEU A 86 22.770 -11.574 -10.368 1.00 53.20 C ATOM 1302 O LEU A 86 23.995 -11.479 -10.412 1.00 3.44 O ATOM 1303 CB LEU A 86 21.461 -13.189 -11.865 1.00 63.24 C ATOM 1304 CG LEU A 86 20.667 -12.025 -12.460 1.00 43.45 C ATOM 1305 CD1 LEU A 86 21.603 -10.963 -13.041 1.00 3.32 C ATOM 1306 CD2 LEU A 86 19.655 -12.523 -13.494 1.00 12.42 C ATOM 0 H LEU A 86 20.137 -13.167 -9.774 1.00 71.15 H new ATOM 0 HA LEU A 86 22.871 -13.695 -10.386 1.00 11.31 H new ATOM 0 HB2 LEU A 86 22.253 -13.457 -12.564 1.00 63.24 H new ATOM 0 HB3 LEU A 86 20.799 -14.052 -11.787 1.00 63.24 H new ATOM 0 HG LEU A 86 20.101 -11.552 -11.657 1.00 43.45 H new ATOM 0 HD11 LEU A 86 21.013 -10.147 -13.458 1.00 3.32 H new ATOM 0 HD12 LEU A 86 22.250 -10.578 -12.253 1.00 3.32 H new ATOM 0 HD13 LEU A 86 22.214 -11.407 -13.827 1.00 3.32 H new ATOM 0 HD21 LEU A 86 19.104 -11.675 -13.901 1.00 12.42 H new ATOM 0 HD22 LEU A 86 20.180 -13.035 -14.300 1.00 12.42 H new ATOM 0 HD23 LEU A 86 18.959 -13.214 -13.018 1.00 12.42 H new ATOM 1318 N GLU A 87 21.943 -10.550 -10.214 1.00 75.34 N ATOM 1319 CA GLU A 87 22.447 -9.194 -10.082 1.00 13.11 C ATOM 1320 C GLU A 87 23.471 -9.117 -8.948 1.00 43.23 C ATOM 1321 O GLU A 87 24.438 -8.361 -9.031 1.00 63.21 O ATOM 1322 CB GLU A 87 21.303 -8.204 -9.855 1.00 52.53 C ATOM 1323 CG GLU A 87 20.303 -8.247 -11.013 1.00 11.44 C ATOM 1324 CD GLU A 87 20.844 -7.499 -12.233 1.00 22.11 C ATOM 1325 OE1 GLU A 87 21.556 -6.495 -12.080 1.00 32.23 O ATOM 1326 OE2 GLU A 87 20.502 -7.996 -13.373 1.00 21.50 O ATOM 0 H GLU A 87 20.927 -10.633 -10.178 1.00 75.34 H new ATOM 0 HA GLU A 87 22.943 -8.919 -11.013 1.00 13.11 H new ATOM 0 HB2 GLU A 87 20.793 -8.440 -8.921 1.00 52.53 H new ATOM 0 HB3 GLU A 87 21.704 -7.196 -9.754 1.00 52.53 H new ATOM 0 HG2 GLU A 87 20.095 -9.283 -11.280 1.00 11.44 H new ATOM 0 HG3 GLU A 87 19.358 -7.803 -10.699 1.00 11.44 H new ATOM 1334 N ALA A 88 23.224 -9.909 -7.915 1.00 64.15 N ATOM 1335 CA ALA A 88 24.113 -9.940 -6.767 1.00 25.14 C ATOM 1336 C ALA A 88 25.186 -11.009 -6.986 1.00 44.52 C ATOM 1337 O ALA A 88 26.246 -10.966 -6.363 1.00 62.32 O ATOM 1338 CB ALA A 88 23.297 -10.186 -5.496 1.00 5.31 C ATOM 0 H ALA A 88 22.421 -10.534 -7.849 1.00 64.15 H new ATOM 0 HA ALA A 88 24.621 -8.983 -6.649 1.00 25.14 H new ATOM 0 HB1 ALA A 88 23.964 -10.209 -4.634 1.00 5.31 H new ATOM 0 HB2 ALA A 88 22.569 -9.384 -5.370 1.00 5.31 H new ATOM 0 HB3 ALA A 88 22.776 -11.140 -5.577 1.00 5.31 H new ATOM 1344 N PHE A 89 24.874 -11.941 -7.874 1.00 24.21 N ATOM 1345 CA PHE A 89 25.799 -13.019 -8.183 1.00 54.14 C ATOM 1346 C PHE A 89 27.038 -12.488 -8.907 1.00 11.34 C ATOM 1347 O PHE A 89 28.149 -12.572 -8.386 1.00 31.43 O ATOM 1348 CB PHE A 89 25.060 -13.990 -9.107 1.00 45.43 C ATOM 1349 CG PHE A 89 25.853 -15.255 -9.442 1.00 44.41 C ATOM 1350 CD1 PHE A 89 26.440 -15.973 -8.447 1.00 53.12 C ATOM 1351 CD2 PHE A 89 25.972 -15.661 -10.735 1.00 12.33 C ATOM 1352 CE1 PHE A 89 27.176 -17.147 -8.758 1.00 35.00 C ATOM 1353 CE2 PHE A 89 26.708 -16.835 -11.045 1.00 54.34 C ATOM 1354 CZ PHE A 89 27.294 -17.553 -10.051 1.00 31.14 C ATOM 0 H PHE A 89 23.994 -11.972 -8.389 1.00 24.21 H new ATOM 0 HA PHE A 89 26.128 -13.502 -7.263 1.00 54.14 H new ATOM 0 HB2 PHE A 89 24.119 -14.277 -8.638 1.00 45.43 H new ATOM 0 HB3 PHE A 89 24.810 -13.474 -10.034 1.00 45.43 H new ATOM 0 HD1 PHE A 89 26.346 -15.650 -7.421 1.00 53.12 H new ATOM 0 HD2 PHE A 89 25.507 -15.091 -11.525 1.00 12.33 H new ATOM 0 HE1 PHE A 89 27.642 -17.717 -7.968 1.00 35.00 H new ATOM 0 HE2 PHE A 89 26.802 -17.158 -12.071 1.00 54.34 H new ATOM 0 HZ PHE A 89 27.853 -18.446 -10.288 1.00 31.14 H new ATOM 1364 N LYS A 90 26.805 -11.952 -10.096 1.00 5.22 N ATOM 1365 CA LYS A 90 27.889 -11.407 -10.896 1.00 1.22 C ATOM 1366 C LYS A 90 28.519 -10.225 -10.156 1.00 52.22 C ATOM 1367 O LYS A 90 29.720 -9.986 -10.269 1.00 41.13 O ATOM 1368 CB LYS A 90 27.395 -11.060 -12.302 1.00 2.02 C ATOM 1369 CG LYS A 90 26.424 -9.879 -12.266 1.00 15.44 C ATOM 1370 CD LYS A 90 25.052 -10.280 -12.813 1.00 1.34 C ATOM 1371 CE LYS A 90 25.050 -10.276 -14.343 1.00 14.15 C ATOM 1372 NZ LYS A 90 26.392 -10.616 -14.864 1.00 4.12 N ATOM 0 H LYS A 90 25.882 -11.883 -10.525 1.00 5.22 H new ATOM 0 HA LYS A 90 28.673 -12.152 -11.033 1.00 1.22 H new ATOM 0 HB2 LYS A 90 28.245 -10.817 -12.940 1.00 2.02 H new ATOM 0 HB3 LYS A 90 26.903 -11.927 -12.743 1.00 2.02 H new ATOM 0 HG2 LYS A 90 26.320 -9.520 -11.242 1.00 15.44 H new ATOM 0 HG3 LYS A 90 26.827 -9.054 -12.854 1.00 15.44 H new ATOM 0 HD2 LYS A 90 24.787 -11.272 -12.448 1.00 1.34 H new ATOM 0 HD3 LYS A 90 24.293 -9.591 -12.443 1.00 1.34 H new ATOM 0 HE2 LYS A 90 24.317 -10.993 -14.713 1.00 14.15 H new ATOM 0 HE3 LYS A 90 24.749 -9.295 -14.710 1.00 14.15 H new ATOM 0 HZ1 LYS A 90 26.381 -10.576 -15.903 1.00 4.12 H new ATOM 0 HZ2 LYS A 90 27.089 -9.936 -14.498 1.00 4.12 H new ATOM 0 HZ3 LYS A 90 26.650 -11.576 -14.558 1.00 4.12 H new ATOM 1385 N VAL A 91 27.679 -9.516 -9.415 1.00 63.44 N ATOM 1386 CA VAL A 91 28.139 -8.365 -8.657 1.00 73.03 C ATOM 1387 C VAL A 91 29.227 -8.807 -7.677 1.00 11.33 C ATOM 1388 O VAL A 91 30.343 -8.290 -7.708 1.00 71.45 O ATOM 1389 CB VAL A 91 26.954 -7.685 -7.969 1.00 35.13 C ATOM 1390 CG1 VAL A 91 27.374 -7.073 -6.631 1.00 41.01 C ATOM 1391 CG2 VAL A 91 26.321 -6.631 -8.880 1.00 2.03 C ATOM 0 H VAL A 91 26.683 -9.717 -9.324 1.00 63.44 H new ATOM 0 HA VAL A 91 28.582 -7.622 -9.320 1.00 73.03 H new ATOM 0 HB VAL A 91 26.202 -8.448 -7.767 1.00 35.13 H new ATOM 0 HG11 VAL A 91 26.513 -6.596 -6.163 1.00 41.01 H new ATOM 0 HG12 VAL A 91 27.755 -7.857 -5.976 1.00 41.01 H new ATOM 0 HG13 VAL A 91 28.153 -6.330 -6.799 1.00 41.01 H new ATOM 0 HG21 VAL A 91 25.481 -6.163 -8.366 1.00 2.03 H new ATOM 0 HG22 VAL A 91 27.063 -5.872 -9.128 1.00 2.03 H new ATOM 0 HG23 VAL A 91 25.968 -7.106 -9.795 1.00 2.03 H new ATOM 1401 N PHE A 92 28.864 -9.757 -6.828 1.00 72.44 N ATOM 1402 CA PHE A 92 29.795 -10.274 -5.840 1.00 62.42 C ATOM 1403 C PHE A 92 31.001 -10.931 -6.515 1.00 24.44 C ATOM 1404 O PHE A 92 32.148 -10.777 -6.142 1.00 34.13 O ATOM 1405 CB PHE A 92 29.044 -11.330 -5.026 1.00 53.42 C ATOM 1406 CG PHE A 92 28.431 -10.795 -3.730 1.00 20.40 C ATOM 1407 CD1 PHE A 92 27.361 -9.958 -3.778 1.00 54.35 C ATOM 1408 CD2 PHE A 92 28.957 -11.158 -2.529 1.00 72.03 C ATOM 1409 CE1 PHE A 92 26.792 -9.462 -2.576 1.00 0.15 C ATOM 1410 CE2 PHE A 92 28.388 -10.662 -1.326 1.00 62.23 C ATOM 1411 CZ PHE A 92 27.318 -9.825 -1.375 1.00 12.52 C ATOM 0 H PHE A 92 27.937 -10.182 -6.804 1.00 72.44 H new ATOM 0 HA PHE A 92 30.161 -9.461 -5.213 1.00 62.42 H new ATOM 0 HB2 PHE A 92 28.252 -11.754 -5.643 1.00 53.42 H new ATOM 0 HB3 PHE A 92 29.729 -12.143 -4.784 1.00 53.42 H new ATOM 0 HD1 PHE A 92 26.943 -9.670 -4.732 1.00 54.35 H new ATOM 0 HD2 PHE A 92 29.807 -11.823 -2.490 1.00 72.03 H new ATOM 0 HE1 PHE A 92 25.942 -8.797 -2.615 1.00 0.15 H new ATOM 0 HE2 PHE A 92 28.805 -10.950 -0.372 1.00 62.23 H new ATOM 0 HZ PHE A 92 26.885 -9.448 -0.460 1.00 12.52 H new ATOM 1421 N ASP A 93 30.717 -11.686 -7.540 1.00 15.12 N ATOM 1422 CA ASP A 93 31.805 -12.377 -8.286 1.00 44.13 C ATOM 1423 C ASP A 93 32.636 -11.353 -9.067 1.00 23.40 C ATOM 1424 O ASP A 93 32.199 -10.961 -10.148 1.00 24.41 O ATOM 1425 CB ASP A 93 31.087 -13.328 -9.244 1.00 53.10 C ATOM 1426 CG ASP A 93 31.793 -14.685 -9.243 1.00 54.33 C ATOM 1427 OD1 ASP A 93 31.543 -15.461 -8.336 1.00 30.23 O ATOM 1428 OD2 ASP A 93 32.571 -14.927 -10.152 1.00 11.23 O ATOM 0 H ASP A 93 29.775 -11.854 -7.894 1.00 15.12 H new ATOM 0 HA ASP A 93 32.490 -12.908 -7.625 1.00 44.13 H new ATOM 0 HB2 ASP A 93 30.046 -13.448 -8.942 1.00 53.10 H new ATOM 0 HB3 ASP A 93 31.081 -12.910 -10.251 1.00 53.10 H new ATOM 1433 N LYS A 94 33.776 -10.948 -8.527 1.00 1.12 N ATOM 1434 CA LYS A 94 34.620 -9.975 -9.201 1.00 35.43 C ATOM 1435 C LYS A 94 35.562 -10.703 -10.161 1.00 64.11 C ATOM 1436 O LYS A 94 35.949 -10.154 -11.192 1.00 23.23 O ATOM 1437 CB LYS A 94 35.342 -9.094 -8.180 1.00 12.12 C ATOM 1438 CG LYS A 94 34.473 -8.865 -6.941 1.00 64.30 C ATOM 1439 CD LYS A 94 33.136 -8.226 -7.319 1.00 72.15 C ATOM 1440 CE LYS A 94 33.172 -6.712 -7.105 1.00 14.31 C ATOM 1441 NZ LYS A 94 33.385 -6.011 -8.391 1.00 5.12 N ATOM 0 H LYS A 94 34.135 -11.276 -7.630 1.00 1.12 H new ATOM 0 HA LYS A 94 34.015 -9.296 -9.801 1.00 35.43 H new ATOM 0 HB2 LYS A 94 36.281 -9.564 -7.888 1.00 12.12 H new ATOM 0 HB3 LYS A 94 35.593 -8.136 -8.634 1.00 12.12 H new ATOM 0 HG2 LYS A 94 34.296 -9.815 -6.436 1.00 64.30 H new ATOM 0 HG3 LYS A 94 35.001 -8.223 -6.236 1.00 64.30 H new ATOM 0 HD2 LYS A 94 32.907 -8.444 -8.362 1.00 72.15 H new ATOM 0 HD3 LYS A 94 32.338 -8.663 -6.719 1.00 72.15 H new ATOM 0 HE2 LYS A 94 32.237 -6.380 -6.654 1.00 14.31 H new ATOM 0 HE3 LYS A 94 33.970 -6.456 -6.408 1.00 14.31 H new ATOM 0 HZ1 LYS A 94 32.829 -5.132 -8.404 1.00 5.12 H new ATOM 0 HZ2 LYS A 94 34.394 -5.784 -8.500 1.00 5.12 H new ATOM 0 HZ3 LYS A 94 33.082 -6.624 -9.175 1.00 5.12 H new ATOM 1454 N ASN A 95 35.905 -11.928 -9.789 1.00 10.40 N ATOM 1455 CA ASN A 95 36.795 -12.736 -10.605 1.00 22.24 C ATOM 1456 C ASN A 95 36.014 -13.313 -11.786 1.00 75.53 C ATOM 1457 O ASN A 95 36.485 -13.282 -12.922 1.00 0.11 O ATOM 1458 CB ASN A 95 37.369 -13.905 -9.801 1.00 52.10 C ATOM 1459 CG ASN A 95 37.638 -15.111 -10.703 1.00 43.23 C ATOM 1460 OD1 ASN A 95 37.324 -16.244 -10.379 1.00 21.13 O ATOM 1461 ND2 ASN A 95 38.236 -14.805 -11.851 1.00 42.31 N ATOM 0 H ASN A 95 35.582 -12.380 -8.933 1.00 10.40 H new ATOM 0 HA ASN A 95 37.610 -12.099 -10.948 1.00 22.24 H new ATOM 0 HB2 ASN A 95 38.294 -13.597 -9.314 1.00 52.10 H new ATOM 0 HB3 ASN A 95 36.672 -14.185 -9.011 1.00 52.10 H new ATOM 0 HD21 ASN A 95 38.459 -15.540 -12.522 1.00 42.31 H new ATOM 0 HD22 ASN A 95 38.472 -13.835 -12.060 1.00 42.31 H new ATOM 1468 N GLY A 96 34.832 -13.828 -11.478 1.00 52.55 N ATOM 1469 CA GLY A 96 33.980 -14.411 -12.501 1.00 62.10 C ATOM 1470 C GLY A 96 34.315 -15.889 -12.716 1.00 12.44 C ATOM 1471 O GLY A 96 34.982 -16.243 -13.686 1.00 74.15 O ATOM 0 H GLY A 96 34.445 -13.854 -10.535 1.00 52.55 H new ATOM 0 HA2 GLY A 96 32.935 -14.310 -12.210 1.00 62.10 H new ATOM 0 HA3 GLY A 96 34.104 -13.866 -13.437 1.00 62.10 H new ATOM 1475 N ASP A 97 33.836 -16.711 -11.793 1.00 43.33 N ATOM 1476 CA ASP A 97 34.076 -18.142 -11.869 1.00 43.23 C ATOM 1477 C ASP A 97 32.798 -18.890 -11.486 1.00 10.02 C ATOM 1478 O ASP A 97 32.819 -20.105 -11.293 1.00 45.33 O ATOM 1479 CB ASP A 97 35.182 -18.567 -10.901 1.00 34.12 C ATOM 1480 CG ASP A 97 34.694 -19.263 -9.629 1.00 21.53 C ATOM 1481 OD1 ASP A 97 33.846 -18.733 -8.895 1.00 61.54 O ATOM 1482 OD2 ASP A 97 35.229 -20.414 -9.398 1.00 23.31 O ATOM 0 H ASP A 97 33.283 -16.413 -10.989 1.00 43.33 H new ATOM 0 HA ASP A 97 34.379 -18.380 -12.889 1.00 43.23 H new ATOM 0 HB2 ASP A 97 35.865 -19.236 -11.424 1.00 34.12 H new ATOM 0 HB3 ASP A 97 35.755 -17.684 -10.617 1.00 34.12 H new ATOM 1488 N GLY A 98 31.715 -18.133 -11.386 1.00 71.44 N ATOM 1489 CA GLY A 98 30.430 -18.710 -11.029 1.00 53.33 C ATOM 1490 C GLY A 98 30.420 -19.166 -9.569 1.00 62.51 C ATOM 1491 O GLY A 98 29.575 -19.967 -9.171 1.00 2.43 O ATOM 0 H GLY A 98 31.701 -17.126 -11.546 1.00 71.44 H new ATOM 0 HA2 GLY A 98 29.641 -17.976 -11.190 1.00 53.33 H new ATOM 0 HA3 GLY A 98 30.215 -19.557 -11.680 1.00 53.33 H new ATOM 1495 N LEU A 99 31.370 -18.638 -8.811 1.00 72.30 N ATOM 1496 CA LEU A 99 31.481 -18.982 -7.404 1.00 5.24 C ATOM 1497 C LEU A 99 32.062 -17.792 -6.637 1.00 41.41 C ATOM 1498 O LEU A 99 33.235 -17.457 -6.798 1.00 72.43 O ATOM 1499 CB LEU A 99 32.281 -20.275 -7.229 1.00 50.43 C ATOM 1500 CG LEU A 99 32.087 -21.335 -8.315 1.00 53.12 C ATOM 1501 CD1 LEU A 99 33.259 -22.318 -8.338 1.00 11.32 C ATOM 1502 CD2 LEU A 99 30.743 -22.049 -8.150 1.00 44.45 C ATOM 0 H LEU A 99 32.069 -17.975 -9.145 1.00 72.30 H new ATOM 0 HA LEU A 99 30.496 -19.184 -6.983 1.00 5.24 H new ATOM 0 HB2 LEU A 99 33.340 -20.020 -7.182 1.00 50.43 H new ATOM 0 HB3 LEU A 99 32.016 -20.715 -6.268 1.00 50.43 H new ATOM 0 HG LEU A 99 32.069 -20.833 -9.283 1.00 53.12 H new ATOM 0 HD11 LEU A 99 33.096 -23.061 -9.119 1.00 11.32 H new ATOM 0 HD12 LEU A 99 34.184 -21.777 -8.539 1.00 11.32 H new ATOM 0 HD13 LEU A 99 33.334 -22.818 -7.372 1.00 11.32 H new ATOM 0 HD21 LEU A 99 30.630 -22.797 -8.934 1.00 44.45 H new ATOM 0 HD22 LEU A 99 30.707 -22.536 -7.176 1.00 44.45 H new ATOM 0 HD23 LEU A 99 29.934 -21.322 -8.222 1.00 44.45 H new ATOM 1514 N ILE A 100 31.214 -17.185 -5.820 1.00 3.43 N ATOM 1515 CA ILE A 100 31.629 -16.039 -5.028 1.00 15.11 C ATOM 1516 C ILE A 100 32.502 -16.516 -3.866 1.00 63.32 C ATOM 1517 O ILE A 100 31.995 -17.055 -2.884 1.00 11.13 O ATOM 1518 CB ILE A 100 30.411 -15.224 -4.587 1.00 40.21 C ATOM 1519 CG1 ILE A 100 29.711 -14.589 -5.791 1.00 21.33 C ATOM 1520 CG2 ILE A 100 30.800 -14.183 -3.536 1.00 13.35 C ATOM 1521 CD1 ILE A 100 28.281 -14.176 -5.438 1.00 72.11 C ATOM 0 H ILE A 100 30.242 -17.465 -5.689 1.00 3.43 H new ATOM 0 HA ILE A 100 32.238 -15.362 -5.628 1.00 15.11 H new ATOM 0 HB ILE A 100 29.697 -15.902 -4.120 1.00 40.21 H new ATOM 0 HG12 ILE A 100 30.273 -13.717 -6.125 1.00 21.33 H new ATOM 0 HG13 ILE A 100 29.695 -15.295 -6.621 1.00 21.33 H new ATOM 0 HG21 ILE A 100 29.917 -13.617 -3.240 1.00 13.35 H new ATOM 0 HG22 ILE A 100 31.219 -14.685 -2.664 1.00 13.35 H new ATOM 0 HG23 ILE A 100 31.542 -13.503 -3.954 1.00 13.35 H new ATOM 0 HD11 ILE A 100 27.806 -13.728 -6.311 1.00 72.11 H new ATOM 0 HD12 ILE A 100 27.715 -15.054 -5.128 1.00 72.11 H new ATOM 0 HD13 ILE A 100 28.302 -13.452 -4.624 1.00 72.11 H new ATOM 1533 N SER A 101 33.801 -16.301 -4.017 1.00 71.43 N ATOM 1534 CA SER A 101 34.750 -16.703 -2.993 1.00 21.00 C ATOM 1535 C SER A 101 34.593 -15.815 -1.757 1.00 32.21 C ATOM 1536 O SER A 101 33.818 -14.860 -1.769 1.00 5.41 O ATOM 1537 CB SER A 101 36.186 -16.635 -3.516 1.00 22.21 C ATOM 1538 OG SER A 101 37.132 -17.054 -2.535 1.00 52.24 O ATOM 0 H SER A 101 34.218 -15.854 -4.833 1.00 71.43 H new ATOM 0 HA SER A 101 34.540 -17.737 -2.719 1.00 21.00 H new ATOM 0 HB2 SER A 101 36.279 -17.264 -4.402 1.00 22.21 H new ATOM 0 HB3 SER A 101 36.412 -15.614 -3.824 1.00 22.21 H new ATOM 0 HG SER A 101 38.037 -16.998 -2.908 1.00 52.24 H new ATOM 1544 N ALA A 102 35.340 -16.163 -0.719 1.00 50.43 N ATOM 1545 CA ALA A 102 35.293 -15.409 0.522 1.00 23.12 C ATOM 1546 C ALA A 102 35.362 -13.913 0.209 1.00 74.22 C ATOM 1547 O ALA A 102 34.375 -13.196 0.367 1.00 33.43 O ATOM 1548 CB ALA A 102 36.430 -15.865 1.439 1.00 31.23 C ATOM 0 H ALA A 102 35.981 -16.957 -0.712 1.00 50.43 H new ATOM 0 HA ALA A 102 34.356 -15.593 1.047 1.00 23.12 H new ATOM 0 HB1 ALA A 102 36.395 -15.300 2.370 1.00 31.23 H new ATOM 0 HB2 ALA A 102 36.319 -16.928 1.655 1.00 31.23 H new ATOM 0 HB3 ALA A 102 37.387 -15.693 0.946 1.00 31.23 H new ATOM 1554 N ALA A 103 36.536 -13.486 -0.230 1.00 64.24 N ATOM 1555 CA ALA A 103 36.746 -12.088 -0.568 1.00 25.55 C ATOM 1556 C ALA A 103 35.511 -11.552 -1.294 1.00 21.34 C ATOM 1557 O ALA A 103 34.800 -10.698 -0.768 1.00 14.23 O ATOM 1558 CB ALA A 103 38.020 -11.951 -1.404 1.00 41.21 C ATOM 0 H ALA A 103 37.353 -14.083 -0.360 1.00 64.24 H new ATOM 0 HA ALA A 103 36.882 -11.491 0.334 1.00 25.55 H new ATOM 0 HB1 ALA A 103 38.178 -10.903 -1.658 1.00 41.21 H new ATOM 0 HB2 ALA A 103 38.872 -12.318 -0.832 1.00 41.21 H new ATOM 0 HB3 ALA A 103 37.919 -12.535 -2.319 1.00 41.21 H new ATOM 1564 N GLU A 104 35.294 -12.076 -2.491 1.00 30.30 N ATOM 1565 CA GLU A 104 34.157 -11.661 -3.295 1.00 31.03 C ATOM 1566 C GLU A 104 32.937 -11.420 -2.404 1.00 33.14 C ATOM 1567 O GLU A 104 32.075 -10.607 -2.732 1.00 54.42 O ATOM 1568 CB GLU A 104 33.847 -12.693 -4.381 1.00 42.20 C ATOM 1569 CG GLU A 104 35.001 -12.801 -5.380 1.00 3.22 C ATOM 1570 CD GLU A 104 34.894 -14.085 -6.205 1.00 10.30 C ATOM 1571 OE1 GLU A 104 33.823 -14.380 -6.755 1.00 72.14 O ATOM 1572 OE2 GLU A 104 35.975 -14.786 -6.265 1.00 32.42 O ATOM 0 H GLU A 104 35.886 -12.785 -2.924 1.00 30.30 H new ATOM 0 HA GLU A 104 34.411 -10.725 -3.792 1.00 31.03 H new ATOM 0 HB2 GLU A 104 33.666 -13.665 -3.923 1.00 42.20 H new ATOM 0 HB3 GLU A 104 32.933 -12.412 -4.904 1.00 42.20 H new ATOM 0 HG2 GLU A 104 34.994 -11.936 -6.044 1.00 3.22 H new ATOM 0 HG3 GLU A 104 35.951 -12.786 -4.846 1.00 3.22 H new ATOM 1580 N LEU A 105 32.903 -12.142 -1.293 1.00 71.12 N ATOM 1581 CA LEU A 105 31.803 -12.017 -0.352 1.00 73.04 C ATOM 1582 C LEU A 105 32.176 -11.003 0.731 1.00 65.40 C ATOM 1583 O LEU A 105 31.647 -9.894 0.757 1.00 52.50 O ATOM 1584 CB LEU A 105 31.410 -13.389 0.199 1.00 61.35 C ATOM 1585 CG LEU A 105 29.953 -13.544 0.637 1.00 34.14 C ATOM 1586 CD1 LEU A 105 29.352 -14.844 0.097 1.00 4.43 C ATOM 1587 CD2 LEU A 105 29.824 -13.442 2.159 1.00 62.24 C ATOM 0 H LEU A 105 33.620 -12.816 -1.024 1.00 71.12 H new ATOM 0 HA LEU A 105 30.914 -11.635 -0.854 1.00 73.04 H new ATOM 0 HB2 LEU A 105 31.621 -14.139 -0.564 1.00 61.35 H new ATOM 0 HB3 LEU A 105 32.051 -13.613 1.052 1.00 61.35 H new ATOM 0 HG LEU A 105 29.379 -12.722 0.209 1.00 34.14 H new ATOM 0 HD11 LEU A 105 28.316 -14.929 0.423 1.00 4.43 H new ATOM 0 HD12 LEU A 105 29.390 -14.837 -0.992 1.00 4.43 H new ATOM 0 HD13 LEU A 105 29.922 -15.693 0.475 1.00 4.43 H new ATOM 0 HD21 LEU A 105 28.778 -13.556 2.444 1.00 62.24 H new ATOM 0 HD22 LEU A 105 30.415 -14.229 2.628 1.00 62.24 H new ATOM 0 HD23 LEU A 105 30.187 -12.469 2.491 1.00 62.24 H new ATOM 1599 N LYS A 106 33.086 -11.421 1.599 1.00 62.32 N ATOM 1600 CA LYS A 106 33.537 -10.564 2.682 1.00 41.33 C ATOM 1601 C LYS A 106 33.872 -9.179 2.124 1.00 14.31 C ATOM 1602 O LYS A 106 33.332 -8.174 2.584 1.00 2.51 O ATOM 1603 CB LYS A 106 34.695 -11.219 3.437 1.00 2.31 C ATOM 1604 CG LYS A 106 35.890 -11.454 2.511 1.00 4.03 C ATOM 1605 CD LYS A 106 36.984 -12.256 3.220 1.00 12.44 C ATOM 1606 CE LYS A 106 38.165 -11.359 3.596 1.00 42.15 C ATOM 1607 NZ LYS A 106 39.267 -11.518 2.620 1.00 53.32 N ATOM 0 H LYS A 106 33.523 -12.342 1.574 1.00 62.32 H new ATOM 0 HA LYS A 106 32.744 -10.429 3.417 1.00 41.33 H new ATOM 0 HB2 LYS A 106 34.996 -10.584 4.271 1.00 2.31 H new ATOM 0 HB3 LYS A 106 34.367 -12.168 3.861 1.00 2.31 H new ATOM 0 HG2 LYS A 106 35.564 -11.988 1.618 1.00 4.03 H new ATOM 0 HG3 LYS A 106 36.292 -10.496 2.181 1.00 4.03 H new ATOM 0 HD2 LYS A 106 36.576 -12.721 4.117 1.00 12.44 H new ATOM 0 HD3 LYS A 106 37.327 -13.062 2.572 1.00 12.44 H new ATOM 0 HE2 LYS A 106 37.844 -10.318 3.625 1.00 42.15 H new ATOM 0 HE3 LYS A 106 38.517 -11.612 4.596 1.00 42.15 H new ATOM 0 HZ1 LYS A 106 40.061 -10.903 2.889 1.00 53.32 H new ATOM 0 HZ2 LYS A 106 39.584 -12.509 2.613 1.00 53.32 H new ATOM 0 HZ3 LYS A 106 38.931 -11.255 1.671 1.00 53.32 H new ATOM 1620 N HIS A 107 34.760 -9.170 1.141 1.00 31.51 N ATOM 1621 CA HIS A 107 35.173 -7.925 0.516 1.00 73.51 C ATOM 1622 C HIS A 107 33.938 -7.093 0.166 1.00 52.30 C ATOM 1623 O HIS A 107 33.938 -5.874 0.336 1.00 74.54 O ATOM 1624 CB HIS A 107 36.068 -8.196 -0.695 1.00 32.40 C ATOM 1625 CG HIS A 107 35.492 -7.714 -2.005 1.00 13.22 C ATOM 1626 ND1 HIS A 107 34.327 -8.035 -2.638 1.00 31.35 N flip ATOM 1627 CD2 HIS A 107 36.135 -6.792 -2.813 1.00 44.05 C flip ATOM 1628 CE1 HIS A 107 34.262 -7.346 -3.771 1.00 22.30 C flip ATOM 1629 NE2 HIS A 107 35.382 -6.575 -3.881 1.00 41.10 N flip ATOM 0 H HIS A 107 35.205 -10.006 0.762 1.00 31.51 H new ATOM 0 HA HIS A 107 35.774 -7.344 1.216 1.00 73.51 H new ATOM 0 HB2 HIS A 107 37.033 -7.715 -0.535 1.00 32.40 H new ATOM 0 HB3 HIS A 107 36.254 -9.268 -0.764 1.00 32.40 H new ATOM 0 HD2 HIS A 107 37.089 -6.328 -2.608 1.00 44.05 H new ATOM 0 HE1 HIS A 107 33.455 -7.389 -4.488 1.00 22.30 H new ATOM 0 HE2 HIS A 107 35.601 -5.942 -4.651 1.00 41.10 H new ATOM 1637 N VAL A 108 32.915 -7.783 -0.316 1.00 62.52 N ATOM 1638 CA VAL A 108 31.677 -7.123 -0.692 1.00 35.14 C ATOM 1639 C VAL A 108 31.002 -6.563 0.562 1.00 32.33 C ATOM 1640 O VAL A 108 30.620 -5.395 0.597 1.00 53.43 O ATOM 1641 CB VAL A 108 30.783 -8.091 -1.470 1.00 52.41 C ATOM 1642 CG1 VAL A 108 29.306 -7.848 -1.154 1.00 13.51 C ATOM 1643 CG2 VAL A 108 31.045 -7.990 -2.974 1.00 65.20 C ATOM 0 H VAL A 108 32.918 -8.794 -0.455 1.00 62.52 H new ATOM 0 HA VAL A 108 31.879 -6.283 -1.356 1.00 35.14 H new ATOM 0 HB VAL A 108 31.031 -9.104 -1.153 1.00 52.41 H new ATOM 0 HG11 VAL A 108 28.693 -8.549 -1.720 1.00 13.51 H new ATOM 0 HG12 VAL A 108 29.133 -7.994 -0.088 1.00 13.51 H new ATOM 0 HG13 VAL A 108 29.038 -6.828 -1.429 1.00 13.51 H new ATOM 0 HG21 VAL A 108 30.397 -8.688 -3.504 1.00 65.20 H new ATOM 0 HG22 VAL A 108 30.838 -6.975 -3.312 1.00 65.20 H new ATOM 0 HG23 VAL A 108 32.087 -8.235 -3.179 1.00 65.20 H new ATOM 1653 N LEU A 109 30.876 -7.424 1.562 1.00 52.22 N ATOM 1654 CA LEU A 109 30.254 -7.030 2.815 1.00 51.24 C ATOM 1655 C LEU A 109 30.987 -5.813 3.383 1.00 63.23 C ATOM 1656 O LEU A 109 30.370 -4.939 3.988 1.00 12.43 O ATOM 1657 CB LEU A 109 30.192 -8.216 3.779 1.00 63.34 C ATOM 1658 CG LEU A 109 28.922 -9.067 3.715 1.00 61.01 C ATOM 1659 CD1 LEU A 109 27.711 -8.283 4.225 1.00 23.42 C ATOM 1660 CD2 LEU A 109 28.698 -9.613 2.303 1.00 21.14 C ATOM 0 H LEU A 109 31.194 -8.393 1.530 1.00 52.22 H new ATOM 0 HA LEU A 109 29.219 -6.730 2.649 1.00 51.24 H new ATOM 0 HB2 LEU A 109 31.048 -8.862 3.585 1.00 63.34 H new ATOM 0 HB3 LEU A 109 30.302 -7.838 4.796 1.00 63.34 H new ATOM 0 HG LEU A 109 29.052 -9.925 4.375 1.00 61.01 H new ATOM 0 HD11 LEU A 109 26.821 -8.910 4.169 1.00 23.42 H new ATOM 0 HD12 LEU A 109 27.880 -7.985 5.260 1.00 23.42 H new ATOM 0 HD13 LEU A 109 27.568 -7.394 3.610 1.00 23.42 H new ATOM 0 HD21 LEU A 109 27.789 -10.214 2.285 1.00 21.14 H new ATOM 0 HD22 LEU A 109 28.598 -8.783 1.604 1.00 21.14 H new ATOM 0 HD23 LEU A 109 29.548 -10.231 2.013 1.00 21.14 H new ATOM 1672 N THR A 110 32.294 -5.797 3.167 1.00 5.52 N ATOM 1673 CA THR A 110 33.119 -4.702 3.650 1.00 13.33 C ATOM 1674 C THR A 110 33.014 -3.500 2.709 1.00 11.13 C ATOM 1675 O THR A 110 33.374 -2.384 3.080 1.00 54.52 O ATOM 1676 CB THR A 110 34.548 -5.222 3.814 1.00 31.41 C ATOM 1677 OG1 THR A 110 34.431 -6.258 4.786 1.00 11.32 O ATOM 1678 CG2 THR A 110 35.473 -4.197 4.472 1.00 42.42 C ATOM 0 H THR A 110 32.802 -6.524 2.664 1.00 5.52 H new ATOM 0 HA THR A 110 32.774 -4.346 4.621 1.00 13.33 H new ATOM 0 HB THR A 110 34.948 -5.497 2.838 1.00 31.41 H new ATOM 0 HG1 THR A 110 34.138 -7.085 4.349 1.00 11.32 H new ATOM 0 HG21 THR A 110 36.475 -4.617 4.564 1.00 42.42 H new ATOM 0 HG22 THR A 110 35.512 -3.296 3.859 1.00 42.42 H new ATOM 0 HG23 THR A 110 35.092 -3.946 5.462 1.00 42.42 H new ATOM 1686 N SER A 111 32.520 -3.769 1.510 1.00 73.41 N ATOM 1687 CA SER A 111 32.363 -2.724 0.513 1.00 70.11 C ATOM 1688 C SER A 111 31.055 -1.967 0.750 1.00 53.04 C ATOM 1689 O SER A 111 30.747 -1.014 0.036 1.00 41.41 O ATOM 1690 CB SER A 111 32.392 -3.304 -0.902 1.00 72.35 C ATOM 1691 OG SER A 111 33.439 -2.742 -1.689 1.00 15.41 O ATOM 0 H SER A 111 32.223 -4.696 1.206 1.00 73.41 H new ATOM 0 HA SER A 111 33.199 -2.031 0.609 1.00 70.11 H new ATOM 0 HB2 SER A 111 32.520 -4.385 -0.848 1.00 72.35 H new ATOM 0 HB3 SER A 111 31.434 -3.120 -1.389 1.00 72.35 H new ATOM 0 HG SER A 111 33.066 -2.074 -2.302 1.00 15.41 H new ATOM 1697 N ILE A 112 30.320 -2.420 1.754 1.00 34.14 N ATOM 1698 CA ILE A 112 29.051 -1.797 2.094 1.00 25.43 C ATOM 1699 C ILE A 112 29.147 -1.187 3.494 1.00 41.42 C ATOM 1700 O ILE A 112 28.540 -0.152 3.766 1.00 4.31 O ATOM 1701 CB ILE A 112 27.904 -2.798 1.937 1.00 43.52 C ATOM 1702 CG1 ILE A 112 28.064 -3.972 2.904 1.00 65.41 C ATOM 1703 CG2 ILE A 112 27.778 -3.263 0.485 1.00 64.31 C ATOM 1704 CD1 ILE A 112 26.702 -4.538 3.310 1.00 61.34 C ATOM 0 H ILE A 112 30.578 -3.211 2.344 1.00 34.14 H new ATOM 0 HA ILE A 112 28.829 -0.982 1.405 1.00 25.43 H new ATOM 0 HB ILE A 112 26.973 -2.294 2.196 1.00 43.52 H new ATOM 0 HG12 ILE A 112 28.662 -4.754 2.436 1.00 65.41 H new ATOM 0 HG13 ILE A 112 28.605 -3.645 3.792 1.00 65.41 H new ATOM 0 HG21 ILE A 112 26.956 -3.974 0.401 1.00 64.31 H new ATOM 0 HG22 ILE A 112 27.582 -2.404 -0.157 1.00 64.31 H new ATOM 0 HG23 ILE A 112 28.706 -3.743 0.175 1.00 64.31 H new ATOM 0 HD11 ILE A 112 26.845 -5.372 3.998 1.00 61.34 H new ATOM 0 HD12 ILE A 112 26.116 -3.760 3.799 1.00 61.34 H new ATOM 0 HD13 ILE A 112 26.174 -4.886 2.423 1.00 61.34 H new ATOM 1716 N GLY A 113 29.914 -1.853 4.344 1.00 34.05 N ATOM 1717 CA GLY A 113 30.096 -1.389 5.709 1.00 4.31 C ATOM 1718 C GLY A 113 30.431 -2.553 6.644 1.00 12.42 C ATOM 1719 O GLY A 113 31.258 -2.413 7.544 1.00 61.03 O ATOM 0 H GLY A 113 30.417 -2.710 4.114 1.00 34.05 H new ATOM 0 HA2 GLY A 113 30.896 -0.650 5.742 1.00 4.31 H new ATOM 0 HA3 GLY A 113 29.189 -0.892 6.052 1.00 4.31 H new ATOM 1723 N GLU A 114 29.770 -3.675 6.400 1.00 44.13 N ATOM 1724 CA GLU A 114 29.987 -4.862 7.209 1.00 61.34 C ATOM 1725 C GLU A 114 31.484 -5.147 7.343 1.00 4.11 C ATOM 1726 O GLU A 114 32.306 -4.475 6.721 1.00 72.20 O ATOM 1727 CB GLU A 114 29.251 -6.068 6.621 1.00 15.24 C ATOM 1728 CG GLU A 114 27.789 -6.091 7.073 1.00 10.24 C ATOM 1729 CD GLU A 114 27.625 -6.905 8.358 1.00 22.51 C ATOM 1730 OE1 GLU A 114 26.998 -6.431 9.317 1.00 30.40 O ATOM 1731 OE2 GLU A 114 28.176 -8.072 8.338 1.00 4.43 O ATOM 0 H GLU A 114 29.084 -3.787 5.654 1.00 44.13 H new ATOM 0 HA GLU A 114 29.581 -4.679 8.204 1.00 61.34 H new ATOM 0 HB2 GLU A 114 29.299 -6.032 5.533 1.00 15.24 H new ATOM 0 HB3 GLU A 114 29.746 -6.988 6.932 1.00 15.24 H new ATOM 0 HG2 GLU A 114 27.439 -5.072 7.237 1.00 10.24 H new ATOM 0 HG3 GLU A 114 27.168 -6.518 6.286 1.00 10.24 H new ATOM 1739 N LYS A 115 31.794 -6.144 8.159 1.00 12.44 N ATOM 1740 CA LYS A 115 33.178 -6.525 8.383 1.00 31.24 C ATOM 1741 C LYS A 115 33.223 -7.926 8.997 1.00 1.15 C ATOM 1742 O LYS A 115 32.916 -8.101 10.175 1.00 35.34 O ATOM 1743 CB LYS A 115 33.898 -5.464 9.218 1.00 31.21 C ATOM 1744 CG LYS A 115 33.007 -4.965 10.357 1.00 15.30 C ATOM 1745 CD LYS A 115 33.763 -3.983 11.255 1.00 74.22 C ATOM 1746 CE LYS A 115 34.460 -4.716 12.403 1.00 54.30 C ATOM 1747 NZ LYS A 115 35.661 -5.427 11.911 1.00 54.12 N ATOM 0 H LYS A 115 31.110 -6.699 8.673 1.00 12.44 H new ATOM 0 HA LYS A 115 33.718 -6.573 7.437 1.00 31.24 H new ATOM 0 HB2 LYS A 115 34.818 -5.881 9.627 1.00 31.21 H new ATOM 0 HB3 LYS A 115 34.183 -4.627 8.581 1.00 31.21 H new ATOM 0 HG2 LYS A 115 32.122 -4.480 9.945 1.00 15.30 H new ATOM 0 HG3 LYS A 115 32.660 -5.812 10.949 1.00 15.30 H new ATOM 0 HD2 LYS A 115 34.501 -3.439 10.665 1.00 74.22 H new ATOM 0 HD3 LYS A 115 33.069 -3.245 11.658 1.00 74.22 H new ATOM 0 HE2 LYS A 115 34.744 -4.004 13.178 1.00 54.30 H new ATOM 0 HE3 LYS A 115 33.771 -5.427 12.860 1.00 54.30 H new ATOM 0 HZ1 LYS A 115 36.356 -5.507 12.680 1.00 54.12 H new ATOM 0 HZ2 LYS A 115 35.393 -6.378 11.586 1.00 54.12 H new ATOM 0 HZ3 LYS A 115 36.079 -4.896 11.120 1.00 54.12 H new ATOM 1760 N LEU A 116 33.609 -8.887 8.171 1.00 20.25 N ATOM 1761 CA LEU A 116 33.699 -10.267 8.619 1.00 55.14 C ATOM 1762 C LEU A 116 35.127 -10.774 8.411 1.00 71.13 C ATOM 1763 O LEU A 116 35.745 -10.495 7.385 1.00 65.12 O ATOM 1764 CB LEU A 116 32.635 -11.124 7.929 1.00 41.34 C ATOM 1765 CG LEU A 116 31.349 -11.364 8.722 1.00 50.22 C ATOM 1766 CD1 LEU A 116 30.522 -10.081 8.826 1.00 34.20 C ATOM 1767 CD2 LEU A 116 30.543 -12.519 8.123 1.00 3.43 C ATOM 0 H LEU A 116 33.863 -8.738 7.194 1.00 20.25 H new ATOM 0 HA LEU A 116 33.488 -10.336 9.686 1.00 55.14 H new ATOM 0 HB2 LEU A 116 32.372 -10.650 6.983 1.00 41.34 H new ATOM 0 HB3 LEU A 116 33.076 -12.091 7.689 1.00 41.34 H new ATOM 0 HG LEU A 116 31.622 -11.654 9.737 1.00 50.22 H new ATOM 0 HD11 LEU A 116 29.613 -10.279 9.394 1.00 34.20 H new ATOM 0 HD12 LEU A 116 31.106 -9.312 9.331 1.00 34.20 H new ATOM 0 HD13 LEU A 116 30.257 -9.737 7.826 1.00 34.20 H new ATOM 0 HD21 LEU A 116 29.634 -12.669 8.705 1.00 3.43 H new ATOM 0 HD22 LEU A 116 30.279 -12.282 7.092 1.00 3.43 H new ATOM 0 HD23 LEU A 116 31.142 -13.430 8.144 1.00 3.43 H new ATOM 1779 N THR A 117 35.609 -11.510 9.401 1.00 62.50 N ATOM 1780 CA THR A 117 36.953 -12.059 9.340 1.00 63.34 C ATOM 1781 C THR A 117 36.999 -13.253 8.384 1.00 35.54 C ATOM 1782 O THR A 117 35.974 -13.881 8.121 1.00 61.24 O ATOM 1783 CB THR A 117 37.388 -12.405 10.765 1.00 5.42 C ATOM 1784 OG1 THR A 117 36.668 -13.596 11.069 1.00 2.11 O ATOM 1785 CG2 THR A 117 36.883 -11.391 11.794 1.00 53.24 C ATOM 0 H THR A 117 35.093 -11.739 10.250 1.00 62.50 H new ATOM 0 HA THR A 117 37.658 -11.332 8.937 1.00 63.34 H new ATOM 0 HB THR A 117 38.476 -12.456 10.810 1.00 5.42 H new ATOM 0 HG1 THR A 117 36.892 -13.891 11.976 1.00 2.11 H new ATOM 0 HG21 THR A 117 37.220 -11.684 12.789 1.00 53.24 H new ATOM 0 HG22 THR A 117 37.276 -10.403 11.554 1.00 53.24 H new ATOM 0 HG23 THR A 117 35.794 -11.363 11.773 1.00 53.24 H new ATOM 1793 N ASP A 118 38.197 -13.531 7.892 1.00 33.50 N ATOM 1794 CA ASP A 118 38.389 -14.639 6.972 1.00 60.33 C ATOM 1795 C ASP A 118 37.847 -15.922 7.605 1.00 70.54 C ATOM 1796 O ASP A 118 37.512 -16.873 6.900 1.00 53.04 O ATOM 1797 CB ASP A 118 39.873 -14.852 6.669 1.00 65.23 C ATOM 1798 CG ASP A 118 40.207 -16.168 5.963 1.00 41.03 C ATOM 1799 OD1 ASP A 118 40.491 -17.186 6.611 1.00 74.43 O ATOM 1800 OD2 ASP A 118 40.167 -16.121 4.674 1.00 4.41 O ATOM 0 H ASP A 118 39.044 -13.008 8.113 1.00 33.50 H new ATOM 0 HA ASP A 118 37.862 -14.404 6.047 1.00 60.33 H new ATOM 0 HB2 ASP A 118 40.224 -14.026 6.050 1.00 65.23 H new ATOM 0 HB3 ASP A 118 40.429 -14.808 7.605 1.00 65.23 H new ATOM 1806 N ALA A 119 37.778 -15.908 8.928 1.00 71.34 N ATOM 1807 CA ALA A 119 37.282 -17.059 9.664 1.00 62.05 C ATOM 1808 C ALA A 119 35.756 -16.992 9.739 1.00 14.54 C ATOM 1809 O ALA A 119 35.091 -18.019 9.864 1.00 13.24 O ATOM 1810 CB ALA A 119 37.934 -17.099 11.047 1.00 35.44 C ATOM 0 H ALA A 119 38.057 -15.118 9.510 1.00 71.34 H new ATOM 0 HA ALA A 119 37.545 -17.985 9.153 1.00 62.05 H new ATOM 0 HB1 ALA A 119 37.562 -17.962 11.600 1.00 35.44 H new ATOM 0 HB2 ALA A 119 39.016 -17.177 10.937 1.00 35.44 H new ATOM 0 HB3 ALA A 119 37.689 -16.187 11.591 1.00 35.44 H new ATOM 1816 N GLU A 120 35.244 -15.772 9.660 1.00 5.25 N ATOM 1817 CA GLU A 120 33.809 -15.557 9.719 1.00 54.24 C ATOM 1818 C GLU A 120 33.170 -15.871 8.364 1.00 34.24 C ATOM 1819 O GLU A 120 32.200 -16.624 8.292 1.00 73.24 O ATOM 1820 CB GLU A 120 33.486 -14.128 10.159 1.00 55.43 C ATOM 1821 CG GLU A 120 33.373 -14.035 11.682 1.00 74.13 C ATOM 1822 CD GLU A 120 33.588 -12.598 12.161 1.00 31.22 C ATOM 1823 OE1 GLU A 120 34.135 -12.384 13.253 1.00 24.41 O ATOM 1824 OE2 GLU A 120 33.165 -11.685 11.354 1.00 14.04 O ATOM 0 H GLU A 120 35.798 -14.922 9.556 1.00 5.25 H new ATOM 0 HA GLU A 120 33.390 -16.234 10.463 1.00 54.24 H new ATOM 0 HB2 GLU A 120 34.264 -13.451 9.807 1.00 55.43 H new ATOM 0 HB3 GLU A 120 32.551 -13.805 9.701 1.00 55.43 H new ATOM 0 HG2 GLU A 120 32.391 -14.385 11.999 1.00 74.13 H new ATOM 0 HG3 GLU A 120 34.110 -14.691 12.146 1.00 74.13 H new ATOM 1832 N VAL A 121 33.739 -15.278 7.325 1.00 21.44 N ATOM 1833 CA VAL A 121 33.237 -15.486 5.978 1.00 41.24 C ATOM 1834 C VAL A 121 33.473 -16.941 5.569 1.00 73.23 C ATOM 1835 O VAL A 121 32.552 -17.619 5.115 1.00 61.02 O ATOM 1836 CB VAL A 121 33.883 -14.483 5.019 1.00 74.43 C ATOM 1837 CG1 VAL A 121 35.167 -15.053 4.413 1.00 2.25 C ATOM 1838 CG2 VAL A 121 32.901 -14.062 3.924 1.00 54.50 C ATOM 0 H VAL A 121 34.543 -14.653 7.389 1.00 21.44 H new ATOM 0 HA VAL A 121 32.162 -15.308 5.939 1.00 41.24 H new ATOM 0 HB VAL A 121 34.148 -13.594 5.592 1.00 74.43 H new ATOM 0 HG11 VAL A 121 35.606 -14.321 3.736 1.00 2.25 H new ATOM 0 HG12 VAL A 121 35.875 -15.281 5.210 1.00 2.25 H new ATOM 0 HG13 VAL A 121 34.936 -15.964 3.862 1.00 2.25 H new ATOM 0 HG21 VAL A 121 33.385 -13.349 3.256 1.00 54.50 H new ATOM 0 HG22 VAL A 121 32.591 -14.939 3.356 1.00 54.50 H new ATOM 0 HG23 VAL A 121 32.026 -13.597 4.379 1.00 54.50 H new ATOM 1848 N ASP A 122 34.711 -17.379 5.744 1.00 11.32 N ATOM 1849 CA ASP A 122 35.079 -18.741 5.399 1.00 22.31 C ATOM 1850 C ASP A 122 34.071 -19.710 6.020 1.00 23.33 C ATOM 1851 O ASP A 122 33.883 -20.819 5.523 1.00 64.51 O ATOM 1852 CB ASP A 122 36.467 -19.091 5.941 1.00 53.22 C ATOM 1853 CG ASP A 122 36.868 -20.559 5.791 1.00 65.44 C ATOM 1854 OD1 ASP A 122 36.750 -21.354 6.735 1.00 3.34 O ATOM 1855 OD2 ASP A 122 37.326 -20.883 4.629 1.00 61.32 O ATOM 0 H ASP A 122 35.472 -16.814 6.120 1.00 11.32 H new ATOM 0 HA ASP A 122 35.085 -18.824 4.312 1.00 22.31 H new ATOM 0 HB2 ASP A 122 37.206 -18.474 5.430 1.00 53.22 H new ATOM 0 HB3 ASP A 122 36.506 -18.826 6.997 1.00 53.22 H new ATOM 1861 N ASP A 123 33.449 -19.256 7.098 1.00 23.35 N ATOM 1862 CA ASP A 123 32.465 -20.069 7.793 1.00 63.21 C ATOM 1863 C ASP A 123 31.077 -19.786 7.215 1.00 21.03 C ATOM 1864 O ASP A 123 30.255 -20.693 7.093 1.00 11.31 O ATOM 1865 CB ASP A 123 32.433 -19.738 9.286 1.00 34.32 C ATOM 1866 CG ASP A 123 31.135 -20.115 10.004 1.00 71.22 C ATOM 1867 OD1 ASP A 123 30.071 -19.533 9.746 1.00 34.34 O ATOM 1868 OD2 ASP A 123 31.247 -21.063 10.872 1.00 4.41 O ATOM 0 H ASP A 123 33.607 -18.335 7.507 1.00 23.35 H new ATOM 0 HA ASP A 123 32.739 -21.116 7.662 1.00 63.21 H new ATOM 0 HB2 ASP A 123 33.262 -20.250 9.774 1.00 34.32 H new ATOM 0 HB3 ASP A 123 32.601 -18.668 9.409 1.00 34.32 H new ATOM 1874 N MET A 124 30.859 -18.524 6.876 1.00 72.25 N ATOM 1875 CA MET A 124 29.584 -18.110 6.314 1.00 63.12 C ATOM 1876 C MET A 124 29.248 -18.922 5.061 1.00 13.41 C ATOM 1877 O MET A 124 28.088 -19.261 4.830 1.00 41.53 O ATOM 1878 CB MET A 124 29.642 -16.623 5.959 1.00 74.01 C ATOM 1879 CG MET A 124 28.348 -16.171 5.279 1.00 74.43 C ATOM 1880 SD MET A 124 27.333 -15.268 6.436 1.00 12.22 S ATOM 1881 CE MET A 124 28.492 -14.010 6.949 1.00 75.54 C ATOM 0 H MET A 124 31.543 -17.775 6.979 1.00 72.25 H new ATOM 0 HA MET A 124 28.806 -18.285 7.057 1.00 63.12 H new ATOM 0 HB2 MET A 124 29.807 -16.036 6.862 1.00 74.01 H new ATOM 0 HB3 MET A 124 30.489 -16.436 5.299 1.00 74.01 H new ATOM 0 HG2 MET A 124 28.580 -15.543 4.419 1.00 74.43 H new ATOM 0 HG3 MET A 124 27.803 -17.037 4.904 1.00 74.43 H new ATOM 0 HE1 MET A 124 27.953 -13.091 7.180 1.00 75.54 H new ATOM 0 HE2 MET A 124 29.028 -14.349 7.836 1.00 75.54 H new ATOM 0 HE3 MET A 124 29.203 -13.821 6.145 1.00 75.54 H new ATOM 1891 N LEU A 125 30.283 -19.210 4.286 1.00 54.43 N ATOM 1892 CA LEU A 125 30.111 -19.975 3.062 1.00 3.24 C ATOM 1893 C LEU A 125 29.626 -21.383 3.411 1.00 63.51 C ATOM 1894 O LEU A 125 28.602 -21.835 2.901 1.00 12.13 O ATOM 1895 CB LEU A 125 31.397 -19.955 2.233 1.00 11.42 C ATOM 1896 CG LEU A 125 31.982 -18.572 1.937 1.00 61.35 C ATOM 1897 CD1 LEU A 125 33.487 -18.659 1.674 1.00 12.34 C ATOM 1898 CD2 LEU A 125 31.237 -17.898 0.783 1.00 1.40 C ATOM 0 H LEU A 125 31.243 -18.928 4.481 1.00 54.43 H new ATOM 0 HA LEU A 125 29.346 -19.521 2.432 1.00 3.24 H new ATOM 0 HB2 LEU A 125 32.152 -20.543 2.755 1.00 11.42 H new ATOM 0 HB3 LEU A 125 31.203 -20.456 1.285 1.00 11.42 H new ATOM 0 HG LEU A 125 31.844 -17.946 2.819 1.00 61.35 H new ATOM 0 HD11 LEU A 125 33.878 -17.663 1.466 1.00 12.34 H new ATOM 0 HD12 LEU A 125 33.987 -19.069 2.552 1.00 12.34 H new ATOM 0 HD13 LEU A 125 33.670 -19.307 0.817 1.00 12.34 H new ATOM 0 HD21 LEU A 125 31.672 -16.917 0.593 1.00 1.40 H new ATOM 0 HD22 LEU A 125 31.322 -18.513 -0.113 1.00 1.40 H new ATOM 0 HD23 LEU A 125 30.185 -17.784 1.046 1.00 1.40 H new ATOM 1910 N ARG A 126 30.385 -22.039 4.277 1.00 44.32 N ATOM 1911 CA ARG A 126 30.046 -23.387 4.699 1.00 11.13 C ATOM 1912 C ARG A 126 28.529 -23.536 4.829 1.00 33.14 C ATOM 1913 O ARG A 126 27.986 -24.616 4.602 1.00 71.23 O ATOM 1914 CB ARG A 126 30.701 -23.725 6.040 1.00 65.54 C ATOM 1915 CG ARG A 126 32.226 -23.643 5.941 1.00 61.25 C ATOM 1916 CD ARG A 126 32.881 -23.961 7.286 1.00 31.23 C ATOM 1917 NE ARG A 126 34.238 -24.510 7.071 1.00 23.44 N ATOM 1918 CZ ARG A 126 34.859 -25.350 7.927 1.00 61.54 C ATOM 1919 NH1 ARG A 126 34.248 -25.746 9.064 1.00 51.44 N ATOM 1920 NH2 ARG A 126 36.073 -25.780 7.635 1.00 53.45 N ATOM 0 H ARG A 126 31.234 -21.661 4.698 1.00 44.32 H new ATOM 0 HA ARG A 126 30.419 -24.076 3.941 1.00 11.13 H new ATOM 0 HB2 ARG A 126 30.345 -23.037 6.806 1.00 65.54 H new ATOM 0 HB3 ARG A 126 30.406 -24.727 6.350 1.00 65.54 H new ATOM 0 HG2 ARG A 126 32.583 -24.342 5.185 1.00 61.25 H new ATOM 0 HG3 ARG A 126 32.520 -22.645 5.617 1.00 61.25 H new ATOM 0 HD2 ARG A 126 32.937 -23.059 7.895 1.00 31.23 H new ATOM 0 HD3 ARG A 126 32.272 -24.679 7.836 1.00 31.23 H new ATOM 0 HE ARG A 126 34.736 -24.237 6.223 1.00 23.44 H new ATOM 0 HH11 ARG A 126 33.310 -25.411 9.282 1.00 51.44 H new ATOM 0 HH12 ARG A 126 34.725 -26.381 9.705 1.00 51.44 H new ATOM 0 HH21 ARG A 126 36.528 -25.477 6.774 1.00 53.45 H new ATOM 0 HH22 ARG A 126 36.556 -26.415 8.271 1.00 53.45 H new ATOM 1933 N GLU A 127 27.887 -22.436 5.195 1.00 61.10 N ATOM 1934 CA GLU A 127 26.443 -22.431 5.358 1.00 62.10 C ATOM 1935 C GLU A 127 25.775 -23.165 4.194 1.00 60.23 C ATOM 1936 O GLU A 127 24.937 -24.040 4.406 1.00 31.10 O ATOM 1937 CB GLU A 127 25.911 -21.002 5.483 1.00 34.33 C ATOM 1938 CG GLU A 127 26.488 -20.308 6.719 1.00 73.43 C ATOM 1939 CD GLU A 127 25.976 -20.962 8.004 1.00 55.31 C ATOM 1940 OE1 GLU A 127 26.770 -21.254 8.910 1.00 61.11 O ATOM 1941 OE2 GLU A 127 24.702 -21.163 8.043 1.00 70.40 O ATOM 0 H GLU A 127 28.340 -21.542 5.383 1.00 61.10 H new ATOM 0 HA GLU A 127 26.199 -22.957 6.281 1.00 62.10 H new ATOM 0 HB2 GLU A 127 26.169 -20.434 4.589 1.00 34.33 H new ATOM 0 HB3 GLU A 127 24.823 -21.019 5.546 1.00 34.33 H new ATOM 0 HG2 GLU A 127 27.577 -20.355 6.692 1.00 73.43 H new ATOM 0 HG3 GLU A 127 26.214 -19.253 6.709 1.00 73.43 H new ATOM 1949 N VAL A 128 26.171 -22.782 2.989 1.00 41.01 N ATOM 1950 CA VAL A 128 25.621 -23.393 1.791 1.00 40.13 C ATOM 1951 C VAL A 128 26.763 -23.771 0.846 1.00 44.02 C ATOM 1952 O VAL A 128 26.529 -24.106 -0.314 1.00 40.34 O ATOM 1953 CB VAL A 128 24.598 -22.454 1.147 1.00 64.30 C ATOM 1954 CG1 VAL A 128 23.448 -22.153 2.110 1.00 24.10 C ATOM 1955 CG2 VAL A 128 25.265 -21.163 0.668 1.00 71.23 C ATOM 0 H VAL A 128 26.866 -22.056 2.817 1.00 41.01 H new ATOM 0 HA VAL A 128 25.088 -24.311 2.041 1.00 40.13 H new ATOM 0 HB VAL A 128 24.181 -22.959 0.276 1.00 64.30 H new ATOM 0 HG11 VAL A 128 22.735 -21.484 1.628 1.00 24.10 H new ATOM 0 HG12 VAL A 128 22.947 -23.083 2.380 1.00 24.10 H new ATOM 0 HG13 VAL A 128 23.841 -21.678 3.009 1.00 24.10 H new ATOM 0 HG21 VAL A 128 24.516 -20.513 0.214 1.00 71.23 H new ATOM 0 HG22 VAL A 128 25.722 -20.653 1.516 1.00 71.23 H new ATOM 0 HG23 VAL A 128 26.032 -21.402 -0.068 1.00 71.23 H new ATOM 1965 N SER A 129 27.975 -23.705 1.378 1.00 41.14 N ATOM 1966 CA SER A 129 29.154 -24.036 0.596 1.00 24.11 C ATOM 1967 C SER A 129 29.590 -25.473 0.890 1.00 4.11 C ATOM 1968 O SER A 129 30.628 -25.922 0.406 1.00 70.14 O ATOM 1969 CB SER A 129 30.299 -23.064 0.888 1.00 42.14 C ATOM 1970 OG SER A 129 31.139 -23.529 1.941 1.00 0.40 O ATOM 0 H SER A 129 28.166 -23.427 2.341 1.00 41.14 H new ATOM 0 HA SER A 129 28.900 -23.949 -0.460 1.00 24.11 H new ATOM 0 HB2 SER A 129 30.894 -22.923 -0.015 1.00 42.14 H new ATOM 0 HB3 SER A 129 29.889 -22.090 1.155 1.00 42.14 H new ATOM 0 HG SER A 129 31.858 -22.882 2.096 1.00 0.40 H new ATOM 1976 N ASP A 130 28.776 -26.154 1.683 1.00 71.15 N ATOM 1977 CA ASP A 130 29.064 -27.531 2.047 1.00 44.21 C ATOM 1978 C ASP A 130 30.563 -27.679 2.318 1.00 11.33 C ATOM 1979 O ASP A 130 31.157 -28.706 1.996 1.00 63.21 O ATOM 1980 CB ASP A 130 28.692 -28.490 0.914 1.00 1.25 C ATOM 1981 CG ASP A 130 28.744 -29.974 1.281 1.00 62.31 C ATOM 1982 OD1 ASP A 130 27.885 -30.481 2.018 1.00 4.43 O ATOM 1983 OD2 ASP A 130 29.731 -30.628 0.769 1.00 63.03 O ATOM 0 H ASP A 130 27.917 -25.778 2.084 1.00 71.15 H new ATOM 0 HA ASP A 130 28.478 -27.775 2.933 1.00 44.21 H new ATOM 0 HB2 ASP A 130 27.685 -28.251 0.571 1.00 1.25 H new ATOM 0 HB3 ASP A 130 29.365 -28.315 0.074 1.00 1.25 H new ATOM 1989 N GLY A 131 31.131 -26.637 2.908 1.00 35.13 N ATOM 1990 CA GLY A 131 32.548 -26.638 3.227 1.00 63.13 C ATOM 1991 C GLY A 131 33.396 -26.704 1.955 1.00 51.44 C ATOM 1992 O GLY A 131 34.339 -27.489 1.873 1.00 43.33 O ATOM 0 H GLY A 131 30.635 -25.786 3.173 1.00 35.13 H new ATOM 0 HA2 GLY A 131 32.799 -25.738 3.789 1.00 63.13 H new ATOM 0 HA3 GLY A 131 32.780 -27.489 3.867 1.00 63.13 H new ATOM 1996 N SER A 132 33.029 -25.868 0.994 1.00 61.43 N ATOM 1997 CA SER A 132 33.744 -25.822 -0.270 1.00 40.54 C ATOM 1998 C SER A 132 34.753 -24.671 -0.259 1.00 32.22 C ATOM 1999 O SER A 132 35.958 -24.899 -0.166 1.00 41.43 O ATOM 2000 CB SER A 132 32.776 -25.667 -1.445 1.00 41.21 C ATOM 2001 OG SER A 132 32.326 -26.927 -1.936 1.00 3.13 O ATOM 0 H SER A 132 32.246 -25.218 1.066 1.00 61.43 H new ATOM 0 HA SER A 132 34.278 -26.764 -0.395 1.00 40.54 H new ATOM 0 HB2 SER A 132 31.918 -25.073 -1.132 1.00 41.21 H new ATOM 0 HB3 SER A 132 33.267 -25.119 -2.249 1.00 41.21 H new ATOM 0 HG SER A 132 31.709 -26.785 -2.684 1.00 3.13 H new ATOM 2007 N GLY A 133 34.223 -23.461 -0.354 1.00 14.30 N ATOM 2008 CA GLY A 133 35.062 -22.274 -0.356 1.00 35.34 C ATOM 2009 C GLY A 133 34.428 -21.156 -1.186 1.00 22.10 C ATOM 2010 O GLY A 133 34.818 -19.995 -1.070 1.00 71.22 O ATOM 0 H GLY A 133 33.223 -23.276 -0.430 1.00 14.30 H new ATOM 0 HA2 GLY A 133 35.215 -21.930 0.667 1.00 35.34 H new ATOM 0 HA3 GLY A 133 36.044 -22.519 -0.760 1.00 35.34 H new ATOM 2014 N GLU A 134 33.462 -21.545 -2.005 1.00 63.20 N ATOM 2015 CA GLU A 134 32.771 -20.590 -2.854 1.00 62.15 C ATOM 2016 C GLU A 134 31.283 -20.936 -2.941 1.00 3.23 C ATOM 2017 O GLU A 134 30.862 -21.999 -2.488 1.00 62.33 O ATOM 2018 CB GLU A 134 33.403 -20.537 -4.247 1.00 3.13 C ATOM 2019 CG GLU A 134 34.918 -20.345 -4.154 1.00 44.11 C ATOM 2020 CD GLU A 134 35.569 -20.440 -5.536 1.00 15.41 C ATOM 2021 OE1 GLU A 134 35.981 -21.532 -5.953 1.00 71.04 O ATOM 2022 OE2 GLU A 134 35.637 -19.326 -6.184 1.00 21.23 O ATOM 0 H GLU A 134 33.142 -22.509 -2.099 1.00 63.20 H new ATOM 0 HA GLU A 134 32.869 -19.600 -2.408 1.00 62.15 H new ATOM 0 HB2 GLU A 134 33.182 -21.458 -4.786 1.00 3.13 H new ATOM 0 HB3 GLU A 134 32.964 -19.720 -4.819 1.00 3.13 H new ATOM 0 HG2 GLU A 134 35.139 -19.374 -3.710 1.00 44.11 H new ATOM 0 HG3 GLU A 134 35.344 -21.101 -3.495 1.00 44.11 H new ATOM 2030 N ILE A 135 30.528 -20.017 -3.525 1.00 31.23 N ATOM 2031 CA ILE A 135 29.096 -20.212 -3.676 1.00 51.50 C ATOM 2032 C ILE A 135 28.666 -19.740 -5.066 1.00 53.24 C ATOM 2033 O ILE A 135 29.009 -18.635 -5.485 1.00 32.22 O ATOM 2034 CB ILE A 135 28.339 -19.530 -2.534 1.00 61.30 C ATOM 2035 CG1 ILE A 135 28.781 -18.074 -2.375 1.00 62.12 C ATOM 2036 CG2 ILE A 135 28.486 -20.319 -1.231 1.00 61.34 C ATOM 2037 CD1 ILE A 135 28.229 -17.471 -1.082 1.00 30.52 C ATOM 0 H ILE A 135 30.881 -19.136 -3.899 1.00 31.23 H new ATOM 0 HA ILE A 135 28.846 -21.271 -3.606 1.00 51.50 H new ATOM 0 HB ILE A 135 27.279 -19.519 -2.786 1.00 61.30 H new ATOM 0 HG12 ILE A 135 29.870 -18.019 -2.370 1.00 62.12 H new ATOM 0 HG13 ILE A 135 28.436 -17.490 -3.229 1.00 62.12 H new ATOM 0 HG21 ILE A 135 27.939 -19.813 -0.436 1.00 61.34 H new ATOM 0 HG22 ILE A 135 28.084 -21.323 -1.366 1.00 61.34 H new ATOM 0 HG23 ILE A 135 29.540 -20.384 -0.962 1.00 61.34 H new ATOM 0 HD11 ILE A 135 28.558 -16.436 -0.994 1.00 30.52 H new ATOM 0 HD12 ILE A 135 27.140 -17.505 -1.101 1.00 30.52 H new ATOM 0 HD13 ILE A 135 28.595 -18.042 -0.229 1.00 30.52 H new ATOM 2049 N ASN A 136 27.921 -20.601 -5.744 1.00 54.31 N ATOM 2050 CA ASN A 136 27.440 -20.286 -7.079 1.00 10.13 C ATOM 2051 C ASN A 136 26.040 -19.677 -6.981 1.00 52.23 C ATOM 2052 O ASN A 136 25.542 -19.428 -5.884 1.00 70.43 O ATOM 2053 CB ASN A 136 27.349 -21.545 -7.942 1.00 74.35 C ATOM 2054 CG ASN A 136 27.681 -22.796 -7.126 1.00 0.33 C ATOM 2055 OD1 ASN A 136 28.810 -23.023 -6.723 1.00 32.45 O ATOM 2056 ND2 ASN A 136 26.638 -23.591 -6.905 1.00 50.22 N ATOM 0 H ASN A 136 27.639 -21.516 -5.394 1.00 54.31 H new ATOM 0 HA ASN A 136 28.141 -19.587 -7.534 1.00 10.13 H new ATOM 0 HB2 ASN A 136 26.345 -21.633 -8.357 1.00 74.35 H new ATOM 0 HB3 ASN A 136 28.036 -21.463 -8.784 1.00 74.35 H new ATOM 0 HD21 ASN A 136 26.757 -24.451 -6.369 1.00 50.22 H new ATOM 0 HD22 ASN A 136 25.720 -23.341 -7.271 1.00 50.22 H new ATOM 2063 N ILE A 137 25.444 -19.454 -8.144 1.00 2.24 N ATOM 2064 CA ILE A 137 24.111 -18.879 -8.203 1.00 42.52 C ATOM 2065 C ILE A 137 23.140 -19.771 -7.427 1.00 42.33 C ATOM 2066 O ILE A 137 22.038 -19.345 -7.085 1.00 43.51 O ATOM 2067 CB ILE A 137 23.697 -18.636 -9.656 1.00 33.21 C ATOM 2068 CG1 ILE A 137 22.426 -17.788 -9.729 1.00 53.51 C ATOM 2069 CG2 ILE A 137 23.547 -19.958 -10.411 1.00 65.33 C ATOM 2070 CD1 ILE A 137 22.655 -16.402 -9.121 1.00 24.50 C ATOM 0 H ILE A 137 25.860 -19.661 -9.052 1.00 2.24 H new ATOM 0 HA ILE A 137 24.096 -17.900 -7.724 1.00 42.52 H new ATOM 0 HB ILE A 137 24.490 -18.072 -10.147 1.00 33.21 H new ATOM 0 HG12 ILE A 137 22.112 -17.686 -10.768 1.00 53.51 H new ATOM 0 HG13 ILE A 137 21.617 -18.292 -9.200 1.00 53.51 H new ATOM 0 HG21 ILE A 137 23.252 -19.757 -11.441 1.00 65.33 H new ATOM 0 HG22 ILE A 137 24.497 -20.491 -10.403 1.00 65.33 H new ATOM 0 HG23 ILE A 137 22.784 -20.568 -9.928 1.00 65.33 H new ATOM 0 HD11 ILE A 137 21.736 -15.820 -9.186 1.00 24.50 H new ATOM 0 HD12 ILE A 137 22.945 -16.507 -8.076 1.00 24.50 H new ATOM 0 HD13 ILE A 137 23.447 -15.891 -9.668 1.00 24.50 H new ATOM 2082 N GLN A 138 23.584 -20.993 -7.172 1.00 45.43 N ATOM 2083 CA GLN A 138 22.769 -21.949 -6.443 1.00 54.41 C ATOM 2084 C GLN A 138 23.040 -21.842 -4.941 1.00 44.12 C ATOM 2085 O GLN A 138 22.109 -21.746 -4.144 1.00 20.05 O ATOM 2086 CB GLN A 138 23.013 -23.373 -6.945 1.00 21.24 C ATOM 2087 CG GLN A 138 23.045 -23.418 -8.474 1.00 35.43 C ATOM 2088 CD GLN A 138 21.643 -23.230 -9.057 1.00 35.13 C ATOM 2089 OE1 GLN A 138 21.236 -21.964 -9.090 1.00 41.11 O flip ATOM 2090 NE2 GLN A 138 20.974 -24.172 -9.450 1.00 61.21 N flip ATOM 0 H GLN A 138 24.499 -21.343 -7.458 1.00 45.43 H new ATOM 0 HA GLN A 138 21.720 -21.712 -6.620 1.00 54.41 H new ATOM 0 HB2 GLN A 138 23.957 -23.746 -6.547 1.00 21.24 H new ATOM 0 HB3 GLN A 138 22.228 -24.032 -6.575 1.00 21.24 H new ATOM 0 HG2 GLN A 138 23.707 -22.638 -8.851 1.00 35.43 H new ATOM 0 HG3 GLN A 138 23.456 -24.372 -8.805 1.00 35.43 H new ATOM 0 HE21 GLN A 138 21.347 -25.120 -9.396 1.00 61.21 H new ATOM 0 HE22 GLN A 138 20.042 -24.011 -9.832 1.00 61.21 H new ATOM 2099 N GLN A 139 24.321 -21.862 -4.601 1.00 73.01 N ATOM 2100 CA GLN A 139 24.727 -21.769 -3.209 1.00 52.31 C ATOM 2101 C GLN A 139 24.465 -20.360 -2.673 1.00 15.11 C ATOM 2102 O GLN A 139 23.752 -20.191 -1.685 1.00 12.32 O ATOM 2103 CB GLN A 139 26.198 -22.155 -3.040 1.00 14.41 C ATOM 2104 CG GLN A 139 26.431 -23.614 -3.436 1.00 74.01 C ATOM 2105 CD GLN A 139 27.924 -23.908 -3.593 1.00 11.14 C ATOM 2106 OE1 GLN A 139 28.684 -23.364 -2.647 1.00 71.12 O flip ATOM 2107 NE2 GLN A 139 28.357 -24.584 -4.511 1.00 45.40 N flip ATOM 0 H GLN A 139 25.091 -21.941 -5.266 1.00 73.01 H new ATOM 0 HA GLN A 139 24.131 -22.474 -2.629 1.00 52.31 H new ATOM 0 HB2 GLN A 139 26.821 -21.504 -3.653 1.00 14.41 H new ATOM 0 HB3 GLN A 139 26.501 -22.003 -2.004 1.00 14.41 H new ATOM 0 HG2 GLN A 139 26.005 -24.272 -2.679 1.00 74.01 H new ATOM 0 HG3 GLN A 139 25.914 -23.827 -4.372 1.00 74.01 H new ATOM 0 HE21 GLN A 139 27.717 -24.972 -5.204 1.00 45.40 H new ATOM 0 HE22 GLN A 139 29.359 -24.761 -4.586 1.00 45.40 H new ATOM 2116 N PHE A 140 25.055 -19.385 -3.348 1.00 52.23 N ATOM 2117 CA PHE A 140 24.894 -17.996 -2.952 1.00 72.12 C ATOM 2118 C PHE A 140 23.436 -17.692 -2.599 1.00 45.01 C ATOM 2119 O PHE A 140 23.156 -17.112 -1.551 1.00 50.45 O ATOM 2120 CB PHE A 140 25.305 -17.139 -4.151 1.00 4.45 C ATOM 2121 CG PHE A 140 24.921 -15.663 -4.022 1.00 35.45 C ATOM 2122 CD1 PHE A 140 25.310 -14.952 -2.930 1.00 5.20 C ATOM 2123 CD2 PHE A 140 24.188 -15.064 -4.998 1.00 45.32 C ATOM 2124 CE1 PHE A 140 24.953 -13.583 -2.810 1.00 43.23 C ATOM 2125 CE2 PHE A 140 23.831 -13.695 -4.878 1.00 42.44 C ATOM 2126 CZ PHE A 140 24.221 -12.983 -3.787 1.00 22.01 C ATOM 0 H PHE A 140 25.646 -19.529 -4.167 1.00 52.23 H new ATOM 0 HA PHE A 140 25.504 -17.786 -2.073 1.00 72.12 H new ATOM 0 HB2 PHE A 140 26.384 -17.213 -4.284 1.00 4.45 H new ATOM 0 HB3 PHE A 140 24.844 -17.546 -5.051 1.00 4.45 H new ATOM 0 HD1 PHE A 140 25.891 -15.429 -2.154 1.00 5.20 H new ATOM 0 HD2 PHE A 140 23.877 -15.629 -5.864 1.00 45.32 H new ATOM 0 HE1 PHE A 140 25.263 -13.018 -1.943 1.00 43.23 H new ATOM 0 HE2 PHE A 140 23.249 -13.219 -5.654 1.00 42.44 H new ATOM 0 HZ PHE A 140 23.950 -11.942 -3.696 1.00 22.01 H new ATOM 2136 N ALA A 141 22.547 -18.098 -3.494 1.00 2.34 N ATOM 2137 CA ALA A 141 21.126 -17.876 -3.290 1.00 12.24 C ATOM 2138 C ALA A 141 20.674 -18.618 -2.030 1.00 52.31 C ATOM 2139 O ALA A 141 19.764 -18.170 -1.334 1.00 51.43 O ATOM 2140 CB ALA A 141 20.356 -18.319 -4.535 1.00 71.12 C ATOM 0 H ALA A 141 22.784 -18.579 -4.362 1.00 2.34 H new ATOM 0 HA ALA A 141 20.921 -16.816 -3.140 1.00 12.24 H new ATOM 0 HB1 ALA A 141 19.290 -18.152 -4.382 1.00 71.12 H new ATOM 0 HB2 ALA A 141 20.693 -17.742 -5.396 1.00 71.12 H new ATOM 0 HB3 ALA A 141 20.535 -19.379 -4.716 1.00 71.12 H new ATOM 2146 N ALA A 142 21.330 -19.740 -1.775 1.00 45.13 N ATOM 2147 CA ALA A 142 21.008 -20.548 -0.612 1.00 34.22 C ATOM 2148 C ALA A 142 21.103 -19.684 0.647 1.00 45.31 C ATOM 2149 O ALA A 142 20.404 -19.930 1.628 1.00 13.21 O ATOM 2150 CB ALA A 142 21.939 -21.761 -0.558 1.00 73.14 C ATOM 0 H ALA A 142 22.084 -20.109 -2.355 1.00 45.13 H new ATOM 0 HA ALA A 142 19.987 -20.924 -0.678 1.00 34.22 H new ATOM 0 HB1 ALA A 142 21.697 -22.367 0.315 1.00 73.14 H new ATOM 0 HB2 ALA A 142 21.811 -22.358 -1.461 1.00 73.14 H new ATOM 0 HB3 ALA A 142 22.973 -21.423 -0.490 1.00 73.14 H new ATOM 2156 N LEU A 143 21.976 -18.689 0.578 1.00 52.12 N ATOM 2157 CA LEU A 143 22.172 -17.786 1.700 1.00 62.54 C ATOM 2158 C LEU A 143 20.982 -16.830 1.794 1.00 72.02 C ATOM 2159 O LEU A 143 20.429 -16.626 2.873 1.00 11.34 O ATOM 2160 CB LEU A 143 23.523 -17.077 1.587 1.00 63.53 C ATOM 2161 CG LEU A 143 24.745 -17.889 2.022 1.00 21.02 C ATOM 2162 CD1 LEU A 143 25.919 -17.669 1.066 1.00 74.35 C ATOM 2163 CD2 LEU A 143 25.122 -17.578 3.472 1.00 14.21 C ATOM 0 H LEU A 143 22.555 -18.488 -0.237 1.00 52.12 H new ATOM 0 HA LEU A 143 22.208 -18.344 2.636 1.00 62.54 H new ATOM 0 HB2 LEU A 143 23.665 -16.771 0.550 1.00 63.53 H new ATOM 0 HB3 LEU A 143 23.484 -16.167 2.185 1.00 63.53 H new ATOM 0 HG LEU A 143 24.486 -18.947 1.976 1.00 21.02 H new ATOM 0 HD11 LEU A 143 26.774 -18.258 1.398 1.00 74.35 H new ATOM 0 HD12 LEU A 143 25.633 -17.980 0.061 1.00 74.35 H new ATOM 0 HD13 LEU A 143 26.187 -16.613 1.056 1.00 74.35 H new ATOM 0 HD21 LEU A 143 25.993 -18.168 3.756 1.00 14.21 H new ATOM 0 HD22 LEU A 143 25.355 -16.518 3.568 1.00 14.21 H new ATOM 0 HD23 LEU A 143 24.287 -17.826 4.126 1.00 14.21 H new ATOM 2175 N LEU A 144 20.622 -16.269 0.649 1.00 61.35 N ATOM 2176 CA LEU A 144 19.507 -15.339 0.588 1.00 23.32 C ATOM 2177 C LEU A 144 18.194 -16.115 0.708 1.00 62.42 C ATOM 2178 O LEU A 144 17.119 -15.520 0.757 1.00 42.32 O ATOM 2179 CB LEU A 144 19.598 -14.475 -0.671 1.00 3.10 C ATOM 2180 CG LEU A 144 21.001 -14.005 -1.062 1.00 11.42 C ATOM 2181 CD1 LEU A 144 20.942 -13.014 -2.226 1.00 63.35 C ATOM 2182 CD2 LEU A 144 21.742 -13.426 0.146 1.00 74.44 C ATOM 0 H LEU A 144 21.083 -16.441 -0.244 1.00 61.35 H new ATOM 0 HA LEU A 144 19.545 -14.644 1.427 1.00 23.32 H new ATOM 0 HB2 LEU A 144 19.179 -15.038 -1.505 1.00 3.10 H new ATOM 0 HB3 LEU A 144 18.968 -13.597 -0.531 1.00 3.10 H new ATOM 0 HG LEU A 144 21.568 -14.871 -1.404 1.00 11.42 H new ATOM 0 HD11 LEU A 144 21.952 -12.696 -2.484 1.00 63.35 H new ATOM 0 HD12 LEU A 144 20.481 -13.494 -3.089 1.00 63.35 H new ATOM 0 HD13 LEU A 144 20.351 -12.146 -1.935 1.00 63.35 H new ATOM 0 HD21 LEU A 144 22.736 -13.100 -0.159 1.00 74.44 H new ATOM 0 HD22 LEU A 144 21.186 -12.576 0.541 1.00 74.44 H new ATOM 0 HD23 LEU A 144 21.832 -14.190 0.918 1.00 74.44 H new ATOM 2194 N SER A 145 18.325 -17.433 0.751 1.00 33.12 N ATOM 2195 CA SER A 145 17.162 -18.297 0.864 1.00 12.02 C ATOM 2196 C SER A 145 17.291 -19.189 2.100 1.00 32.24 C ATOM 2197 O SER A 145 16.403 -19.991 2.387 1.00 63.31 O ATOM 2198 CB SER A 145 16.987 -19.153 -0.392 1.00 42.41 C ATOM 2199 OG SER A 145 16.020 -20.183 -0.206 1.00 42.33 O ATOM 0 H SER A 145 19.218 -17.923 0.710 1.00 33.12 H new ATOM 0 HA SER A 145 16.278 -17.668 0.968 1.00 12.02 H new ATOM 0 HB2 SER A 145 16.684 -18.518 -1.224 1.00 42.41 H new ATOM 0 HB3 SER A 145 17.944 -19.599 -0.663 1.00 42.41 H new ATOM 0 HG SER A 145 15.754 -20.216 0.737 1.00 42.33 H new ATOM 2205 N LYS A 146 18.403 -19.020 2.800 1.00 42.53 N ATOM 2206 CA LYS A 146 18.660 -19.799 3.999 1.00 71.45 C ATOM 2207 C LYS A 146 20.038 -19.434 4.554 1.00 62.53 C ATOM 2208 O LYS A 146 21.058 -19.704 3.920 1.00 14.33 O ATOM 2209 CB LYS A 146 18.487 -21.293 3.713 1.00 5.34 C ATOM 2210 CG LYS A 146 17.622 -21.959 4.785 1.00 74.05 C ATOM 2211 CD LYS A 146 18.442 -22.269 6.038 1.00 1.12 C ATOM 2212 CE LYS A 146 17.995 -23.587 6.674 1.00 44.02 C ATOM 2213 NZ LYS A 146 17.936 -24.660 5.656 1.00 43.43 N ATOM 0 H LYS A 146 19.137 -18.354 2.559 1.00 42.53 H new ATOM 0 HA LYS A 146 17.931 -19.559 4.773 1.00 71.45 H new ATOM 0 HB2 LYS A 146 18.028 -21.429 2.734 1.00 5.34 H new ATOM 0 HB3 LYS A 146 19.464 -21.776 3.677 1.00 5.34 H new ATOM 0 HG2 LYS A 146 16.790 -21.305 5.044 1.00 74.05 H new ATOM 0 HG3 LYS A 146 17.193 -22.880 4.390 1.00 74.05 H new ATOM 0 HD2 LYS A 146 19.499 -22.326 5.780 1.00 1.12 H new ATOM 0 HD3 LYS A 146 18.333 -21.458 6.758 1.00 1.12 H new ATOM 0 HE2 LYS A 146 18.688 -23.868 7.467 1.00 44.02 H new ATOM 0 HE3 LYS A 146 17.016 -23.461 7.136 1.00 44.02 H new ATOM 0 HZ1 LYS A 146 18.154 -25.574 6.102 1.00 43.43 H new ATOM 0 HZ2 LYS A 146 16.982 -24.695 5.244 1.00 43.43 H new ATOM 0 HZ3 LYS A 146 18.630 -24.466 4.906 1.00 43.43 H new ATOM 2226 N GLY A 147 20.025 -18.827 5.731 1.00 34.21 N ATOM 2227 CA GLY A 147 21.261 -18.423 6.379 1.00 52.42 C ATOM 2228 C GLY A 147 21.444 -19.149 7.713 1.00 62.12 C ATOM 2229 O GLY A 147 20.724 -20.101 8.009 1.00 11.05 O ATOM 0 H GLY A 147 19.177 -18.605 6.253 1.00 34.21 H new ATOM 0 HA2 GLY A 147 22.106 -18.638 5.725 1.00 52.42 H new ATOM 0 HA3 GLY A 147 21.253 -17.346 6.545 1.00 52.42 H new ATOM 2233 N SER A 148 22.412 -18.672 8.482 1.00 63.45 N ATOM 2234 CA SER A 148 22.700 -19.265 9.777 1.00 55.40 C ATOM 2235 C SER A 148 21.801 -18.642 10.848 1.00 72.54 C ATOM 2236 O SER A 148 21.952 -17.469 11.185 1.00 75.14 O ATOM 2237 CB SER A 148 24.172 -19.085 10.150 1.00 3.23 C ATOM 2238 OG SER A 148 24.978 -18.786 9.014 1.00 45.11 O ATOM 0 H SER A 148 23.007 -17.882 8.233 1.00 63.45 H new ATOM 0 HA SER A 148 22.497 -20.334 9.717 1.00 55.40 H new ATOM 0 HB2 SER A 148 24.265 -18.283 10.882 1.00 3.23 H new ATOM 0 HB3 SER A 148 24.539 -19.994 10.626 1.00 3.23 H new ATOM 0 HG SER A 148 25.924 -18.819 9.266 1.00 45.11 H new ATOM 2244 N SER A 149 20.886 -19.457 11.352 1.00 14.44 N ATOM 2245 CA SER A 149 19.962 -19.001 12.378 1.00 45.11 C ATOM 2246 C SER A 149 19.526 -17.563 12.088 1.00 61.42 C ATOM 2247 O SER A 149 19.669 -16.684 12.936 1.00 34.32 O ATOM 2248 CB SER A 149 20.594 -19.093 13.768 1.00 24.42 C ATOM 2249 OG SER A 149 19.643 -18.860 14.803 1.00 5.45 O ATOM 0 H SER A 149 20.764 -20.430 11.070 1.00 14.44 H new ATOM 0 HA SER A 149 19.086 -19.650 12.362 1.00 45.11 H new ATOM 0 HB2 SER A 149 21.039 -20.079 13.900 1.00 24.42 H new ATOM 0 HB3 SER A 149 21.402 -18.366 13.848 1.00 24.42 H new ATOM 0 HG SER A 149 19.258 -17.965 14.698 1.00 5.45 H new ATOM 2255 N THR A 150 19.003 -17.369 10.886 1.00 1.11 N ATOM 2256 CA THR A 150 18.545 -16.053 10.473 1.00 31.24 C ATOM 2257 C THR A 150 17.157 -15.767 11.050 1.00 51.24 C ATOM 2258 O THR A 150 16.161 -16.318 10.583 1.00 42.44 O ATOM 2259 CB THR A 150 18.593 -15.994 8.945 1.00 15.23 C ATOM 2260 OG1 THR A 150 17.525 -16.842 8.532 1.00 61.35 O ATOM 2261 CG2 THR A 150 19.844 -16.662 8.372 1.00 74.50 C ATOM 0 H THR A 150 18.886 -18.101 10.185 1.00 1.11 H new ATOM 0 HA THR A 150 19.192 -15.268 10.863 1.00 31.24 H new ATOM 0 HB THR A 150 18.557 -14.954 8.620 1.00 15.23 H new ATOM 0 HG1 THR A 150 17.003 -17.115 9.315 1.00 61.35 H new ATOM 0 HG21 THR A 150 19.828 -16.592 7.284 1.00 74.50 H new ATOM 0 HG22 THR A 150 20.732 -16.160 8.755 1.00 74.50 H new ATOM 0 HG23 THR A 150 19.864 -17.711 8.668 1.00 74.50 H new ATOM 2269 N GLY A 151 17.135 -14.906 12.056 1.00 4.42 N ATOM 2270 CA GLY A 151 15.886 -14.539 12.701 1.00 30.43 C ATOM 2271 C GLY A 151 15.584 -13.052 12.507 1.00 73.23 C ATOM 2272 O GLY A 151 14.779 -12.685 11.652 1.00 61.43 O ATOM 0 H GLY A 151 17.963 -14.451 12.441 1.00 4.42 H new ATOM 0 HA2 GLY A 151 15.072 -15.136 12.290 1.00 30.43 H new ATOM 0 HA3 GLY A 151 15.942 -14.766 13.766 1.00 30.43 H new ATOM 2276 N THR A 453 16.245 -12.236 13.314 1.00 20.11 N ATOM 2277 CA THR A 453 16.057 -10.797 13.241 1.00 22.04 C ATOM 2278 C THR A 453 17.410 -10.083 13.216 1.00 22.33 C ATOM 2279 O THR A 453 17.469 -8.855 13.256 1.00 21.32 O ATOM 2280 CB THR A 453 15.170 -10.376 14.415 1.00 72.24 C ATOM 2281 OG1 THR A 453 15.883 -10.819 15.566 1.00 61.42 O ATOM 2282 CG2 THR A 453 13.856 -11.159 14.466 1.00 64.42 C ATOM 0 H THR A 453 16.912 -12.544 14.022 1.00 20.11 H new ATOM 0 HA THR A 453 15.556 -10.510 12.316 1.00 22.04 H new ATOM 0 HB THR A 453 14.955 -9.310 14.343 1.00 72.24 H new ATOM 0 HG1 THR A 453 15.379 -10.585 16.373 1.00 61.42 H new ATOM 0 HG21 THR A 453 13.264 -10.822 15.317 1.00 64.42 H new ATOM 0 HG22 THR A 453 13.297 -10.991 13.546 1.00 64.42 H new ATOM 0 HG23 THR A 453 14.070 -12.223 14.572 1.00 64.42 H new ATOM 2290 N ARG A 454 18.464 -10.883 13.150 1.00 21.43 N ATOM 2291 CA ARG A 454 19.813 -10.344 13.119 1.00 12.44 C ATOM 2292 C ARG A 454 20.574 -10.885 11.907 1.00 33.15 C ATOM 2293 O ARG A 454 20.960 -10.124 11.022 1.00 42.01 O ATOM 2294 CB ARG A 454 20.578 -10.701 14.395 1.00 44.21 C ATOM 2295 CG ARG A 454 19.825 -10.225 15.638 1.00 14.24 C ATOM 2296 CD ARG A 454 19.895 -8.702 15.773 1.00 73.24 C ATOM 2297 NE ARG A 454 21.085 -8.318 16.564 1.00 34.34 N ATOM 2298 CZ ARG A 454 21.186 -8.474 17.902 1.00 44.44 C ATOM 2299 NH1 ARG A 454 20.168 -9.007 18.609 1.00 71.52 N ATOM 2300 NH2 ARG A 454 22.297 -8.095 18.507 1.00 34.52 N ATOM 0 H ARG A 454 18.411 -11.901 13.117 1.00 21.43 H new ATOM 0 HA ARG A 454 19.735 -9.259 13.047 1.00 12.44 H new ATOM 0 HB2 ARG A 454 20.724 -11.780 14.445 1.00 44.21 H new ATOM 0 HB3 ARG A 454 21.568 -10.246 14.369 1.00 44.21 H new ATOM 0 HG2 ARG A 454 18.783 -10.541 15.580 1.00 14.24 H new ATOM 0 HG3 ARG A 454 20.250 -10.692 16.526 1.00 14.24 H new ATOM 0 HD2 ARG A 454 19.941 -8.243 14.785 1.00 73.24 H new ATOM 0 HD3 ARG A 454 18.992 -8.330 16.256 1.00 73.24 H new ATOM 0 HE ARG A 454 21.878 -7.910 16.068 1.00 34.34 H new ATOM 0 HH11 ARG A 454 19.313 -9.296 18.133 1.00 71.52 H new ATOM 0 HH12 ARG A 454 20.253 -9.121 19.619 1.00 71.52 H new ATOM 0 HH21 ARG A 454 23.061 -7.692 17.965 1.00 34.52 H new ATOM 0 HH22 ARG A 454 22.391 -8.205 19.517 1.00 34.52 H new ATOM 2313 N ARG A 455 20.766 -12.196 11.907 1.00 30.01 N ATOM 2314 CA ARG A 455 21.474 -12.848 10.818 1.00 33.25 C ATOM 2315 C ARG A 455 20.715 -12.658 9.503 1.00 25.32 C ATOM 2316 O ARG A 455 21.321 -12.623 8.433 1.00 10.31 O ATOM 2317 CB ARG A 455 21.643 -14.344 11.090 1.00 63.40 C ATOM 2318 CG ARG A 455 23.031 -14.644 11.660 1.00 61.30 C ATOM 2319 CD ARG A 455 24.127 -14.037 10.782 1.00 3.23 C ATOM 2320 NE ARG A 455 25.384 -14.802 10.940 1.00 3.02 N ATOM 2321 CZ ARG A 455 26.225 -14.669 11.988 1.00 10.40 C ATOM 2322 NH1 ARG A 455 25.949 -13.797 12.981 1.00 1.32 N ATOM 2323 NH2 ARG A 455 27.321 -15.403 12.027 1.00 71.32 N ATOM 0 H ARG A 455 20.444 -12.824 12.643 1.00 30.01 H new ATOM 0 HA ARG A 455 22.460 -12.390 10.741 1.00 33.25 H new ATOM 0 HB2 ARG A 455 20.878 -14.679 11.791 1.00 63.40 H new ATOM 0 HB3 ARG A 455 21.496 -14.904 10.166 1.00 63.40 H new ATOM 0 HG2 ARG A 455 23.107 -14.244 12.671 1.00 61.30 H new ATOM 0 HG3 ARG A 455 23.173 -15.722 11.732 1.00 61.30 H new ATOM 0 HD2 ARG A 455 23.815 -14.046 9.738 1.00 3.23 H new ATOM 0 HD3 ARG A 455 24.289 -12.995 11.057 1.00 3.23 H new ATOM 0 HE ARG A 455 25.631 -15.472 10.211 1.00 3.02 H new ATOM 0 HH11 ARG A 455 25.100 -13.233 12.943 1.00 1.32 H new ATOM 0 HH12 ARG A 455 26.589 -13.702 13.769 1.00 1.32 H new ATOM 0 HH21 ARG A 455 27.523 -16.059 11.272 1.00 71.32 H new ATOM 0 HH22 ARG A 455 27.967 -15.314 12.812 1.00 71.32 H new ATOM 2336 N LYS A 456 19.401 -12.541 9.626 1.00 25.42 N ATOM 2337 CA LYS A 456 18.554 -12.356 8.460 1.00 22.03 C ATOM 2338 C LYS A 456 18.913 -11.034 7.779 1.00 5.12 C ATOM 2339 O LYS A 456 18.659 -10.855 6.589 1.00 21.51 O ATOM 2340 CB LYS A 456 17.078 -12.467 8.848 1.00 62.25 C ATOM 2341 CG LYS A 456 16.619 -11.228 9.618 1.00 13.22 C ATOM 2342 CD LYS A 456 15.117 -10.998 9.441 1.00 54.53 C ATOM 2343 CE LYS A 456 14.805 -10.464 8.041 1.00 4.50 C ATOM 2344 NZ LYS A 456 14.441 -11.573 7.132 1.00 34.33 N ATOM 0 H LYS A 456 18.902 -12.571 10.515 1.00 25.42 H new ATOM 0 HA LYS A 456 18.729 -13.148 7.732 1.00 22.03 H new ATOM 0 HB2 LYS A 456 16.471 -12.588 7.951 1.00 62.25 H new ATOM 0 HB3 LYS A 456 16.925 -13.357 9.459 1.00 62.25 H new ATOM 0 HG2 LYS A 456 16.850 -11.347 10.677 1.00 13.22 H new ATOM 0 HG3 LYS A 456 17.168 -10.354 9.268 1.00 13.22 H new ATOM 0 HD2 LYS A 456 14.581 -11.932 9.606 1.00 54.53 H new ATOM 0 HD3 LYS A 456 14.763 -10.291 10.191 1.00 54.53 H new ATOM 0 HE2 LYS A 456 13.987 -9.746 8.093 1.00 4.50 H new ATOM 0 HE3 LYS A 456 15.671 -9.932 7.647 1.00 4.50 H new ATOM 0 HZ1 LYS A 456 15.158 -11.657 6.383 1.00 34.33 H new ATOM 0 HZ2 LYS A 456 14.396 -12.462 7.670 1.00 34.33 H new ATOM 0 HZ3 LYS A 456 13.513 -11.380 6.703 1.00 34.33 H new ATOM 2357 N ALA A 457 19.499 -10.141 8.564 1.00 62.15 N ATOM 2358 CA ALA A 457 19.896 -8.841 8.051 1.00 40.40 C ATOM 2359 C ALA A 457 21.154 -8.997 7.194 1.00 31.12 C ATOM 2360 O ALA A 457 21.442 -8.152 6.348 1.00 72.43 O ATOM 2361 CB ALA A 457 20.102 -7.873 9.218 1.00 21.00 C ATOM 0 H ALA A 457 19.708 -10.292 9.551 1.00 62.15 H new ATOM 0 HA ALA A 457 19.114 -8.425 7.416 1.00 40.40 H new ATOM 0 HB1 ALA A 457 20.400 -6.898 8.833 1.00 21.00 H new ATOM 0 HB2 ALA A 457 19.172 -7.774 9.777 1.00 21.00 H new ATOM 0 HB3 ALA A 457 20.882 -8.257 9.876 1.00 21.00 H new ATOM 2367 N LEU A 458 21.870 -10.084 7.444 1.00 53.24 N ATOM 2368 CA LEU A 458 23.090 -10.362 6.706 1.00 41.24 C ATOM 2369 C LEU A 458 22.763 -10.487 5.216 1.00 31.32 C ATOM 2370 O LEU A 458 23.382 -9.827 4.383 1.00 23.52 O ATOM 2371 CB LEU A 458 23.799 -11.588 7.285 1.00 41.41 C ATOM 2372 CG LEU A 458 25.323 -11.609 7.146 1.00 74.31 C ATOM 2373 CD1 LEU A 458 25.737 -11.763 5.681 1.00 4.53 C ATOM 2374 CD2 LEU A 458 25.950 -10.373 7.793 1.00 52.21 C ATOM 0 H LEU A 458 21.628 -10.782 8.147 1.00 53.24 H new ATOM 0 HA LEU A 458 23.794 -9.537 6.810 1.00 41.24 H new ATOM 0 HB2 LEU A 458 23.549 -11.661 8.344 1.00 41.41 H new ATOM 0 HB3 LEU A 458 23.397 -12.478 6.800 1.00 41.41 H new ATOM 0 HG LEU A 458 25.703 -12.479 7.681 1.00 74.31 H new ATOM 0 HD11 LEU A 458 26.825 -11.775 5.610 1.00 4.53 H new ATOM 0 HD12 LEU A 458 25.337 -12.697 5.286 1.00 4.53 H new ATOM 0 HD13 LEU A 458 25.345 -10.927 5.102 1.00 4.53 H new ATOM 0 HD21 LEU A 458 27.033 -10.413 7.680 1.00 52.21 H new ATOM 0 HD22 LEU A 458 25.568 -9.475 7.308 1.00 52.21 H new ATOM 0 HD23 LEU A 458 25.696 -10.349 8.853 1.00 52.21 H new ATOM 2386 N ARG A 459 21.790 -11.339 4.926 1.00 2.15 N ATOM 2387 CA ARG A 459 21.373 -11.559 3.552 1.00 22.41 C ATOM 2388 C ARG A 459 20.659 -10.320 3.009 1.00 73.31 C ATOM 2389 O ARG A 459 20.581 -10.126 1.797 1.00 41.42 O ATOM 2390 CB ARG A 459 20.438 -12.766 3.447 1.00 2.20 C ATOM 2391 CG ARG A 459 18.985 -12.357 3.696 1.00 41.42 C ATOM 2392 CD ARG A 459 18.054 -13.569 3.624 1.00 41.32 C ATOM 2393 NE ARG A 459 17.634 -13.966 4.986 1.00 14.41 N ATOM 2394 CZ ARG A 459 16.564 -14.746 5.251 1.00 43.10 C ATOM 2395 NH1 ARG A 459 15.797 -15.221 4.247 1.00 51.52 N ATOM 2396 NH2 ARG A 459 16.280 -15.038 6.507 1.00 43.24 N ATOM 0 H ARG A 459 21.279 -11.885 5.620 1.00 2.15 H new ATOM 0 HA ARG A 459 22.268 -11.755 2.961 1.00 22.41 H new ATOM 0 HB2 ARG A 459 20.529 -13.216 2.458 1.00 2.20 H new ATOM 0 HB3 ARG A 459 20.735 -13.525 4.171 1.00 2.20 H new ATOM 0 HG2 ARG A 459 18.899 -11.886 4.675 1.00 41.42 H new ATOM 0 HG3 ARG A 459 18.680 -11.616 2.957 1.00 41.42 H new ATOM 0 HD2 ARG A 459 17.179 -13.330 3.020 1.00 41.32 H new ATOM 0 HD3 ARG A 459 18.562 -14.400 3.135 1.00 41.32 H new ATOM 0 HE ARG A 459 18.187 -13.629 5.774 1.00 14.41 H new ATOM 0 HH11 ARG A 459 16.024 -14.991 3.279 1.00 51.52 H new ATOM 0 HH12 ARG A 459 14.991 -15.810 4.456 1.00 51.52 H new ATOM 0 HH21 ARG A 459 16.865 -14.676 7.260 1.00 43.24 H new ATOM 0 HH22 ARG A 459 15.475 -15.626 6.725 1.00 43.24 H new ATOM 2409 N ASN A 460 20.155 -9.515 3.932 1.00 10.41 N ATOM 2410 CA ASN A 460 19.450 -8.300 3.561 1.00 55.30 C ATOM 2411 C ASN A 460 20.458 -7.261 3.066 1.00 13.41 C ATOM 2412 O ASN A 460 20.102 -6.353 2.316 1.00 73.32 O ATOM 2413 CB ASN A 460 18.708 -7.705 4.760 1.00 70.31 C ATOM 2414 CG ASN A 460 18.056 -6.370 4.394 1.00 20.24 C ATOM 2415 OD1 ASN A 460 17.677 -6.125 3.261 1.00 11.41 O ATOM 2416 ND2 ASN A 460 17.947 -5.524 5.415 1.00 63.13 N ATOM 0 H ASN A 460 20.221 -9.680 4.936 1.00 10.41 H new ATOM 0 HA ASN A 460 18.731 -8.553 2.781 1.00 55.30 H new ATOM 0 HB2 ASN A 460 17.946 -8.404 5.104 1.00 70.31 H new ATOM 0 HB3 ASN A 460 19.403 -7.560 5.587 1.00 70.31 H new ATOM 0 HD21 ASN A 460 17.525 -4.606 5.274 1.00 63.13 H new ATOM 0 HD22 ASN A 460 18.285 -5.793 6.339 1.00 63.13 H new ATOM 2423 N LYS A 461 21.696 -7.428 3.506 1.00 21.13 N ATOM 2424 CA LYS A 461 22.758 -6.516 3.118 1.00 43.04 C ATOM 2425 C LYS A 461 23.007 -6.641 1.613 1.00 15.20 C ATOM 2426 O LYS A 461 23.488 -5.703 0.980 1.00 40.42 O ATOM 2427 CB LYS A 461 24.007 -6.754 3.969 1.00 62.13 C ATOM 2428 CG LYS A 461 24.219 -5.611 4.964 1.00 52.15 C ATOM 2429 CD LYS A 461 23.515 -5.902 6.291 1.00 51.55 C ATOM 2430 CE LYS A 461 22.177 -5.164 6.374 1.00 31.33 C ATOM 2431 NZ LYS A 461 21.169 -5.820 5.511 1.00 0.23 N ATOM 0 H LYS A 461 21.988 -8.182 4.128 1.00 21.13 H new ATOM 0 HA LYS A 461 22.462 -5.484 3.309 1.00 43.04 H new ATOM 0 HB2 LYS A 461 23.910 -7.697 4.508 1.00 62.13 H new ATOM 0 HB3 LYS A 461 24.880 -6.845 3.323 1.00 62.13 H new ATOM 0 HG2 LYS A 461 25.286 -5.468 5.138 1.00 52.15 H new ATOM 0 HG3 LYS A 461 23.838 -4.681 4.542 1.00 52.15 H new ATOM 0 HD2 LYS A 461 23.350 -6.975 6.392 1.00 51.55 H new ATOM 0 HD3 LYS A 461 24.154 -5.599 7.120 1.00 51.55 H new ATOM 0 HE2 LYS A 461 21.827 -5.149 7.406 1.00 31.33 H new ATOM 0 HE3 LYS A 461 22.308 -4.126 6.067 1.00 31.33 H new ATOM 0 HZ1 LYS A 461 20.233 -5.756 5.960 1.00 0.23 H new ATOM 0 HZ2 LYS A 461 21.143 -5.346 4.586 1.00 0.23 H new ATOM 0 HZ3 LYS A 461 21.422 -6.820 5.380 1.00 0.23 H new ATOM 2444 N ILE A 462 22.667 -7.807 1.084 1.00 35.13 N ATOM 2445 CA ILE A 462 22.846 -8.067 -0.334 1.00 45.30 C ATOM 2446 C ILE A 462 21.578 -7.662 -1.087 1.00 52.32 C ATOM 2447 O ILE A 462 21.652 -7.132 -2.195 1.00 14.33 O ATOM 2448 CB ILE A 462 23.260 -9.522 -0.564 1.00 42.31 C ATOM 2449 CG1 ILE A 462 24.293 -9.969 0.473 1.00 14.40 C ATOM 2450 CG2 ILE A 462 23.758 -9.730 -1.996 1.00 24.24 C ATOM 2451 CD1 ILE A 462 24.804 -11.377 0.165 1.00 23.34 C ATOM 0 H ILE A 462 22.268 -8.583 1.613 1.00 35.13 H new ATOM 0 HA ILE A 462 23.660 -7.461 -0.732 1.00 45.30 H new ATOM 0 HB ILE A 462 22.380 -10.152 -0.434 1.00 42.31 H new ATOM 0 HG12 ILE A 462 25.129 -9.269 0.484 1.00 14.40 H new ATOM 0 HG13 ILE A 462 23.847 -9.949 1.468 1.00 14.40 H new ATOM 0 HG21 ILE A 462 24.046 -10.772 -2.133 1.00 24.24 H new ATOM 0 HG22 ILE A 462 22.963 -9.478 -2.698 1.00 24.24 H new ATOM 0 HG23 ILE A 462 24.620 -9.088 -2.178 1.00 24.24 H new ATOM 0 HD11 ILE A 462 25.537 -11.671 0.917 1.00 23.34 H new ATOM 0 HD12 ILE A 462 23.969 -12.078 0.178 1.00 23.34 H new ATOM 0 HD13 ILE A 462 25.271 -11.387 -0.820 1.00 23.34 H new ATOM 2463 N LEU A 463 20.443 -7.927 -0.456 1.00 43.22 N ATOM 2464 CA LEU A 463 19.160 -7.597 -1.053 1.00 3.41 C ATOM 2465 C LEU A 463 19.257 -6.232 -1.738 1.00 3.35 C ATOM 2466 O LEU A 463 18.849 -6.080 -2.888 1.00 15.23 O ATOM 2467 CB LEU A 463 18.046 -7.683 -0.008 1.00 54.24 C ATOM 2468 CG LEU A 463 17.763 -9.076 0.558 1.00 50.05 C ATOM 2469 CD1 LEU A 463 16.696 -9.017 1.652 1.00 12.01 C ATOM 2470 CD2 LEU A 463 17.387 -10.055 -0.557 1.00 4.40 C ATOM 0 H LEU A 463 20.385 -8.366 0.463 1.00 43.22 H new ATOM 0 HA LEU A 463 18.900 -8.323 -1.824 1.00 3.41 H new ATOM 0 HB2 LEU A 463 18.300 -7.021 0.820 1.00 54.24 H new ATOM 0 HB3 LEU A 463 17.128 -7.300 -0.453 1.00 54.24 H new ATOM 0 HG LEU A 463 18.677 -9.449 1.020 1.00 50.05 H new ATOM 0 HD11 LEU A 463 16.514 -10.020 2.037 1.00 12.01 H new ATOM 0 HD12 LEU A 463 17.041 -8.374 2.462 1.00 12.01 H new ATOM 0 HD13 LEU A 463 15.772 -8.614 1.238 1.00 12.01 H new ATOM 0 HD21 LEU A 463 17.191 -11.038 -0.128 1.00 4.40 H new ATOM 0 HD22 LEU A 463 16.493 -9.698 -1.069 1.00 4.40 H new ATOM 0 HD23 LEU A 463 18.209 -10.128 -1.270 1.00 4.40 H new ATOM 2482 N ALA A 464 19.801 -5.273 -1.001 1.00 73.55 N ATOM 2483 CA ALA A 464 19.957 -3.926 -1.523 1.00 74.33 C ATOM 2484 C ALA A 464 20.998 -3.935 -2.644 1.00 24.52 C ATOM 2485 O ALA A 464 20.718 -3.504 -3.761 1.00 34.11 O ATOM 2486 CB ALA A 464 20.334 -2.978 -0.384 1.00 2.22 C ATOM 0 H ALA A 464 20.139 -5.403 -0.047 1.00 73.55 H new ATOM 0 HA ALA A 464 19.019 -3.568 -1.948 1.00 74.33 H new ATOM 0 HB1 ALA A 464 20.451 -1.967 -0.775 1.00 2.22 H new ATOM 0 HB2 ALA A 464 19.548 -2.986 0.371 1.00 2.22 H new ATOM 0 HB3 ALA A 464 21.272 -3.304 0.065 1.00 2.22 H new ATOM 2492 N ILE A 465 22.179 -4.432 -2.306 1.00 45.21 N ATOM 2493 CA ILE A 465 23.265 -4.503 -3.270 1.00 13.12 C ATOM 2494 C ILE A 465 22.761 -5.171 -4.551 1.00 14.24 C ATOM 2495 O ILE A 465 23.344 -4.993 -5.619 1.00 0.22 O ATOM 2496 CB ILE A 465 24.483 -5.194 -2.654 1.00 43.34 C ATOM 2497 CG1 ILE A 465 25.100 -4.335 -1.548 1.00 71.13 C ATOM 2498 CG2 ILE A 465 25.506 -5.563 -3.731 1.00 0.20 C ATOM 2499 CD1 ILE A 465 25.777 -5.208 -0.490 1.00 33.14 C ATOM 0 H ILE A 465 22.408 -4.789 -1.378 1.00 45.21 H new ATOM 0 HA ILE A 465 23.599 -3.502 -3.543 1.00 13.12 H new ATOM 0 HB ILE A 465 24.151 -6.124 -2.192 1.00 43.34 H new ATOM 0 HG12 ILE A 465 25.829 -3.649 -1.979 1.00 71.13 H new ATOM 0 HG13 ILE A 465 24.326 -3.726 -1.081 1.00 71.13 H new ATOM 0 HG21 ILE A 465 26.362 -6.053 -3.267 1.00 0.20 H new ATOM 0 HG22 ILE A 465 25.047 -6.240 -4.452 1.00 0.20 H new ATOM 0 HG23 ILE A 465 25.838 -4.659 -4.242 1.00 0.20 H new ATOM 0 HD11 ILE A 465 26.207 -4.573 0.284 1.00 33.14 H new ATOM 0 HD12 ILE A 465 25.040 -5.876 -0.044 1.00 33.14 H new ATOM 0 HD13 ILE A 465 26.566 -5.798 -0.956 1.00 33.14 H new ATOM 2511 N ALA A 466 21.682 -5.926 -4.401 1.00 41.23 N ATOM 2512 CA ALA A 466 21.093 -6.621 -5.533 1.00 31.31 C ATOM 2513 C ALA A 466 20.122 -5.683 -6.253 1.00 70.51 C ATOM 2514 O ALA A 466 20.365 -5.287 -7.392 1.00 24.51 O ATOM 2515 CB ALA A 466 20.413 -7.903 -5.047 1.00 63.00 C ATOM 0 H ALA A 466 21.201 -6.071 -3.513 1.00 41.23 H new ATOM 0 HA ALA A 466 21.863 -6.911 -6.248 1.00 31.31 H new ATOM 0 HB1 ALA A 466 19.971 -8.425 -5.896 1.00 63.00 H new ATOM 0 HB2 ALA A 466 21.151 -8.548 -4.569 1.00 63.00 H new ATOM 0 HB3 ALA A 466 19.632 -7.651 -4.329 1.00 63.00 H new ATOM 2521 N LYS A 467 19.042 -5.355 -5.559 1.00 60.43 N ATOM 2522 CA LYS A 467 18.033 -4.471 -6.118 1.00 62.53 C ATOM 2523 C LYS A 467 18.683 -3.140 -6.501 1.00 22.31 C ATOM 2524 O LYS A 467 18.734 -2.786 -7.678 1.00 10.34 O ATOM 2525 CB LYS A 467 16.855 -4.326 -5.154 1.00 13.43 C ATOM 2526 CG LYS A 467 15.967 -5.571 -5.181 1.00 34.34 C ATOM 2527 CD LYS A 467 15.452 -5.908 -3.780 1.00 14.12 C ATOM 2528 CE LYS A 467 14.550 -7.144 -3.809 1.00 43.13 C ATOM 2529 NZ LYS A 467 14.560 -7.824 -2.495 1.00 24.21 N ATOM 0 H LYS A 467 18.844 -5.685 -4.615 1.00 60.43 H new ATOM 0 HA LYS A 467 17.617 -4.897 -7.031 1.00 62.53 H new ATOM 0 HB2 LYS A 467 17.227 -4.162 -4.142 1.00 13.43 H new ATOM 0 HB3 LYS A 467 16.266 -3.449 -5.423 1.00 13.43 H new ATOM 0 HG2 LYS A 467 15.124 -5.406 -5.852 1.00 34.34 H new ATOM 0 HG3 LYS A 467 16.530 -6.415 -5.578 1.00 34.34 H new ATOM 0 HD2 LYS A 467 16.295 -6.084 -3.112 1.00 14.12 H new ATOM 0 HD3 LYS A 467 14.899 -5.059 -3.378 1.00 14.12 H new ATOM 0 HE2 LYS A 467 13.532 -6.852 -4.066 1.00 43.13 H new ATOM 0 HE3 LYS A 467 14.890 -7.832 -4.583 1.00 43.13 H new ATOM 0 HZ1 LYS A 467 14.356 -8.835 -2.626 1.00 24.21 H new ATOM 0 HZ2 LYS A 467 15.496 -7.714 -2.054 1.00 24.21 H new ATOM 0 HZ3 LYS A 467 13.836 -7.401 -1.880 1.00 24.21 H new ATOM 2542 N VAL A 468 19.164 -2.439 -5.485 1.00 21.55 N ATOM 2543 CA VAL A 468 19.809 -1.155 -5.700 1.00 33.14 C ATOM 2544 C VAL A 468 20.663 -1.224 -6.967 1.00 54.23 C ATOM 2545 O VAL A 468 20.729 -0.260 -7.728 1.00 50.33 O ATOM 2546 CB VAL A 468 20.611 -0.758 -4.459 1.00 24.31 C ATOM 2547 CG1 VAL A 468 21.272 0.609 -4.647 1.00 70.25 C ATOM 2548 CG2 VAL A 468 19.731 -0.774 -3.208 1.00 14.10 C ATOM 0 H VAL A 468 19.120 -2.736 -4.510 1.00 21.55 H new ATOM 0 HA VAL A 468 19.064 -0.374 -5.852 1.00 33.14 H new ATOM 0 HB VAL A 468 21.401 -1.496 -4.322 1.00 24.31 H new ATOM 0 HG11 VAL A 468 21.836 0.867 -3.750 1.00 70.25 H new ATOM 0 HG12 VAL A 468 21.947 0.572 -5.502 1.00 70.25 H new ATOM 0 HG13 VAL A 468 20.505 1.363 -4.823 1.00 70.25 H new ATOM 0 HG21 VAL A 468 20.326 -0.488 -2.341 1.00 14.10 H new ATOM 0 HG22 VAL A 468 18.909 -0.069 -3.332 1.00 14.10 H new ATOM 0 HG23 VAL A 468 19.330 -1.776 -3.058 1.00 14.10 H new ATOM 2558 N SER A 469 21.295 -2.373 -7.155 1.00 75.11 N ATOM 2559 CA SER A 469 22.141 -2.580 -8.318 1.00 24.25 C ATOM 2560 C SER A 469 21.280 -2.712 -9.575 1.00 64.33 C ATOM 2561 O SER A 469 21.549 -2.066 -10.587 1.00 3.02 O ATOM 2562 CB SER A 469 23.021 -3.820 -8.144 1.00 4.30 C ATOM 2563 OG SER A 469 23.583 -4.253 -9.380 1.00 74.20 O ATOM 0 H SER A 469 21.238 -3.170 -6.521 1.00 75.11 H new ATOM 0 HA SER A 469 22.795 -1.715 -8.424 1.00 24.25 H new ATOM 0 HB2 SER A 469 23.822 -3.600 -7.439 1.00 4.30 H new ATOM 0 HB3 SER A 469 22.429 -4.627 -7.712 1.00 4.30 H new ATOM 0 HG SER A 469 23.715 -5.224 -9.357 1.00 74.20 H new ATOM 2569 N ARG A 470 20.263 -3.554 -9.471 1.00 74.12 N ATOM 2570 CA ARG A 470 19.360 -3.779 -10.588 1.00 25.42 C ATOM 2571 C ARG A 470 18.734 -2.458 -11.038 1.00 75.55 C ATOM 2572 O ARG A 470 18.510 -2.248 -12.230 1.00 3.24 O ATOM 2573 CB ARG A 470 18.249 -4.760 -10.209 1.00 22.33 C ATOM 2574 CG ARG A 470 17.226 -4.893 -11.338 1.00 52.44 C ATOM 2575 CD ARG A 470 16.054 -3.930 -11.132 1.00 62.33 C ATOM 2576 NE ARG A 470 14.792 -4.569 -11.569 1.00 3.44 N ATOM 2577 CZ ARG A 470 13.584 -3.969 -11.518 1.00 52.12 C ATOM 2578 NH1 ARG A 470 13.463 -2.709 -11.049 1.00 4.20 N ATOM 2579 NH2 ARG A 470 12.522 -4.633 -11.934 1.00 72.14 N ATOM 0 H ARG A 470 20.044 -4.089 -8.631 1.00 74.12 H new ATOM 0 HA ARG A 470 19.942 -4.206 -11.405 1.00 25.42 H new ATOM 0 HB2 ARG A 470 18.681 -5.736 -9.988 1.00 22.33 H new ATOM 0 HB3 ARG A 470 17.752 -4.419 -9.301 1.00 22.33 H new ATOM 0 HG2 ARG A 470 17.706 -4.688 -12.295 1.00 52.44 H new ATOM 0 HG3 ARG A 470 16.856 -5.918 -11.380 1.00 52.44 H new ATOM 0 HD2 ARG A 470 15.984 -3.648 -10.081 1.00 62.33 H new ATOM 0 HD3 ARG A 470 16.222 -3.013 -11.697 1.00 62.33 H new ATOM 0 HE ARG A 470 14.838 -5.521 -11.931 1.00 3.44 H new ATOM 0 HH11 ARG A 470 14.289 -2.202 -10.729 1.00 4.20 H new ATOM 0 HH12 ARG A 470 12.546 -2.264 -11.014 1.00 4.20 H new ATOM 0 HH21 ARG A 470 12.622 -5.585 -12.287 1.00 72.14 H new ATOM 0 HH22 ARG A 470 11.602 -4.194 -11.902 1.00 72.14 H new ATOM 2592 N MET A 471 18.467 -1.603 -10.062 1.00 61.23 N ATOM 2593 CA MET A 471 17.870 -0.309 -10.344 1.00 3.44 C ATOM 2594 C MET A 471 18.648 0.428 -11.437 1.00 33.34 C ATOM 2595 O MET A 471 18.107 1.312 -12.100 1.00 22.45 O ATOM 2596 CB MET A 471 17.858 0.536 -9.068 1.00 44.21 C ATOM 2597 CG MET A 471 16.581 0.293 -8.261 1.00 63.23 C ATOM 2598 SD MET A 471 16.096 1.790 -7.420 1.00 0.41 S ATOM 2599 CE MET A 471 17.584 2.120 -6.490 1.00 72.42 C ATOM 0 H MET A 471 18.653 -1.781 -9.075 1.00 61.23 H new ATOM 0 HA MET A 471 16.851 -0.469 -10.695 1.00 3.44 H new ATOM 0 HB2 MET A 471 18.729 0.294 -8.459 1.00 44.21 H new ATOM 0 HB3 MET A 471 17.934 1.592 -9.326 1.00 44.21 H new ATOM 0 HG2 MET A 471 15.780 -0.038 -8.923 1.00 63.23 H new ATOM 0 HG3 MET A 471 16.745 -0.504 -7.536 1.00 63.23 H new ATOM 0 HE1 MET A 471 17.684 3.194 -6.332 1.00 72.42 H new ATOM 0 HE2 MET A 471 17.530 1.615 -5.526 1.00 72.42 H new ATOM 0 HE3 MET A 471 18.448 1.753 -7.044 1.00 72.42 H new ATOM 2609 N PHE A 472 19.904 0.036 -11.591 1.00 31.02 N ATOM 2610 CA PHE A 472 20.761 0.648 -12.592 1.00 21.30 C ATOM 2611 C PHE A 472 20.646 -0.082 -13.932 1.00 51.41 C ATOM 2612 O PHE A 472 20.891 0.505 -14.985 1.00 53.01 O ATOM 2613 CB PHE A 472 22.199 0.529 -12.082 1.00 52.44 C ATOM 2614 CG PHE A 472 23.199 1.413 -12.831 1.00 61.53 C ATOM 2615 CD1 PHE A 472 22.957 2.743 -12.975 1.00 51.10 C ATOM 2616 CD2 PHE A 472 24.330 0.867 -13.353 1.00 62.01 C ATOM 2617 CE1 PHE A 472 23.885 3.563 -13.670 1.00 61.40 C ATOM 2618 CE2 PHE A 472 25.258 1.687 -14.048 1.00 65.42 C ATOM 2619 CZ PHE A 472 25.016 3.017 -14.192 1.00 43.10 C ATOM 0 H PHE A 472 20.349 -0.698 -11.039 1.00 31.02 H new ATOM 0 HA PHE A 472 20.469 1.686 -12.748 1.00 21.30 H new ATOM 0 HB2 PHE A 472 22.221 0.789 -11.024 1.00 52.44 H new ATOM 0 HB3 PHE A 472 22.517 -0.510 -12.162 1.00 52.44 H new ATOM 0 HD1 PHE A 472 22.059 3.176 -12.561 1.00 51.10 H new ATOM 0 HD2 PHE A 472 24.522 -0.190 -13.239 1.00 62.01 H new ATOM 0 HE1 PHE A 472 23.693 4.620 -13.784 1.00 61.40 H new ATOM 0 HE2 PHE A 472 26.156 1.254 -14.462 1.00 65.42 H new ATOM 0 HZ PHE A 472 25.722 3.640 -14.721 1.00 43.10 H new ATOM 2629 N SER A 473 20.273 -1.350 -13.849 1.00 21.22 N ATOM 2630 CA SER A 473 20.122 -2.166 -15.042 1.00 5.20 C ATOM 2631 C SER A 473 18.680 -2.093 -15.547 1.00 31.34 C ATOM 2632 O SER A 473 18.350 -2.674 -16.579 1.00 73.42 O ATOM 2633 CB SER A 473 20.517 -3.619 -14.769 1.00 40.44 C ATOM 2634 OG SER A 473 20.783 -4.334 -15.973 1.00 22.34 O ATOM 0 H SER A 473 20.071 -1.833 -12.974 1.00 21.22 H new ATOM 0 HA SER A 473 20.789 -1.775 -15.811 1.00 5.20 H new ATOM 0 HB2 SER A 473 21.401 -3.641 -14.131 1.00 40.44 H new ATOM 0 HB3 SER A 473 19.716 -4.116 -14.221 1.00 40.44 H new ATOM 0 HG SER A 473 20.125 -4.083 -16.655 1.00 22.34 H new ATOM 2640 N VAL A 474 17.859 -1.375 -14.795 1.00 1.14 N ATOM 2641 CA VAL A 474 16.460 -1.219 -15.153 1.00 14.23 C ATOM 2642 C VAL A 474 16.222 0.207 -15.654 1.00 71.03 C ATOM 2643 O VAL A 474 15.613 0.406 -16.704 1.00 62.05 O ATOM 2644 CB VAL A 474 15.571 -1.590 -13.964 1.00 73.30 C ATOM 2645 CG1 VAL A 474 15.735 -0.586 -12.822 1.00 14.22 C ATOM 2646 CG2 VAL A 474 14.105 -1.703 -14.389 1.00 63.03 C ATOM 0 H VAL A 474 18.136 -0.895 -13.939 1.00 1.14 H new ATOM 0 HA VAL A 474 16.196 -1.897 -15.964 1.00 14.23 H new ATOM 0 HB VAL A 474 15.890 -2.566 -13.600 1.00 73.30 H new ATOM 0 HG11 VAL A 474 15.092 -0.873 -11.990 1.00 14.22 H new ATOM 0 HG12 VAL A 474 16.774 -0.577 -12.492 1.00 14.22 H new ATOM 0 HG13 VAL A 474 15.456 0.409 -13.169 1.00 14.22 H new ATOM 0 HG21 VAL A 474 13.495 -1.968 -13.525 1.00 63.03 H new ATOM 0 HG22 VAL A 474 13.768 -0.748 -14.792 1.00 63.03 H new ATOM 0 HG23 VAL A 474 14.006 -2.474 -15.153 1.00 63.03 H new ATOM 2656 N LEU A 475 16.715 1.162 -14.880 1.00 14.41 N ATOM 2657 CA LEU A 475 16.563 2.564 -15.232 1.00 65.14 C ATOM 2658 C LEU A 475 16.765 2.731 -16.740 1.00 22.31 C ATOM 2659 O LEU A 475 16.135 3.583 -17.363 1.00 51.35 O ATOM 2660 CB LEU A 475 17.497 3.433 -14.387 1.00 61.31 C ATOM 2661 CG LEU A 475 18.484 4.308 -15.163 1.00 13.14 C ATOM 2662 CD1 LEU A 475 17.770 5.495 -15.812 1.00 1.41 C ATOM 2663 CD2 LEU A 475 19.641 4.755 -14.267 1.00 62.13 C ATOM 0 H LEU A 475 17.220 0.993 -14.010 1.00 14.41 H new ATOM 0 HA LEU A 475 15.554 2.907 -15.005 1.00 65.14 H new ATOM 0 HB2 LEU A 475 16.887 4.080 -13.756 1.00 61.31 H new ATOM 0 HB3 LEU A 475 18.064 2.782 -13.722 1.00 61.31 H new ATOM 0 HG LEU A 475 18.912 3.710 -15.968 1.00 13.14 H new ATOM 0 HD11 LEU A 475 18.494 6.101 -16.357 1.00 1.41 H new ATOM 0 HD12 LEU A 475 17.010 5.129 -16.502 1.00 1.41 H new ATOM 0 HD13 LEU A 475 17.297 6.102 -15.040 1.00 1.41 H new ATOM 0 HD21 LEU A 475 20.328 5.375 -14.842 1.00 62.13 H new ATOM 0 HD22 LEU A 475 19.250 5.329 -13.427 1.00 62.13 H new ATOM 0 HD23 LEU A 475 20.170 3.879 -13.892 1.00 62.13 H new ATOM 2675 N ARG A 476 17.646 1.903 -17.282 1.00 4.02 N ATOM 2676 CA ARG A 476 17.939 1.948 -18.704 1.00 41.14 C ATOM 2677 C ARG A 476 16.655 2.180 -19.503 1.00 60.24 C ATOM 2678 O ARG A 476 16.017 1.228 -19.949 1.00 73.41 O ATOM 2679 CB ARG A 476 18.596 0.648 -19.173 1.00 54.11 C ATOM 2680 CG ARG A 476 19.507 0.897 -20.377 1.00 11.03 C ATOM 2681 CD ARG A 476 18.716 0.835 -21.685 1.00 62.42 C ATOM 2682 NE ARG A 476 19.630 0.556 -22.816 1.00 33.03 N ATOM 2683 CZ ARG A 476 19.222 0.144 -24.035 1.00 15.41 C ATOM 2684 NH1 ARG A 476 17.909 -0.040 -24.292 1.00 21.21 N ATOM 2685 NH2 ARG A 476 20.125 -0.075 -24.972 1.00 71.00 N ATOM 0 H ARG A 476 18.167 1.197 -16.762 1.00 4.02 H new ATOM 0 HA ARG A 476 18.631 2.773 -18.874 1.00 41.14 H new ATOM 0 HB2 ARG A 476 19.175 0.214 -18.358 1.00 54.11 H new ATOM 0 HB3 ARG A 476 17.827 -0.077 -19.438 1.00 54.11 H new ATOM 0 HG2 ARG A 476 19.983 1.873 -20.282 1.00 11.03 H new ATOM 0 HG3 ARG A 476 20.304 0.154 -20.394 1.00 11.03 H new ATOM 0 HD2 ARG A 476 17.954 0.058 -21.622 1.00 62.42 H new ATOM 0 HD3 ARG A 476 18.196 1.779 -21.851 1.00 62.42 H new ATOM 0 HE ARG A 476 20.631 0.683 -22.665 1.00 33.03 H new ATOM 0 HH11 ARG A 476 17.217 0.133 -23.562 1.00 21.21 H new ATOM 0 HH12 ARG A 476 17.609 -0.351 -25.216 1.00 21.21 H new ATOM 0 HH21 ARG A 476 21.115 0.067 -24.770 1.00 71.00 H new ATOM 0 HH22 ARG A 476 19.833 -0.387 -25.898 1.00 71.00 H new TER 2698 ARG A 476 HETATM 2699 CA CA A 201 22.609 10.221 3.835 1.00 4.44 CA HETATM 2700 CA CA A 202 13.611 10.354 -0.278 1.00 62.31 CA HETATM 2701 CA CA A 203 35.046 -16.188 -8.574 1.00 43.31 CA