USER MOD reduce.3.24.130724 H: found=0, std=0, add=1241, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1240 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 90 LYS NZ :NH3+ 171:sc= 0.298 (180deg=0) USER MOD Set 1.2: A 109 GLN : amide:sc= -0.681 K(o=-0.38,f=-1.7) USER MOD Set 2.1: A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 17 ASN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.217 K(o=-0.22,f=-0.79) USER MOD Single : A 10 SER OG : rot 160:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.407 K(o=-0.41,f=-1.1) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 85:sc= 0.00249 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 MET CE :methyl -127:sc= -1.27 (180deg=-6.65!) USER MOD Single : A 29 SER OG : rot 180:sc= -0.594 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.0304 K(o=-0.03,f=-1.2!) USER MOD Single : A 40 TYR OH : rot 100:sc= -0.948 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.165) USER MOD Single : A 53 THR OG1 : rot 71:sc= 1.22 USER MOD Single : A 57 THR OG1 : rot 180:sc= -1 USER MOD Single : A 61 SER OG : rot -170:sc= 0 USER MOD Single : A 68 SER OG : rot 150:sc= -0.412 USER MOD Single : A 69 THR OG1 : rot -45:sc= -1.47 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 75 MET CE :methyl -152:sc= -0.106 (180deg=-0.621) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.238 X(o=-0.24,f=-0.24) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.175 K(o=-0.17,f=-2!) USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -172:sc= -0.41 (180deg=-0.425) USER MOD Single : A 95 GLN : amide:sc= -0.212 X(o=-0.21,f=-0.64) USER MOD Single : A 96 GLN :FLIP amide:sc= -0.281 F(o=-0.99,f=-0.28) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -114:sc= -0.189 (180deg=-3.4!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0189 USER MOD Single : A 101 SER OG : rot 60:sc= 0.893 USER MOD Single : A 103 GLN : amide:sc= -4.23! C(o=-4.2!,f=-4.6!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot 82:sc= 1.79 USER MOD Single : A 107 LYS NZ :NH3+ -135:sc= -0.13 (180deg=-1.49!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -133:sc= -0.424 (180deg=-0.937) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0987 USER MOD Single : A 115 HIS : no HD1:sc= -0.219 X(o=-0.22,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.152) USER MOD Single : A 123 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.61) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -155:sc= -0.0103 (180deg=-0.657) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 HIS : no HD1:sc= -0.168 X(o=-0.17,f=-0.054) USER MOD Single : A 169 SER OG : rot -12:sc= 0.729 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0.134 USER MOD Single : A 178 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 7.876 4.453 -0.280 1.00 5.10 N ATOM 2 CA MET A 4 8.831 4.248 -1.364 1.00 13.34 C ATOM 3 C MET A 4 8.506 2.977 -2.141 1.00 74.12 C ATOM 4 O MET A 4 9.216 1.977 -2.040 1.00 3.43 O ATOM 5 CB MET A 4 10.255 4.171 -0.810 1.00 52.40 C ATOM 6 CG MET A 4 10.411 3.178 0.330 1.00 60.44 C ATOM 7 SD MET A 4 11.004 3.949 1.847 1.00 4.14 S ATOM 8 CE MET A 4 12.447 2.946 2.195 1.00 1.23 C ATOM 0 HA MET A 4 8.759 5.097 -2.044 1.00 13.34 H new ATOM 0 HB2 MET A 4 10.935 3.896 -1.616 1.00 52.40 H new ATOM 0 HB3 MET A 4 10.555 5.160 -0.463 1.00 52.40 H new ATOM 0 HG2 MET A 4 9.451 2.698 0.522 1.00 60.44 H new ATOM 0 HG3 MET A 4 11.106 2.393 0.030 1.00 60.44 H new ATOM 0 HE1 MET A 4 12.925 3.301 3.108 1.00 1.23 H new ATOM 0 HE2 MET A 4 12.145 1.907 2.324 1.00 1.23 H new ATOM 0 HE3 MET A 4 13.150 3.020 1.365 1.00 1.23 H new ATOM 18 N ALA A 5 7.427 3.022 -2.917 1.00 3.32 N ATOM 19 CA ALA A 5 7.010 1.875 -3.712 1.00 73.35 C ATOM 20 C ALA A 5 6.947 2.228 -5.195 1.00 33.14 C ATOM 21 O ALA A 5 7.821 1.846 -5.971 1.00 30.30 O ATOM 22 CB ALA A 5 5.660 1.362 -3.232 1.00 50.41 C ATOM 0 H ALA A 5 6.827 3.841 -3.011 1.00 3.32 H new ATOM 0 HA ALA A 5 7.752 1.087 -3.584 1.00 73.35 H new ATOM 0 HB1 ALA A 5 5.361 0.505 -3.835 1.00 50.41 H new ATOM 0 HB2 ALA A 5 5.736 1.062 -2.187 1.00 50.41 H new ATOM 0 HB3 ALA A 5 4.915 2.152 -3.329 1.00 50.41 H new ATOM 28 N ASN A 6 5.906 2.959 -5.580 1.00 50.21 N ATOM 29 CA ASN A 6 5.728 3.363 -6.970 1.00 64.22 C ATOM 30 C ASN A 6 6.516 4.634 -7.272 1.00 53.33 C ATOM 31 O ASN A 6 6.400 5.633 -6.561 1.00 0.12 O ATOM 32 CB ASN A 6 4.245 3.584 -7.273 1.00 62.15 C ATOM 33 CG ASN A 6 3.637 2.434 -8.052 1.00 75.40 C ATOM 34 OD1 ASN A 6 4.244 1.912 -8.987 1.00 23.32 O ATOM 35 ND2 ASN A 6 2.430 2.033 -7.669 1.00 13.01 N ATOM 0 H ASN A 6 5.173 3.284 -4.949 1.00 50.21 H new ATOM 0 HA ASN A 6 6.106 2.563 -7.606 1.00 64.22 H new ATOM 0 HB2 ASN A 6 3.701 3.713 -6.337 1.00 62.15 H new ATOM 0 HB3 ASN A 6 4.126 4.507 -7.841 1.00 62.15 H new ATOM 0 HD21 ASN A 6 1.970 1.264 -8.156 1.00 13.01 H new ATOM 0 HD22 ASN A 6 1.963 2.494 -6.888 1.00 13.01 H new ATOM 42 N LEU A 7 7.316 4.590 -8.332 1.00 13.31 N ATOM 43 CA LEU A 7 8.122 5.739 -8.730 1.00 24.14 C ATOM 44 C LEU A 7 7.472 6.486 -9.890 1.00 32.25 C ATOM 45 O LEU A 7 8.153 7.138 -10.681 1.00 71.54 O ATOM 46 CB LEU A 7 9.529 5.287 -9.124 1.00 64.35 C ATOM 47 CG LEU A 7 10.479 4.964 -7.971 1.00 23.05 C ATOM 48 CD1 LEU A 7 11.749 4.309 -8.492 1.00 30.14 C ATOM 49 CD2 LEU A 7 10.811 6.224 -7.184 1.00 51.15 C ATOM 0 H LEU A 7 7.424 3.771 -8.931 1.00 13.31 H new ATOM 0 HA LEU A 7 8.189 6.417 -7.879 1.00 24.14 H new ATOM 0 HB2 LEU A 7 9.441 4.402 -9.754 1.00 64.35 H new ATOM 0 HB3 LEU A 7 9.982 6.069 -9.733 1.00 64.35 H new ATOM 0 HG LEU A 7 9.981 4.262 -7.302 1.00 23.05 H new ATOM 0 HD11 LEU A 7 12.413 4.087 -7.657 1.00 30.14 H new ATOM 0 HD12 LEU A 7 11.495 3.384 -9.010 1.00 30.14 H new ATOM 0 HD13 LEU A 7 12.250 4.986 -9.183 1.00 30.14 H new ATOM 0 HD21 LEU A 7 11.488 5.975 -6.367 1.00 51.15 H new ATOM 0 HD22 LEU A 7 11.288 6.949 -7.843 1.00 51.15 H new ATOM 0 HD23 LEU A 7 9.894 6.651 -6.778 1.00 51.15 H new ATOM 61 N ASP A 8 6.150 6.388 -9.982 1.00 42.11 N ATOM 62 CA ASP A 8 5.407 7.057 -11.043 1.00 55.22 C ATOM 63 C ASP A 8 4.718 8.313 -10.516 1.00 64.42 C ATOM 64 O ASP A 8 3.698 8.744 -11.052 1.00 52.44 O ATOM 65 CB ASP A 8 4.370 6.107 -11.646 1.00 2.40 C ATOM 66 CG ASP A 8 3.531 5.419 -10.588 1.00 13.45 C ATOM 67 OD1 ASP A 8 2.828 6.127 -9.836 1.00 74.33 O ATOM 68 OD2 ASP A 8 3.577 4.174 -10.510 1.00 24.32 O ATOM 0 H ASP A 8 5.572 5.852 -9.335 1.00 42.11 H new ATOM 0 HA ASP A 8 6.115 7.350 -11.819 1.00 55.22 H new ATOM 0 HB2 ASP A 8 3.717 6.665 -12.317 1.00 2.40 H new ATOM 0 HB3 ASP A 8 4.878 5.354 -12.249 1.00 2.40 H new ATOM 73 N ARG A 9 5.283 8.893 -9.463 1.00 25.25 N ATOM 74 CA ARG A 9 4.723 10.097 -8.862 1.00 1.14 C ATOM 75 C ARG A 9 5.530 11.329 -9.260 1.00 2.45 C ATOM 76 O ARG A 9 4.969 12.345 -9.672 1.00 23.33 O ATOM 77 CB ARG A 9 4.692 9.965 -7.338 1.00 15.22 C ATOM 78 CG ARG A 9 3.577 9.066 -6.827 1.00 43.33 C ATOM 79 CD ARG A 9 3.827 8.630 -5.392 1.00 51.10 C ATOM 80 NE ARG A 9 2.979 9.351 -4.446 1.00 22.42 N ATOM 81 CZ ARG A 9 2.840 9.003 -3.171 1.00 72.45 C ATOM 82 NH1 ARG A 9 3.489 7.950 -2.693 1.00 41.04 N ATOM 83 NH2 ARG A 9 2.050 9.708 -2.372 1.00 40.43 N ATOM 0 H ARG A 9 6.129 8.549 -9.008 1.00 25.25 H new ATOM 0 HA ARG A 9 3.704 10.217 -9.230 1.00 1.14 H new ATOM 0 HB2 ARG A 9 5.650 9.572 -6.996 1.00 15.22 H new ATOM 0 HB3 ARG A 9 4.579 10.956 -6.898 1.00 15.22 H new ATOM 0 HG2 ARG A 9 2.626 9.594 -6.887 1.00 43.33 H new ATOM 0 HG3 ARG A 9 3.495 8.187 -7.466 1.00 43.33 H new ATOM 0 HD2 ARG A 9 3.643 7.559 -5.301 1.00 51.10 H new ATOM 0 HD3 ARG A 9 4.874 8.796 -5.140 1.00 51.10 H new ATOM 0 HE ARG A 9 2.466 10.166 -4.782 1.00 22.42 H new ATOM 0 HH11 ARG A 9 4.097 7.405 -3.304 1.00 41.04 H new ATOM 0 HH12 ARG A 9 3.380 7.685 -1.714 1.00 41.04 H new ATOM 0 HH21 ARG A 9 1.548 10.518 -2.736 1.00 40.43 H new ATOM 0 HH22 ARG A 9 1.944 9.440 -1.394 1.00 40.43 H new ATOM 97 N SER A 10 6.850 11.233 -9.132 1.00 72.45 N ATOM 98 CA SER A 10 7.734 12.341 -9.475 1.00 20.54 C ATOM 99 C SER A 10 7.868 12.481 -10.988 1.00 11.52 C ATOM 100 O SER A 10 8.043 13.583 -11.506 1.00 53.23 O ATOM 101 CB SER A 10 9.113 12.133 -8.846 1.00 64.43 C ATOM 102 OG SER A 10 9.842 13.347 -8.803 1.00 43.10 O ATOM 0 H SER A 10 7.330 10.399 -8.793 1.00 72.45 H new ATOM 0 HA SER A 10 7.297 13.258 -9.081 1.00 20.54 H new ATOM 0 HB2 SER A 10 9.000 11.737 -7.837 1.00 64.43 H new ATOM 0 HB3 SER A 10 9.669 11.391 -9.419 1.00 64.43 H new ATOM 0 HG SER A 10 10.555 13.277 -8.134 1.00 43.10 H new ATOM 108 N ASN A 11 7.784 11.356 -11.690 1.00 45.32 N ATOM 109 CA ASN A 11 7.897 11.353 -13.144 1.00 72.13 C ATOM 110 C ASN A 11 6.763 12.152 -13.779 1.00 50.14 C ATOM 111 O ASN A 11 6.950 12.807 -14.805 1.00 1.33 O ATOM 112 CB ASN A 11 7.883 9.918 -13.674 1.00 62.43 C ATOM 113 CG ASN A 11 7.773 9.860 -15.186 1.00 13.53 C ATOM 114 OD1 ASN A 11 8.318 10.709 -15.892 1.00 15.34 O ATOM 115 ND2 ASN A 11 7.065 8.856 -15.689 1.00 54.35 N ATOM 0 H ASN A 11 7.638 10.435 -11.276 1.00 45.32 H new ATOM 0 HA ASN A 11 8.843 11.823 -13.411 1.00 72.13 H new ATOM 0 HB2 ASN A 11 8.794 9.409 -13.359 1.00 62.43 H new ATOM 0 HB3 ASN A 11 7.046 9.378 -13.231 1.00 62.43 H new ATOM 0 HD21 ASN A 11 6.955 8.765 -16.699 1.00 54.35 H new ATOM 0 HD22 ASN A 11 6.631 8.175 -15.065 1.00 54.35 H new ATOM 122 N ASP A 12 5.588 12.093 -13.163 1.00 12.52 N ATOM 123 CA ASP A 12 4.423 12.813 -13.666 1.00 65.02 C ATOM 124 C ASP A 12 4.317 14.192 -13.023 1.00 10.11 C ATOM 125 O ASP A 12 3.798 15.132 -13.625 1.00 73.14 O ATOM 126 CB ASP A 12 3.148 12.012 -13.400 1.00 11.25 C ATOM 127 CG ASP A 12 2.191 12.039 -14.575 1.00 41.02 C ATOM 128 OD1 ASP A 12 2.633 11.749 -15.707 1.00 10.11 O ATOM 129 OD2 ASP A 12 1.000 12.349 -14.363 1.00 43.05 O ATOM 0 H ASP A 12 5.416 11.554 -12.314 1.00 12.52 H new ATOM 0 HA ASP A 12 4.543 12.943 -14.742 1.00 65.02 H new ATOM 0 HB2 ASP A 12 3.412 10.979 -13.174 1.00 11.25 H new ATOM 0 HB3 ASP A 12 2.648 12.413 -12.519 1.00 11.25 H new ATOM 134 N LYS A 13 4.811 14.306 -11.795 1.00 1.22 N ATOM 135 CA LYS A 13 4.772 15.570 -11.068 1.00 64.22 C ATOM 136 C LYS A 13 5.713 16.590 -11.701 1.00 3.21 C ATOM 137 O LYS A 13 5.411 17.782 -11.749 1.00 15.51 O ATOM 138 CB LYS A 13 5.152 15.351 -9.602 1.00 61.50 C ATOM 139 CG LYS A 13 5.443 16.638 -8.850 1.00 71.30 C ATOM 140 CD LYS A 13 4.769 16.653 -7.488 1.00 73.54 C ATOM 141 CE LYS A 13 3.277 16.923 -7.608 1.00 73.41 C ATOM 142 NZ LYS A 13 2.848 18.059 -6.747 1.00 11.23 N ATOM 0 H LYS A 13 5.243 13.538 -11.282 1.00 1.22 H new ATOM 0 HA LYS A 13 3.755 15.959 -11.119 1.00 64.22 H new ATOM 0 HB2 LYS A 13 4.341 14.822 -9.100 1.00 61.50 H new ATOM 0 HB3 LYS A 13 6.030 14.706 -9.555 1.00 61.50 H new ATOM 0 HG2 LYS A 13 6.520 16.752 -8.725 1.00 71.30 H new ATOM 0 HG3 LYS A 13 5.098 17.489 -9.437 1.00 71.30 H new ATOM 0 HD2 LYS A 13 4.928 15.696 -6.992 1.00 73.54 H new ATOM 0 HD3 LYS A 13 5.229 17.417 -6.862 1.00 73.54 H new ATOM 0 HE2 LYS A 13 3.030 17.141 -8.647 1.00 73.41 H new ATOM 0 HE3 LYS A 13 2.722 16.027 -7.330 1.00 73.41 H new ATOM 0 HZ1 LYS A 13 1.825 18.211 -6.857 1.00 11.23 H new ATOM 0 HZ2 LYS A 13 3.060 17.840 -5.753 1.00 11.23 H new ATOM 0 HZ3 LYS A 13 3.358 18.920 -7.029 1.00 11.23 H new ATOM 156 N VAL A 14 6.855 16.114 -12.187 1.00 23.13 N ATOM 157 CA VAL A 14 7.839 16.985 -12.819 1.00 62.50 C ATOM 158 C VAL A 14 7.292 17.586 -14.109 1.00 4.23 C ATOM 159 O VAL A 14 7.609 18.723 -14.458 1.00 40.55 O ATOM 160 CB VAL A 14 9.142 16.225 -13.132 1.00 20.21 C ATOM 161 CG1 VAL A 14 8.868 15.059 -14.070 1.00 24.25 C ATOM 162 CG2 VAL A 14 10.178 17.167 -13.727 1.00 74.33 C ATOM 0 H VAL A 14 7.122 15.130 -12.155 1.00 23.13 H new ATOM 0 HA VAL A 14 8.055 17.785 -12.111 1.00 62.50 H new ATOM 0 HB VAL A 14 9.541 15.824 -12.200 1.00 20.21 H new ATOM 0 HG11 VAL A 14 9.800 14.534 -14.280 1.00 24.25 H new ATOM 0 HG12 VAL A 14 8.163 14.373 -13.601 1.00 24.25 H new ATOM 0 HG13 VAL A 14 8.445 15.434 -15.002 1.00 24.25 H new ATOM 0 HG21 VAL A 14 11.092 16.614 -13.942 1.00 74.33 H new ATOM 0 HG22 VAL A 14 9.790 17.599 -14.649 1.00 74.33 H new ATOM 0 HG23 VAL A 14 10.395 17.964 -13.016 1.00 74.33 H new ATOM 172 N TYR A 15 6.470 16.816 -14.812 1.00 15.13 N ATOM 173 CA TYR A 15 5.879 17.272 -16.065 1.00 4.24 C ATOM 174 C TYR A 15 4.786 18.305 -15.808 1.00 32.53 C ATOM 175 O TYR A 15 4.470 19.118 -16.675 1.00 2.52 O ATOM 176 CB TYR A 15 5.305 16.087 -16.843 1.00 41.52 C ATOM 177 CG TYR A 15 4.479 16.494 -18.043 1.00 4.33 C ATOM 178 CD1 TYR A 15 4.965 17.413 -18.966 1.00 31.35 C ATOM 179 CD2 TYR A 15 3.214 15.961 -18.253 1.00 13.31 C ATOM 180 CE1 TYR A 15 4.214 17.788 -20.063 1.00 11.03 C ATOM 181 CE2 TYR A 15 2.456 16.330 -19.348 1.00 24.41 C ATOM 182 CZ TYR A 15 2.961 17.243 -20.250 1.00 14.33 C ATOM 183 OH TYR A 15 2.209 17.614 -21.341 1.00 73.10 O ATOM 0 H TYR A 15 6.197 15.873 -14.536 1.00 15.13 H new ATOM 0 HA TYR A 15 6.664 17.741 -16.658 1.00 4.24 H new ATOM 0 HB2 TYR A 15 6.125 15.450 -17.176 1.00 41.52 H new ATOM 0 HB3 TYR A 15 4.688 15.488 -16.173 1.00 41.52 H new ATOM 0 HD1 TYR A 15 5.946 17.841 -18.823 1.00 31.35 H new ATOM 0 HD2 TYR A 15 2.816 15.246 -17.548 1.00 13.31 H new ATOM 0 HE1 TYR A 15 4.606 18.504 -20.770 1.00 11.03 H new ATOM 0 HE2 TYR A 15 1.474 15.906 -19.497 1.00 24.41 H new ATOM 0 HH TYR A 15 1.353 17.138 -21.325 1.00 73.10 H new ATOM 193 N GLU A 16 4.212 18.264 -14.609 1.00 62.41 N ATOM 194 CA GLU A 16 3.154 19.195 -14.237 1.00 53.13 C ATOM 195 C GLU A 16 3.736 20.454 -13.600 1.00 74.31 C ATOM 196 O GLU A 16 3.495 21.566 -14.066 1.00 54.33 O ATOM 197 CB GLU A 16 2.173 18.528 -13.271 1.00 73.21 C ATOM 198 CG GLU A 16 1.287 17.483 -13.928 1.00 54.14 C ATOM 199 CD GLU A 16 0.441 16.722 -12.926 1.00 75.24 C ATOM 200 OE1 GLU A 16 0.788 16.734 -11.727 1.00 0.22 O ATOM 201 OE2 GLU A 16 -0.568 16.114 -13.341 1.00 71.22 O ATOM 0 H GLU A 16 4.462 17.596 -13.880 1.00 62.41 H new ATOM 0 HA GLU A 16 2.621 19.481 -15.144 1.00 53.13 H new ATOM 0 HB2 GLU A 16 2.734 18.060 -12.462 1.00 73.21 H new ATOM 0 HB3 GLU A 16 1.543 19.294 -12.820 1.00 73.21 H new ATOM 0 HG2 GLU A 16 0.635 17.969 -14.653 1.00 54.14 H new ATOM 0 HG3 GLU A 16 1.910 16.780 -14.481 1.00 54.14 H new ATOM 208 N ASN A 17 4.503 20.268 -12.531 1.00 35.14 N ATOM 209 CA ASN A 17 5.118 21.388 -11.828 1.00 23.32 C ATOM 210 C ASN A 17 5.912 22.264 -12.791 1.00 45.24 C ATOM 211 O ASN A 17 5.913 23.490 -12.676 1.00 71.13 O ATOM 212 CB ASN A 17 6.034 20.876 -10.713 1.00 55.35 C ATOM 213 CG ASN A 17 5.442 21.094 -9.334 1.00 61.31 C ATOM 214 OD1 ASN A 17 4.661 20.127 -8.866 1.00 23.53 O flip ATOM 215 ND2 ASN A 17 5.685 22.119 -8.697 1.00 53.25 N flip ATOM 0 H ASN A 17 4.714 19.353 -12.133 1.00 35.14 H new ATOM 0 HA ASN A 17 4.323 21.990 -11.388 1.00 23.32 H new ATOM 0 HB2 ASN A 17 6.223 19.813 -10.861 1.00 55.35 H new ATOM 0 HB3 ASN A 17 6.997 21.382 -10.776 1.00 55.35 H new ATOM 0 HD21 ASN A 17 6.291 22.836 -9.096 1.00 53.25 H new ATOM 0 HD22 ASN A 17 5.280 22.251 -7.770 1.00 53.25 H new ATOM 222 N VAL A 18 6.588 21.627 -13.743 1.00 1.14 N ATOM 223 CA VAL A 18 7.385 22.348 -14.728 1.00 2.02 C ATOM 224 C VAL A 18 6.537 23.363 -15.485 1.00 15.43 C ATOM 225 O VAL A 18 7.055 24.332 -16.040 1.00 42.35 O ATOM 226 CB VAL A 18 8.035 21.384 -15.738 1.00 22.11 C ATOM 227 CG1 VAL A 18 6.969 20.645 -16.533 1.00 24.34 C ATOM 228 CG2 VAL A 18 8.975 22.139 -16.665 1.00 65.02 C ATOM 0 H VAL A 18 6.599 20.613 -13.852 1.00 1.14 H new ATOM 0 HA VAL A 18 8.168 22.871 -14.179 1.00 2.02 H new ATOM 0 HB VAL A 18 8.619 20.647 -15.187 1.00 22.11 H new ATOM 0 HG11 VAL A 18 7.447 19.969 -17.241 1.00 24.34 H new ATOM 0 HG12 VAL A 18 6.339 20.072 -15.852 1.00 24.34 H new ATOM 0 HG13 VAL A 18 6.356 21.364 -17.076 1.00 24.34 H new ATOM 0 HG21 VAL A 18 9.426 21.443 -17.372 1.00 65.02 H new ATOM 0 HG22 VAL A 18 8.415 22.899 -17.211 1.00 65.02 H new ATOM 0 HG23 VAL A 18 9.759 22.617 -16.078 1.00 65.02 H new ATOM 238 N THR A 19 5.227 23.136 -15.502 1.00 73.04 N ATOM 239 CA THR A 19 4.305 24.030 -16.191 1.00 50.15 C ATOM 240 C THR A 19 3.717 25.059 -15.233 1.00 35.34 C ATOM 241 O THR A 19 3.705 26.255 -15.520 1.00 61.32 O ATOM 242 CB THR A 19 3.156 23.249 -16.857 1.00 21.14 C ATOM 243 OG1 THR A 19 3.680 22.135 -17.588 1.00 21.33 O ATOM 244 CG2 THR A 19 2.361 24.147 -17.792 1.00 43.32 C ATOM 0 H THR A 19 4.781 22.340 -15.046 1.00 73.04 H new ATOM 0 HA THR A 19 4.880 24.543 -16.962 1.00 50.15 H new ATOM 0 HB THR A 19 2.490 22.888 -16.073 1.00 21.14 H new ATOM 0 HG1 THR A 19 3.800 21.374 -16.983 1.00 21.33 H new ATOM 0 HG21 THR A 19 1.556 23.573 -18.250 1.00 43.32 H new ATOM 0 HG22 THR A 19 1.939 24.978 -17.227 1.00 43.32 H new ATOM 0 HG23 THR A 19 3.018 24.535 -18.570 1.00 43.32 H new ATOM 252 N GLY A 20 3.229 24.585 -14.090 1.00 75.20 N ATOM 253 CA GLY A 20 2.646 25.478 -13.105 1.00 75.55 C ATOM 254 C GLY A 20 3.540 26.661 -12.794 1.00 24.43 C ATOM 255 O GLY A 20 3.097 27.809 -12.826 1.00 43.40 O ATOM 0 H GLY A 20 3.227 23.599 -13.829 1.00 75.20 H new ATOM 0 HA2 GLY A 20 1.685 25.839 -13.471 1.00 75.55 H new ATOM 0 HA3 GLY A 20 2.450 24.923 -12.187 1.00 75.55 H new ATOM 259 N LEU A 21 4.803 26.381 -12.489 1.00 51.22 N ATOM 260 CA LEU A 21 5.763 27.432 -12.168 1.00 70.42 C ATOM 261 C LEU A 21 5.774 28.508 -13.249 1.00 12.24 C ATOM 262 O LEU A 21 6.018 29.682 -12.968 1.00 75.21 O ATOM 263 CB LEU A 21 7.164 26.838 -12.009 1.00 51.24 C ATOM 264 CG LEU A 21 7.640 25.928 -13.143 1.00 11.54 C ATOM 265 CD1 LEU A 21 8.295 26.747 -14.244 1.00 62.44 C ATOM 266 CD2 LEU A 21 8.603 24.876 -12.613 1.00 33.22 C ATOM 0 H LEU A 21 5.186 25.436 -12.457 1.00 51.22 H new ATOM 0 HA LEU A 21 5.461 27.892 -11.227 1.00 70.42 H new ATOM 0 HB2 LEU A 21 7.875 27.658 -11.905 1.00 51.24 H new ATOM 0 HB3 LEU A 21 7.193 26.271 -11.078 1.00 51.24 H new ATOM 0 HG LEU A 21 6.773 25.419 -13.564 1.00 11.54 H new ATOM 0 HD11 LEU A 21 8.628 26.083 -15.042 1.00 62.44 H new ATOM 0 HD12 LEU A 21 7.575 27.462 -14.643 1.00 62.44 H new ATOM 0 HD13 LEU A 21 9.152 27.283 -13.837 1.00 62.44 H new ATOM 0 HD21 LEU A 21 8.932 24.237 -13.433 1.00 33.22 H new ATOM 0 HD22 LEU A 21 9.468 25.367 -12.166 1.00 33.22 H new ATOM 0 HD23 LEU A 21 8.101 24.269 -11.860 1.00 33.22 H new ATOM 278 N VAL A 22 5.506 28.101 -14.485 1.00 71.13 N ATOM 279 CA VAL A 22 5.481 29.031 -15.608 1.00 64.10 C ATOM 280 C VAL A 22 4.333 30.025 -15.473 1.00 63.13 C ATOM 281 O VAL A 22 4.524 31.233 -15.612 1.00 12.33 O ATOM 282 CB VAL A 22 5.347 28.287 -16.950 1.00 41.11 C ATOM 283 CG1 VAL A 22 5.536 29.248 -18.114 1.00 72.33 C ATOM 284 CG2 VAL A 22 6.345 27.142 -17.026 1.00 63.31 C ATOM 0 H VAL A 22 5.303 27.133 -14.735 1.00 71.13 H new ATOM 0 HA VAL A 22 6.428 29.570 -15.593 1.00 64.10 H new ATOM 0 HB VAL A 22 4.343 27.868 -17.015 1.00 41.11 H new ATOM 0 HG11 VAL A 22 5.438 28.705 -19.054 1.00 72.33 H new ATOM 0 HG12 VAL A 22 4.779 30.031 -18.066 1.00 72.33 H new ATOM 0 HG13 VAL A 22 6.527 29.698 -18.057 1.00 72.33 H new ATOM 0 HG21 VAL A 22 6.236 26.627 -17.981 1.00 63.31 H new ATOM 0 HG22 VAL A 22 7.358 27.536 -16.939 1.00 63.31 H new ATOM 0 HG23 VAL A 22 6.157 26.441 -16.213 1.00 63.31 H new ATOM 294 N LYS A 23 3.140 29.508 -15.202 1.00 14.33 N ATOM 295 CA LYS A 23 1.959 30.349 -15.046 1.00 12.41 C ATOM 296 C LYS A 23 2.221 31.477 -14.052 1.00 61.43 C ATOM 297 O LYS A 23 1.833 32.622 -14.282 1.00 65.31 O ATOM 298 CB LYS A 23 0.768 29.510 -14.578 1.00 54.14 C ATOM 299 CG LYS A 23 0.529 28.270 -15.423 1.00 14.25 C ATOM 300 CD LYS A 23 -0.758 27.565 -15.026 1.00 25.13 C ATOM 301 CE LYS A 23 -0.832 26.166 -15.618 1.00 25.10 C ATOM 302 NZ LYS A 23 -1.168 25.145 -14.588 1.00 32.52 N ATOM 0 H LYS A 23 2.965 28.510 -15.086 1.00 14.33 H new ATOM 0 HA LYS A 23 1.727 30.789 -16.016 1.00 12.41 H new ATOM 0 HB2 LYS A 23 0.931 29.209 -13.543 1.00 54.14 H new ATOM 0 HB3 LYS A 23 -0.130 30.128 -14.593 1.00 54.14 H new ATOM 0 HG2 LYS A 23 0.482 28.549 -16.476 1.00 14.25 H new ATOM 0 HG3 LYS A 23 1.370 27.585 -15.312 1.00 14.25 H new ATOM 0 HD2 LYS A 23 -0.821 27.505 -13.939 1.00 25.13 H new ATOM 0 HD3 LYS A 23 -1.614 28.150 -15.363 1.00 25.13 H new ATOM 0 HE2 LYS A 23 -1.583 26.145 -16.408 1.00 25.10 H new ATOM 0 HE3 LYS A 23 0.123 25.916 -16.079 1.00 25.10 H new ATOM 0 HZ1 LYS A 23 -1.209 24.205 -15.031 1.00 32.52 H new ATOM 0 HZ2 LYS A 23 -0.439 25.147 -13.847 1.00 32.52 H new ATOM 0 HZ3 LYS A 23 -2.092 25.369 -14.166 1.00 32.52 H new ATOM 316 N ALA A 24 2.883 31.144 -12.949 1.00 14.45 N ATOM 317 CA ALA A 24 3.200 32.130 -11.922 1.00 75.31 C ATOM 318 C ALA A 24 4.189 33.167 -12.443 1.00 73.44 C ATOM 319 O ALA A 24 4.041 34.362 -12.190 1.00 4.31 O ATOM 320 CB ALA A 24 3.756 31.442 -10.684 1.00 61.03 C ATOM 0 H ALA A 24 3.210 30.200 -12.743 1.00 14.45 H new ATOM 0 HA ALA A 24 2.279 32.648 -11.654 1.00 75.31 H new ATOM 0 HB1 ALA A 24 3.988 32.190 -9.926 1.00 61.03 H new ATOM 0 HB2 ALA A 24 3.016 30.745 -10.292 1.00 61.03 H new ATOM 0 HB3 ALA A 24 4.663 30.898 -10.947 1.00 61.03 H new ATOM 326 N VAL A 25 5.198 32.701 -13.173 1.00 32.03 N ATOM 327 CA VAL A 25 6.212 33.588 -13.730 1.00 55.41 C ATOM 328 C VAL A 25 5.574 34.711 -14.541 1.00 34.13 C ATOM 329 O VAL A 25 6.099 35.823 -14.601 1.00 24.21 O ATOM 330 CB VAL A 25 7.199 32.819 -14.628 1.00 32.04 C ATOM 331 CG1 VAL A 25 8.219 33.769 -15.236 1.00 23.21 C ATOM 332 CG2 VAL A 25 7.889 31.717 -13.838 1.00 34.13 C ATOM 0 H VAL A 25 5.335 31.714 -13.392 1.00 32.03 H new ATOM 0 HA VAL A 25 6.756 34.015 -12.887 1.00 55.41 H new ATOM 0 HB VAL A 25 6.640 32.356 -15.441 1.00 32.04 H new ATOM 0 HG11 VAL A 25 8.908 33.208 -15.867 1.00 23.21 H new ATOM 0 HG12 VAL A 25 7.705 34.519 -15.837 1.00 23.21 H new ATOM 0 HG13 VAL A 25 8.776 34.262 -14.440 1.00 23.21 H new ATOM 0 HG21 VAL A 25 8.583 31.184 -14.488 1.00 34.13 H new ATOM 0 HG22 VAL A 25 8.437 32.156 -13.004 1.00 34.13 H new ATOM 0 HG23 VAL A 25 7.142 31.021 -13.456 1.00 34.13 H new ATOM 342 N ILE A 26 4.438 34.413 -15.162 1.00 73.52 N ATOM 343 CA ILE A 26 3.727 35.397 -15.968 1.00 50.41 C ATOM 344 C ILE A 26 2.891 36.324 -15.092 1.00 53.23 C ATOM 345 O ILE A 26 2.938 37.545 -15.242 1.00 74.43 O ATOM 346 CB ILE A 26 2.809 34.721 -17.003 1.00 71.12 C ATOM 347 CG1 ILE A 26 3.574 33.636 -17.764 1.00 41.43 C ATOM 348 CG2 ILE A 26 2.245 35.755 -17.967 1.00 23.51 C ATOM 349 CD1 ILE A 26 4.717 34.174 -18.596 1.00 5.21 C ATOM 0 H ILE A 26 3.990 33.497 -15.122 1.00 73.52 H new ATOM 0 HA ILE A 26 4.483 35.981 -16.493 1.00 50.41 H new ATOM 0 HB ILE A 26 1.977 34.252 -16.477 1.00 71.12 H new ATOM 0 HG12 ILE A 26 3.965 32.910 -17.051 1.00 41.43 H new ATOM 0 HG13 ILE A 26 2.881 33.103 -18.415 1.00 41.43 H new ATOM 0 HG21 ILE A 26 1.598 35.261 -18.692 1.00 23.51 H new ATOM 0 HG22 ILE A 26 1.669 36.495 -17.411 1.00 23.51 H new ATOM 0 HG23 ILE A 26 3.064 36.251 -18.489 1.00 23.51 H new ATOM 0 HD11 ILE A 26 5.214 33.350 -19.107 1.00 5.21 H new ATOM 0 HD12 ILE A 26 4.331 34.878 -19.333 1.00 5.21 H new ATOM 0 HD13 ILE A 26 5.431 34.682 -17.948 1.00 5.21 H new ATOM 361 N GLU A 27 2.128 35.735 -14.177 1.00 13.43 N ATOM 362 CA GLU A 27 1.282 36.509 -13.276 1.00 13.41 C ATOM 363 C GLU A 27 2.084 37.609 -12.586 1.00 24.41 C ATOM 364 O GLU A 27 1.799 38.795 -12.748 1.00 63.32 O ATOM 365 CB GLU A 27 0.643 35.595 -12.228 1.00 62.14 C ATOM 366 CG GLU A 27 -0.869 35.724 -12.148 1.00 64.01 C ATOM 367 CD GLU A 27 -1.315 36.690 -11.068 1.00 51.43 C ATOM 368 OE1 GLU A 27 -1.081 36.397 -9.877 1.00 10.30 O ATOM 369 OE2 GLU A 27 -1.898 37.739 -11.414 1.00 32.01 O ATOM 0 H GLU A 27 2.078 34.725 -14.040 1.00 13.43 H new ATOM 0 HA GLU A 27 0.495 36.975 -13.870 1.00 13.41 H new ATOM 0 HB2 GLU A 27 0.899 34.560 -12.456 1.00 62.14 H new ATOM 0 HB3 GLU A 27 1.071 35.822 -11.251 1.00 62.14 H new ATOM 0 HG2 GLU A 27 -1.253 36.059 -13.111 1.00 64.01 H new ATOM 0 HG3 GLU A 27 -1.304 34.743 -11.955 1.00 64.01 H new ATOM 376 N MET A 28 3.089 37.205 -11.815 1.00 72.41 N ATOM 377 CA MET A 28 3.933 38.155 -11.101 1.00 23.24 C ATOM 378 C MET A 28 4.577 39.144 -12.067 1.00 54.11 C ATOM 379 O MET A 28 4.630 40.344 -11.798 1.00 12.12 O ATOM 380 CB MET A 28 5.017 37.415 -10.313 1.00 53.23 C ATOM 381 CG MET A 28 5.897 36.527 -11.178 1.00 11.13 C ATOM 382 SD MET A 28 6.423 35.028 -10.324 1.00 55.42 S ATOM 383 CE MET A 28 8.152 35.393 -10.033 1.00 52.24 C ATOM 0 H MET A 28 3.338 36.227 -11.669 1.00 72.41 H new ATOM 0 HA MET A 28 3.303 38.711 -10.406 1.00 23.24 H new ATOM 0 HB2 MET A 28 5.644 38.144 -9.800 1.00 53.23 H new ATOM 0 HB3 MET A 28 4.543 36.805 -9.544 1.00 53.23 H new ATOM 0 HG2 MET A 28 5.353 36.254 -12.082 1.00 11.13 H new ATOM 0 HG3 MET A 28 6.776 37.089 -11.492 1.00 11.13 H new ATOM 0 HE1 MET A 28 8.765 34.577 -10.415 1.00 52.24 H new ATOM 0 HE2 MET A 28 8.419 36.318 -10.543 1.00 52.24 H new ATOM 0 HE3 MET A 28 8.325 35.506 -8.963 1.00 52.24 H new ATOM 393 N SER A 29 5.064 38.633 -13.193 1.00 23.21 N ATOM 394 CA SER A 29 5.708 39.471 -14.197 1.00 52.35 C ATOM 395 C SER A 29 4.745 40.537 -14.713 1.00 64.00 C ATOM 396 O SER A 29 5.165 41.547 -15.278 1.00 71.24 O ATOM 397 CB SER A 29 6.210 38.615 -15.362 1.00 33.03 C ATOM 398 OG SER A 29 6.361 39.391 -16.538 1.00 13.23 O ATOM 0 H SER A 29 5.025 37.642 -13.433 1.00 23.21 H new ATOM 0 HA SER A 29 6.557 39.968 -13.729 1.00 52.35 H new ATOM 0 HB2 SER A 29 7.165 38.160 -15.098 1.00 33.03 H new ATOM 0 HB3 SER A 29 5.509 37.801 -15.547 1.00 33.03 H new ATOM 0 HG SER A 29 6.684 38.821 -17.267 1.00 13.23 H new ATOM 404 N SER A 30 3.452 40.304 -14.514 1.00 22.35 N ATOM 405 CA SER A 30 2.428 41.241 -14.961 1.00 65.21 C ATOM 406 C SER A 30 2.335 42.435 -14.017 1.00 2.43 C ATOM 407 O SER A 30 2.538 43.580 -14.422 1.00 42.11 O ATOM 408 CB SER A 30 1.071 40.541 -15.052 1.00 61.10 C ATOM 409 OG SER A 30 0.306 41.050 -16.131 1.00 21.21 O ATOM 0 H SER A 30 3.088 39.474 -14.046 1.00 22.35 H new ATOM 0 HA SER A 30 2.709 41.603 -15.950 1.00 65.21 H new ATOM 0 HB2 SER A 30 1.219 39.469 -15.181 1.00 61.10 H new ATOM 0 HB3 SER A 30 0.525 40.677 -14.119 1.00 61.10 H new ATOM 0 HG SER A 30 -0.556 40.585 -16.169 1.00 21.21 H new ATOM 415 N LYS A 31 2.026 42.160 -12.754 1.00 3.40 N ATOM 416 CA LYS A 31 1.907 43.210 -11.749 1.00 54.11 C ATOM 417 C LYS A 31 3.160 43.280 -10.883 1.00 44.03 C ATOM 418 O LYS A 31 3.089 43.596 -9.695 1.00 53.44 O ATOM 419 CB LYS A 31 0.679 42.964 -10.869 1.00 1.32 C ATOM 420 CG LYS A 31 -0.628 43.392 -11.514 1.00 63.43 C ATOM 421 CD LYS A 31 -1.382 44.383 -10.644 1.00 21.54 C ATOM 422 CE LYS A 31 -2.457 45.113 -11.434 1.00 0.05 C ATOM 423 NZ LYS A 31 -3.560 44.201 -11.843 1.00 75.12 N ATOM 0 H LYS A 31 1.853 41.218 -12.402 1.00 3.40 H new ATOM 0 HA LYS A 31 1.792 44.162 -12.267 1.00 54.11 H new ATOM 0 HB2 LYS A 31 0.624 41.903 -10.625 1.00 1.32 H new ATOM 0 HB3 LYS A 31 0.803 43.501 -9.929 1.00 1.32 H new ATOM 0 HG2 LYS A 31 -0.425 43.841 -12.486 1.00 63.43 H new ATOM 0 HG3 LYS A 31 -1.251 42.515 -11.692 1.00 63.43 H new ATOM 0 HD2 LYS A 31 -1.839 43.858 -9.805 1.00 21.54 H new ATOM 0 HD3 LYS A 31 -0.683 45.106 -10.225 1.00 21.54 H new ATOM 0 HE2 LYS A 31 -2.862 45.925 -10.831 1.00 0.05 H new ATOM 0 HE3 LYS A 31 -2.012 45.565 -12.320 1.00 0.05 H new ATOM 0 HZ1 LYS A 31 -4.272 44.736 -12.379 1.00 75.12 H new ATOM 0 HZ2 LYS A 31 -3.178 43.440 -12.440 1.00 75.12 H new ATOM 0 HZ3 LYS A 31 -4.002 43.789 -10.996 1.00 75.12 H new ATOM 437 N ILE A 32 4.307 42.984 -11.486 1.00 2.42 N ATOM 438 CA ILE A 32 5.576 43.017 -10.770 1.00 23.44 C ATOM 439 C ILE A 32 5.872 44.415 -10.238 1.00 31.25 C ATOM 440 O ILE A 32 6.350 44.573 -9.115 1.00 2.32 O ATOM 441 CB ILE A 32 6.742 42.565 -11.669 1.00 71.21 C ATOM 442 CG1 ILE A 32 8.065 42.644 -10.905 1.00 1.32 C ATOM 443 CG2 ILE A 32 6.800 43.416 -12.929 1.00 34.12 C ATOM 444 CD1 ILE A 32 8.086 41.807 -9.645 1.00 4.40 C ATOM 0 H ILE A 32 4.383 42.719 -12.468 1.00 2.42 H new ATOM 0 HA ILE A 32 5.483 42.325 -9.933 1.00 23.44 H new ATOM 0 HB ILE A 32 6.575 41.528 -11.961 1.00 71.21 H new ATOM 0 HG12 ILE A 32 8.874 42.320 -11.560 1.00 1.32 H new ATOM 0 HG13 ILE A 32 8.263 43.684 -10.644 1.00 1.32 H new ATOM 0 HG21 ILE A 32 7.629 43.084 -13.554 1.00 34.12 H new ATOM 0 HG22 ILE A 32 5.866 43.313 -13.481 1.00 34.12 H new ATOM 0 HG23 ILE A 32 6.947 44.461 -12.656 1.00 34.12 H new ATOM 0 HD11 ILE A 32 9.054 41.911 -9.155 1.00 4.40 H new ATOM 0 HD12 ILE A 32 7.300 42.145 -8.970 1.00 4.40 H new ATOM 0 HD13 ILE A 32 7.919 40.761 -9.901 1.00 4.40 H new ATOM 456 N GLN A 33 5.582 45.425 -11.051 1.00 41.11 N ATOM 457 CA GLN A 33 5.816 46.810 -10.661 1.00 41.51 C ATOM 458 C GLN A 33 4.984 47.179 -9.437 1.00 44.41 C ATOM 459 O GLN A 33 5.511 47.533 -8.382 1.00 22.31 O ATOM 460 CB GLN A 33 5.484 47.752 -11.820 1.00 64.34 C ATOM 461 CG GLN A 33 6.711 48.263 -12.559 1.00 73.43 C ATOM 462 CD GLN A 33 6.387 49.394 -13.515 1.00 0.34 C ATOM 463 OE1 GLN A 33 5.406 50.116 -13.331 1.00 70.52 O ATOM 464 NE2 GLN A 33 7.212 49.556 -14.542 1.00 44.41 N ATOM 0 H GLN A 33 5.185 45.310 -11.983 1.00 41.11 H new ATOM 0 HA GLN A 33 6.871 46.916 -10.407 1.00 41.51 H new ATOM 0 HB2 GLN A 33 4.835 47.232 -12.525 1.00 64.34 H new ATOM 0 HB3 GLN A 33 4.921 48.603 -11.436 1.00 64.34 H new ATOM 0 HG2 GLN A 33 7.450 48.605 -11.835 1.00 73.43 H new ATOM 0 HG3 GLN A 33 7.164 47.442 -13.114 1.00 73.43 H new ATOM 0 HE21 GLN A 33 8.013 48.935 -14.656 1.00 44.41 H new ATOM 0 HE22 GLN A 33 7.045 50.302 -15.217 1.00 44.41 H new ATOM 473 N PRO A 34 3.653 47.097 -9.579 1.00 22.42 N ATOM 474 CA PRO A 34 2.720 47.418 -8.495 1.00 22.33 C ATOM 475 C PRO A 34 2.763 46.389 -7.370 1.00 13.23 C ATOM 476 O PRO A 34 2.157 46.583 -6.316 1.00 24.21 O ATOM 477 CB PRO A 34 1.354 47.399 -9.185 1.00 61.21 C ATOM 478 CG PRO A 34 1.534 46.496 -10.357 1.00 2.25 C ATOM 479 CD PRO A 34 2.956 46.683 -10.808 1.00 63.42 C ATOM 0 HA PRO A 34 2.959 48.369 -8.020 1.00 22.33 H new ATOM 0 HB2 PRO A 34 0.577 47.029 -8.516 1.00 61.21 H new ATOM 0 HB3 PRO A 34 1.055 48.399 -9.498 1.00 61.21 H new ATOM 0 HG2 PRO A 34 1.345 45.458 -10.083 1.00 2.25 H new ATOM 0 HG3 PRO A 34 0.835 46.748 -11.155 1.00 2.25 H new ATOM 0 HD2 PRO A 34 3.373 45.762 -11.215 1.00 63.42 H new ATOM 0 HD3 PRO A 34 3.034 47.440 -11.588 1.00 63.42 H new ATOM 487 N ALA A 35 3.482 45.296 -7.601 1.00 21.24 N ATOM 488 CA ALA A 35 3.605 44.238 -6.605 1.00 43.22 C ATOM 489 C ALA A 35 3.929 44.813 -5.230 1.00 51.24 C ATOM 490 O ALA A 35 5.047 45.254 -4.963 1.00 31.13 O ATOM 491 CB ALA A 35 4.673 43.239 -7.026 1.00 51.12 C ATOM 0 H ALA A 35 3.988 45.120 -8.469 1.00 21.24 H new ATOM 0 HA ALA A 35 2.647 43.723 -6.538 1.00 43.22 H new ATOM 0 HB1 ALA A 35 4.754 42.455 -6.274 1.00 51.12 H new ATOM 0 HB2 ALA A 35 4.400 42.796 -7.984 1.00 51.12 H new ATOM 0 HB3 ALA A 35 5.631 43.750 -7.123 1.00 51.12 H new ATOM 497 N PRO A 36 2.929 44.810 -4.337 1.00 12.53 N ATOM 498 CA PRO A 36 3.083 45.329 -2.974 1.00 63.12 C ATOM 499 C PRO A 36 3.983 44.446 -2.117 1.00 21.45 C ATOM 500 O PRO A 36 4.321 43.320 -2.484 1.00 11.13 O ATOM 501 CB PRO A 36 1.653 45.325 -2.429 1.00 21.22 C ATOM 502 CG PRO A 36 0.950 44.275 -3.218 1.00 32.23 C ATOM 503 CD PRO A 36 1.570 44.301 -4.587 1.00 62.32 C ATOM 0 HA PRO A 36 3.555 46.312 -2.962 1.00 63.12 H new ATOM 0 HB2 PRO A 36 1.636 45.097 -1.363 1.00 21.22 H new ATOM 0 HB3 PRO A 36 1.179 46.298 -2.554 1.00 21.22 H new ATOM 0 HG2 PRO A 36 1.067 43.295 -2.755 1.00 32.23 H new ATOM 0 HG3 PRO A 36 -0.120 44.477 -3.270 1.00 32.23 H new ATOM 0 HD2 PRO A 36 1.589 43.309 -5.038 1.00 62.32 H new ATOM 0 HD3 PRO A 36 1.017 44.949 -5.266 1.00 62.32 H new ATOM 511 N PRO A 37 4.381 44.965 -0.946 1.00 2.13 N ATOM 512 CA PRO A 37 5.246 44.239 -0.011 1.00 44.41 C ATOM 513 C PRO A 37 4.534 43.060 0.643 1.00 54.44 C ATOM 514 O PRO A 37 5.174 42.157 1.178 1.00 31.53 O ATOM 515 CB PRO A 37 5.602 45.297 1.037 1.00 63.21 C ATOM 516 CG PRO A 37 4.478 46.273 0.987 1.00 30.00 C ATOM 517 CD PRO A 37 4.017 46.301 -0.444 1.00 32.31 C ATOM 0 HA PRO A 37 6.112 43.805 -0.511 1.00 44.41 H new ATOM 0 HB2 PRO A 37 5.699 44.855 2.029 1.00 63.21 H new ATOM 0 HB3 PRO A 37 6.553 45.777 0.808 1.00 63.21 H new ATOM 0 HG2 PRO A 37 3.669 45.971 1.652 1.00 30.00 H new ATOM 0 HG3 PRO A 37 4.805 47.261 1.311 1.00 30.00 H new ATOM 0 HD2 PRO A 37 2.944 46.479 -0.517 1.00 32.31 H new ATOM 0 HD3 PRO A 37 4.511 47.091 -1.010 1.00 32.31 H new ATOM 525 N GLU A 38 3.205 43.077 0.594 1.00 62.01 N ATOM 526 CA GLU A 38 2.407 42.008 1.182 1.00 14.24 C ATOM 527 C GLU A 38 2.234 40.853 0.200 1.00 45.53 C ATOM 528 O GLU A 38 2.114 39.697 0.601 1.00 24.44 O ATOM 529 CB GLU A 38 1.036 42.540 1.606 1.00 31.05 C ATOM 530 CG GLU A 38 0.089 41.458 2.099 1.00 42.30 C ATOM 531 CD GLU A 38 -0.952 41.990 3.064 1.00 34.02 C ATOM 532 OE1 GLU A 38 -1.354 43.163 2.917 1.00 13.05 O ATOM 533 OE2 GLU A 38 -1.366 41.232 3.967 1.00 63.14 O ATOM 0 H GLU A 38 2.660 43.818 0.154 1.00 62.01 H new ATOM 0 HA GLU A 38 2.934 41.638 2.061 1.00 14.24 H new ATOM 0 HB2 GLU A 38 1.171 43.280 2.395 1.00 31.05 H new ATOM 0 HB3 GLU A 38 0.578 43.055 0.761 1.00 31.05 H new ATOM 0 HG2 GLU A 38 -0.412 41.002 1.245 1.00 42.30 H new ATOM 0 HG3 GLU A 38 0.664 40.672 2.588 1.00 42.30 H new ATOM 540 N GLU A 39 2.223 41.178 -1.089 1.00 61.25 N ATOM 541 CA GLU A 39 2.064 40.168 -2.129 1.00 62.22 C ATOM 542 C GLU A 39 3.419 39.615 -2.562 1.00 50.13 C ATOM 543 O GLU A 39 3.498 38.561 -3.194 1.00 5.03 O ATOM 544 CB GLU A 39 1.332 40.758 -3.336 1.00 60.54 C ATOM 545 CG GLU A 39 -0.135 41.054 -3.074 1.00 21.25 C ATOM 546 CD GLU A 39 -0.952 39.797 -2.844 1.00 2.21 C ATOM 547 OE1 GLU A 39 -1.225 39.080 -3.829 1.00 20.40 O ATOM 548 OE2 GLU A 39 -1.318 39.531 -1.680 1.00 51.31 O ATOM 0 H GLU A 39 2.322 42.131 -1.438 1.00 61.25 H new ATOM 0 HA GLU A 39 1.472 39.350 -1.718 1.00 62.22 H new ATOM 0 HB2 GLU A 39 1.831 41.679 -3.638 1.00 60.54 H new ATOM 0 HB3 GLU A 39 1.410 40.064 -4.172 1.00 60.54 H new ATOM 0 HG2 GLU A 39 -0.221 41.703 -2.203 1.00 21.25 H new ATOM 0 HG3 GLU A 39 -0.548 41.601 -3.921 1.00 21.25 H new ATOM 555 N TYR A 40 4.482 40.334 -2.219 1.00 53.30 N ATOM 556 CA TYR A 40 5.833 39.918 -2.574 1.00 42.54 C ATOM 557 C TYR A 40 6.343 38.846 -1.617 1.00 33.42 C ATOM 558 O TYR A 40 7.079 37.942 -2.013 1.00 0.01 O ATOM 559 CB TYR A 40 6.779 41.120 -2.561 1.00 42.43 C ATOM 560 CG TYR A 40 8.211 40.767 -2.893 1.00 45.43 C ATOM 561 CD1 TYR A 40 8.507 39.828 -3.873 1.00 61.11 C ATOM 562 CD2 TYR A 40 9.269 41.374 -2.227 1.00 43.54 C ATOM 563 CE1 TYR A 40 9.814 39.502 -4.179 1.00 22.11 C ATOM 564 CE2 TYR A 40 10.580 41.056 -2.528 1.00 35.33 C ATOM 565 CZ TYR A 40 10.847 40.119 -3.504 1.00 32.42 C ATOM 566 OH TYR A 40 12.150 39.798 -3.807 1.00 22.45 O ATOM 0 H TYR A 40 4.434 41.208 -1.695 1.00 53.30 H new ATOM 0 HA TYR A 40 5.803 39.497 -3.579 1.00 42.54 H new ATOM 0 HB2 TYR A 40 6.421 41.861 -3.276 1.00 42.43 H new ATOM 0 HB3 TYR A 40 6.747 41.586 -1.576 1.00 42.43 H new ATOM 0 HD1 TYR A 40 7.701 39.344 -4.405 1.00 61.11 H new ATOM 0 HD2 TYR A 40 9.063 42.107 -1.461 1.00 43.54 H new ATOM 0 HE1 TYR A 40 10.026 38.768 -4.942 1.00 22.11 H new ATOM 0 HE2 TYR A 40 11.390 41.538 -2.002 1.00 35.33 H new ATOM 0 HH TYR A 40 12.527 40.483 -4.398 1.00 22.45 H new ATOM 576 N VAL A 41 5.944 38.952 -0.353 1.00 42.11 N ATOM 577 CA VAL A 41 6.358 37.991 0.663 1.00 52.35 C ATOM 578 C VAL A 41 6.088 36.561 0.209 1.00 55.25 C ATOM 579 O VAL A 41 6.988 35.725 0.139 1.00 23.22 O ATOM 580 CB VAL A 41 5.633 38.240 1.999 1.00 72.24 C ATOM 581 CG1 VAL A 41 5.446 36.934 2.756 1.00 60.11 C ATOM 582 CG2 VAL A 41 6.399 39.249 2.840 1.00 21.14 C ATOM 0 H VAL A 41 5.335 39.694 -0.008 1.00 42.11 H new ATOM 0 HA VAL A 41 7.430 38.126 0.809 1.00 52.35 H new ATOM 0 HB VAL A 41 4.647 38.653 1.787 1.00 72.24 H new ATOM 0 HG11 VAL A 41 4.932 37.129 3.697 1.00 60.11 H new ATOM 0 HG12 VAL A 41 4.852 36.246 2.154 1.00 60.11 H new ATOM 0 HG13 VAL A 41 6.420 36.489 2.960 1.00 60.11 H new ATOM 0 HG21 VAL A 41 5.873 39.413 3.780 1.00 21.14 H new ATOM 0 HG22 VAL A 41 7.399 38.867 3.046 1.00 21.14 H new ATOM 0 HG23 VAL A 41 6.475 40.191 2.298 1.00 21.14 H new ATOM 592 N PRO A 42 4.817 36.271 -0.109 1.00 40.53 N ATOM 593 CA PRO A 42 4.398 34.942 -0.564 1.00 1.24 C ATOM 594 C PRO A 42 4.925 34.613 -1.956 1.00 74.03 C ATOM 595 O PRO A 42 5.215 33.457 -2.263 1.00 4.23 O ATOM 596 CB PRO A 42 2.870 35.037 -0.578 1.00 44.51 C ATOM 597 CG PRO A 42 2.583 36.488 -0.755 1.00 40.55 C ATOM 598 CD PRO A 42 3.692 37.219 -0.050 1.00 53.41 C ATOM 0 HA PRO A 42 4.783 34.151 0.079 1.00 1.24 H new ATOM 0 HB2 PRO A 42 2.444 34.447 -1.390 1.00 44.51 H new ATOM 0 HB3 PRO A 42 2.441 34.659 0.350 1.00 44.51 H new ATOM 0 HG2 PRO A 42 2.551 36.753 -1.812 1.00 40.55 H new ATOM 0 HG3 PRO A 42 1.613 36.748 -0.331 1.00 40.55 H new ATOM 0 HD2 PRO A 42 3.932 38.159 -0.546 1.00 53.41 H new ATOM 0 HD3 PRO A 42 3.424 37.461 0.978 1.00 53.41 H new ATOM 606 N MET A 43 5.045 35.636 -2.796 1.00 10.45 N ATOM 607 CA MET A 43 5.538 35.455 -4.156 1.00 25.23 C ATOM 608 C MET A 43 6.867 34.704 -4.157 1.00 15.45 C ATOM 609 O MET A 43 7.052 33.751 -4.913 1.00 33.23 O ATOM 610 CB MET A 43 5.705 36.810 -4.846 1.00 74.10 C ATOM 611 CG MET A 43 4.977 36.907 -6.177 1.00 51.21 C ATOM 612 SD MET A 43 3.215 37.236 -5.983 1.00 12.21 S ATOM 613 CE MET A 43 3.110 38.907 -6.621 1.00 31.43 C ATOM 0 H MET A 43 4.807 36.599 -2.558 1.00 10.45 H new ATOM 0 HA MET A 43 4.805 34.864 -4.705 1.00 25.23 H new ATOM 0 HB2 MET A 43 5.339 37.594 -4.183 1.00 74.10 H new ATOM 0 HB3 MET A 43 6.766 36.998 -5.007 1.00 74.10 H new ATOM 0 HG2 MET A 43 5.427 37.699 -6.776 1.00 51.21 H new ATOM 0 HG3 MET A 43 5.110 35.976 -6.728 1.00 51.21 H new ATOM 0 HE1 MET A 43 2.078 39.253 -6.567 1.00 31.43 H new ATOM 0 HE2 MET A 43 3.744 39.564 -6.026 1.00 31.43 H new ATOM 0 HE3 MET A 43 3.444 38.922 -7.658 1.00 31.43 H new ATOM 623 N VAL A 44 7.789 35.141 -3.305 1.00 13.34 N ATOM 624 CA VAL A 44 9.099 34.510 -3.207 1.00 4.33 C ATOM 625 C VAL A 44 8.971 33.009 -2.974 1.00 54.11 C ATOM 626 O VAL A 44 9.674 32.211 -3.593 1.00 61.34 O ATOM 627 CB VAL A 44 9.935 35.125 -2.068 1.00 52.32 C ATOM 628 CG1 VAL A 44 11.290 34.441 -1.970 1.00 51.25 C ATOM 629 CG2 VAL A 44 10.098 36.623 -2.277 1.00 44.22 C ATOM 0 H VAL A 44 7.652 35.930 -2.673 1.00 13.34 H new ATOM 0 HA VAL A 44 9.606 34.686 -4.156 1.00 4.33 H new ATOM 0 HB VAL A 44 9.407 34.968 -1.127 1.00 52.32 H new ATOM 0 HG11 VAL A 44 11.866 34.889 -1.160 1.00 51.25 H new ATOM 0 HG12 VAL A 44 11.148 33.379 -1.770 1.00 51.25 H new ATOM 0 HG13 VAL A 44 11.829 34.564 -2.910 1.00 51.25 H new ATOM 0 HG21 VAL A 44 10.691 37.041 -1.464 1.00 44.22 H new ATOM 0 HG22 VAL A 44 10.603 36.805 -3.225 1.00 44.22 H new ATOM 0 HG23 VAL A 44 9.117 37.097 -2.292 1.00 44.22 H new ATOM 639 N LYS A 45 8.066 32.630 -2.077 1.00 43.53 N ATOM 640 CA LYS A 45 7.842 31.225 -1.763 1.00 22.55 C ATOM 641 C LYS A 45 7.437 30.446 -3.010 1.00 35.32 C ATOM 642 O LYS A 45 7.767 29.269 -3.152 1.00 35.14 O ATOM 643 CB LYS A 45 6.761 31.087 -0.688 1.00 51.14 C ATOM 644 CG LYS A 45 7.313 31.022 0.725 1.00 14.13 C ATOM 645 CD LYS A 45 7.376 32.400 1.363 1.00 33.32 C ATOM 646 CE LYS A 45 8.665 32.593 2.146 1.00 45.02 C ATOM 647 NZ LYS A 45 8.433 33.312 3.429 1.00 2.00 N ATOM 0 H LYS A 45 7.476 33.278 -1.555 1.00 43.53 H new ATOM 0 HA LYS A 45 8.776 30.810 -1.385 1.00 22.55 H new ATOM 0 HB2 LYS A 45 6.076 31.932 -0.763 1.00 51.14 H new ATOM 0 HB3 LYS A 45 6.179 30.186 -0.883 1.00 51.14 H new ATOM 0 HG2 LYS A 45 6.687 30.368 1.331 1.00 14.13 H new ATOM 0 HG3 LYS A 45 8.310 30.582 0.707 1.00 14.13 H new ATOM 0 HD2 LYS A 45 7.301 33.164 0.589 1.00 33.32 H new ATOM 0 HD3 LYS A 45 6.522 32.534 2.027 1.00 33.32 H new ATOM 0 HE2 LYS A 45 9.114 31.621 2.351 1.00 45.02 H new ATOM 0 HE3 LYS A 45 9.378 33.153 1.540 1.00 45.02 H new ATOM 0 HZ1 LYS A 45 9.247 33.925 3.636 1.00 2.00 H new ATOM 0 HZ2 LYS A 45 7.574 33.892 3.351 1.00 2.00 H new ATOM 0 HZ3 LYS A 45 8.316 32.621 4.198 1.00 2.00 H new ATOM 661 N GLU A 46 6.721 31.111 -3.911 1.00 14.22 N ATOM 662 CA GLU A 46 6.271 30.480 -5.146 1.00 64.01 C ATOM 663 C GLU A 46 7.460 30.054 -6.003 1.00 41.42 C ATOM 664 O GLU A 46 7.597 28.883 -6.358 1.00 13.44 O ATOM 665 CB GLU A 46 5.375 31.435 -5.936 1.00 51.45 C ATOM 666 CG GLU A 46 4.039 30.829 -6.332 1.00 50.33 C ATOM 667 CD GLU A 46 2.861 31.560 -5.717 1.00 45.31 C ATOM 668 OE1 GLU A 46 2.625 31.387 -4.503 1.00 3.31 O ATOM 669 OE2 GLU A 46 2.176 32.305 -6.449 1.00 24.40 O ATOM 0 H GLU A 46 6.440 32.086 -3.809 1.00 14.22 H new ATOM 0 HA GLU A 46 5.698 29.591 -4.882 1.00 64.01 H new ATOM 0 HB2 GLU A 46 5.196 32.329 -5.339 1.00 51.45 H new ATOM 0 HB3 GLU A 46 5.901 31.753 -6.836 1.00 51.45 H new ATOM 0 HG2 GLU A 46 3.945 30.845 -7.418 1.00 50.33 H new ATOM 0 HG3 GLU A 46 4.013 29.783 -6.025 1.00 50.33 H new ATOM 676 N VAL A 47 8.318 31.015 -6.333 1.00 70.44 N ATOM 677 CA VAL A 47 9.496 30.741 -7.148 1.00 74.43 C ATOM 678 C VAL A 47 10.490 29.861 -6.399 1.00 33.40 C ATOM 679 O VAL A 47 11.020 28.897 -6.950 1.00 33.31 O ATOM 680 CB VAL A 47 10.199 32.043 -7.574 1.00 51.10 C ATOM 681 CG1 VAL A 47 11.286 31.753 -8.597 1.00 44.03 C ATOM 682 CG2 VAL A 47 9.189 33.038 -8.125 1.00 13.10 C ATOM 0 H VAL A 47 8.219 31.990 -6.049 1.00 70.44 H new ATOM 0 HA VAL A 47 9.150 30.216 -8.038 1.00 74.43 H new ATOM 0 HB VAL A 47 10.669 32.486 -6.696 1.00 51.10 H new ATOM 0 HG11 VAL A 47 11.772 32.685 -8.886 1.00 44.03 H new ATOM 0 HG12 VAL A 47 12.024 31.079 -8.162 1.00 44.03 H new ATOM 0 HG13 VAL A 47 10.843 31.287 -9.477 1.00 44.03 H new ATOM 0 HG21 VAL A 47 9.703 33.952 -8.421 1.00 13.10 H new ATOM 0 HG22 VAL A 47 8.688 32.606 -8.992 1.00 13.10 H new ATOM 0 HG23 VAL A 47 8.450 33.269 -7.358 1.00 13.10 H new ATOM 692 N GLY A 48 10.738 30.199 -5.137 1.00 40.33 N ATOM 693 CA GLY A 48 11.668 29.430 -4.332 1.00 21.40 C ATOM 694 C GLY A 48 11.315 27.956 -4.287 1.00 53.23 C ATOM 695 O GLY A 48 12.198 27.099 -4.248 1.00 64.03 O ATOM 0 H GLY A 48 10.311 30.992 -4.658 1.00 40.33 H new ATOM 0 HA2 GLY A 48 12.674 29.547 -4.734 1.00 21.40 H new ATOM 0 HA3 GLY A 48 11.681 29.828 -3.318 1.00 21.40 H new ATOM 699 N LEU A 49 10.020 27.660 -4.291 1.00 72.22 N ATOM 700 CA LEU A 49 9.551 26.279 -4.249 1.00 71.02 C ATOM 701 C LEU A 49 9.802 25.578 -5.580 1.00 62.23 C ATOM 702 O LEU A 49 10.149 24.398 -5.616 1.00 23.33 O ATOM 703 CB LEU A 49 8.060 26.236 -3.911 1.00 12.14 C ATOM 704 CG LEU A 49 7.711 25.917 -2.456 1.00 54.45 C ATOM 705 CD1 LEU A 49 8.026 24.464 -2.138 1.00 12.10 C ATOM 706 CD2 LEU A 49 8.459 26.847 -1.512 1.00 61.22 C ATOM 0 H LEU A 49 9.276 28.357 -4.323 1.00 72.22 H new ATOM 0 HA LEU A 49 10.109 25.756 -3.472 1.00 71.02 H new ATOM 0 HB2 LEU A 49 7.622 27.201 -4.166 1.00 12.14 H new ATOM 0 HB3 LEU A 49 7.584 25.492 -4.550 1.00 12.14 H new ATOM 0 HG LEU A 49 6.642 26.074 -2.316 1.00 54.45 H new ATOM 0 HD11 LEU A 49 7.771 24.255 -1.099 1.00 12.10 H new ATOM 0 HD12 LEU A 49 7.444 23.814 -2.792 1.00 12.10 H new ATOM 0 HD13 LEU A 49 9.089 24.279 -2.295 1.00 12.10 H new ATOM 0 HD21 LEU A 49 8.199 26.606 -0.481 1.00 61.22 H new ATOM 0 HD22 LEU A 49 9.533 26.723 -1.654 1.00 61.22 H new ATOM 0 HD23 LEU A 49 8.182 27.880 -1.724 1.00 61.22 H new ATOM 718 N ALA A 50 9.626 26.313 -6.673 1.00 43.41 N ATOM 719 CA ALA A 50 9.838 25.763 -8.006 1.00 40.53 C ATOM 720 C ALA A 50 11.274 25.280 -8.179 1.00 32.21 C ATOM 721 O ALA A 50 11.512 24.141 -8.583 1.00 32.44 O ATOM 722 CB ALA A 50 9.498 26.801 -9.065 1.00 52.55 C ATOM 0 H ALA A 50 9.337 27.291 -6.661 1.00 43.41 H new ATOM 0 HA ALA A 50 9.177 24.905 -8.127 1.00 40.53 H new ATOM 0 HB1 ALA A 50 9.661 26.377 -10.056 1.00 52.55 H new ATOM 0 HB2 ALA A 50 8.453 27.096 -8.964 1.00 52.55 H new ATOM 0 HB3 ALA A 50 10.136 27.675 -8.935 1.00 52.55 H new ATOM 728 N LEU A 51 12.228 26.152 -7.872 1.00 32.32 N ATOM 729 CA LEU A 51 13.642 25.814 -7.994 1.00 34.54 C ATOM 730 C LEU A 51 14.017 24.688 -7.034 1.00 40.55 C ATOM 731 O LEU A 51 14.534 23.651 -7.450 1.00 52.44 O ATOM 732 CB LEU A 51 14.506 27.045 -7.717 1.00 64.42 C ATOM 733 CG LEU A 51 14.061 28.343 -8.392 1.00 24.31 C ATOM 734 CD1 LEU A 51 13.831 29.431 -7.355 1.00 54.12 C ATOM 735 CD2 LEU A 51 15.092 28.791 -9.418 1.00 71.21 C ATOM 0 H LEU A 51 12.048 27.098 -7.537 1.00 32.32 H new ATOM 0 HA LEU A 51 13.823 25.473 -9.013 1.00 34.54 H new ATOM 0 HB2 LEU A 51 14.533 27.210 -6.640 1.00 64.42 H new ATOM 0 HB3 LEU A 51 15.526 26.826 -8.032 1.00 64.42 H new ATOM 0 HG LEU A 51 13.120 28.157 -8.909 1.00 24.31 H new ATOM 0 HD11 LEU A 51 13.515 30.348 -7.853 1.00 54.12 H new ATOM 0 HD12 LEU A 51 13.057 29.111 -6.658 1.00 54.12 H new ATOM 0 HD13 LEU A 51 14.757 29.615 -6.810 1.00 54.12 H new ATOM 0 HD21 LEU A 51 14.759 29.716 -9.888 1.00 71.21 H new ATOM 0 HD22 LEU A 51 16.048 28.959 -8.923 1.00 71.21 H new ATOM 0 HD23 LEU A 51 15.208 28.019 -10.178 1.00 71.21 H new ATOM 747 N ARG A 52 13.752 24.900 -5.750 1.00 14.14 N ATOM 748 CA ARG A 52 14.061 23.904 -4.731 1.00 73.53 C ATOM 749 C ARG A 52 13.470 22.546 -5.102 1.00 44.23 C ATOM 750 O ARG A 52 14.180 21.541 -5.152 1.00 74.43 O ATOM 751 CB ARG A 52 13.524 24.350 -3.370 1.00 53.44 C ATOM 752 CG ARG A 52 13.821 23.371 -2.247 1.00 33.41 C ATOM 753 CD ARG A 52 12.638 22.452 -1.982 1.00 64.53 C ATOM 754 NE ARG A 52 11.855 22.886 -0.829 1.00 53.11 N ATOM 755 CZ ARG A 52 12.215 22.664 0.430 1.00 1.31 C ATOM 756 NH1 ARG A 52 13.341 22.017 0.697 1.00 71.23 N ATOM 757 NH2 ARG A 52 11.449 23.091 1.426 1.00 73.13 N ATOM 0 H ARG A 52 13.324 25.753 -5.390 1.00 14.14 H new ATOM 0 HA ARG A 52 15.145 23.807 -4.672 1.00 73.53 H new ATOM 0 HB2 ARG A 52 13.955 25.319 -3.119 1.00 53.44 H new ATOM 0 HB3 ARG A 52 12.445 24.490 -3.443 1.00 53.44 H new ATOM 0 HG2 ARG A 52 14.696 22.774 -2.505 1.00 33.41 H new ATOM 0 HG3 ARG A 52 14.067 23.921 -1.339 1.00 33.41 H new ATOM 0 HD2 ARG A 52 11.998 22.422 -2.864 1.00 64.53 H new ATOM 0 HD3 ARG A 52 12.998 21.437 -1.814 1.00 64.53 H new ATOM 0 HE ARG A 52 10.983 23.387 -1.000 1.00 53.11 H new ATOM 0 HH11 ARG A 52 13.933 21.688 -0.065 1.00 71.23 H new ATOM 0 HH12 ARG A 52 13.615 21.848 1.665 1.00 71.23 H new ATOM 0 HH21 ARG A 52 10.583 23.590 1.225 1.00 73.13 H new ATOM 0 HH22 ARG A 52 11.727 22.920 2.392 1.00 73.13 H new ATOM 771 N THR A 53 12.167 22.524 -5.361 1.00 55.44 N ATOM 772 CA THR A 53 11.480 21.291 -5.726 1.00 2.51 C ATOM 773 C THR A 53 12.037 20.715 -7.023 1.00 13.22 C ATOM 774 O THR A 53 12.202 19.502 -7.155 1.00 34.44 O ATOM 775 CB THR A 53 9.965 21.518 -5.887 1.00 2.33 C ATOM 776 OG1 THR A 53 9.424 22.079 -4.686 1.00 14.43 O ATOM 777 CG2 THR A 53 9.254 20.213 -6.208 1.00 73.32 C ATOM 0 H THR A 53 11.565 23.347 -5.325 1.00 55.44 H new ATOM 0 HA THR A 53 11.649 20.583 -4.915 1.00 2.51 H new ATOM 0 HB THR A 53 9.809 22.211 -6.714 1.00 2.33 H new ATOM 0 HG1 THR A 53 9.732 23.004 -4.590 1.00 14.43 H new ATOM 0 HG21 THR A 53 8.185 20.398 -6.317 1.00 73.32 H new ATOM 0 HG22 THR A 53 9.648 19.803 -7.138 1.00 73.32 H new ATOM 0 HG23 THR A 53 9.418 19.501 -5.399 1.00 73.32 H new ATOM 785 N LEU A 54 12.325 21.592 -7.978 1.00 64.22 N ATOM 786 CA LEU A 54 12.865 21.170 -9.266 1.00 60.32 C ATOM 787 C LEU A 54 14.079 20.265 -9.078 1.00 52.31 C ATOM 788 O LEU A 54 14.286 19.319 -9.839 1.00 54.34 O ATOM 789 CB LEU A 54 13.249 22.390 -10.105 1.00 60.10 C ATOM 790 CG LEU A 54 12.213 22.852 -11.131 1.00 4.13 C ATOM 791 CD1 LEU A 54 12.702 24.094 -11.860 1.00 61.23 C ATOM 792 CD2 LEU A 54 11.907 21.736 -12.119 1.00 51.41 C ATOM 0 H LEU A 54 12.194 22.599 -7.885 1.00 64.22 H new ATOM 0 HA LEU A 54 12.092 20.606 -9.789 1.00 60.32 H new ATOM 0 HB2 LEU A 54 13.457 23.220 -9.429 1.00 60.10 H new ATOM 0 HB3 LEU A 54 14.177 22.167 -10.631 1.00 60.10 H new ATOM 0 HG LEU A 54 11.293 23.104 -10.603 1.00 4.13 H new ATOM 0 HD11 LEU A 54 11.952 24.409 -12.586 1.00 61.23 H new ATOM 0 HD12 LEU A 54 12.869 24.896 -11.141 1.00 61.23 H new ATOM 0 HD13 LEU A 54 13.635 23.869 -12.376 1.00 61.23 H new ATOM 0 HD21 LEU A 54 11.168 22.082 -12.842 1.00 51.41 H new ATOM 0 HD22 LEU A 54 12.820 21.452 -12.642 1.00 51.41 H new ATOM 0 HD23 LEU A 54 11.513 20.873 -11.582 1.00 51.41 H new ATOM 804 N LEU A 55 14.878 20.561 -8.059 1.00 34.55 N ATOM 805 CA LEU A 55 16.070 19.773 -7.768 1.00 65.41 C ATOM 806 C LEU A 55 15.720 18.299 -7.592 1.00 70.54 C ATOM 807 O LEU A 55 16.394 17.422 -8.131 1.00 63.44 O ATOM 808 CB LEU A 55 16.759 20.299 -6.507 1.00 73.33 C ATOM 809 CG LEU A 55 18.271 20.502 -6.603 1.00 62.43 C ATOM 810 CD1 LEU A 55 18.595 21.679 -7.510 1.00 25.22 C ATOM 811 CD2 LEU A 55 18.870 20.710 -5.220 1.00 41.40 C ATOM 0 H LEU A 55 14.722 21.341 -7.421 1.00 34.55 H new ATOM 0 HA LEU A 55 16.752 19.867 -8.613 1.00 65.41 H new ATOM 0 HB2 LEU A 55 16.301 21.251 -6.237 1.00 73.33 H new ATOM 0 HB3 LEU A 55 16.557 19.606 -5.691 1.00 73.33 H new ATOM 0 HG LEU A 55 18.712 19.604 -7.036 1.00 62.43 H new ATOM 0 HD11 LEU A 55 19.676 21.808 -7.566 1.00 25.22 H new ATOM 0 HD12 LEU A 55 18.200 21.489 -8.508 1.00 25.22 H new ATOM 0 HD13 LEU A 55 18.142 22.585 -7.107 1.00 25.22 H new ATOM 0 HD21 LEU A 55 19.947 20.853 -5.308 1.00 41.40 H new ATOM 0 HD22 LEU A 55 18.423 21.591 -4.759 1.00 41.40 H new ATOM 0 HD23 LEU A 55 18.669 19.835 -4.601 1.00 41.40 H new ATOM 823 N ALA A 56 14.660 18.034 -6.836 1.00 74.23 N ATOM 824 CA ALA A 56 14.217 16.667 -6.593 1.00 72.53 C ATOM 825 C ALA A 56 13.540 16.081 -7.828 1.00 65.21 C ATOM 826 O ALA A 56 13.913 15.008 -8.304 1.00 24.34 O ATOM 827 CB ALA A 56 13.273 16.622 -5.401 1.00 31.52 C ATOM 0 H ALA A 56 14.092 18.749 -6.381 1.00 74.23 H new ATOM 0 HA ALA A 56 15.095 16.061 -6.370 1.00 72.53 H new ATOM 0 HB1 ALA A 56 12.950 15.595 -5.231 1.00 31.52 H new ATOM 0 HB2 ALA A 56 13.788 16.992 -4.515 1.00 31.52 H new ATOM 0 HB3 ALA A 56 12.403 17.247 -5.602 1.00 31.52 H new ATOM 833 N THR A 57 12.543 16.792 -8.344 1.00 74.21 N ATOM 834 CA THR A 57 11.813 16.342 -9.523 1.00 32.55 C ATOM 835 C THR A 57 12.765 16.005 -10.664 1.00 45.30 C ATOM 836 O THR A 57 12.781 14.879 -11.162 1.00 4.44 O ATOM 837 CB THR A 57 10.810 17.407 -10.003 1.00 54.02 C ATOM 838 OG1 THR A 57 11.029 18.637 -9.304 1.00 12.13 O ATOM 839 CG2 THR A 57 9.378 16.941 -9.783 1.00 63.14 C ATOM 0 H THR A 57 12.222 17.682 -7.964 1.00 74.21 H new ATOM 0 HA THR A 57 11.267 15.444 -9.233 1.00 32.55 H new ATOM 0 HB THR A 57 10.964 17.564 -11.071 1.00 54.02 H new ATOM 0 HG1 THR A 57 10.388 19.309 -9.616 1.00 12.13 H new ATOM 0 HG21 THR A 57 8.688 17.710 -10.130 1.00 63.14 H new ATOM 0 HG22 THR A 57 9.205 16.020 -10.340 1.00 63.14 H new ATOM 0 HG23 THR A 57 9.214 16.758 -8.721 1.00 63.14 H new ATOM 847 N VAL A 58 13.560 16.989 -11.075 1.00 32.21 N ATOM 848 CA VAL A 58 14.518 16.796 -12.157 1.00 55.43 C ATOM 849 C VAL A 58 15.441 15.618 -11.871 1.00 22.12 C ATOM 850 O VAL A 58 15.614 14.733 -12.709 1.00 40.23 O ATOM 851 CB VAL A 58 15.370 18.059 -12.384 1.00 13.22 C ATOM 852 CG1 VAL A 58 16.400 17.820 -13.477 1.00 73.42 C ATOM 853 CG2 VAL A 58 14.482 19.246 -12.727 1.00 20.00 C ATOM 0 H VAL A 58 13.559 17.927 -10.675 1.00 32.21 H new ATOM 0 HA VAL A 58 13.940 16.590 -13.058 1.00 55.43 H new ATOM 0 HB VAL A 58 15.902 18.287 -11.461 1.00 13.22 H new ATOM 0 HG11 VAL A 58 16.992 18.723 -13.623 1.00 73.42 H new ATOM 0 HG12 VAL A 58 17.056 16.999 -13.186 1.00 73.42 H new ATOM 0 HG13 VAL A 58 15.891 17.566 -14.407 1.00 73.42 H new ATOM 0 HG21 VAL A 58 15.100 20.130 -12.884 1.00 20.00 H new ATOM 0 HG22 VAL A 58 13.921 19.030 -13.636 1.00 20.00 H new ATOM 0 HG23 VAL A 58 13.788 19.430 -11.907 1.00 20.00 H new ATOM 863 N ASP A 59 16.032 15.612 -10.681 1.00 42.41 N ATOM 864 CA ASP A 59 16.938 14.541 -10.282 1.00 51.32 C ATOM 865 C ASP A 59 16.286 13.176 -10.481 1.00 1.44 C ATOM 866 O ASP A 59 16.964 12.192 -10.773 1.00 34.31 O ATOM 867 CB ASP A 59 17.354 14.714 -8.821 1.00 32.05 C ATOM 868 CG ASP A 59 18.052 13.487 -8.268 1.00 75.42 C ATOM 869 OD1 ASP A 59 19.069 13.068 -8.858 1.00 23.42 O ATOM 870 OD2 ASP A 59 17.579 12.944 -7.247 1.00 3.31 O ATOM 0 H ASP A 59 15.900 16.337 -9.976 1.00 42.41 H new ATOM 0 HA ASP A 59 17.826 14.595 -10.912 1.00 51.32 H new ATOM 0 HB2 ASP A 59 18.017 15.575 -8.735 1.00 32.05 H new ATOM 0 HB3 ASP A 59 16.472 14.929 -8.218 1.00 32.05 H new ATOM 875 N GLU A 60 14.968 13.127 -10.319 1.00 34.44 N ATOM 876 CA GLU A 60 14.225 11.882 -10.478 1.00 65.42 C ATOM 877 C GLU A 60 13.924 11.613 -11.950 1.00 23.42 C ATOM 878 O GLU A 60 13.821 10.461 -12.373 1.00 11.31 O ATOM 879 CB GLU A 60 12.921 11.934 -9.681 1.00 33.34 C ATOM 880 CG GLU A 60 13.129 11.995 -8.177 1.00 12.33 C ATOM 881 CD GLU A 60 12.537 10.799 -7.456 1.00 41.35 C ATOM 882 OE1 GLU A 60 11.294 10.706 -7.385 1.00 13.21 O ATOM 883 OE2 GLU A 60 13.317 9.957 -6.964 1.00 74.05 O ATOM 0 H GLU A 60 14.393 13.934 -10.078 1.00 34.44 H new ATOM 0 HA GLU A 60 14.843 11.069 -10.096 1.00 65.42 H new ATOM 0 HB2 GLU A 60 12.347 12.806 -9.996 1.00 33.34 H new ATOM 0 HB3 GLU A 60 12.323 11.055 -9.921 1.00 33.34 H new ATOM 0 HG2 GLU A 60 14.196 12.051 -7.964 1.00 12.33 H new ATOM 0 HG3 GLU A 60 12.678 12.908 -7.789 1.00 12.33 H new ATOM 890 N SER A 61 13.784 12.684 -12.724 1.00 62.45 N ATOM 891 CA SER A 61 13.491 12.564 -14.148 1.00 15.32 C ATOM 892 C SER A 61 14.742 12.179 -14.930 1.00 43.44 C ATOM 893 O SER A 61 14.657 11.616 -16.022 1.00 64.24 O ATOM 894 CB SER A 61 12.924 13.880 -14.685 1.00 72.12 C ATOM 895 OG SER A 61 12.004 13.647 -15.737 1.00 74.23 O ATOM 0 H SER A 61 13.869 13.644 -12.390 1.00 62.45 H new ATOM 0 HA SER A 61 12.748 11.777 -14.276 1.00 15.32 H new ATOM 0 HB2 SER A 61 12.430 14.423 -13.879 1.00 72.12 H new ATOM 0 HB3 SER A 61 13.738 14.511 -15.042 1.00 72.12 H new ATOM 0 HG SER A 61 11.777 14.498 -16.167 1.00 74.23 H new ATOM 901 N LEU A 62 15.904 12.488 -14.365 1.00 20.34 N ATOM 902 CA LEU A 62 17.175 12.175 -15.008 1.00 23.30 C ATOM 903 C LEU A 62 17.265 10.689 -15.343 1.00 2.25 C ATOM 904 O LEU A 62 17.434 10.297 -16.497 1.00 71.13 O ATOM 905 CB LEU A 62 18.340 12.576 -14.102 1.00 5.41 C ATOM 906 CG LEU A 62 19.591 11.701 -14.189 1.00 43.21 C ATOM 907 CD1 LEU A 62 20.138 11.692 -15.608 1.00 62.31 C ATOM 908 CD2 LEU A 62 20.651 12.186 -13.210 1.00 52.14 C ATOM 0 H LEU A 62 15.992 12.955 -13.463 1.00 20.34 H new ATOM 0 HA LEU A 62 17.233 12.742 -15.937 1.00 23.30 H new ATOM 0 HB2 LEU A 62 18.622 13.602 -14.339 1.00 5.41 H new ATOM 0 HB3 LEU A 62 17.989 12.572 -13.070 1.00 5.41 H new ATOM 0 HG LEU A 62 19.317 10.681 -13.920 1.00 43.21 H new ATOM 0 HD11 LEU A 62 21.028 11.064 -15.651 1.00 62.31 H new ATOM 0 HD12 LEU A 62 19.382 11.297 -16.287 1.00 62.31 H new ATOM 0 HD13 LEU A 62 20.396 12.709 -15.905 1.00 62.31 H new ATOM 0 HD21 LEU A 62 21.534 11.551 -13.286 1.00 52.14 H new ATOM 0 HD22 LEU A 62 20.922 13.215 -13.447 1.00 52.14 H new ATOM 0 HD23 LEU A 62 20.257 12.140 -12.195 1.00 52.14 H new ATOM 920 N PRO A 63 17.148 9.842 -14.310 1.00 32.43 N ATOM 921 CA PRO A 63 17.210 8.386 -14.469 1.00 72.34 C ATOM 922 C PRO A 63 15.988 7.829 -15.192 1.00 14.23 C ATOM 923 O PRO A 63 16.112 7.012 -16.104 1.00 32.22 O ATOM 924 CB PRO A 63 17.259 7.873 -13.028 1.00 71.51 C ATOM 925 CG PRO A 63 16.608 8.943 -12.222 1.00 53.24 C ATOM 926 CD PRO A 63 16.945 10.239 -12.906 1.00 50.24 C ATOM 0 HA PRO A 63 18.063 8.078 -15.074 1.00 72.34 H new ATOM 0 HB2 PRO A 63 16.731 6.925 -12.927 1.00 71.51 H new ATOM 0 HB3 PRO A 63 18.285 7.702 -12.703 1.00 71.51 H new ATOM 0 HG2 PRO A 63 15.529 8.795 -12.176 1.00 53.24 H new ATOM 0 HG3 PRO A 63 16.975 8.936 -11.196 1.00 53.24 H new ATOM 0 HD2 PRO A 63 16.140 10.967 -12.807 1.00 50.24 H new ATOM 0 HD3 PRO A 63 17.841 10.695 -12.484 1.00 50.24 H new ATOM 934 N VAL A 64 14.806 8.278 -14.778 1.00 65.53 N ATOM 935 CA VAL A 64 13.561 7.825 -15.387 1.00 43.33 C ATOM 936 C VAL A 64 13.604 7.977 -16.904 1.00 24.24 C ATOM 937 O VAL A 64 12.964 7.218 -17.633 1.00 4.01 O ATOM 938 CB VAL A 64 12.352 8.606 -14.839 1.00 22.05 C ATOM 939 CG1 VAL A 64 11.092 8.254 -15.615 1.00 4.31 C ATOM 940 CG2 VAL A 64 12.169 8.328 -13.354 1.00 54.51 C ATOM 0 H VAL A 64 14.685 8.954 -14.024 1.00 65.53 H new ATOM 0 HA VAL A 64 13.450 6.771 -15.133 1.00 43.33 H new ATOM 0 HB VAL A 64 12.541 9.672 -14.966 1.00 22.05 H new ATOM 0 HG11 VAL A 64 10.249 8.816 -15.213 1.00 4.31 H new ATOM 0 HG12 VAL A 64 11.229 8.508 -16.666 1.00 4.31 H new ATOM 0 HG13 VAL A 64 10.894 7.186 -15.522 1.00 4.31 H new ATOM 0 HG21 VAL A 64 11.311 8.887 -12.982 1.00 54.51 H new ATOM 0 HG22 VAL A 64 12.001 7.262 -13.201 1.00 54.51 H new ATOM 0 HG23 VAL A 64 13.064 8.635 -12.813 1.00 54.51 H new ATOM 950 N LEU A 65 14.363 8.961 -17.373 1.00 2.12 N ATOM 951 CA LEU A 65 14.491 9.213 -18.804 1.00 61.21 C ATOM 952 C LEU A 65 15.833 8.710 -19.328 1.00 34.14 C ATOM 953 O LEU A 65 16.790 8.525 -18.576 1.00 43.32 O ATOM 954 CB LEU A 65 14.346 10.708 -19.094 1.00 74.30 C ATOM 955 CG LEU A 65 12.914 11.233 -19.206 1.00 41.40 C ATOM 956 CD1 LEU A 65 12.203 10.597 -20.390 1.00 72.00 C ATOM 957 CD2 LEU A 65 12.148 10.972 -17.918 1.00 14.03 C ATOM 0 H LEU A 65 14.899 9.597 -16.783 1.00 2.12 H new ATOM 0 HA LEU A 65 13.696 8.671 -19.315 1.00 61.21 H new ATOM 0 HB2 LEU A 65 14.854 11.262 -18.305 1.00 74.30 H new ATOM 0 HB3 LEU A 65 14.867 10.929 -20.025 1.00 74.30 H new ATOM 0 HG LEU A 65 12.954 12.310 -19.369 1.00 41.40 H new ATOM 0 HD11 LEU A 65 11.186 10.983 -20.453 1.00 72.00 H new ATOM 0 HD12 LEU A 65 12.740 10.836 -21.308 1.00 72.00 H new ATOM 0 HD13 LEU A 65 12.173 9.515 -20.258 1.00 72.00 H new ATOM 0 HD21 LEU A 65 11.131 11.352 -18.016 1.00 14.03 H new ATOM 0 HD22 LEU A 65 12.117 9.900 -17.724 1.00 14.03 H new ATOM 0 HD23 LEU A 65 12.646 11.477 -17.090 1.00 14.03 H new ATOM 969 N PRO A 66 15.906 8.484 -20.648 1.00 0.43 N ATOM 970 CA PRO A 66 17.126 8.003 -21.302 1.00 22.41 C ATOM 971 C PRO A 66 18.228 9.056 -21.321 1.00 42.45 C ATOM 972 O PRO A 66 17.954 10.253 -21.403 1.00 10.34 O ATOM 973 CB PRO A 66 16.664 7.686 -22.726 1.00 73.03 C ATOM 974 CG PRO A 66 15.477 8.560 -22.942 1.00 41.44 C ATOM 975 CD PRO A 66 14.804 8.683 -21.604 1.00 34.24 C ATOM 0 HA PRO A 66 17.559 7.150 -20.780 1.00 22.41 H new ATOM 0 HB2 PRO A 66 17.448 7.897 -23.453 1.00 73.03 H new ATOM 0 HB3 PRO A 66 16.405 6.633 -22.833 1.00 73.03 H new ATOM 0 HG2 PRO A 66 15.776 9.538 -23.320 1.00 41.44 H new ATOM 0 HG3 PRO A 66 14.802 8.126 -23.680 1.00 41.44 H new ATOM 0 HD2 PRO A 66 14.335 9.659 -21.479 1.00 34.24 H new ATOM 0 HD3 PRO A 66 14.022 7.934 -21.477 1.00 34.24 H new ATOM 983 N ALA A 67 19.475 8.603 -21.247 1.00 43.20 N ATOM 984 CA ALA A 67 20.619 9.507 -21.259 1.00 14.31 C ATOM 985 C ALA A 67 20.615 10.380 -22.509 1.00 42.31 C ATOM 986 O ALA A 67 20.496 9.879 -23.627 1.00 41.52 O ATOM 987 CB ALA A 67 21.916 8.718 -21.167 1.00 44.32 C ATOM 0 H ALA A 67 19.719 7.615 -21.178 1.00 43.20 H new ATOM 0 HA ALA A 67 20.543 10.162 -20.391 1.00 14.31 H new ATOM 0 HB1 ALA A 67 22.762 9.406 -21.177 1.00 44.32 H new ATOM 0 HB2 ALA A 67 21.927 8.143 -20.241 1.00 44.32 H new ATOM 0 HB3 ALA A 67 21.990 8.039 -22.017 1.00 44.32 H new ATOM 993 N SER A 68 20.746 11.688 -22.312 1.00 50.43 N ATOM 994 CA SER A 68 20.753 12.632 -23.424 1.00 63.32 C ATOM 995 C SER A 68 20.879 14.066 -22.919 1.00 63.21 C ATOM 996 O SER A 68 21.497 14.913 -23.565 1.00 71.04 O ATOM 997 CB SER A 68 19.478 12.482 -24.256 1.00 41.10 C ATOM 998 OG SER A 68 18.989 13.746 -24.672 1.00 65.42 O ATOM 0 H SER A 68 20.849 12.118 -21.393 1.00 50.43 H new ATOM 0 HA SER A 68 21.616 12.410 -24.052 1.00 63.32 H new ATOM 0 HB2 SER A 68 19.681 11.862 -25.129 1.00 41.10 H new ATOM 0 HB3 SER A 68 18.716 11.969 -23.670 1.00 41.10 H new ATOM 0 HG SER A 68 18.524 13.651 -25.529 1.00 65.42 H new ATOM 1004 N THR A 69 20.289 14.332 -21.758 1.00 73.20 N ATOM 1005 CA THR A 69 20.333 15.662 -21.165 1.00 53.42 C ATOM 1006 C THR A 69 21.167 15.669 -19.890 1.00 22.35 C ATOM 1007 O THR A 69 20.946 16.486 -18.995 1.00 30.40 O ATOM 1008 CB THR A 69 18.919 16.181 -20.843 1.00 35.24 C ATOM 1009 OG1 THR A 69 18.986 17.535 -20.383 1.00 2.20 O ATOM 1010 CG2 THR A 69 18.253 15.314 -19.785 1.00 34.41 C ATOM 0 H THR A 69 19.775 13.643 -21.209 1.00 73.20 H new ATOM 0 HA THR A 69 20.795 16.320 -21.901 1.00 53.42 H new ATOM 0 HB THR A 69 18.324 16.137 -21.755 1.00 35.24 H new ATOM 0 HG1 THR A 69 19.710 17.623 -19.728 1.00 2.20 H new ATOM 0 HG21 THR A 69 17.256 15.700 -19.574 1.00 34.41 H new ATOM 0 HG22 THR A 69 18.176 14.290 -20.149 1.00 34.41 H new ATOM 0 HG23 THR A 69 18.849 15.331 -18.873 1.00 34.41 H new ATOM 1018 N HIS A 70 22.128 14.753 -19.812 1.00 10.32 N ATOM 1019 CA HIS A 70 22.997 14.655 -18.645 1.00 23.33 C ATOM 1020 C HIS A 70 23.645 16.001 -18.334 1.00 71.24 C ATOM 1021 O HIS A 70 23.362 16.614 -17.305 1.00 24.33 O ATOM 1022 CB HIS A 70 24.077 13.597 -18.875 1.00 1.02 C ATOM 1023 CG HIS A 70 23.652 12.213 -18.490 1.00 51.43 C ATOM 1024 ND1 HIS A 70 24.399 11.398 -17.667 1.00 21.12 N ATOM 1025 CD2 HIS A 70 22.548 11.503 -18.820 1.00 61.31 C ATOM 1026 CE1 HIS A 70 23.774 10.245 -17.508 1.00 62.21 C ATOM 1027 NE2 HIS A 70 22.648 10.283 -18.197 1.00 61.13 N ATOM 0 H HIS A 70 22.324 14.069 -20.543 1.00 10.32 H new ATOM 0 HA HIS A 70 22.386 14.361 -17.792 1.00 23.33 H new ATOM 0 HB2 HIS A 70 24.360 13.602 -19.928 1.00 1.02 H new ATOM 0 HB3 HIS A 70 24.966 13.867 -18.305 1.00 1.02 H new ATOM 0 HD2 HIS A 70 21.739 11.834 -19.455 1.00 61.31 H new ATOM 0 HE1 HIS A 70 24.124 9.413 -16.915 1.00 62.21 H new ATOM 0 HE2 HIS A 70 21.964 9.529 -18.257 1.00 61.13 H new ATOM 1035 N ARG A 71 24.515 16.454 -19.231 1.00 11.20 N ATOM 1036 CA ARG A 71 25.204 17.726 -19.052 1.00 11.54 C ATOM 1037 C ARG A 71 24.211 18.844 -18.748 1.00 12.50 C ATOM 1038 O ARG A 71 24.370 19.581 -17.775 1.00 72.11 O ATOM 1039 CB ARG A 71 26.012 18.074 -20.303 1.00 24.21 C ATOM 1040 CG ARG A 71 26.694 19.430 -20.231 1.00 11.54 C ATOM 1041 CD ARG A 71 27.689 19.494 -19.082 1.00 74.32 C ATOM 1042 NE ARG A 71 28.759 18.511 -19.230 1.00 40.45 N ATOM 1043 CZ ARG A 71 29.512 18.087 -18.222 1.00 30.02 C ATOM 1044 NH1 ARG A 71 29.312 18.556 -16.998 1.00 3.21 N ATOM 1045 NH2 ARG A 71 30.467 17.191 -18.436 1.00 72.12 N ATOM 0 H ARG A 71 24.759 15.959 -20.089 1.00 11.20 H new ATOM 0 HA ARG A 71 25.883 17.626 -18.205 1.00 11.54 H new ATOM 0 HB2 ARG A 71 26.768 17.305 -20.462 1.00 24.21 H new ATOM 0 HB3 ARG A 71 25.350 18.055 -21.169 1.00 24.21 H new ATOM 0 HG2 ARG A 71 27.209 19.630 -21.171 1.00 11.54 H new ATOM 0 HG3 ARG A 71 25.943 20.210 -20.107 1.00 11.54 H new ATOM 0 HD2 ARG A 71 28.120 20.494 -19.031 1.00 74.32 H new ATOM 0 HD3 ARG A 71 27.167 19.323 -18.140 1.00 74.32 H new ATOM 0 HE ARG A 71 28.938 18.129 -20.159 1.00 40.45 H new ATOM 0 HH11 ARG A 71 28.578 19.244 -16.829 1.00 3.21 H new ATOM 0 HH12 ARG A 71 29.892 18.229 -16.225 1.00 3.21 H new ATOM 0 HH21 ARG A 71 30.623 16.827 -19.376 1.00 72.12 H new ATOM 0 HH22 ARG A 71 31.045 16.866 -17.661 1.00 72.12 H new ATOM 1059 N GLU A 72 23.187 18.964 -19.588 1.00 45.40 N ATOM 1060 CA GLU A 72 22.170 19.994 -19.409 1.00 60.45 C ATOM 1061 C GLU A 72 21.615 19.969 -17.988 1.00 43.41 C ATOM 1062 O GLU A 72 21.780 20.926 -17.230 1.00 24.30 O ATOM 1063 CB GLU A 72 21.034 19.799 -20.415 1.00 73.35 C ATOM 1064 CG GLU A 72 21.258 20.520 -21.734 1.00 13.01 C ATOM 1065 CD GLU A 72 20.135 20.285 -22.726 1.00 12.15 C ATOM 1066 OE1 GLU A 72 19.088 20.955 -22.607 1.00 33.24 O ATOM 1067 OE2 GLU A 72 20.304 19.431 -23.621 1.00 0.00 O ATOM 0 H GLU A 72 23.040 18.362 -20.398 1.00 45.40 H new ATOM 0 HA GLU A 72 22.637 20.964 -19.581 1.00 60.45 H new ATOM 0 HB2 GLU A 72 20.911 18.734 -20.609 1.00 73.35 H new ATOM 0 HB3 GLU A 72 20.103 20.152 -19.972 1.00 73.35 H new ATOM 0 HG2 GLU A 72 21.355 21.590 -21.547 1.00 13.01 H new ATOM 0 HG3 GLU A 72 22.199 20.186 -22.171 1.00 13.01 H new ATOM 1074 N ILE A 73 20.957 18.871 -17.635 1.00 21.42 N ATOM 1075 CA ILE A 73 20.379 18.721 -16.305 1.00 54.53 C ATOM 1076 C ILE A 73 21.423 18.965 -15.221 1.00 32.50 C ATOM 1077 O ILE A 73 21.118 19.521 -14.167 1.00 23.14 O ATOM 1078 CB ILE A 73 19.769 17.321 -16.110 1.00 60.45 C ATOM 1079 CG1 ILE A 73 18.624 17.097 -17.100 1.00 34.20 C ATOM 1080 CG2 ILE A 73 19.281 17.150 -14.680 1.00 22.54 C ATOM 1081 CD1 ILE A 73 17.442 18.013 -16.874 1.00 12.44 C ATOM 0 H ILE A 73 20.810 18.072 -18.251 1.00 21.42 H new ATOM 0 HA ILE A 73 19.589 19.467 -16.219 1.00 54.53 H new ATOM 0 HB ILE A 73 20.541 16.575 -16.301 1.00 60.45 H new ATOM 0 HG12 ILE A 73 18.997 17.242 -18.114 1.00 34.20 H new ATOM 0 HG13 ILE A 73 18.290 16.062 -17.029 1.00 34.20 H new ATOM 0 HG21 ILE A 73 18.852 16.155 -14.558 1.00 22.54 H new ATOM 0 HG22 ILE A 73 20.118 17.271 -13.993 1.00 22.54 H new ATOM 0 HG23 ILE A 73 18.522 17.901 -14.462 1.00 22.54 H new ATOM 0 HD11 ILE A 73 16.669 17.798 -17.612 1.00 12.44 H new ATOM 0 HD12 ILE A 73 17.043 17.852 -15.873 1.00 12.44 H new ATOM 0 HD13 ILE A 73 17.761 19.050 -16.975 1.00 12.44 H new ATOM 1093 N GLU A 74 22.655 18.545 -15.489 1.00 64.22 N ATOM 1094 CA GLU A 74 23.745 18.718 -14.536 1.00 1.31 C ATOM 1095 C GLU A 74 23.969 20.196 -14.229 1.00 0.24 C ATOM 1096 O GLU A 74 23.967 20.607 -13.069 1.00 21.24 O ATOM 1097 CB GLU A 74 25.033 18.099 -15.082 1.00 22.33 C ATOM 1098 CG GLU A 74 25.366 16.748 -14.470 1.00 10.33 C ATOM 1099 CD GLU A 74 26.748 16.258 -14.854 1.00 44.23 C ATOM 1100 OE1 GLU A 74 26.890 15.684 -15.954 1.00 44.10 O ATOM 1101 OE2 GLU A 74 27.689 16.449 -14.055 1.00 13.42 O ATOM 0 H GLU A 74 22.923 18.083 -16.358 1.00 64.22 H new ATOM 0 HA GLU A 74 23.470 18.210 -13.612 1.00 1.31 H new ATOM 0 HB2 GLU A 74 24.943 17.987 -16.162 1.00 22.33 H new ATOM 0 HB3 GLU A 74 25.861 18.785 -14.901 1.00 22.33 H new ATOM 0 HG2 GLU A 74 25.298 16.819 -13.384 1.00 10.33 H new ATOM 0 HG3 GLU A 74 24.624 16.016 -14.789 1.00 10.33 H new ATOM 1108 N MET A 75 24.162 20.990 -15.277 1.00 65.30 N ATOM 1109 CA MET A 75 24.387 22.422 -15.120 1.00 24.03 C ATOM 1110 C MET A 75 23.107 23.129 -14.688 1.00 13.13 C ATOM 1111 O MET A 75 23.151 24.213 -14.106 1.00 60.23 O ATOM 1112 CB MET A 75 24.901 23.026 -16.428 1.00 51.11 C ATOM 1113 CG MET A 75 26.390 23.330 -16.414 1.00 23.22 C ATOM 1114 SD MET A 75 26.747 25.073 -16.709 1.00 34.52 S ATOM 1115 CE MET A 75 25.992 25.305 -18.317 1.00 22.14 C ATOM 0 H MET A 75 24.167 20.666 -16.244 1.00 65.30 H new ATOM 0 HA MET A 75 25.139 22.563 -14.343 1.00 24.03 H new ATOM 0 HB2 MET A 75 24.687 22.337 -17.245 1.00 51.11 H new ATOM 0 HB3 MET A 75 24.353 23.945 -16.634 1.00 51.11 H new ATOM 0 HG2 MET A 75 26.808 23.036 -15.451 1.00 23.22 H new ATOM 0 HG3 MET A 75 26.887 22.728 -17.175 1.00 23.22 H new ATOM 0 HE1 MET A 75 26.511 26.101 -18.851 1.00 22.14 H new ATOM 0 HE2 MET A 75 26.062 24.379 -18.889 1.00 22.14 H new ATOM 0 HE3 MET A 75 24.944 25.576 -18.191 1.00 22.14 H new ATOM 1125 N ALA A 76 21.967 22.509 -14.976 1.00 63.21 N ATOM 1126 CA ALA A 76 20.675 23.078 -14.616 1.00 11.42 C ATOM 1127 C ALA A 76 20.509 23.148 -13.102 1.00 13.25 C ATOM 1128 O ALA A 76 19.962 24.116 -12.573 1.00 23.34 O ATOM 1129 CB ALA A 76 19.548 22.265 -15.235 1.00 63.14 C ATOM 0 H ALA A 76 21.913 21.612 -15.458 1.00 63.21 H new ATOM 0 HA ALA A 76 20.632 24.094 -15.008 1.00 11.42 H new ATOM 0 HB1 ALA A 76 18.589 22.702 -14.957 1.00 63.14 H new ATOM 0 HB2 ALA A 76 19.649 22.271 -16.320 1.00 63.14 H new ATOM 0 HB3 ALA A 76 19.598 21.239 -14.872 1.00 63.14 H new ATOM 1135 N GLN A 77 20.983 22.116 -12.411 1.00 11.53 N ATOM 1136 CA GLN A 77 20.885 22.061 -10.957 1.00 13.41 C ATOM 1137 C GLN A 77 21.665 23.204 -10.315 1.00 20.20 C ATOM 1138 O GLN A 77 21.097 24.042 -9.615 1.00 14.01 O ATOM 1139 CB GLN A 77 21.405 20.719 -10.440 1.00 71.01 C ATOM 1140 CG GLN A 77 20.439 19.566 -10.660 1.00 54.44 C ATOM 1141 CD GLN A 77 20.991 18.241 -10.175 1.00 62.44 C ATOM 1142 OE1 GLN A 77 21.931 18.200 -9.381 1.00 13.05 O ATOM 1143 NE2 GLN A 77 20.409 17.146 -10.652 1.00 44.44 N ATOM 0 H GLN A 77 21.438 21.307 -12.834 1.00 11.53 H new ATOM 0 HA GLN A 77 19.835 22.165 -10.685 1.00 13.41 H new ATOM 0 HB2 GLN A 77 22.349 20.490 -10.934 1.00 71.01 H new ATOM 0 HB3 GLN A 77 21.616 20.807 -9.374 1.00 71.01 H new ATOM 0 HG2 GLN A 77 19.504 19.777 -10.142 1.00 54.44 H new ATOM 0 HG3 GLN A 77 20.205 19.491 -11.722 1.00 54.44 H new ATOM 0 HE21 GLN A 77 19.632 17.226 -11.309 1.00 44.44 H new ATOM 0 HE22 GLN A 77 20.739 16.225 -10.362 1.00 44.44 H new ATOM 1152 N LYS A 78 22.971 23.231 -10.558 1.00 1.25 N ATOM 1153 CA LYS A 78 23.831 24.271 -10.004 1.00 71.24 C ATOM 1154 C LYS A 78 23.273 25.657 -10.309 1.00 50.42 C ATOM 1155 O LYS A 78 23.243 26.530 -9.441 1.00 14.34 O ATOM 1156 CB LYS A 78 25.247 24.144 -10.569 1.00 65.14 C ATOM 1157 CG LYS A 78 26.317 23.992 -9.501 1.00 51.35 C ATOM 1158 CD LYS A 78 27.706 24.239 -10.065 1.00 3.12 C ATOM 1159 CE LYS A 78 28.749 24.318 -8.961 1.00 25.04 C ATOM 1160 NZ LYS A 78 30.062 24.801 -9.471 1.00 63.23 N ATOM 0 H LYS A 78 23.457 22.545 -11.135 1.00 1.25 H new ATOM 0 HA LYS A 78 23.865 24.142 -8.922 1.00 71.24 H new ATOM 0 HB2 LYS A 78 25.287 23.283 -11.236 1.00 65.14 H new ATOM 0 HB3 LYS A 78 25.469 25.025 -11.171 1.00 65.14 H new ATOM 0 HG2 LYS A 78 26.123 24.692 -8.688 1.00 51.35 H new ATOM 0 HG3 LYS A 78 26.269 22.989 -9.076 1.00 51.35 H new ATOM 0 HD2 LYS A 78 27.967 23.438 -10.757 1.00 3.12 H new ATOM 0 HD3 LYS A 78 27.708 25.167 -10.636 1.00 3.12 H new ATOM 0 HE2 LYS A 78 28.396 24.987 -8.176 1.00 25.04 H new ATOM 0 HE3 LYS A 78 28.875 23.334 -8.509 1.00 25.04 H new ATOM 0 HZ1 LYS A 78 30.745 24.841 -8.688 1.00 63.23 H new ATOM 0 HZ2 LYS A 78 30.411 24.149 -10.203 1.00 63.23 H new ATOM 0 HZ3 LYS A 78 29.948 25.751 -9.879 1.00 63.23 H new ATOM 1174 N LEU A 79 22.831 25.853 -11.547 1.00 2.44 N ATOM 1175 CA LEU A 79 22.272 27.134 -11.966 1.00 3.14 C ATOM 1176 C LEU A 79 21.063 27.505 -11.114 1.00 14.12 C ATOM 1177 O LEU A 79 20.877 28.668 -10.753 1.00 52.24 O ATOM 1178 CB LEU A 79 21.874 27.081 -13.442 1.00 21.35 C ATOM 1179 CG LEU A 79 21.444 28.407 -14.069 1.00 44.12 C ATOM 1180 CD1 LEU A 79 22.631 29.351 -14.188 1.00 20.15 C ATOM 1181 CD2 LEU A 79 20.810 28.171 -15.432 1.00 40.52 C ATOM 0 H LEU A 79 22.849 25.142 -12.278 1.00 2.44 H new ATOM 0 HA LEU A 79 23.037 27.898 -11.830 1.00 3.14 H new ATOM 0 HB2 LEU A 79 22.717 26.689 -14.011 1.00 21.35 H new ATOM 0 HB3 LEU A 79 21.057 26.368 -13.552 1.00 21.35 H new ATOM 0 HG LEU A 79 20.701 28.870 -13.420 1.00 44.12 H new ATOM 0 HD11 LEU A 79 22.306 30.290 -14.636 1.00 20.15 H new ATOM 0 HD12 LEU A 79 23.042 29.545 -13.197 1.00 20.15 H new ATOM 0 HD13 LEU A 79 23.397 28.895 -14.816 1.00 20.15 H new ATOM 0 HD21 LEU A 79 20.510 29.126 -15.864 1.00 40.52 H new ATOM 0 HD22 LEU A 79 21.531 27.686 -16.090 1.00 40.52 H new ATOM 0 HD23 LEU A 79 19.934 27.532 -15.320 1.00 40.52 H new ATOM 1193 N LEU A 80 20.244 26.510 -10.793 1.00 74.53 N ATOM 1194 CA LEU A 80 19.052 26.730 -9.981 1.00 40.32 C ATOM 1195 C LEU A 80 19.409 27.412 -8.664 1.00 63.51 C ATOM 1196 O LEU A 80 18.963 28.524 -8.389 1.00 0.35 O ATOM 1197 CB LEU A 80 18.345 25.402 -9.706 1.00 60.01 C ATOM 1198 CG LEU A 80 16.909 25.287 -10.219 1.00 41.11 C ATOM 1199 CD1 LEU A 80 16.870 25.433 -11.732 1.00 74.34 C ATOM 1200 CD2 LEU A 80 16.295 23.962 -9.793 1.00 31.33 C ATOM 0 H LEU A 80 20.383 25.542 -11.083 1.00 74.53 H new ATOM 0 HA LEU A 80 18.379 27.383 -10.537 1.00 40.32 H new ATOM 0 HB2 LEU A 80 18.934 24.601 -10.152 1.00 60.01 H new ATOM 0 HB3 LEU A 80 18.340 25.232 -8.629 1.00 60.01 H new ATOM 0 HG LEU A 80 16.321 26.094 -9.781 1.00 41.11 H new ATOM 0 HD11 LEU A 80 15.840 25.348 -12.079 1.00 74.34 H new ATOM 0 HD12 LEU A 80 17.269 26.407 -12.014 1.00 74.34 H new ATOM 0 HD13 LEU A 80 17.473 24.648 -12.189 1.00 74.34 H new ATOM 0 HD21 LEU A 80 15.273 23.898 -10.167 1.00 31.33 H new ATOM 0 HD22 LEU A 80 16.883 23.140 -10.201 1.00 31.33 H new ATOM 0 HD23 LEU A 80 16.288 23.897 -8.705 1.00 31.33 H new ATOM 1212 N ASN A 81 20.219 26.736 -7.855 1.00 30.01 N ATOM 1213 CA ASN A 81 20.638 27.277 -6.567 1.00 50.00 C ATOM 1214 C ASN A 81 21.267 28.657 -6.735 1.00 60.33 C ATOM 1215 O ASN A 81 20.941 29.592 -6.005 1.00 1.24 O ATOM 1216 CB ASN A 81 21.632 26.330 -5.892 1.00 32.15 C ATOM 1217 CG ASN A 81 21.168 24.886 -5.923 1.00 51.52 C ATOM 1218 OD1 ASN A 81 21.720 24.061 -6.651 1.00 54.45 O ATOM 1219 ND2 ASN A 81 20.148 24.575 -5.131 1.00 45.31 N ATOM 0 H ASN A 81 20.598 25.813 -8.069 1.00 30.01 H new ATOM 0 HA ASN A 81 19.754 27.375 -5.937 1.00 50.00 H new ATOM 0 HB2 ASN A 81 22.599 26.409 -6.389 1.00 32.15 H new ATOM 0 HB3 ASN A 81 21.779 26.639 -4.857 1.00 32.15 H new ATOM 0 HD21 ASN A 81 19.792 23.619 -5.110 1.00 45.31 H new ATOM 0 HD22 ASN A 81 19.721 25.292 -4.544 1.00 45.31 H new ATOM 1226 N SER A 82 22.170 28.775 -7.704 1.00 11.45 N ATOM 1227 CA SER A 82 22.847 30.040 -7.966 1.00 64.43 C ATOM 1228 C SER A 82 21.838 31.168 -8.153 1.00 10.31 C ATOM 1229 O SER A 82 21.797 32.116 -7.368 1.00 24.22 O ATOM 1230 CB SER A 82 23.731 29.920 -9.209 1.00 45.11 C ATOM 1231 OG SER A 82 25.043 29.508 -8.864 1.00 73.25 O ATOM 0 H SER A 82 22.449 28.011 -8.320 1.00 11.45 H new ATOM 0 HA SER A 82 23.472 30.275 -7.104 1.00 64.43 H new ATOM 0 HB2 SER A 82 23.292 29.203 -9.903 1.00 45.11 H new ATOM 0 HB3 SER A 82 23.771 30.880 -9.724 1.00 45.11 H new ATOM 0 HG SER A 82 25.588 29.437 -9.676 1.00 73.25 H new ATOM 1237 N ASP A 83 21.025 31.059 -9.198 1.00 11.43 N ATOM 1238 CA ASP A 83 20.014 32.069 -9.489 1.00 10.45 C ATOM 1239 C ASP A 83 19.084 32.267 -8.295 1.00 61.24 C ATOM 1240 O ASP A 83 18.723 33.394 -7.956 1.00 51.50 O ATOM 1241 CB ASP A 83 19.203 31.670 -10.722 1.00 61.32 C ATOM 1242 CG ASP A 83 18.526 32.856 -11.379 1.00 54.21 C ATOM 1243 OD1 ASP A 83 17.420 33.230 -10.933 1.00 44.53 O ATOM 1244 OD2 ASP A 83 19.101 33.411 -12.338 1.00 52.23 O ATOM 0 H ASP A 83 21.046 30.281 -9.858 1.00 11.43 H new ATOM 0 HA ASP A 83 20.525 33.011 -9.689 1.00 10.45 H new ATOM 0 HB2 ASP A 83 19.860 31.185 -11.444 1.00 61.32 H new ATOM 0 HB3 ASP A 83 18.448 30.938 -10.435 1.00 61.32 H new ATOM 1249 N LEU A 84 18.699 31.164 -7.663 1.00 61.32 N ATOM 1250 CA LEU A 84 17.810 31.215 -6.508 1.00 31.21 C ATOM 1251 C LEU A 84 18.323 32.208 -5.470 1.00 34.34 C ATOM 1252 O LEU A 84 17.626 33.154 -5.104 1.00 34.43 O ATOM 1253 CB LEU A 84 17.677 29.826 -5.880 1.00 53.22 C ATOM 1254 CG LEU A 84 17.094 29.781 -4.467 1.00 51.43 C ATOM 1255 CD1 LEU A 84 15.776 30.538 -4.409 1.00 42.51 C ATOM 1256 CD2 LEU A 84 16.904 28.341 -4.014 1.00 41.21 C ATOM 0 H LEU A 84 18.989 30.223 -7.931 1.00 61.32 H new ATOM 0 HA LEU A 84 16.830 31.548 -6.849 1.00 31.21 H new ATOM 0 HB2 LEU A 84 17.051 29.214 -6.529 1.00 53.22 H new ATOM 0 HB3 LEU A 84 18.663 29.363 -5.859 1.00 53.22 H new ATOM 0 HG LEU A 84 17.797 30.264 -3.789 1.00 51.43 H new ATOM 0 HD11 LEU A 84 15.376 30.495 -3.396 1.00 42.51 H new ATOM 0 HD12 LEU A 84 15.941 31.578 -4.690 1.00 42.51 H new ATOM 0 HD13 LEU A 84 15.065 30.084 -5.099 1.00 42.51 H new ATOM 0 HD21 LEU A 84 16.488 28.328 -3.006 1.00 41.21 H new ATOM 0 HD22 LEU A 84 16.221 27.833 -4.695 1.00 41.21 H new ATOM 0 HD23 LEU A 84 17.866 27.829 -4.016 1.00 41.21 H new ATOM 1268 N ALA A 85 19.546 31.986 -5.001 1.00 2.44 N ATOM 1269 CA ALA A 85 20.154 32.864 -4.008 1.00 20.21 C ATOM 1270 C ALA A 85 20.126 34.317 -4.469 1.00 14.10 C ATOM 1271 O ALA A 85 19.950 35.230 -3.662 1.00 61.35 O ATOM 1272 CB ALA A 85 21.583 32.427 -3.722 1.00 21.23 C ATOM 0 H ALA A 85 20.135 31.206 -5.292 1.00 2.44 H new ATOM 0 HA ALA A 85 19.572 32.790 -3.089 1.00 20.21 H new ATOM 0 HB1 ALA A 85 22.025 33.091 -2.979 1.00 21.23 H new ATOM 0 HB2 ALA A 85 21.582 31.406 -3.341 1.00 21.23 H new ATOM 0 HB3 ALA A 85 22.168 32.471 -4.641 1.00 21.23 H new ATOM 1278 N GLU A 86 20.300 34.524 -5.771 1.00 31.14 N ATOM 1279 CA GLU A 86 20.296 35.867 -6.337 1.00 55.43 C ATOM 1280 C GLU A 86 18.926 36.521 -6.177 1.00 0.13 C ATOM 1281 O GLU A 86 18.824 37.701 -5.838 1.00 24.13 O ATOM 1282 CB GLU A 86 20.681 35.822 -7.817 1.00 73.14 C ATOM 1283 CG GLU A 86 22.060 36.391 -8.105 1.00 71.22 C ATOM 1284 CD GLU A 86 22.205 37.829 -7.648 1.00 13.33 C ATOM 1285 OE1 GLU A 86 21.318 38.647 -7.970 1.00 42.25 O ATOM 1286 OE2 GLU A 86 23.205 38.137 -6.966 1.00 63.43 O ATOM 0 H GLU A 86 20.445 33.779 -6.452 1.00 31.14 H new ATOM 0 HA GLU A 86 21.030 36.464 -5.796 1.00 55.43 H new ATOM 0 HB2 GLU A 86 20.644 34.789 -8.162 1.00 73.14 H new ATOM 0 HB3 GLU A 86 19.941 36.377 -8.393 1.00 73.14 H new ATOM 0 HG2 GLU A 86 22.813 35.778 -7.609 1.00 71.22 H new ATOM 0 HG3 GLU A 86 22.257 36.332 -9.175 1.00 71.22 H new ATOM 1293 N LEU A 87 17.875 35.747 -6.423 1.00 61.20 N ATOM 1294 CA LEU A 87 16.510 36.249 -6.307 1.00 5.33 C ATOM 1295 C LEU A 87 16.186 36.615 -4.862 1.00 2.02 C ATOM 1296 O LEU A 87 15.758 37.733 -4.576 1.00 13.44 O ATOM 1297 CB LEU A 87 15.516 35.204 -6.816 1.00 1.32 C ATOM 1298 CG LEU A 87 15.691 34.764 -8.270 1.00 32.14 C ATOM 1299 CD1 LEU A 87 14.621 33.754 -8.653 1.00 73.35 C ATOM 1300 CD2 LEU A 87 15.649 35.967 -9.200 1.00 42.21 C ATOM 0 H LEU A 87 17.942 34.769 -6.704 1.00 61.20 H new ATOM 0 HA LEU A 87 16.426 37.148 -6.918 1.00 5.33 H new ATOM 0 HB2 LEU A 87 15.588 34.322 -6.179 1.00 1.32 H new ATOM 0 HB3 LEU A 87 14.508 35.602 -6.696 1.00 1.32 H new ATOM 0 HG LEU A 87 16.666 34.287 -8.371 1.00 32.14 H new ATOM 0 HD11 LEU A 87 14.761 33.452 -9.691 1.00 73.35 H new ATOM 0 HD12 LEU A 87 14.698 32.880 -8.007 1.00 73.35 H new ATOM 0 HD13 LEU A 87 13.636 34.206 -8.536 1.00 73.35 H new ATOM 0 HD21 LEU A 87 15.775 35.635 -10.230 1.00 42.21 H new ATOM 0 HD22 LEU A 87 14.689 36.473 -9.097 1.00 42.21 H new ATOM 0 HD23 LEU A 87 16.453 36.656 -8.940 1.00 42.21 H new ATOM 1312 N ILE A 88 16.395 35.666 -3.956 1.00 4.14 N ATOM 1313 CA ILE A 88 16.128 35.890 -2.540 1.00 65.02 C ATOM 1314 C ILE A 88 16.893 37.104 -2.022 1.00 34.41 C ATOM 1315 O ILE A 88 16.404 37.837 -1.164 1.00 51.30 O ATOM 1316 CB ILE A 88 16.507 34.660 -1.695 1.00 33.35 C ATOM 1317 CG1 ILE A 88 15.836 33.403 -2.254 1.00 15.44 C ATOM 1318 CG2 ILE A 88 16.113 34.875 -0.241 1.00 32.21 C ATOM 1319 CD1 ILE A 88 14.328 33.507 -2.332 1.00 5.41 C ATOM 0 H ILE A 88 16.748 34.735 -4.177 1.00 4.14 H new ATOM 0 HA ILE A 88 15.057 36.070 -2.445 1.00 65.02 H new ATOM 0 HB ILE A 88 17.587 34.524 -1.742 1.00 33.35 H new ATOM 0 HG12 ILE A 88 16.230 33.203 -3.250 1.00 15.44 H new ATOM 0 HG13 ILE A 88 16.102 32.551 -1.629 1.00 15.44 H new ATOM 0 HG21 ILE A 88 16.387 33.997 0.344 1.00 32.21 H new ATOM 0 HG22 ILE A 88 16.633 35.749 0.151 1.00 32.21 H new ATOM 0 HG23 ILE A 88 15.037 35.033 -0.175 1.00 32.21 H new ATOM 0 HD11 ILE A 88 13.920 32.581 -2.737 1.00 5.41 H new ATOM 0 HD12 ILE A 88 13.923 33.676 -1.334 1.00 5.41 H new ATOM 0 HD13 ILE A 88 14.054 34.339 -2.981 1.00 5.41 H new ATOM 1331 N ASN A 89 18.095 37.309 -2.551 1.00 15.33 N ATOM 1332 CA ASN A 89 18.927 38.435 -2.142 1.00 54.34 C ATOM 1333 C ASN A 89 18.202 39.758 -2.372 1.00 2.35 C ATOM 1334 O ASN A 89 18.049 40.563 -1.452 1.00 64.12 O ATOM 1335 CB ASN A 89 20.249 38.425 -2.912 1.00 73.14 C ATOM 1336 CG ASN A 89 21.302 39.303 -2.264 1.00 61.44 C ATOM 1337 OD1 ASN A 89 20.982 40.290 -1.603 1.00 12.30 O ATOM 1338 ND2 ASN A 89 22.567 38.945 -2.453 1.00 1.35 N ATOM 0 H ASN A 89 18.514 36.711 -3.263 1.00 15.33 H new ATOM 0 HA ASN A 89 19.134 38.334 -1.077 1.00 54.34 H new ATOM 0 HB2 ASN A 89 20.621 37.403 -2.976 1.00 73.14 H new ATOM 0 HB3 ASN A 89 20.074 38.765 -3.933 1.00 73.14 H new ATOM 0 HD21 ASN A 89 23.320 39.497 -2.042 1.00 1.35 H new ATOM 0 HD22 ASN A 89 22.785 38.118 -3.009 1.00 1.35 H new ATOM 1345 N LYS A 90 17.757 39.977 -3.604 1.00 71.12 N ATOM 1346 CA LYS A 90 17.046 41.201 -3.956 1.00 25.42 C ATOM 1347 C LYS A 90 15.870 41.436 -3.014 1.00 54.14 C ATOM 1348 O LYS A 90 15.560 42.575 -2.666 1.00 52.13 O ATOM 1349 CB LYS A 90 16.550 41.129 -5.402 1.00 3.23 C ATOM 1350 CG LYS A 90 17.652 40.853 -6.410 1.00 2.10 C ATOM 1351 CD LYS A 90 18.351 42.133 -6.836 1.00 65.03 C ATOM 1352 CE LYS A 90 19.752 41.855 -7.360 1.00 3.03 C ATOM 1353 NZ LYS A 90 20.659 43.020 -7.165 1.00 14.40 N ATOM 0 H LYS A 90 17.876 39.322 -4.377 1.00 71.12 H new ATOM 0 HA LYS A 90 17.739 42.036 -3.858 1.00 25.42 H new ATOM 0 HB2 LYS A 90 15.794 40.347 -5.479 1.00 3.23 H new ATOM 0 HB3 LYS A 90 16.063 42.070 -5.657 1.00 3.23 H new ATOM 0 HG2 LYS A 90 18.380 40.167 -5.976 1.00 2.10 H new ATOM 0 HG3 LYS A 90 17.230 40.359 -7.285 1.00 2.10 H new ATOM 0 HD2 LYS A 90 17.764 42.629 -7.609 1.00 65.03 H new ATOM 0 HD3 LYS A 90 18.407 42.817 -5.989 1.00 65.03 H new ATOM 0 HE2 LYS A 90 20.164 40.984 -6.850 1.00 3.03 H new ATOM 0 HE3 LYS A 90 19.701 41.608 -8.420 1.00 3.03 H new ATOM 0 HZ1 LYS A 90 21.635 42.742 -7.392 1.00 14.40 H new ATOM 0 HZ2 LYS A 90 20.366 43.797 -7.791 1.00 14.40 H new ATOM 0 HZ3 LYS A 90 20.611 43.336 -6.175 1.00 14.40 H new ATOM 1367 N MET A 91 15.219 40.352 -2.605 1.00 51.02 N ATOM 1368 CA MET A 91 14.078 40.442 -1.702 1.00 33.34 C ATOM 1369 C MET A 91 14.450 41.197 -0.430 1.00 34.04 C ATOM 1370 O MET A 91 13.784 42.161 -0.050 1.00 72.51 O ATOM 1371 CB MET A 91 13.569 39.043 -1.348 1.00 31.01 C ATOM 1372 CG MET A 91 12.212 39.045 -0.663 1.00 1.25 C ATOM 1373 SD MET A 91 12.176 38.004 0.809 1.00 74.31 S ATOM 1374 CE MET A 91 11.528 39.153 2.021 1.00 71.42 C ATOM 0 H MET A 91 15.462 39.402 -2.884 1.00 51.02 H new ATOM 0 HA MET A 91 13.286 40.991 -2.211 1.00 33.34 H new ATOM 0 HB2 MET A 91 13.506 38.447 -2.258 1.00 31.01 H new ATOM 0 HB3 MET A 91 14.295 38.555 -0.697 1.00 31.01 H new ATOM 0 HG2 MET A 91 11.950 40.066 -0.387 1.00 1.25 H new ATOM 0 HG3 MET A 91 11.454 38.700 -1.366 1.00 1.25 H new ATOM 0 HE1 MET A 91 11.447 38.655 2.987 1.00 71.42 H new ATOM 0 HE2 MET A 91 12.199 40.007 2.108 1.00 71.42 H new ATOM 0 HE3 MET A 91 10.543 39.497 1.706 1.00 71.42 H new ATOM 1384 N LYS A 92 15.517 40.753 0.226 1.00 51.41 N ATOM 1385 CA LYS A 92 15.979 41.387 1.455 1.00 13.40 C ATOM 1386 C LYS A 92 16.356 42.845 1.207 1.00 34.42 C ATOM 1387 O LYS A 92 16.309 43.672 2.118 1.00 1.14 O ATOM 1388 CB LYS A 92 17.179 40.629 2.025 1.00 64.34 C ATOM 1389 CG LYS A 92 16.867 39.191 2.403 1.00 51.31 C ATOM 1390 CD LYS A 92 16.573 39.057 3.888 1.00 73.24 C ATOM 1391 CE LYS A 92 15.471 38.040 4.148 1.00 44.43 C ATOM 1392 NZ LYS A 92 15.907 36.982 5.100 1.00 2.03 N ATOM 0 H LYS A 92 16.078 39.956 -0.073 1.00 51.41 H new ATOM 0 HA LYS A 92 15.163 41.359 2.177 1.00 13.40 H new ATOM 0 HB2 LYS A 92 17.985 40.636 1.291 1.00 64.34 H new ATOM 0 HB3 LYS A 92 17.546 41.156 2.906 1.00 64.34 H new ATOM 0 HG2 LYS A 92 16.010 38.840 1.828 1.00 51.31 H new ATOM 0 HG3 LYS A 92 17.710 38.553 2.139 1.00 51.31 H new ATOM 0 HD2 LYS A 92 17.479 38.756 4.414 1.00 73.24 H new ATOM 0 HD3 LYS A 92 16.278 40.026 4.291 1.00 73.24 H new ATOM 0 HE2 LYS A 92 14.594 38.549 4.547 1.00 44.43 H new ATOM 0 HE3 LYS A 92 15.171 37.580 3.206 1.00 44.43 H new ATOM 0 HZ1 LYS A 92 15.182 36.238 5.147 1.00 2.03 H new ATOM 0 HZ2 LYS A 92 16.805 36.571 4.775 1.00 2.03 H new ATOM 0 HZ3 LYS A 92 16.039 37.397 6.044 1.00 2.03 H new ATOM 1406 N LEU A 93 16.727 43.152 -0.030 1.00 44.34 N ATOM 1407 CA LEU A 93 17.111 44.511 -0.399 1.00 31.15 C ATOM 1408 C LEU A 93 15.881 45.400 -0.558 1.00 25.51 C ATOM 1409 O LEU A 93 15.773 46.446 0.080 1.00 42.31 O ATOM 1410 CB LEU A 93 17.918 44.500 -1.698 1.00 20.41 C ATOM 1411 CG LEU A 93 19.430 44.673 -1.550 1.00 61.44 C ATOM 1412 CD1 LEU A 93 20.117 44.539 -2.901 1.00 11.13 C ATOM 1413 CD2 LEU A 93 19.754 46.017 -0.916 1.00 54.50 C ATOM 0 H LEU A 93 16.770 42.479 -0.795 1.00 44.34 H new ATOM 0 HA LEU A 93 17.729 44.917 0.401 1.00 31.15 H new ATOM 0 HB2 LEU A 93 17.729 43.558 -2.212 1.00 20.41 H new ATOM 0 HB3 LEU A 93 17.543 45.295 -2.342 1.00 20.41 H new ATOM 0 HG LEU A 93 19.804 43.886 -0.895 1.00 61.44 H new ATOM 0 HD11 LEU A 93 21.192 44.665 -2.776 1.00 11.13 H new ATOM 0 HD12 LEU A 93 19.913 43.552 -3.317 1.00 11.13 H new ATOM 0 HD13 LEU A 93 19.738 45.304 -3.579 1.00 11.13 H new ATOM 0 HD21 LEU A 93 20.835 46.122 -0.819 1.00 54.50 H new ATOM 0 HD22 LEU A 93 19.366 46.819 -1.545 1.00 54.50 H new ATOM 0 HD23 LEU A 93 19.294 46.074 0.070 1.00 54.50 H new ATOM 1425 N ALA A 94 14.956 44.973 -1.412 1.00 4.44 N ATOM 1426 CA ALA A 94 13.733 45.728 -1.651 1.00 54.13 C ATOM 1427 C ALA A 94 13.049 46.096 -0.339 1.00 75.01 C ATOM 1428 O ALA A 94 12.412 47.144 -0.234 1.00 31.13 O ATOM 1429 CB ALA A 94 12.786 44.931 -2.537 1.00 1.31 C ATOM 0 H ALA A 94 15.031 44.109 -1.949 1.00 4.44 H new ATOM 0 HA ALA A 94 14.000 46.653 -2.162 1.00 54.13 H new ATOM 0 HB1 ALA A 94 11.876 45.507 -2.708 1.00 1.31 H new ATOM 0 HB2 ALA A 94 13.269 44.724 -3.492 1.00 1.31 H new ATOM 0 HB3 ALA A 94 12.534 43.991 -2.047 1.00 1.31 H new ATOM 1435 N GLN A 95 13.184 45.227 0.657 1.00 1.15 N ATOM 1436 CA GLN A 95 12.577 45.461 1.962 1.00 1.34 C ATOM 1437 C GLN A 95 13.055 46.782 2.556 1.00 41.41 C ATOM 1438 O GLN A 95 12.299 47.478 3.233 1.00 2.05 O ATOM 1439 CB GLN A 95 12.907 44.311 2.916 1.00 50.44 C ATOM 1440 CG GLN A 95 11.860 43.209 2.924 1.00 2.15 C ATOM 1441 CD GLN A 95 10.533 43.670 3.494 1.00 73.43 C ATOM 1442 OE1 GLN A 95 10.489 44.413 4.474 1.00 31.25 O ATOM 1443 NE2 GLN A 95 9.440 43.230 2.880 1.00 65.32 N ATOM 0 H GLN A 95 13.708 44.355 0.586 1.00 1.15 H new ATOM 0 HA GLN A 95 11.497 45.513 1.827 1.00 1.34 H new ATOM 0 HB2 GLN A 95 13.870 43.884 2.637 1.00 50.44 H new ATOM 0 HB3 GLN A 95 13.014 44.707 3.926 1.00 50.44 H new ATOM 0 HG2 GLN A 95 11.709 42.849 1.906 1.00 2.15 H new ATOM 0 HG3 GLN A 95 12.229 42.366 3.508 1.00 2.15 H new ATOM 0 HE21 GLN A 95 9.522 42.615 2.070 1.00 65.32 H new ATOM 0 HE22 GLN A 95 8.518 43.507 3.218 1.00 65.32 H new ATOM 1452 N GLN A 96 14.314 47.121 2.297 1.00 70.14 N ATOM 1453 CA GLN A 96 14.892 48.358 2.807 1.00 43.44 C ATOM 1454 C GLN A 96 14.950 49.422 1.715 1.00 4.45 C ATOM 1455 O GLN A 96 15.063 50.614 2.002 1.00 5.43 O ATOM 1456 CB GLN A 96 16.295 48.101 3.359 1.00 21.34 C ATOM 1457 CG GLN A 96 17.382 48.124 2.296 1.00 14.14 C ATOM 1458 CD GLN A 96 18.436 47.058 2.517 1.00 64.34 C ATOM 1459 OE1 GLN A 96 17.999 45.812 2.655 1.00 34.53 O flip ATOM 1460 NE2 GLN A 96 19.632 47.351 2.562 1.00 61.43 N flip ATOM 0 H GLN A 96 14.953 46.556 1.737 1.00 70.14 H new ATOM 0 HA GLN A 96 14.254 48.723 3.612 1.00 43.44 H new ATOM 0 HB2 GLN A 96 16.522 48.853 4.115 1.00 21.34 H new ATOM 0 HB3 GLN A 96 16.308 47.132 3.859 1.00 21.34 H new ATOM 0 HG2 GLN A 96 16.929 47.983 1.315 1.00 14.14 H new ATOM 0 HG3 GLN A 96 17.858 49.105 2.290 1.00 14.14 H new ATOM 0 HE21 GLN A 96 19.924 48.322 2.451 1.00 61.43 H new ATOM 0 HE22 GLN A 96 20.330 46.622 2.710 1.00 61.43 H new ATOM 1469 N TYR A 97 14.873 48.984 0.464 1.00 33.10 N ATOM 1470 CA TYR A 97 14.919 49.899 -0.671 1.00 23.54 C ATOM 1471 C TYR A 97 13.518 50.173 -1.207 1.00 73.21 C ATOM 1472 O TYR A 97 13.343 50.511 -2.378 1.00 4.01 O ATOM 1473 CB TYR A 97 15.799 49.322 -1.781 1.00 51.13 C ATOM 1474 CG TYR A 97 17.221 49.836 -1.756 1.00 54.10 C ATOM 1475 CD1 TYR A 97 17.877 50.062 -0.552 1.00 51.13 C ATOM 1476 CD2 TYR A 97 17.907 50.097 -2.935 1.00 62.24 C ATOM 1477 CE1 TYR A 97 19.176 50.532 -0.524 1.00 53.31 C ATOM 1478 CE2 TYR A 97 19.206 50.566 -2.917 1.00 24.22 C ATOM 1479 CZ TYR A 97 19.836 50.782 -1.709 1.00 2.11 C ATOM 1480 OH TYR A 97 21.130 51.251 -1.686 1.00 71.41 O ATOM 0 H TYR A 97 14.778 48.001 0.209 1.00 33.10 H new ATOM 0 HA TYR A 97 15.347 50.841 -0.329 1.00 23.54 H new ATOM 0 HB2 TYR A 97 15.813 48.236 -1.694 1.00 51.13 H new ATOM 0 HB3 TYR A 97 15.353 49.559 -2.747 1.00 51.13 H new ATOM 0 HD1 TYR A 97 17.363 49.867 0.378 1.00 51.13 H new ATOM 0 HD2 TYR A 97 17.416 49.930 -3.882 1.00 62.24 H new ATOM 0 HE1 TYR A 97 19.672 50.703 0.420 1.00 53.31 H new ATOM 0 HE2 TYR A 97 19.725 50.762 -3.843 1.00 24.22 H new ATOM 0 HH TYR A 97 21.450 51.374 -2.604 1.00 71.41 H new ATOM 1490 N VAL A 98 12.520 50.025 -0.341 1.00 2.10 N ATOM 1491 CA VAL A 98 11.133 50.258 -0.725 1.00 42.13 C ATOM 1492 C VAL A 98 10.608 51.558 -0.127 1.00 1.14 C ATOM 1493 O VAL A 98 9.856 52.290 -0.770 1.00 5.33 O ATOM 1494 CB VAL A 98 10.225 49.097 -0.280 1.00 34.20 C ATOM 1495 CG1 VAL A 98 10.440 48.785 1.193 1.00 20.21 C ATOM 1496 CG2 VAL A 98 8.765 49.427 -0.556 1.00 24.42 C ATOM 0 H VAL A 98 12.647 49.745 0.632 1.00 2.10 H new ATOM 0 HA VAL A 98 11.113 50.328 -1.813 1.00 42.13 H new ATOM 0 HB VAL A 98 10.489 48.211 -0.857 1.00 34.20 H new ATOM 0 HG11 VAL A 98 9.790 47.962 1.489 1.00 20.21 H new ATOM 0 HG12 VAL A 98 11.480 48.503 1.357 1.00 20.21 H new ATOM 0 HG13 VAL A 98 10.205 49.666 1.790 1.00 20.21 H new ATOM 0 HG21 VAL A 98 8.137 48.596 -0.235 1.00 24.42 H new ATOM 0 HG22 VAL A 98 8.485 50.326 -0.007 1.00 24.42 H new ATOM 0 HG23 VAL A 98 8.626 49.596 -1.624 1.00 24.42 H new ATOM 1506 N MET A 99 11.010 51.839 1.109 1.00 74.12 N ATOM 1507 CA MET A 99 10.581 53.052 1.794 1.00 15.51 C ATOM 1508 C MET A 99 11.327 54.271 1.260 1.00 11.04 C ATOM 1509 O MET A 99 10.944 55.412 1.524 1.00 61.50 O ATOM 1510 CB MET A 99 10.808 52.920 3.301 1.00 1.32 C ATOM 1511 CG MET A 99 12.266 53.058 3.710 1.00 14.42 C ATOM 1512 SD MET A 99 12.606 54.616 4.552 1.00 42.34 S ATOM 1513 CE MET A 99 14.392 54.680 4.436 1.00 4.00 C ATOM 0 H MET A 99 11.632 51.243 1.656 1.00 74.12 H new ATOM 0 HA MET A 99 9.516 53.189 1.605 1.00 15.51 H new ATOM 0 HB2 MET A 99 10.221 53.680 3.817 1.00 1.32 H new ATOM 0 HB3 MET A 99 10.436 51.951 3.633 1.00 1.32 H new ATOM 0 HG2 MET A 99 12.536 52.229 4.365 1.00 14.42 H new ATOM 0 HG3 MET A 99 12.897 52.983 2.824 1.00 14.42 H new ATOM 0 HE1 MET A 99 14.824 54.601 5.433 1.00 4.00 H new ATOM 0 HE2 MET A 99 14.746 53.853 3.820 1.00 4.00 H new ATOM 0 HE3 MET A 99 14.694 55.625 3.984 1.00 4.00 H new ATOM 1523 N THR A 100 12.395 54.023 0.508 1.00 11.05 N ATOM 1524 CA THR A 100 13.195 55.100 -0.061 1.00 25.52 C ATOM 1525 C THR A 100 12.647 55.536 -1.414 1.00 53.33 C ATOM 1526 O THR A 100 12.014 56.586 -1.529 1.00 33.22 O ATOM 1527 CB THR A 100 14.667 54.677 -0.229 1.00 22.14 C ATOM 1528 OG1 THR A 100 14.776 53.250 -0.175 1.00 3.12 O ATOM 1529 CG2 THR A 100 15.535 55.298 0.855 1.00 5.21 C ATOM 0 H THR A 100 12.726 53.086 0.279 1.00 11.05 H new ATOM 0 HA THR A 100 13.141 55.936 0.636 1.00 25.52 H new ATOM 0 HB THR A 100 15.015 55.031 -1.199 1.00 22.14 H new ATOM 0 HG1 THR A 100 15.714 52.989 -0.284 1.00 3.12 H new ATOM 0 HG21 THR A 100 16.570 54.985 0.716 1.00 5.21 H new ATOM 0 HG22 THR A 100 15.473 56.384 0.793 1.00 5.21 H new ATOM 0 HG23 THR A 100 15.185 54.970 1.834 1.00 5.21 H new ATOM 1537 N SER A 101 12.893 54.724 -2.437 1.00 53.34 N ATOM 1538 CA SER A 101 12.425 55.029 -3.785 1.00 23.03 C ATOM 1539 C SER A 101 12.918 53.983 -4.780 1.00 74.21 C ATOM 1540 O SER A 101 12.261 53.707 -5.785 1.00 51.42 O ATOM 1541 CB SER A 101 12.902 56.419 -4.211 1.00 21.14 C ATOM 1542 OG SER A 101 11.864 57.375 -4.085 1.00 74.13 O ATOM 0 H SER A 101 13.413 53.850 -2.359 1.00 53.34 H new ATOM 0 HA SER A 101 11.335 55.013 -3.777 1.00 23.03 H new ATOM 0 HB2 SER A 101 13.753 56.718 -3.599 1.00 21.14 H new ATOM 0 HB3 SER A 101 13.248 56.387 -5.244 1.00 21.14 H new ATOM 0 HG SER A 101 11.569 57.417 -3.151 1.00 74.13 H new ATOM 1548 N LEU A 102 14.078 53.403 -4.493 1.00 71.15 N ATOM 1549 CA LEU A 102 14.660 52.386 -5.363 1.00 4.24 C ATOM 1550 C LEU A 102 13.933 51.055 -5.206 1.00 72.35 C ATOM 1551 O LEU A 102 14.531 50.052 -4.817 1.00 42.24 O ATOM 1552 CB LEU A 102 16.147 52.208 -5.047 1.00 54.34 C ATOM 1553 CG LEU A 102 16.969 53.493 -4.944 1.00 43.13 C ATOM 1554 CD1 LEU A 102 18.443 53.169 -4.753 1.00 50.44 C ATOM 1555 CD2 LEU A 102 16.767 54.357 -6.181 1.00 31.33 C ATOM 0 H LEU A 102 14.634 53.619 -3.666 1.00 71.15 H new ATOM 0 HA LEU A 102 14.551 52.719 -6.395 1.00 4.24 H new ATOM 0 HB2 LEU A 102 16.236 51.667 -4.105 1.00 54.34 H new ATOM 0 HB3 LEU A 102 16.589 51.578 -5.819 1.00 54.34 H new ATOM 0 HG LEU A 102 16.625 54.053 -4.075 1.00 43.13 H new ATOM 0 HD11 LEU A 102 19.013 54.095 -4.682 1.00 50.44 H new ATOM 0 HD12 LEU A 102 18.573 52.592 -3.838 1.00 50.44 H new ATOM 0 HD13 LEU A 102 18.801 52.587 -5.603 1.00 50.44 H new ATOM 0 HD21 LEU A 102 17.360 55.267 -6.090 1.00 31.33 H new ATOM 0 HD22 LEU A 102 17.083 53.805 -7.066 1.00 31.33 H new ATOM 0 HD23 LEU A 102 15.713 54.618 -6.274 1.00 31.33 H new ATOM 1567 N GLN A 103 12.640 51.053 -5.515 1.00 30.13 N ATOM 1568 CA GLN A 103 11.832 49.844 -5.410 1.00 32.21 C ATOM 1569 C GLN A 103 11.724 49.142 -6.760 1.00 11.42 C ATOM 1570 O GLN A 103 12.155 48.000 -6.911 1.00 72.35 O ATOM 1571 CB GLN A 103 10.436 50.182 -4.885 1.00 14.34 C ATOM 1572 CG GLN A 103 9.428 49.059 -5.068 1.00 53.11 C ATOM 1573 CD GLN A 103 8.594 48.814 -3.826 1.00 24.03 C ATOM 1574 OE1 GLN A 103 7.672 49.571 -3.524 1.00 13.44 O ATOM 1575 NE2 GLN A 103 8.916 47.751 -3.097 1.00 55.13 N ATOM 0 H GLN A 103 12.130 51.875 -5.840 1.00 30.13 H new ATOM 0 HA GLN A 103 12.323 49.169 -4.708 1.00 32.21 H new ATOM 0 HB2 GLN A 103 10.505 50.428 -3.825 1.00 14.34 H new ATOM 0 HB3 GLN A 103 10.071 51.073 -5.396 1.00 14.34 H new ATOM 0 HG2 GLN A 103 8.769 49.300 -5.902 1.00 53.11 H new ATOM 0 HG3 GLN A 103 9.955 48.143 -5.333 1.00 53.11 H new ATOM 0 HE21 GLN A 103 9.688 47.150 -3.385 1.00 55.13 H new ATOM 0 HE22 GLN A 103 8.391 47.536 -2.250 1.00 55.13 H new ATOM 1584 N GLN A 104 11.146 49.835 -7.736 1.00 71.52 N ATOM 1585 CA GLN A 104 10.981 49.276 -9.073 1.00 52.52 C ATOM 1586 C GLN A 104 12.315 48.788 -9.628 1.00 11.32 C ATOM 1587 O GLN A 104 12.355 47.912 -10.490 1.00 61.52 O ATOM 1588 CB GLN A 104 10.375 50.320 -10.013 1.00 44.32 C ATOM 1589 CG GLN A 104 9.143 51.007 -9.447 1.00 72.22 C ATOM 1590 CD GLN A 104 8.172 51.446 -10.526 1.00 22.22 C ATOM 1591 OE1 GLN A 104 7.005 51.054 -10.523 1.00 53.42 O ATOM 1592 NE2 GLN A 104 8.651 52.264 -11.456 1.00 32.30 N ATOM 0 H GLN A 104 10.785 50.783 -7.627 1.00 71.52 H new ATOM 0 HA GLN A 104 10.305 48.424 -9.003 1.00 52.52 H new ATOM 0 HB2 GLN A 104 11.129 51.074 -10.240 1.00 44.32 H new ATOM 0 HB3 GLN A 104 10.112 49.839 -10.955 1.00 44.32 H new ATOM 0 HG2 GLN A 104 8.636 50.328 -8.761 1.00 72.22 H new ATOM 0 HG3 GLN A 104 9.451 51.876 -8.865 1.00 72.22 H new ATOM 0 HE21 GLN A 104 9.625 52.563 -11.419 1.00 32.30 H new ATOM 0 HE22 GLN A 104 8.045 52.593 -12.207 1.00 32.30 H new ATOM 1601 N GLU A 105 13.404 49.363 -9.127 1.00 63.40 N ATOM 1602 CA GLU A 105 14.740 48.986 -9.574 1.00 70.24 C ATOM 1603 C GLU A 105 14.934 47.474 -9.495 1.00 3.34 C ATOM 1604 O GLU A 105 15.180 46.815 -10.505 1.00 21.11 O ATOM 1605 CB GLU A 105 15.803 49.693 -8.731 1.00 31.11 C ATOM 1606 CG GLU A 105 15.987 51.158 -9.087 1.00 51.52 C ATOM 1607 CD GLU A 105 17.285 51.731 -8.552 1.00 21.55 C ATOM 1608 OE1 GLU A 105 17.885 51.103 -7.655 1.00 24.34 O ATOM 1609 OE2 GLU A 105 17.701 52.807 -9.030 1.00 75.32 O ATOM 0 H GLU A 105 13.387 50.091 -8.412 1.00 63.40 H new ATOM 0 HA GLU A 105 14.848 49.295 -10.614 1.00 70.24 H new ATOM 0 HB2 GLU A 105 15.531 49.615 -7.678 1.00 31.11 H new ATOM 0 HB3 GLU A 105 16.755 49.176 -8.853 1.00 31.11 H new ATOM 0 HG2 GLU A 105 15.965 51.270 -10.171 1.00 51.52 H new ATOM 0 HG3 GLU A 105 15.150 51.732 -8.690 1.00 51.52 H new ATOM 1616 N TYR A 106 14.823 46.933 -8.287 1.00 32.41 N ATOM 1617 CA TYR A 106 14.989 45.500 -8.074 1.00 20.24 C ATOM 1618 C TYR A 106 13.931 44.709 -8.838 1.00 4.05 C ATOM 1619 O TYR A 106 14.188 43.603 -9.313 1.00 24.33 O ATOM 1620 CB TYR A 106 14.908 45.172 -6.582 1.00 1.33 C ATOM 1621 CG TYR A 106 13.646 44.438 -6.191 1.00 15.04 C ATOM 1622 CD1 TYR A 106 13.561 43.055 -6.298 1.00 5.15 C ATOM 1623 CD2 TYR A 106 12.537 45.127 -5.715 1.00 75.32 C ATOM 1624 CE1 TYR A 106 12.410 42.380 -5.942 1.00 72.11 C ATOM 1625 CE2 TYR A 106 11.381 44.460 -5.356 1.00 64.31 C ATOM 1626 CZ TYR A 106 11.323 43.086 -5.471 1.00 52.55 C ATOM 1627 OH TYR A 106 10.173 42.419 -5.116 1.00 64.51 O ATOM 0 H TYR A 106 14.619 47.465 -7.441 1.00 32.41 H new ATOM 0 HA TYR A 106 15.972 45.214 -8.449 1.00 20.24 H new ATOM 0 HB2 TYR A 106 15.771 44.567 -6.304 1.00 1.33 H new ATOM 0 HB3 TYR A 106 14.971 46.098 -6.011 1.00 1.33 H new ATOM 0 HD1 TYR A 106 14.410 42.498 -6.666 1.00 5.15 H new ATOM 0 HD2 TYR A 106 12.579 46.202 -5.624 1.00 75.32 H new ATOM 0 HE1 TYR A 106 12.361 41.305 -6.032 1.00 72.11 H new ATOM 0 HE2 TYR A 106 10.528 45.011 -4.988 1.00 64.31 H new ATOM 0 HH TYR A 106 10.270 42.060 -4.209 1.00 64.51 H new ATOM 1637 N LYS A 107 12.740 45.285 -8.952 1.00 54.23 N ATOM 1638 CA LYS A 107 11.641 44.638 -9.660 1.00 21.14 C ATOM 1639 C LYS A 107 11.981 44.448 -11.135 1.00 15.05 C ATOM 1640 O LYS A 107 11.730 43.388 -11.709 1.00 12.14 O ATOM 1641 CB LYS A 107 10.361 45.465 -9.522 1.00 40.12 C ATOM 1642 CG LYS A 107 9.504 45.067 -8.333 1.00 61.11 C ATOM 1643 CD LYS A 107 9.035 46.283 -7.552 1.00 21.34 C ATOM 1644 CE LYS A 107 8.037 45.899 -6.470 1.00 54.13 C ATOM 1645 NZ LYS A 107 7.135 47.032 -6.121 1.00 30.41 N ATOM 0 H LYS A 107 12.510 46.200 -8.563 1.00 54.23 H new ATOM 0 HA LYS A 107 11.481 43.657 -9.213 1.00 21.14 H new ATOM 0 HB2 LYS A 107 10.627 46.518 -9.431 1.00 40.12 H new ATOM 0 HB3 LYS A 107 9.772 45.363 -10.434 1.00 40.12 H new ATOM 0 HG2 LYS A 107 8.640 44.501 -8.680 1.00 61.11 H new ATOM 0 HG3 LYS A 107 10.074 44.409 -7.677 1.00 61.11 H new ATOM 0 HD2 LYS A 107 9.893 46.778 -7.098 1.00 21.34 H new ATOM 0 HD3 LYS A 107 8.577 47.000 -8.233 1.00 21.34 H new ATOM 0 HE2 LYS A 107 7.441 45.052 -6.809 1.00 54.13 H new ATOM 0 HE3 LYS A 107 8.574 45.574 -5.579 1.00 54.13 H new ATOM 0 HZ1 LYS A 107 7.051 47.103 -5.087 1.00 30.41 H new ATOM 0 HZ2 LYS A 107 7.528 47.918 -6.498 1.00 30.41 H new ATOM 0 HZ3 LYS A 107 6.195 46.867 -6.534 1.00 30.41 H new ATOM 1659 N LYS A 108 12.553 45.481 -11.743 1.00 5.02 N ATOM 1660 CA LYS A 108 12.930 45.428 -13.150 1.00 64.13 C ATOM 1661 C LYS A 108 13.989 44.356 -13.390 1.00 52.10 C ATOM 1662 O LYS A 108 13.746 43.380 -14.099 1.00 30.34 O ATOM 1663 CB LYS A 108 13.455 46.790 -13.611 1.00 20.22 C ATOM 1664 CG LYS A 108 12.360 47.747 -14.049 1.00 21.10 C ATOM 1665 CD LYS A 108 12.453 48.058 -15.533 1.00 53.24 C ATOM 1666 CE LYS A 108 11.647 49.297 -15.894 1.00 63.14 C ATOM 1667 NZ LYS A 108 10.928 49.133 -17.188 1.00 44.53 N ATOM 0 H LYS A 108 12.766 46.366 -11.283 1.00 5.02 H new ATOM 0 HA LYS A 108 12.042 45.173 -13.728 1.00 64.13 H new ATOM 0 HB2 LYS A 108 14.021 47.246 -12.799 1.00 20.22 H new ATOM 0 HB3 LYS A 108 14.149 46.642 -14.439 1.00 20.22 H new ATOM 0 HG2 LYS A 108 11.385 47.312 -13.828 1.00 21.10 H new ATOM 0 HG3 LYS A 108 12.434 48.672 -13.477 1.00 21.10 H new ATOM 0 HD2 LYS A 108 13.497 48.208 -15.810 1.00 53.24 H new ATOM 0 HD3 LYS A 108 12.090 47.206 -16.108 1.00 53.24 H new ATOM 0 HE2 LYS A 108 10.927 49.505 -15.102 1.00 63.14 H new ATOM 0 HE3 LYS A 108 12.312 50.158 -15.955 1.00 63.14 H new ATOM 0 HZ1 LYS A 108 10.391 49.998 -17.399 1.00 44.53 H new ATOM 0 HZ2 LYS A 108 11.616 48.959 -17.948 1.00 44.53 H new ATOM 0 HZ3 LYS A 108 10.274 48.327 -17.122 1.00 44.53 H new ATOM 1681 N GLN A 109 15.162 44.545 -12.794 1.00 14.11 N ATOM 1682 CA GLN A 109 16.256 43.593 -12.943 1.00 10.20 C ATOM 1683 C GLN A 109 15.794 42.177 -12.616 1.00 72.14 C ATOM 1684 O GLN A 109 16.277 41.206 -13.199 1.00 12.42 O ATOM 1685 CB GLN A 109 17.425 43.982 -12.037 1.00 44.40 C ATOM 1686 CG GLN A 109 17.030 44.173 -10.581 1.00 63.45 C ATOM 1687 CD GLN A 109 18.035 45.003 -9.808 1.00 23.24 C ATOM 1688 OE1 GLN A 109 18.964 44.468 -9.201 1.00 42.04 O ATOM 1689 NE2 GLN A 109 17.855 46.318 -9.824 1.00 52.33 N ATOM 0 H GLN A 109 15.379 45.348 -12.204 1.00 14.11 H new ATOM 0 HA GLN A 109 16.586 43.617 -13.982 1.00 10.20 H new ATOM 0 HB2 GLN A 109 18.193 43.211 -12.098 1.00 44.40 H new ATOM 0 HB3 GLN A 109 17.870 44.905 -12.408 1.00 44.40 H new ATOM 0 HG2 GLN A 109 16.053 44.655 -10.534 1.00 63.45 H new ATOM 0 HG3 GLN A 109 16.928 43.198 -10.105 1.00 63.45 H new ATOM 0 HE21 GLN A 109 17.072 46.719 -10.340 1.00 52.33 H new ATOM 0 HE22 GLN A 109 18.500 46.927 -9.320 1.00 52.33 H new ATOM 1698 N MET A 110 14.856 42.067 -11.681 1.00 71.32 N ATOM 1699 CA MET A 110 14.328 40.768 -11.278 1.00 42.41 C ATOM 1700 C MET A 110 13.645 40.071 -12.450 1.00 42.34 C ATOM 1701 O MET A 110 13.922 38.907 -12.740 1.00 64.33 O ATOM 1702 CB MET A 110 13.340 40.932 -10.121 1.00 43.44 C ATOM 1703 CG MET A 110 13.978 40.773 -8.751 1.00 33.43 C ATOM 1704 SD MET A 110 14.541 39.089 -8.439 1.00 24.43 S ATOM 1705 CE MET A 110 12.983 38.261 -8.131 1.00 52.34 C ATOM 0 H MET A 110 14.446 42.861 -11.188 1.00 71.32 H new ATOM 0 HA MET A 110 15.164 40.151 -10.948 1.00 42.41 H new ATOM 0 HB2 MET A 110 12.878 41.917 -10.185 1.00 43.44 H new ATOM 0 HB3 MET A 110 12.542 40.198 -10.229 1.00 43.44 H new ATOM 0 HG2 MET A 110 14.823 41.456 -8.667 1.00 33.43 H new ATOM 0 HG3 MET A 110 13.259 41.060 -7.984 1.00 33.43 H new ATOM 0 HE1 MET A 110 13.069 37.645 -7.236 1.00 52.34 H new ATOM 0 HE2 MET A 110 12.199 39.004 -7.986 1.00 52.34 H new ATOM 0 HE3 MET A 110 12.732 37.629 -8.983 1.00 52.34 H new ATOM 1715 N LEU A 111 12.752 40.790 -13.121 1.00 53.01 N ATOM 1716 CA LEU A 111 12.029 40.240 -14.262 1.00 55.15 C ATOM 1717 C LEU A 111 12.993 39.635 -15.278 1.00 13.31 C ATOM 1718 O LEU A 111 12.767 38.538 -15.788 1.00 72.54 O ATOM 1719 CB LEU A 111 11.184 41.328 -14.929 1.00 24.13 C ATOM 1720 CG LEU A 111 9.669 41.129 -14.876 1.00 23.35 C ATOM 1721 CD1 LEU A 111 8.958 42.233 -15.642 1.00 44.20 C ATOM 1722 CD2 LEU A 111 9.291 39.763 -15.431 1.00 1.24 C ATOM 0 H LEU A 111 12.511 41.755 -12.895 1.00 53.01 H new ATOM 0 HA LEU A 111 11.372 39.451 -13.897 1.00 55.15 H new ATOM 0 HB2 LEU A 111 11.421 42.283 -14.460 1.00 24.13 H new ATOM 0 HB3 LEU A 111 11.484 41.403 -15.974 1.00 24.13 H new ATOM 0 HG LEU A 111 9.352 41.176 -13.834 1.00 23.35 H new ATOM 0 HD11 LEU A 111 7.881 42.074 -15.593 1.00 44.20 H new ATOM 0 HD12 LEU A 111 9.203 43.199 -15.200 1.00 44.20 H new ATOM 0 HD13 LEU A 111 9.280 42.219 -16.683 1.00 44.20 H new ATOM 0 HD21 LEU A 111 8.209 39.638 -15.386 1.00 1.24 H new ATOM 0 HD22 LEU A 111 9.622 39.687 -16.467 1.00 1.24 H new ATOM 0 HD23 LEU A 111 9.771 38.984 -14.839 1.00 1.24 H new ATOM 1734 N THR A 112 14.071 40.358 -15.566 1.00 31.10 N ATOM 1735 CA THR A 112 15.070 39.893 -16.519 1.00 64.22 C ATOM 1736 C THR A 112 15.629 38.534 -16.111 1.00 52.33 C ATOM 1737 O THR A 112 15.652 37.597 -16.909 1.00 11.41 O ATOM 1738 CB THR A 112 16.233 40.895 -16.648 1.00 52.23 C ATOM 1739 OG1 THR A 112 15.818 42.188 -16.194 1.00 33.04 O ATOM 1740 CG2 THR A 112 16.710 40.988 -18.090 1.00 13.01 C ATOM 0 H THR A 112 14.274 41.268 -15.152 1.00 31.10 H new ATOM 0 HA THR A 112 14.569 39.803 -17.483 1.00 64.22 H new ATOM 0 HB THR A 112 17.059 40.541 -16.031 1.00 52.23 H new ATOM 0 HG1 THR A 112 16.563 42.819 -16.278 1.00 33.04 H new ATOM 0 HG21 THR A 112 17.531 41.701 -18.156 1.00 13.01 H new ATOM 0 HG22 THR A 112 17.052 40.008 -18.424 1.00 13.01 H new ATOM 0 HG23 THR A 112 15.888 41.321 -18.724 1.00 13.01 H new ATOM 1748 N ALA A 113 16.078 38.434 -14.864 1.00 54.34 N ATOM 1749 CA ALA A 113 16.633 37.189 -14.350 1.00 65.22 C ATOM 1750 C ALA A 113 15.601 36.067 -14.395 1.00 3.33 C ATOM 1751 O ALA A 113 15.847 35.007 -14.969 1.00 42.11 O ATOM 1752 CB ALA A 113 17.142 37.385 -12.930 1.00 30.34 C ATOM 0 H ALA A 113 16.068 39.201 -14.191 1.00 54.34 H new ATOM 0 HA ALA A 113 17.469 36.902 -14.988 1.00 65.22 H new ATOM 0 HB1 ALA A 113 17.554 36.447 -12.558 1.00 30.34 H new ATOM 0 HB2 ALA A 113 17.919 38.150 -12.924 1.00 30.34 H new ATOM 0 HB3 ALA A 113 16.319 37.699 -12.288 1.00 30.34 H new ATOM 1758 N ALA A 114 14.446 36.308 -13.784 1.00 53.30 N ATOM 1759 CA ALA A 114 13.376 35.319 -13.755 1.00 71.34 C ATOM 1760 C ALA A 114 12.956 34.923 -15.167 1.00 65.31 C ATOM 1761 O ALA A 114 12.472 33.813 -15.394 1.00 4.35 O ATOM 1762 CB ALA A 114 12.182 35.854 -12.979 1.00 2.32 C ATOM 0 H ALA A 114 14.227 37.180 -13.302 1.00 53.30 H new ATOM 0 HA ALA A 114 13.753 34.428 -13.252 1.00 71.34 H new ATOM 0 HB1 ALA A 114 11.391 35.104 -12.966 1.00 2.32 H new ATOM 0 HB2 ALA A 114 12.484 36.080 -11.957 1.00 2.32 H new ATOM 0 HB3 ALA A 114 11.814 36.761 -13.458 1.00 2.32 H new ATOM 1768 N HIS A 115 13.144 35.837 -16.114 1.00 24.23 N ATOM 1769 CA HIS A 115 12.785 35.582 -17.504 1.00 41.43 C ATOM 1770 C HIS A 115 13.574 34.402 -18.062 1.00 64.11 C ATOM 1771 O HIS A 115 12.998 33.390 -18.459 1.00 60.14 O ATOM 1772 CB HIS A 115 13.038 36.828 -18.355 1.00 23.35 C ATOM 1773 CG HIS A 115 11.791 37.419 -18.936 1.00 45.43 C ATOM 1774 ND1 HIS A 115 11.212 36.959 -20.100 1.00 11.32 N ATOM 1775 CD2 HIS A 115 11.012 38.439 -18.507 1.00 51.42 C ATOM 1776 CE1 HIS A 115 10.131 37.672 -20.362 1.00 72.32 C ATOM 1777 NE2 HIS A 115 9.987 38.576 -19.411 1.00 12.34 N ATOM 0 H HIS A 115 13.543 36.760 -15.944 1.00 24.23 H new ATOM 0 HA HIS A 115 11.724 35.336 -17.540 1.00 41.43 H new ATOM 0 HB2 HIS A 115 13.536 37.580 -17.744 1.00 23.35 H new ATOM 0 HB3 HIS A 115 13.721 36.572 -19.165 1.00 23.35 H new ATOM 0 HD2 HIS A 115 11.167 39.034 -17.619 1.00 51.42 H new ATOM 0 HE1 HIS A 115 9.476 37.538 -21.210 1.00 72.32 H new ATOM 0 HE2 HIS A 115 9.236 39.265 -19.356 1.00 12.34 H new ATOM 1785 N ALA A 116 14.896 34.540 -18.089 1.00 71.32 N ATOM 1786 CA ALA A 116 15.764 33.485 -18.597 1.00 72.50 C ATOM 1787 C ALA A 116 15.705 32.249 -17.705 1.00 62.13 C ATOM 1788 O ALA A 116 15.665 31.119 -18.194 1.00 41.04 O ATOM 1789 CB ALA A 116 17.195 33.988 -18.712 1.00 21.25 C ATOM 0 H ALA A 116 15.389 35.372 -17.765 1.00 71.32 H new ATOM 0 HA ALA A 116 15.410 33.203 -19.588 1.00 72.50 H new ATOM 0 HB1 ALA A 116 17.832 33.189 -19.093 1.00 21.25 H new ATOM 0 HB2 ALA A 116 17.229 34.836 -19.396 1.00 21.25 H new ATOM 0 HB3 ALA A 116 17.551 34.299 -17.730 1.00 21.25 H new ATOM 1795 N LEU A 117 15.701 32.470 -16.395 1.00 43.15 N ATOM 1796 CA LEU A 117 15.648 31.374 -15.435 1.00 22.34 C ATOM 1797 C LEU A 117 14.395 30.529 -15.641 1.00 21.11 C ATOM 1798 O LEU A 117 14.470 29.305 -15.749 1.00 43.44 O ATOM 1799 CB LEU A 117 15.680 31.920 -14.006 1.00 34.40 C ATOM 1800 CG LEU A 117 16.274 30.992 -12.946 1.00 20.32 C ATOM 1801 CD1 LEU A 117 15.402 29.759 -12.766 1.00 62.44 C ATOM 1802 CD2 LEU A 117 17.694 30.593 -13.321 1.00 52.33 C ATOM 0 H LEU A 117 15.734 33.398 -15.974 1.00 43.15 H new ATOM 0 HA LEU A 117 16.521 30.741 -15.595 1.00 22.34 H new ATOM 0 HB2 LEU A 117 16.249 32.850 -14.006 1.00 34.40 H new ATOM 0 HB3 LEU A 117 14.661 32.170 -13.711 1.00 34.40 H new ATOM 0 HG LEU A 117 16.307 31.530 -11.998 1.00 20.32 H new ATOM 0 HD11 LEU A 117 15.841 29.111 -12.008 1.00 62.44 H new ATOM 0 HD12 LEU A 117 14.404 30.062 -12.450 1.00 62.44 H new ATOM 0 HD13 LEU A 117 15.336 29.219 -13.711 1.00 62.44 H new ATOM 0 HD21 LEU A 117 18.101 29.933 -12.555 1.00 52.33 H new ATOM 0 HD22 LEU A 117 17.685 30.075 -14.280 1.00 52.33 H new ATOM 0 HD23 LEU A 117 18.315 31.486 -13.397 1.00 52.33 H new ATOM 1814 N ALA A 118 13.244 31.191 -15.696 1.00 70.21 N ATOM 1815 CA ALA A 118 11.975 30.501 -15.894 1.00 1.41 C ATOM 1816 C ALA A 118 12.042 29.561 -17.093 1.00 1.33 C ATOM 1817 O ALA A 118 11.657 28.395 -17.002 1.00 43.44 O ATOM 1818 CB ALA A 118 10.849 31.509 -16.073 1.00 43.01 C ATOM 0 H ALA A 118 13.164 32.204 -15.606 1.00 70.21 H new ATOM 0 HA ALA A 118 11.773 29.901 -15.007 1.00 1.41 H new ATOM 0 HB1 ALA A 118 9.907 30.980 -16.220 1.00 43.01 H new ATOM 0 HB2 ALA A 118 10.778 32.137 -15.185 1.00 43.01 H new ATOM 0 HB3 ALA A 118 11.054 32.133 -16.943 1.00 43.01 H new ATOM 1824 N VAL A 119 12.533 30.076 -18.216 1.00 14.11 N ATOM 1825 CA VAL A 119 12.650 29.282 -19.433 1.00 43.21 C ATOM 1826 C VAL A 119 13.416 27.990 -19.174 1.00 62.33 C ATOM 1827 O VAL A 119 13.083 26.938 -19.721 1.00 52.34 O ATOM 1828 CB VAL A 119 13.358 30.070 -20.551 1.00 42.50 C ATOM 1829 CG1 VAL A 119 13.605 29.180 -21.759 1.00 32.50 C ATOM 1830 CG2 VAL A 119 12.542 31.294 -20.939 1.00 12.24 C ATOM 0 H VAL A 119 12.856 31.039 -18.308 1.00 14.11 H new ATOM 0 HA VAL A 119 11.636 29.042 -19.754 1.00 43.21 H new ATOM 0 HB VAL A 119 14.324 30.409 -20.176 1.00 42.50 H new ATOM 0 HG11 VAL A 119 14.106 29.755 -22.538 1.00 32.50 H new ATOM 0 HG12 VAL A 119 14.233 28.338 -21.468 1.00 32.50 H new ATOM 0 HG13 VAL A 119 12.653 28.808 -22.138 1.00 32.50 H new ATOM 0 HG21 VAL A 119 13.057 31.839 -21.730 1.00 12.24 H new ATOM 0 HG22 VAL A 119 11.561 30.979 -21.295 1.00 12.24 H new ATOM 0 HG23 VAL A 119 12.423 31.942 -20.071 1.00 12.24 H new ATOM 1840 N ASP A 120 14.444 28.075 -18.337 1.00 14.13 N ATOM 1841 CA ASP A 120 15.257 26.912 -18.003 1.00 61.53 C ATOM 1842 C ASP A 120 14.397 25.798 -17.414 1.00 71.11 C ATOM 1843 O ASP A 120 14.434 24.659 -17.880 1.00 14.52 O ATOM 1844 CB ASP A 120 16.359 27.299 -17.015 1.00 74.14 C ATOM 1845 CG ASP A 120 17.703 26.705 -17.386 1.00 24.34 C ATOM 1846 OD1 ASP A 120 18.276 27.126 -18.413 1.00 21.04 O ATOM 1847 OD2 ASP A 120 18.184 25.819 -16.648 1.00 14.10 O ATOM 0 H ASP A 120 14.734 28.938 -17.877 1.00 14.13 H new ATOM 0 HA ASP A 120 15.716 26.545 -18.921 1.00 61.53 H new ATOM 0 HB2 ASP A 120 16.443 28.385 -16.976 1.00 74.14 H new ATOM 0 HB3 ASP A 120 16.081 26.965 -16.015 1.00 74.14 H new ATOM 1852 N ALA A 121 13.624 26.135 -16.386 1.00 63.35 N ATOM 1853 CA ALA A 121 12.754 25.164 -15.734 1.00 64.13 C ATOM 1854 C ALA A 121 11.890 24.429 -16.754 1.00 4.14 C ATOM 1855 O ALA A 121 11.661 23.225 -16.636 1.00 13.23 O ATOM 1856 CB ALA A 121 11.880 25.852 -14.697 1.00 10.03 C ATOM 0 H ALA A 121 13.583 27.073 -15.987 1.00 63.35 H new ATOM 0 HA ALA A 121 13.383 24.428 -15.233 1.00 64.13 H new ATOM 0 HB1 ALA A 121 11.235 25.115 -14.218 1.00 10.03 H new ATOM 0 HB2 ALA A 121 12.512 26.325 -13.945 1.00 10.03 H new ATOM 0 HB3 ALA A 121 11.266 26.610 -15.184 1.00 10.03 H new ATOM 1862 N LYS A 122 11.413 25.161 -17.755 1.00 31.15 N ATOM 1863 CA LYS A 122 10.574 24.579 -18.796 1.00 1.42 C ATOM 1864 C LYS A 122 11.407 23.740 -19.759 1.00 74.34 C ATOM 1865 O LYS A 122 11.002 22.647 -20.154 1.00 12.10 O ATOM 1866 CB LYS A 122 9.842 25.682 -19.565 1.00 22.33 C ATOM 1867 CG LYS A 122 8.564 25.209 -20.236 1.00 1.52 C ATOM 1868 CD LYS A 122 8.681 25.252 -21.750 1.00 61.42 C ATOM 1869 CE LYS A 122 7.688 24.309 -22.412 1.00 52.24 C ATOM 1870 NZ LYS A 122 6.293 24.563 -21.956 1.00 42.32 N ATOM 0 H LYS A 122 11.593 26.159 -17.867 1.00 31.15 H new ATOM 0 HA LYS A 122 9.841 23.930 -18.317 1.00 1.42 H new ATOM 0 HB2 LYS A 122 9.603 26.495 -18.879 1.00 22.33 H new ATOM 0 HB3 LYS A 122 10.511 26.091 -20.323 1.00 22.33 H new ATOM 0 HG2 LYS A 122 8.339 24.192 -19.916 1.00 1.52 H new ATOM 0 HG3 LYS A 122 7.731 25.835 -19.917 1.00 1.52 H new ATOM 0 HD2 LYS A 122 8.508 26.269 -22.101 1.00 61.42 H new ATOM 0 HD3 LYS A 122 9.695 24.981 -22.046 1.00 61.42 H new ATOM 0 HE2 LYS A 122 7.743 24.425 -23.494 1.00 52.24 H new ATOM 0 HE3 LYS A 122 7.961 23.278 -22.188 1.00 52.24 H new ATOM 0 HZ1 LYS A 122 5.632 24.009 -22.537 1.00 42.32 H new ATOM 0 HZ2 LYS A 122 6.197 24.282 -20.959 1.00 42.32 H new ATOM 0 HZ3 LYS A 122 6.075 25.575 -22.053 1.00 42.32 H new ATOM 1884 N ASN A 123 12.572 24.257 -20.133 1.00 4.31 N ATOM 1885 CA ASN A 123 13.462 23.554 -21.050 1.00 3.13 C ATOM 1886 C ASN A 123 13.901 22.216 -20.463 1.00 31.13 C ATOM 1887 O ASN A 123 14.372 21.334 -21.182 1.00 43.35 O ATOM 1888 CB ASN A 123 14.689 24.413 -21.362 1.00 41.31 C ATOM 1889 CG ASN A 123 14.977 24.492 -22.849 1.00 75.31 C ATOM 1890 OD1 ASN A 123 14.060 24.590 -23.665 1.00 43.14 O ATOM 1891 ND2 ASN A 123 16.254 24.448 -23.208 1.00 24.14 N ATOM 0 H ASN A 123 12.922 25.161 -19.815 1.00 4.31 H new ATOM 0 HA ASN A 123 12.915 23.364 -21.973 1.00 3.13 H new ATOM 0 HB2 ASN A 123 14.534 25.419 -20.971 1.00 41.31 H new ATOM 0 HB3 ASN A 123 15.558 24.001 -20.848 1.00 41.31 H new ATOM 0 HD21 ASN A 123 16.508 24.496 -24.195 1.00 24.14 H new ATOM 0 HD22 ASN A 123 16.981 24.366 -22.497 1.00 24.14 H new ATOM 1898 N LEU A 124 13.742 22.071 -19.152 1.00 21.31 N ATOM 1899 CA LEU A 124 14.121 20.840 -18.467 1.00 72.50 C ATOM 1900 C LEU A 124 13.540 19.621 -19.177 1.00 63.21 C ATOM 1901 O LEU A 124 14.264 18.863 -19.824 1.00 61.43 O ATOM 1902 CB LEU A 124 13.643 20.873 -17.014 1.00 41.13 C ATOM 1903 CG LEU A 124 14.288 21.933 -16.120 1.00 71.30 C ATOM 1904 CD1 LEU A 124 13.821 21.773 -14.681 1.00 62.24 C ATOM 1905 CD2 LEU A 124 15.805 21.849 -16.203 1.00 0.01 C ATOM 0 H LEU A 124 13.353 22.790 -18.542 1.00 21.31 H new ATOM 0 HA LEU A 124 15.208 20.764 -18.484 1.00 72.50 H new ATOM 0 HB2 LEU A 124 12.564 21.031 -17.011 1.00 41.13 H new ATOM 0 HB3 LEU A 124 13.823 19.894 -16.571 1.00 41.13 H new ATOM 0 HG LEU A 124 13.979 22.917 -16.474 1.00 71.30 H new ATOM 0 HD11 LEU A 124 14.290 22.536 -14.059 1.00 62.24 H new ATOM 0 HD12 LEU A 124 12.738 21.884 -14.636 1.00 62.24 H new ATOM 0 HD13 LEU A 124 14.100 20.785 -14.316 1.00 62.24 H new ATOM 0 HD21 LEU A 124 16.247 22.610 -15.561 1.00 0.01 H new ATOM 0 HD22 LEU A 124 16.133 20.863 -15.875 1.00 0.01 H new ATOM 0 HD23 LEU A 124 16.123 22.014 -17.233 1.00 0.01 H new ATOM 1917 N LEU A 125 12.230 19.439 -19.054 1.00 2.12 N ATOM 1918 CA LEU A 125 11.551 18.313 -19.686 1.00 10.41 C ATOM 1919 C LEU A 125 11.471 18.504 -21.197 1.00 50.51 C ATOM 1920 O LEU A 125 11.420 17.535 -21.954 1.00 20.54 O ATOM 1921 CB LEU A 125 10.145 18.150 -19.106 1.00 20.31 C ATOM 1922 CG LEU A 125 9.870 16.836 -18.373 1.00 0.10 C ATOM 1923 CD1 LEU A 125 10.402 16.898 -16.950 1.00 21.44 C ATOM 1924 CD2 LEU A 125 8.380 16.526 -18.374 1.00 42.45 C ATOM 0 H LEU A 125 11.617 20.057 -18.522 1.00 2.12 H new ATOM 0 HA LEU A 125 12.128 17.411 -19.483 1.00 10.41 H new ATOM 0 HB2 LEU A 125 9.960 18.973 -18.416 1.00 20.31 H new ATOM 0 HB3 LEU A 125 9.425 18.247 -19.918 1.00 20.31 H new ATOM 0 HG LEU A 125 10.388 16.034 -18.899 1.00 0.10 H new ATOM 0 HD11 LEU A 125 10.197 15.955 -16.444 1.00 21.44 H new ATOM 0 HD12 LEU A 125 11.478 17.073 -16.971 1.00 21.44 H new ATOM 0 HD13 LEU A 125 9.913 17.711 -16.414 1.00 21.44 H new ATOM 0 HD21 LEU A 125 8.203 15.588 -17.848 1.00 42.45 H new ATOM 0 HD22 LEU A 125 7.841 17.330 -17.873 1.00 42.45 H new ATOM 0 HD23 LEU A 125 8.027 16.438 -19.402 1.00 42.45 H new ATOM 1936 N ASP A 126 11.462 19.760 -21.630 1.00 4.44 N ATOM 1937 CA ASP A 126 11.392 20.079 -23.051 1.00 2.21 C ATOM 1938 C ASP A 126 12.554 19.444 -23.808 1.00 43.33 C ATOM 1939 O ASP A 126 12.372 18.881 -24.888 1.00 10.42 O ATOM 1940 CB ASP A 126 11.400 21.595 -23.257 1.00 24.25 C ATOM 1941 CG ASP A 126 10.643 22.014 -24.501 1.00 14.43 C ATOM 1942 OD1 ASP A 126 10.860 21.397 -25.565 1.00 1.33 O ATOM 1943 OD2 ASP A 126 9.831 22.959 -24.410 1.00 43.23 O ATOM 0 H ASP A 126 11.502 20.574 -21.017 1.00 4.44 H new ATOM 0 HA ASP A 126 10.460 19.672 -23.444 1.00 2.21 H new ATOM 0 HB2 ASP A 126 10.958 22.079 -22.386 1.00 24.25 H new ATOM 0 HB3 ASP A 126 12.430 21.944 -23.327 1.00 24.25 H new ATOM 1948 N VAL A 127 13.750 19.540 -23.235 1.00 61.14 N ATOM 1949 CA VAL A 127 14.942 18.975 -23.856 1.00 44.11 C ATOM 1950 C VAL A 127 14.950 17.454 -23.748 1.00 42.42 C ATOM 1951 O VAL A 127 14.970 16.751 -24.758 1.00 72.35 O ATOM 1952 CB VAL A 127 16.227 19.531 -23.213 1.00 12.01 C ATOM 1953 CG1 VAL A 127 17.457 18.893 -23.839 1.00 62.04 C ATOM 1954 CG2 VAL A 127 16.276 21.046 -23.345 1.00 72.31 C ATOM 0 H VAL A 127 13.919 20.004 -22.342 1.00 61.14 H new ATOM 0 HA VAL A 127 14.917 19.261 -24.907 1.00 44.11 H new ATOM 0 HB VAL A 127 16.219 19.282 -22.152 1.00 12.01 H new ATOM 0 HG11 VAL A 127 18.355 19.298 -23.372 1.00 62.04 H new ATOM 0 HG12 VAL A 127 17.424 17.814 -23.687 1.00 62.04 H new ATOM 0 HG13 VAL A 127 17.475 19.109 -24.907 1.00 62.04 H new ATOM 0 HG21 VAL A 127 17.190 21.422 -22.885 1.00 72.31 H new ATOM 0 HG22 VAL A 127 16.261 21.320 -24.400 1.00 72.31 H new ATOM 0 HG23 VAL A 127 15.412 21.483 -22.844 1.00 72.31 H new ATOM 1964 N ILE A 128 14.934 16.954 -22.517 1.00 44.04 N ATOM 1965 CA ILE A 128 14.938 15.516 -22.278 1.00 1.32 C ATOM 1966 C ILE A 128 13.829 14.825 -23.063 1.00 54.33 C ATOM 1967 O ILE A 128 13.937 13.648 -23.405 1.00 61.44 O ATOM 1968 CB ILE A 128 14.769 15.195 -20.781 1.00 70.42 C ATOM 1969 CG1 ILE A 128 15.299 13.792 -20.476 1.00 3.35 C ATOM 1970 CG2 ILE A 128 13.308 15.314 -20.376 1.00 14.25 C ATOM 1971 CD1 ILE A 128 15.680 13.593 -19.025 1.00 75.00 C ATOM 0 H ILE A 128 14.918 17.523 -21.670 1.00 44.04 H new ATOM 0 HA ILE A 128 15.905 15.142 -22.615 1.00 1.32 H new ATOM 0 HB ILE A 128 15.346 15.916 -20.202 1.00 70.42 H new ATOM 0 HG12 ILE A 128 14.540 13.058 -20.748 1.00 3.35 H new ATOM 0 HG13 ILE A 128 16.170 13.597 -21.102 1.00 3.35 H new ATOM 0 HG21 ILE A 128 13.205 15.084 -19.316 1.00 14.25 H new ATOM 0 HG22 ILE A 128 12.960 16.330 -20.563 1.00 14.25 H new ATOM 0 HG23 ILE A 128 12.711 14.613 -20.959 1.00 14.25 H new ATOM 0 HD11 ILE A 128 16.047 12.577 -18.881 1.00 75.00 H new ATOM 0 HD12 ILE A 128 16.461 14.303 -18.753 1.00 75.00 H new ATOM 0 HD13 ILE A 128 14.806 13.756 -18.394 1.00 75.00 H new ATOM 1983 N ASP A 129 12.763 15.566 -23.347 1.00 61.14 N ATOM 1984 CA ASP A 129 11.634 15.026 -24.096 1.00 30.32 C ATOM 1985 C ASP A 129 12.093 14.453 -25.433 1.00 54.24 C ATOM 1986 O ASP A 129 11.557 13.451 -25.906 1.00 21.01 O ATOM 1987 CB ASP A 129 10.581 16.111 -24.326 1.00 31.25 C ATOM 1988 CG ASP A 129 9.529 15.692 -25.333 1.00 54.34 C ATOM 1989 OD1 ASP A 129 8.843 14.677 -25.089 1.00 64.14 O ATOM 1990 OD2 ASP A 129 9.390 16.381 -26.366 1.00 33.51 O ATOM 0 H ASP A 129 12.657 16.542 -23.070 1.00 61.14 H new ATOM 0 HA ASP A 129 11.192 14.221 -23.509 1.00 30.32 H new ATOM 0 HB2 ASP A 129 10.098 16.351 -23.379 1.00 31.25 H new ATOM 0 HB3 ASP A 129 11.071 17.021 -24.674 1.00 31.25 H new ATOM 1995 N GLN A 130 13.086 15.097 -26.038 1.00 15.52 N ATOM 1996 CA GLN A 130 13.614 14.653 -27.322 1.00 22.21 C ATOM 1997 C GLN A 130 14.345 13.322 -27.178 1.00 61.12 C ATOM 1998 O GLN A 130 14.499 12.580 -28.148 1.00 23.34 O ATOM 1999 CB GLN A 130 14.559 15.707 -27.901 1.00 1.20 C ATOM 2000 CG GLN A 130 15.005 15.409 -29.323 1.00 61.13 C ATOM 2001 CD GLN A 130 15.501 16.643 -30.050 1.00 41.24 C ATOM 2002 OE1 GLN A 130 16.549 17.196 -29.716 1.00 24.33 O ATOM 2003 NE2 GLN A 130 14.748 17.083 -31.052 1.00 64.01 N ATOM 0 H GLN A 130 13.541 15.928 -25.659 1.00 15.52 H new ATOM 0 HA GLN A 130 12.775 14.515 -28.004 1.00 22.21 H new ATOM 0 HB2 GLN A 130 14.063 16.678 -27.880 1.00 1.20 H new ATOM 0 HB3 GLN A 130 15.439 15.785 -27.262 1.00 1.20 H new ATOM 0 HG2 GLN A 130 15.798 14.661 -29.302 1.00 61.13 H new ATOM 0 HG3 GLN A 130 14.173 14.975 -29.877 1.00 61.13 H new ATOM 0 HE21 GLN A 130 13.887 16.594 -31.295 1.00 64.01 H new ATOM 0 HE22 GLN A 130 15.031 17.910 -31.578 1.00 64.01 H new ATOM 2012 N ALA A 131 14.793 13.027 -25.962 1.00 64.14 N ATOM 2013 CA ALA A 131 15.507 11.785 -25.692 1.00 34.13 C ATOM 2014 C ALA A 131 14.559 10.591 -25.718 1.00 72.44 C ATOM 2015 O ALA A 131 14.754 9.649 -26.487 1.00 35.43 O ATOM 2016 CB ALA A 131 16.218 11.867 -24.349 1.00 62.43 C ATOM 0 H ALA A 131 14.674 13.631 -25.149 1.00 64.14 H new ATOM 0 HA ALA A 131 16.250 11.643 -26.477 1.00 34.13 H new ATOM 0 HB1 ALA A 131 16.747 10.933 -24.160 1.00 62.43 H new ATOM 0 HB2 ALA A 131 16.931 12.691 -24.365 1.00 62.43 H new ATOM 0 HB3 ALA A 131 15.486 12.035 -23.559 1.00 62.43 H new ATOM 2022 N ARG A 132 13.533 10.636 -24.874 1.00 43.03 N ATOM 2023 CA ARG A 132 12.556 9.556 -24.800 1.00 44.42 C ATOM 2024 C ARG A 132 11.989 9.241 -26.181 1.00 71.10 C ATOM 2025 O ARG A 132 11.823 8.076 -26.545 1.00 22.33 O ATOM 2026 CB ARG A 132 11.422 9.931 -23.844 1.00 62.13 C ATOM 2027 CG ARG A 132 10.901 11.345 -24.042 1.00 72.22 C ATOM 2028 CD ARG A 132 9.659 11.603 -23.203 1.00 4.32 C ATOM 2029 NE ARG A 132 9.954 12.418 -22.027 1.00 54.21 N ATOM 2030 CZ ARG A 132 9.129 12.540 -20.993 1.00 4.24 C ATOM 2031 NH1 ARG A 132 7.967 11.903 -20.988 1.00 54.24 N ATOM 2032 NH2 ARG A 132 9.468 13.300 -19.959 1.00 50.40 N ATOM 0 H ARG A 132 13.357 11.409 -24.232 1.00 43.03 H new ATOM 0 HA ARG A 132 13.061 8.667 -24.422 1.00 44.42 H new ATOM 0 HB2 ARG A 132 10.600 9.228 -23.976 1.00 62.13 H new ATOM 0 HB3 ARG A 132 11.773 9.822 -22.818 1.00 62.13 H new ATOM 0 HG2 ARG A 132 11.678 12.061 -23.774 1.00 72.22 H new ATOM 0 HG3 ARG A 132 10.670 11.505 -25.095 1.00 72.22 H new ATOM 0 HD2 ARG A 132 8.907 12.104 -23.813 1.00 4.32 H new ATOM 0 HD3 ARG A 132 9.231 10.652 -22.887 1.00 4.32 H new ATOM 0 HE ARG A 132 10.841 12.920 -21.998 1.00 54.21 H new ATOM 0 HH11 ARG A 132 7.703 11.317 -21.780 1.00 54.24 H new ATOM 0 HH12 ARG A 132 7.336 11.999 -20.192 1.00 54.24 H new ATOM 0 HH21 ARG A 132 10.362 13.791 -19.958 1.00 50.40 H new ATOM 0 HH22 ARG A 132 8.834 13.393 -19.165 1.00 50.40 H new ATOM 2046 N LEU A 133 11.692 10.286 -26.946 1.00 22.23 N ATOM 2047 CA LEU A 133 11.143 10.121 -28.287 1.00 34.11 C ATOM 2048 C LEU A 133 12.197 9.573 -29.244 1.00 35.02 C ATOM 2049 O LEU A 133 11.887 8.794 -30.146 1.00 22.14 O ATOM 2050 CB LEU A 133 10.609 11.456 -28.808 1.00 51.34 C ATOM 2051 CG LEU A 133 9.424 12.050 -28.046 1.00 31.55 C ATOM 2052 CD1 LEU A 133 8.973 13.352 -28.689 1.00 32.42 C ATOM 2053 CD2 LEU A 133 8.274 11.054 -27.988 1.00 42.35 C ATOM 0 H LEU A 133 11.822 11.256 -26.660 1.00 22.23 H new ATOM 0 HA LEU A 133 10.323 9.405 -28.232 1.00 34.11 H new ATOM 0 HB2 LEU A 133 11.424 12.180 -28.794 1.00 51.34 H new ATOM 0 HB3 LEU A 133 10.316 11.325 -29.850 1.00 51.34 H new ATOM 0 HG LEU A 133 9.744 12.265 -27.026 1.00 31.55 H new ATOM 0 HD11 LEU A 133 8.129 13.759 -28.133 1.00 32.42 H new ATOM 0 HD12 LEU A 133 9.795 14.068 -28.677 1.00 32.42 H new ATOM 0 HD13 LEU A 133 8.671 13.164 -29.719 1.00 32.42 H new ATOM 0 HD21 LEU A 133 7.439 11.493 -27.442 1.00 42.35 H new ATOM 0 HD22 LEU A 133 7.955 10.807 -29.001 1.00 42.35 H new ATOM 0 HD23 LEU A 133 8.603 10.148 -27.480 1.00 42.35 H new ATOM 2065 N LYS A 134 13.444 9.984 -29.040 1.00 73.50 N ATOM 2066 CA LYS A 134 14.545 9.532 -29.881 1.00 65.15 C ATOM 2067 C LYS A 134 14.643 8.010 -29.879 1.00 62.33 C ATOM 2068 O LYS A 134 14.951 7.397 -30.901 1.00 60.12 O ATOM 2069 CB LYS A 134 15.865 10.139 -29.399 1.00 72.00 C ATOM 2070 CG LYS A 134 16.349 11.299 -30.252 1.00 74.20 C ATOM 2071 CD LYS A 134 17.850 11.237 -30.477 1.00 50.14 C ATOM 2072 CE LYS A 134 18.381 12.541 -31.052 1.00 44.30 C ATOM 2073 NZ LYS A 134 18.251 12.588 -32.535 1.00 13.13 N ATOM 0 H LYS A 134 13.717 10.630 -28.299 1.00 73.50 H new ATOM 0 HA LYS A 134 14.350 9.864 -30.901 1.00 65.15 H new ATOM 0 HB2 LYS A 134 15.744 10.481 -28.371 1.00 72.00 H new ATOM 0 HB3 LYS A 134 16.630 9.363 -29.389 1.00 72.00 H new ATOM 0 HG2 LYS A 134 15.835 11.284 -31.213 1.00 74.20 H new ATOM 0 HG3 LYS A 134 16.091 12.241 -29.767 1.00 74.20 H new ATOM 0 HD2 LYS A 134 18.352 11.023 -29.533 1.00 50.14 H new ATOM 0 HD3 LYS A 134 18.084 10.417 -31.156 1.00 50.14 H new ATOM 0 HE2 LYS A 134 17.839 13.379 -30.613 1.00 44.30 H new ATOM 0 HE3 LYS A 134 19.429 12.660 -30.775 1.00 44.30 H new ATOM 0 HZ1 LYS A 134 18.624 13.492 -32.888 1.00 13.13 H new ATOM 0 HZ2 LYS A 134 18.789 11.804 -32.956 1.00 13.13 H new ATOM 0 HZ3 LYS A 134 17.249 12.501 -32.799 1.00 13.13 H new ATOM 2087 N MET A 135 14.378 7.406 -28.725 1.00 71.15 N ATOM 2088 CA MET A 135 14.434 5.955 -28.592 1.00 73.33 C ATOM 2089 C MET A 135 13.194 5.305 -29.199 1.00 41.11 C ATOM 2090 O MET A 135 13.299 4.405 -30.032 1.00 61.45 O ATOM 2091 CB MET A 135 14.561 5.561 -27.119 1.00 70.15 C ATOM 2092 CG MET A 135 14.661 4.060 -26.898 1.00 51.32 C ATOM 2093 SD MET A 135 13.785 3.517 -25.419 1.00 22.43 S ATOM 2094 CE MET A 135 14.381 4.704 -24.217 1.00 70.22 C ATOM 0 H MET A 135 14.123 7.899 -27.869 1.00 71.15 H new ATOM 0 HA MET A 135 15.311 5.599 -29.133 1.00 73.33 H new ATOM 0 HB2 MET A 135 15.444 6.042 -26.698 1.00 70.15 H new ATOM 0 HB3 MET A 135 13.699 5.944 -26.573 1.00 70.15 H new ATOM 0 HG2 MET A 135 14.256 3.541 -27.767 1.00 51.32 H new ATOM 0 HG3 MET A 135 15.711 3.777 -26.818 1.00 51.32 H new ATOM 0 HE1 MET A 135 14.311 4.276 -23.217 1.00 70.22 H new ATOM 0 HE2 MET A 135 15.420 4.951 -24.434 1.00 70.22 H new ATOM 0 HE3 MET A 135 13.775 5.608 -24.267 1.00 70.22 H new ATOM 2104 N ILE A 136 12.022 5.767 -28.776 1.00 23.00 N ATOM 2105 CA ILE A 136 10.764 5.231 -29.279 1.00 33.21 C ATOM 2106 C ILE A 136 10.705 5.301 -30.801 1.00 64.11 C ATOM 2107 O ILE A 136 10.542 4.283 -31.474 1.00 2.12 O ATOM 2108 CB ILE A 136 9.556 5.987 -28.695 1.00 0.22 C ATOM 2109 CG1 ILE A 136 9.568 5.908 -27.167 1.00 14.42 C ATOM 2110 CG2 ILE A 136 8.258 5.421 -29.250 1.00 15.31 C ATOM 2111 CD1 ILE A 136 8.622 6.885 -26.504 1.00 52.41 C ATOM 0 H ILE A 136 11.918 6.511 -28.086 1.00 23.00 H new ATOM 0 HA ILE A 136 10.718 4.189 -28.964 1.00 33.21 H new ATOM 0 HB ILE A 136 9.626 7.035 -28.987 1.00 0.22 H new ATOM 0 HG12 ILE A 136 9.305 4.895 -26.862 1.00 14.42 H new ATOM 0 HG13 ILE A 136 10.580 6.096 -26.809 1.00 14.42 H new ATOM 0 HG21 ILE A 136 7.414 5.966 -28.828 1.00 15.31 H new ATOM 0 HG22 ILE A 136 8.251 5.524 -30.335 1.00 15.31 H new ATOM 0 HG23 ILE A 136 8.178 4.367 -28.985 1.00 15.31 H new ATOM 0 HD11 ILE A 136 8.683 6.773 -25.421 1.00 52.41 H new ATOM 0 HD12 ILE A 136 8.898 7.903 -26.780 1.00 52.41 H new ATOM 0 HD13 ILE A 136 7.602 6.684 -26.833 1.00 52.41 H new ATOM 2123 N SER A 137 10.842 6.509 -31.338 1.00 53.20 N ATOM 2124 CA SER A 137 10.803 6.713 -32.781 1.00 53.14 C ATOM 2125 C SER A 137 12.138 6.340 -33.419 1.00 75.20 C ATOM 2126 O SER A 137 12.872 7.204 -33.896 1.00 2.31 O ATOM 2127 CB SER A 137 10.460 8.169 -33.103 1.00 4.11 C ATOM 2128 OG SER A 137 9.997 8.302 -34.435 1.00 71.45 O ATOM 0 H SER A 137 10.981 7.361 -30.795 1.00 53.20 H new ATOM 0 HA SER A 137 10.029 6.065 -33.194 1.00 53.14 H new ATOM 0 HB2 SER A 137 9.697 8.527 -32.412 1.00 4.11 H new ATOM 0 HB3 SER A 137 11.341 8.794 -32.957 1.00 4.11 H new ATOM 0 HG SER A 137 9.783 9.241 -34.615 1.00 71.45 H new ATOM 2134 N GLN A 138 12.443 5.046 -33.423 1.00 2.33 N ATOM 2135 CA GLN A 138 13.690 4.558 -34.001 1.00 14.12 C ATOM 2136 C GLN A 138 13.782 3.040 -33.893 1.00 74.41 C ATOM 2137 O GLN A 138 13.863 2.340 -34.902 1.00 61.34 O ATOM 2138 CB GLN A 138 14.888 5.204 -33.303 1.00 14.32 C ATOM 2139 CG GLN A 138 15.950 5.714 -34.264 1.00 33.42 C ATOM 2140 CD GLN A 138 17.257 4.955 -34.145 1.00 75.40 C ATOM 2141 OE1 GLN A 138 17.872 4.918 -33.079 1.00 41.32 O ATOM 2142 NE2 GLN A 138 17.688 4.342 -35.242 1.00 12.53 N ATOM 0 H GLN A 138 11.845 4.318 -33.033 1.00 2.33 H new ATOM 0 HA GLN A 138 13.703 4.831 -35.056 1.00 14.12 H new ATOM 0 HB2 GLN A 138 14.536 6.034 -32.690 1.00 14.32 H new ATOM 0 HB3 GLN A 138 15.340 4.477 -32.628 1.00 14.32 H new ATOM 0 HG2 GLN A 138 15.579 5.633 -35.286 1.00 33.42 H new ATOM 0 HG3 GLN A 138 16.130 6.772 -34.073 1.00 33.42 H new ATOM 0 HE21 GLN A 138 17.146 4.399 -36.104 1.00 12.53 H new ATOM 0 HE22 GLN A 138 18.561 3.814 -35.222 1.00 12.53 H new ATOM 2151 N SER A 139 13.768 2.537 -32.663 1.00 23.42 N ATOM 2152 CA SER A 139 13.855 1.101 -32.423 1.00 35.10 C ATOM 2153 C SER A 139 13.626 0.782 -30.949 1.00 34.43 C ATOM 2154 O SER A 139 14.087 1.506 -30.067 1.00 13.14 O ATOM 2155 CB SER A 139 15.219 0.569 -32.866 1.00 2.54 C ATOM 2156 OG SER A 139 15.354 -0.807 -32.559 1.00 24.35 O ATOM 0 H SER A 139 13.697 3.102 -31.817 1.00 23.42 H new ATOM 0 HA SER A 139 13.076 0.612 -33.008 1.00 35.10 H new ATOM 0 HB2 SER A 139 15.340 0.719 -33.939 1.00 2.54 H new ATOM 0 HB3 SER A 139 16.011 1.134 -32.374 1.00 2.54 H new ATOM 0 HG SER A 139 16.234 -1.123 -32.854 1.00 24.35 H new ATOM 2162 N ARG A 140 12.910 -0.308 -30.690 1.00 21.00 N ATOM 2163 CA ARG A 140 12.618 -0.724 -29.323 1.00 42.44 C ATOM 2164 C ARG A 140 11.783 0.330 -28.601 1.00 64.13 C ATOM 2165 O ARG A 140 12.264 1.039 -27.717 1.00 33.35 O ATOM 2166 CB ARG A 140 13.917 -0.975 -28.555 1.00 43.45 C ATOM 2167 CG ARG A 140 13.716 -1.712 -27.242 1.00 35.12 C ATOM 2168 CD ARG A 140 14.862 -1.454 -26.277 1.00 31.35 C ATOM 2169 NE ARG A 140 15.283 -2.672 -25.589 1.00 32.10 N ATOM 2170 CZ ARG A 140 15.967 -3.648 -26.175 1.00 44.22 C ATOM 2171 NH1 ARG A 140 16.307 -3.549 -27.453 1.00 41.20 N ATOM 2172 NH2 ARG A 140 16.314 -4.725 -25.483 1.00 23.41 N ATOM 0 H ARG A 140 12.522 -0.919 -31.409 1.00 21.00 H new ATOM 0 HA ARG A 140 12.045 -1.650 -29.366 1.00 42.44 H new ATOM 0 HB2 ARG A 140 14.596 -1.550 -29.185 1.00 43.45 H new ATOM 0 HB3 ARG A 140 14.401 -0.019 -28.355 1.00 43.45 H new ATOM 0 HG2 ARG A 140 12.777 -1.396 -26.786 1.00 35.12 H new ATOM 0 HG3 ARG A 140 13.634 -2.782 -27.433 1.00 35.12 H new ATOM 0 HD2 ARG A 140 15.708 -1.035 -26.822 1.00 31.35 H new ATOM 0 HD3 ARG A 140 14.556 -0.710 -25.542 1.00 31.35 H new ATOM 0 HE ARG A 140 15.038 -2.779 -24.605 1.00 32.10 H new ATOM 0 HH11 ARG A 140 16.043 -2.722 -27.988 1.00 41.20 H new ATOM 0 HH12 ARG A 140 16.832 -4.300 -27.901 1.00 41.20 H new ATOM 0 HH21 ARG A 140 16.056 -4.804 -24.499 1.00 23.41 H new ATOM 0 HH22 ARG A 140 16.839 -5.474 -25.934 1.00 23.41 H new ATOM 2186 N PRO A 141 10.503 0.437 -28.987 1.00 21.03 N ATOM 2187 CA PRO A 141 9.575 1.401 -28.389 1.00 55.11 C ATOM 2188 C PRO A 141 9.214 1.044 -26.951 1.00 40.11 C ATOM 2189 O PRO A 141 9.262 -0.123 -26.560 1.00 5.53 O ATOM 2190 CB PRO A 141 8.340 1.309 -29.289 1.00 35.53 C ATOM 2191 CG PRO A 141 8.402 -0.058 -29.878 1.00 72.31 C ATOM 2192 CD PRO A 141 9.863 -0.375 -30.035 1.00 63.31 C ATOM 0 HA PRO A 141 10.006 2.401 -28.333 1.00 55.11 H new ATOM 0 HB2 PRO A 141 7.423 1.453 -28.718 1.00 35.53 H new ATOM 0 HB3 PRO A 141 8.357 2.075 -30.064 1.00 35.53 H new ATOM 0 HG2 PRO A 141 7.912 -0.785 -29.230 1.00 72.31 H new ATOM 0 HG3 PRO A 141 7.890 -0.092 -30.839 1.00 72.31 H new ATOM 0 HD2 PRO A 141 10.061 -1.438 -29.896 1.00 63.31 H new ATOM 0 HD3 PRO A 141 10.227 -0.110 -31.027 1.00 63.31 H new ATOM 2200 N HIS A 142 8.852 2.055 -26.168 1.00 40.40 N ATOM 2201 CA HIS A 142 8.482 1.847 -24.773 1.00 0.24 C ATOM 2202 C HIS A 142 7.624 3.000 -24.260 1.00 74.14 C ATOM 2203 O HIS A 142 6.576 3.276 -24.844 1.00 23.34 O ATOM 2204 CB HIS A 142 9.734 1.705 -23.907 1.00 21.42 C ATOM 2205 CG HIS A 142 10.155 0.283 -23.692 1.00 44.44 C ATOM 2206 ND1 HIS A 142 9.526 -0.562 -22.804 1.00 34.31 N ATOM 2207 CD2 HIS A 142 11.149 -0.441 -24.259 1.00 11.42 C ATOM 2208 CE1 HIS A 142 10.115 -1.744 -22.832 1.00 34.53 C ATOM 2209 NE2 HIS A 142 11.103 -1.697 -23.707 1.00 74.20 N ATOM 0 H HIS A 142 8.807 3.026 -26.476 1.00 40.40 H new ATOM 0 HA HIS A 142 7.899 0.928 -24.711 1.00 0.24 H new ATOM 0 HB2 HIS A 142 10.553 2.251 -24.375 1.00 21.42 H new ATOM 0 HB3 HIS A 142 9.551 2.172 -22.939 1.00 21.42 H new ATOM 0 HD2 HIS A 142 11.848 -0.095 -25.006 1.00 11.42 H new ATOM 0 HE1 HIS A 142 9.836 -2.603 -22.240 1.00 34.53 H new ATOM 0 HE2 HIS A 142 11.730 -2.468 -23.935 1.00 74.20 H new ATOM 2217 N SER A 169 25.009 18.925 0.697 1.00 74.23 N ATOM 2218 CA SER A 169 25.534 20.282 0.793 1.00 23.52 C ATOM 2219 C SER A 169 24.524 21.294 0.262 1.00 4.53 C ATOM 2220 O SER A 169 24.373 22.384 0.814 1.00 44.23 O ATOM 2221 CB SER A 169 26.847 20.399 0.017 1.00 64.30 C ATOM 2222 OG SER A 169 26.975 19.352 -0.930 1.00 41.52 O ATOM 0 HA SER A 169 25.721 20.500 1.845 1.00 23.52 H new ATOM 0 HB2 SER A 169 26.887 21.362 -0.493 1.00 64.30 H new ATOM 0 HB3 SER A 169 27.687 20.371 0.711 1.00 64.30 H new ATOM 0 HG SER A 169 26.294 18.669 -0.757 1.00 41.52 H new ATOM 2228 N ALA A 170 23.835 20.926 -0.813 1.00 24.24 N ATOM 2229 CA ALA A 170 22.838 21.800 -1.418 1.00 4.12 C ATOM 2230 C ALA A 170 21.636 21.981 -0.498 1.00 11.13 C ATOM 2231 O ALA A 170 21.153 23.097 -0.302 1.00 33.24 O ATOM 2232 CB ALA A 170 22.397 21.245 -2.764 1.00 33.33 C ATOM 0 H ALA A 170 23.949 20.028 -1.283 1.00 24.24 H new ATOM 0 HA ALA A 170 23.294 22.778 -1.573 1.00 4.12 H new ATOM 0 HB1 ALA A 170 21.652 21.908 -3.205 1.00 33.33 H new ATOM 0 HB2 ALA A 170 23.258 21.175 -3.428 1.00 33.33 H new ATOM 0 HB3 ALA A 170 21.964 20.254 -2.625 1.00 33.33 H new ATOM 2238 N THR A 171 21.155 20.877 0.065 1.00 25.50 N ATOM 2239 CA THR A 171 20.008 20.913 0.963 1.00 2.10 C ATOM 2240 C THR A 171 20.244 21.880 2.117 1.00 2.25 C ATOM 2241 O THR A 171 19.298 22.418 2.692 1.00 13.32 O ATOM 2242 CB THR A 171 19.697 19.517 1.534 1.00 74.34 C ATOM 2243 OG1 THR A 171 20.469 18.524 0.849 1.00 52.23 O ATOM 2244 CG2 THR A 171 18.216 19.196 1.400 1.00 74.41 C ATOM 0 H THR A 171 21.543 19.946 -0.086 1.00 25.50 H new ATOM 0 HA THR A 171 19.157 21.254 0.374 1.00 2.10 H new ATOM 0 HB THR A 171 19.960 19.515 2.592 1.00 74.34 H new ATOM 0 HG1 THR A 171 20.267 17.639 1.219 1.00 52.23 H new ATOM 0 HG21 THR A 171 18.020 18.205 1.810 1.00 74.41 H new ATOM 0 HG22 THR A 171 17.632 19.937 1.946 1.00 74.41 H new ATOM 0 HG23 THR A 171 17.933 19.216 0.348 1.00 74.41 H new ATOM 2252 N ARG A 172 21.512 22.097 2.452 1.00 40.23 N ATOM 2253 CA ARG A 172 21.872 23.000 3.539 1.00 71.23 C ATOM 2254 C ARG A 172 21.440 24.429 3.224 1.00 41.11 C ATOM 2255 O ARG A 172 20.827 25.099 4.054 1.00 31.12 O ATOM 2256 CB ARG A 172 23.380 22.955 3.789 1.00 23.21 C ATOM 2257 CG ARG A 172 23.754 22.432 5.167 1.00 53.04 C ATOM 2258 CD ARG A 172 24.974 23.149 5.723 1.00 61.14 C ATOM 2259 NE ARG A 172 25.280 22.730 7.088 1.00 11.50 N ATOM 2260 CZ ARG A 172 24.542 23.063 8.141 1.00 2.54 C ATOM 2261 NH1 ARG A 172 23.461 23.815 7.987 1.00 41.32 N ATOM 2262 NH2 ARG A 172 24.885 22.644 9.352 1.00 23.25 N ATOM 0 H ARG A 172 22.307 21.660 1.986 1.00 40.23 H new ATOM 0 HA ARG A 172 21.352 22.671 4.439 1.00 71.23 H new ATOM 0 HB2 ARG A 172 23.847 22.325 3.032 1.00 23.21 H new ATOM 0 HB3 ARG A 172 23.790 23.957 3.667 1.00 23.21 H new ATOM 0 HG2 ARG A 172 22.913 22.562 5.847 1.00 53.04 H new ATOM 0 HG3 ARG A 172 23.954 21.362 5.109 1.00 53.04 H new ATOM 0 HD2 ARG A 172 25.833 22.952 5.082 1.00 61.14 H new ATOM 0 HD3 ARG A 172 24.802 24.225 5.704 1.00 61.14 H new ATOM 0 HE ARG A 172 26.105 22.150 7.241 1.00 11.50 H new ATOM 0 HH11 ARG A 172 23.194 24.140 7.058 1.00 41.32 H new ATOM 0 HH12 ARG A 172 22.897 24.069 8.798 1.00 41.32 H new ATOM 0 HH21 ARG A 172 25.716 22.066 9.475 1.00 23.25 H new ATOM 0 HH22 ARG A 172 24.318 22.900 10.160 1.00 23.25 H new ATOM 2276 N GLU A 173 21.765 24.889 2.020 1.00 64.43 N ATOM 2277 CA GLU A 173 21.412 26.239 1.597 1.00 60.41 C ATOM 2278 C GLU A 173 19.899 26.434 1.609 1.00 34.01 C ATOM 2279 O GLU A 173 19.393 27.424 2.140 1.00 22.22 O ATOM 2280 CB GLU A 173 21.962 26.519 0.197 1.00 61.12 C ATOM 2281 CG GLU A 173 23.459 26.779 0.172 1.00 60.42 C ATOM 2282 CD GLU A 173 23.883 27.634 -1.006 1.00 50.40 C ATOM 2283 OE1 GLU A 173 23.303 28.725 -1.187 1.00 2.44 O ATOM 2284 OE2 GLU A 173 24.795 27.212 -1.747 1.00 45.41 O ATOM 0 H GLU A 173 22.272 24.347 1.320 1.00 64.43 H new ATOM 0 HA GLU A 173 21.858 26.941 2.302 1.00 60.41 H new ATOM 0 HB2 GLU A 173 21.738 25.670 -0.449 1.00 61.12 H new ATOM 0 HB3 GLU A 173 21.445 27.382 -0.221 1.00 61.12 H new ATOM 0 HG2 GLU A 173 23.754 27.272 1.098 1.00 60.42 H new ATOM 0 HG3 GLU A 173 23.989 25.827 0.135 1.00 60.42 H new ATOM 2291 N LEU A 174 19.181 25.484 1.020 1.00 52.11 N ATOM 2292 CA LEU A 174 17.725 25.551 0.962 1.00 73.42 C ATOM 2293 C LEU A 174 17.129 25.673 2.361 1.00 51.44 C ATOM 2294 O LEU A 174 16.288 26.536 2.614 1.00 10.13 O ATOM 2295 CB LEU A 174 17.165 24.310 0.264 1.00 23.50 C ATOM 2296 CG LEU A 174 17.527 24.150 -1.213 1.00 73.21 C ATOM 2297 CD1 LEU A 174 17.263 22.725 -1.676 1.00 44.41 C ATOM 2298 CD2 LEU A 174 16.746 25.142 -2.063 1.00 65.24 C ATOM 0 H LEU A 174 19.583 24.658 0.576 1.00 52.11 H new ATOM 0 HA LEU A 174 17.450 26.438 0.391 1.00 73.42 H new ATOM 0 HB2 LEU A 174 17.514 23.428 0.801 1.00 23.50 H new ATOM 0 HB3 LEU A 174 16.079 24.328 0.351 1.00 23.50 H new ATOM 0 HG LEU A 174 18.590 24.358 -1.332 1.00 73.21 H new ATOM 0 HD11 LEU A 174 17.526 22.630 -2.729 1.00 44.41 H new ATOM 0 HD12 LEU A 174 17.866 22.034 -1.087 1.00 44.41 H new ATOM 0 HD13 LEU A 174 16.207 22.489 -1.543 1.00 44.41 H new ATOM 0 HD21 LEU A 174 17.016 25.014 -3.111 1.00 65.24 H new ATOM 0 HD22 LEU A 174 15.678 24.965 -1.939 1.00 65.24 H new ATOM 0 HD23 LEU A 174 16.985 26.158 -1.748 1.00 65.24 H new ATOM 2310 N ASP A 175 17.572 24.807 3.265 1.00 72.23 N ATOM 2311 CA ASP A 175 17.085 24.820 4.639 1.00 10.13 C ATOM 2312 C ASP A 175 17.474 26.117 5.341 1.00 2.40 C ATOM 2313 O ASP A 175 16.635 26.781 5.949 1.00 72.31 O ATOM 2314 CB ASP A 175 17.640 23.622 5.411 1.00 30.10 C ATOM 2315 CG ASP A 175 16.558 22.853 6.143 1.00 74.34 C ATOM 2316 OD1 ASP A 175 16.274 23.193 7.310 1.00 33.34 O ATOM 2317 OD2 ASP A 175 15.994 21.911 5.547 1.00 52.20 O ATOM 0 H ASP A 175 18.268 24.087 3.071 1.00 72.23 H new ATOM 0 HA ASP A 175 15.997 24.754 4.613 1.00 10.13 H new ATOM 0 HB2 ASP A 175 18.152 22.953 4.719 1.00 30.10 H new ATOM 0 HB3 ASP A 175 18.384 23.969 6.128 1.00 30.10 H new ATOM 2322 N GLU A 176 18.752 26.472 5.253 1.00 65.32 N ATOM 2323 CA GLU A 176 19.252 27.689 5.881 1.00 23.24 C ATOM 2324 C GLU A 176 18.472 28.909 5.402 1.00 54.04 C ATOM 2325 O GLU A 176 17.861 29.623 6.199 1.00 71.53 O ATOM 2326 CB GLU A 176 20.741 27.871 5.579 1.00 1.02 C ATOM 2327 CG GLU A 176 21.474 28.708 6.614 1.00 42.22 C ATOM 2328 CD GLU A 176 22.444 27.891 7.444 1.00 25.14 C ATOM 2329 OE1 GLU A 176 23.212 27.102 6.854 1.00 51.23 O ATOM 2330 OE2 GLU A 176 22.436 28.039 8.684 1.00 5.41 O ATOM 0 H GLU A 176 19.460 25.934 4.753 1.00 65.32 H new ATOM 0 HA GLU A 176 19.116 27.593 6.958 1.00 23.24 H new ATOM 0 HB2 GLU A 176 21.213 26.890 5.517 1.00 1.02 H new ATOM 0 HB3 GLU A 176 20.850 28.340 4.601 1.00 1.02 H new ATOM 0 HG2 GLU A 176 22.017 29.508 6.111 1.00 42.22 H new ATOM 0 HG3 GLU A 176 20.747 29.182 7.274 1.00 42.22 H new ATOM 2337 N LEU A 177 18.496 29.143 4.094 1.00 5.12 N ATOM 2338 CA LEU A 177 17.792 30.277 3.506 1.00 11.35 C ATOM 2339 C LEU A 177 16.308 30.237 3.856 1.00 12.04 C ATOM 2340 O LEU A 177 15.696 31.270 4.126 1.00 75.10 O ATOM 2341 CB LEU A 177 17.969 30.281 1.987 1.00 4.41 C ATOM 2342 CG LEU A 177 19.174 31.058 1.454 1.00 22.52 C ATOM 2343 CD1 LEU A 177 18.994 32.549 1.688 1.00 3.45 C ATOM 2344 CD2 LEU A 177 20.457 30.564 2.107 1.00 44.33 C ATOM 0 H LEU A 177 18.996 28.562 3.421 1.00 5.12 H new ATOM 0 HA LEU A 177 18.219 31.191 3.918 1.00 11.35 H new ATOM 0 HB2 LEU A 177 18.049 29.248 1.648 1.00 4.41 H new ATOM 0 HB3 LEU A 177 17.067 30.695 1.537 1.00 4.41 H new ATOM 0 HG LEU A 177 19.247 30.887 0.380 1.00 22.52 H new ATOM 0 HD11 LEU A 177 19.861 33.085 1.302 1.00 3.45 H new ATOM 0 HD12 LEU A 177 18.097 32.892 1.173 1.00 3.45 H new ATOM 0 HD13 LEU A 177 18.895 32.740 2.757 1.00 3.45 H new ATOM 0 HD21 LEU A 177 21.304 31.127 1.716 1.00 44.33 H new ATOM 0 HD22 LEU A 177 20.394 30.705 3.186 1.00 44.33 H new ATOM 0 HD23 LEU A 177 20.593 29.505 1.887 1.00 44.33 H new ATOM 2356 N MET A 178 15.736 29.037 3.852 1.00 44.10 N ATOM 2357 CA MET A 178 14.325 28.862 4.173 1.00 55.35 C ATOM 2358 C MET A 178 14.007 29.423 5.555 1.00 25.23 C ATOM 2359 O MET A 178 12.950 30.015 5.767 1.00 1.45 O ATOM 2360 CB MET A 178 13.945 27.382 4.110 1.00 30.43 C ATOM 2361 CG MET A 178 12.515 27.102 4.544 1.00 61.04 C ATOM 2362 SD MET A 178 12.422 25.968 5.943 1.00 44.43 S ATOM 2363 CE MET A 178 10.649 25.801 6.126 1.00 15.21 C ATOM 0 H MET A 178 16.228 28.172 3.630 1.00 44.10 H new ATOM 0 HA MET A 178 13.740 29.411 3.435 1.00 55.35 H new ATOM 0 HB2 MET A 178 14.083 27.023 3.090 1.00 30.43 H new ATOM 0 HB3 MET A 178 14.626 26.813 4.743 1.00 30.43 H new ATOM 0 HG2 MET A 178 12.030 28.041 4.810 1.00 61.04 H new ATOM 0 HG3 MET A 178 11.960 26.683 3.704 1.00 61.04 H new ATOM 0 HE1 MET A 178 10.431 25.128 6.955 1.00 15.21 H new ATOM 0 HE2 MET A 178 10.210 26.778 6.327 1.00 15.21 H new ATOM 0 HE3 MET A 178 10.225 25.395 5.207 1.00 15.21 H new ATOM 2373 N ALA A 179 14.930 29.231 6.492 1.00 21.04 N ATOM 2374 CA ALA A 179 14.749 29.719 7.854 1.00 60.01 C ATOM 2375 C ALA A 179 14.737 31.243 7.894 1.00 51.33 C ATOM 2376 O ALA A 179 13.917 31.849 8.583 1.00 55.31 O ATOM 2377 CB ALA A 179 15.843 29.174 8.760 1.00 44.12 C ATOM 0 H ALA A 179 15.810 28.741 6.333 1.00 21.04 H new ATOM 0 HA ALA A 179 13.784 29.365 8.215 1.00 60.01 H new ATOM 0 HB1 ALA A 179 15.695 29.547 9.774 1.00 44.12 H new ATOM 0 HB2 ALA A 179 15.803 28.085 8.764 1.00 44.12 H new ATOM 0 HB3 ALA A 179 16.816 29.500 8.392 1.00 44.12 H new ATOM 2383 N SER A 180 15.652 31.857 7.151 1.00 43.42 N ATOM 2384 CA SER A 180 15.750 33.312 7.105 1.00 35.40 C ATOM 2385 C SER A 180 14.457 33.926 6.576 1.00 1.11 C ATOM 2386 O SER A 180 14.092 35.044 6.942 1.00 0.13 O ATOM 2387 CB SER A 180 16.927 33.738 6.226 1.00 21.32 C ATOM 2388 OG SER A 180 18.116 33.853 6.988 1.00 44.30 O ATOM 0 H SER A 180 16.336 31.370 6.572 1.00 43.42 H new ATOM 0 HA SER A 180 15.915 33.673 8.120 1.00 35.40 H new ATOM 0 HB2 SER A 180 17.072 33.010 5.428 1.00 21.32 H new ATOM 0 HB3 SER A 180 16.703 34.692 5.750 1.00 21.32 H new ATOM 0 HG SER A 180 18.854 34.125 6.403 1.00 44.30 H new ATOM 2394 N LEU A 181 13.769 33.188 5.713 1.00 73.24 N ATOM 2395 CA LEU A 181 12.516 33.658 5.132 1.00 50.51 C ATOM 2396 C LEU A 181 11.333 33.297 6.024 1.00 55.02 C ATOM 2397 O LEU A 181 10.300 33.967 6.004 1.00 1.00 O ATOM 2398 CB LEU A 181 12.320 33.060 3.738 1.00 64.50 C ATOM 2399 CG LEU A 181 13.239 33.599 2.641 1.00 54.03 C ATOM 2400 CD1 LEU A 181 13.682 32.476 1.716 1.00 5.12 C ATOM 2401 CD2 LEU A 181 12.539 34.697 1.852 1.00 24.31 C ATOM 0 H LEU A 181 14.057 32.261 5.400 1.00 73.24 H new ATOM 0 HA LEU A 181 12.568 34.744 5.050 1.00 50.51 H new ATOM 0 HB2 LEU A 181 12.461 31.981 3.804 1.00 64.50 H new ATOM 0 HB3 LEU A 181 11.287 33.229 3.434 1.00 64.50 H new ATOM 0 HG LEU A 181 14.125 34.025 3.112 1.00 54.03 H new ATOM 0 HD11 LEU A 181 14.335 32.879 0.942 1.00 5.12 H new ATOM 0 HD12 LEU A 181 14.221 31.723 2.290 1.00 5.12 H new ATOM 0 HD13 LEU A 181 12.807 32.020 1.252 1.00 5.12 H new ATOM 0 HD21 LEU A 181 13.207 35.069 1.075 1.00 24.31 H new ATOM 0 HD22 LEU A 181 11.636 34.295 1.392 1.00 24.31 H new ATOM 0 HD23 LEU A 181 12.272 35.513 2.523 1.00 24.31 H new ATOM 2413 N SER A 182 11.491 32.235 6.807 1.00 71.43 N ATOM 2414 CA SER A 182 10.435 31.783 7.705 1.00 30.02 C ATOM 2415 C SER A 182 10.220 32.783 8.837 1.00 53.43 C ATOM 2416 O SER A 182 9.101 33.241 9.072 1.00 71.55 O ATOM 2417 CB SER A 182 10.781 30.409 8.283 1.00 53.12 C ATOM 2418 OG SER A 182 9.610 29.708 8.666 1.00 65.21 O ATOM 0 H SER A 182 12.340 31.671 6.838 1.00 71.43 H new ATOM 0 HA SER A 182 9.512 31.706 7.130 1.00 30.02 H new ATOM 0 HB2 SER A 182 11.331 29.828 7.543 1.00 53.12 H new ATOM 0 HB3 SER A 182 11.436 30.528 9.146 1.00 53.12 H new ATOM 0 HG SER A 182 9.857 28.833 9.031 1.00 65.21 H new ATOM 2424 N ASP A 183 11.299 33.119 9.535 1.00 62.25 N ATOM 2425 CA ASP A 183 11.230 34.066 10.641 1.00 24.24 C ATOM 2426 C ASP A 183 10.262 33.578 11.714 1.00 13.33 C ATOM 2427 O ASP A 183 10.423 32.486 12.260 1.00 72.43 O ATOM 2428 CB ASP A 183 10.800 35.444 10.136 1.00 74.53 C ATOM 2429 CG ASP A 183 11.949 36.223 9.528 1.00 63.54 C ATOM 2430 OD1 ASP A 183 12.769 36.768 10.296 1.00 24.41 O ATOM 2431 OD2 ASP A 183 12.030 36.286 8.283 1.00 14.52 O ATOM 0 H ASP A 183 12.232 32.749 9.354 1.00 62.25 H new ATOM 0 HA ASP A 183 12.224 34.144 11.082 1.00 24.24 H new ATOM 0 HB2 ASP A 183 10.012 35.325 9.392 1.00 74.53 H new ATOM 0 HB3 ASP A 183 10.375 36.014 10.962 1.00 74.53 H new TER 2436 ASP A 183