USER MOD reduce.3.24.130724 H: found=0, std=0, add=1137, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1140 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 96 ZNZN :(H bumps) USER MOD NoAdj-H: A 49 HIS HE2 : A 49 HIS NE2 : A 97 ZNZN :(H bumps) USER MOD NoAdj-H: A 73 HIS HE2 : A 73 HIS NE2 : A 98 ZNZN :(H bumps) USER MOD Set 1.1: A 57 LYS NZ :NH3+ 162:sc= 1.61 (180deg=0.818) USER MOD Set 1.2: B 134 ASN : amide:sc= 1.82 K(o=3.4,f=-6.9!) USER MOD Set 2.1: A 90 ASN : amide:sc= 0.956 K(o=2,f=-4.2) USER MOD Set 2.2: A 94 LYS NZ :NH3+ 166:sc= 1.02 (180deg=-0.00501) USER MOD Set 3.1: A 78 THR OG1 : rot -127:sc= 0.548 USER MOD Set 3.2: B 130 GLN : amide:sc= 1.3 K(o=1.8,f=0.91) USER MOD Set 4.1: A 75 LYS NZ :NH3+ 168:sc= 1.23 (180deg=0) USER MOD Set 4.2: B 147 GLN : amide:sc= 2.61 K(o=3.8,f=-7!) USER MOD Set 5.1: A 66 SER OG : rot 79:sc= 1.03 USER MOD Set 5.2: B 123 CYS SG : rot 84:sc= 0.14 USER MOD Set 6.1: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 52 HIS : no HE2:sc= 1.2 K(o=1.2,f=-3.8!) USER MOD Set 7.1: A 39 HIS : no HD1:sc= 0.847 K(o=1.9,f=-4.2!) USER MOD Set 7.2: A 42 THR OG1 : rot 155:sc= 1.01 USER MOD Set 8.1: A 11 GLN : amide:sc= 0.973 K(o=0.033,f=-2.5!) USER MOD Set 8.2: A 12 GLN : amide:sc= -0.94! X(o=0.033!,f=0.02) USER MOD Single : A 1 ALA N :NH3+ -110:sc= 0.0782 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 175:sc= 1.29 (180deg=1.19) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-2.2!) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -179:sc= 1.25 (180deg=1.19) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 27 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.17) USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 163:sc= 1.49! (180deg=0.617!) USER MOD Single : A 45 ASN : amide:sc= -0.883 K(o=-0.88,f=-1.5!) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 MET CE :methyl -171:sc= -0.826 (180deg=-1.08) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN : amide:sc= 0.835 K(o=0.84,f=-0.012) USER MOD Single : A 63 HIS : no HD1:sc= -0.0912 X(o=-0.091,f=-0.091) USER MOD Single : A 67 SER OG : rot -73:sc= 1.23 USER MOD Single : A 69 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.62) USER MOD Single : A 72 SER OG : rot 81:sc= 2.11 USER MOD Single : A 76 ASN : amide:sc= 0.304 K(o=0.3,f=-3.1!) USER MOD Single : A 80 HIS : no HD1:sc= -0.0741 X(o=-0.074,f=-0.074) USER MOD Single : A 89 LYS NZ :NH3+ 159:sc= 2.01 (180deg=1.55) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot 36:sc= 0.0999 USER MOD Single : B 103 CYS SG : rot 180:sc= 0 USER MOD Single : B 108 GLN : amide:sc= 0.763 K(o=0.76,f=0) USER MOD Single : B 109 SER OG : rot -157:sc= 0.0854 USER MOD Single : B 110 MET CE :methyl 165:sc= -0.0103 (180deg=-0.4) USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 119 THR OG1 : rot 180:sc= 0.074 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 126 ASN : amide:sc= 1.87 K(o=1.9,f=-4.1!) USER MOD Single : B 132 SER OG : rot 180:sc= 0 USER MOD Single : B 137 GLN : amide:sc= 0.789 K(o=0.79,f=0) USER MOD Single : B 149 ASN : amide:sc= 1.1 K(o=1.1,f=-0.019) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 6.481 -11.975 15.944 1.00 0.00 N ATOM 2 CA ALA A 1 5.648 -10.779 15.663 1.00 0.00 C ATOM 3 C ALA A 1 5.653 -9.819 16.860 1.00 0.00 C ATOM 4 O ALA A 1 5.913 -10.231 17.992 1.00 0.00 O ATOM 5 CB ALA A 1 4.219 -11.181 15.258 1.00 0.00 C ATOM 0 H1 ALA A 1 7.339 -11.946 15.357 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.749 -11.983 16.949 1.00 0.00 H new ATOM 0 H3 ALA A 1 5.940 -12.835 15.723 1.00 0.00 H new ATOM 0 HA ALA A 1 6.085 -10.250 14.816 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.632 -10.285 15.058 1.00 0.00 H new ATOM 0 HB2 ALA A 1 4.255 -11.799 14.361 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.756 -11.745 16.068 1.00 0.00 H new ATOM 13 N ASP A 2 5.380 -8.532 16.626 1.00 0.00 N ATOM 14 CA ASP A 2 5.371 -7.462 17.635 1.00 0.00 C ATOM 15 C ASP A 2 4.264 -6.420 17.341 1.00 0.00 C ATOM 16 O ASP A 2 4.070 -6.049 16.177 1.00 0.00 O ATOM 17 CB ASP A 2 6.765 -6.811 17.644 1.00 0.00 C ATOM 18 CG ASP A 2 6.924 -5.784 18.772 1.00 0.00 C ATOM 19 OD1 ASP A 2 6.467 -4.633 18.593 1.00 0.00 O ATOM 20 OD2 ASP A 2 7.492 -6.133 19.834 1.00 0.00 O ATOM 0 H ASP A 2 5.150 -8.191 15.693 1.00 0.00 H new ATOM 0 HA ASP A 2 5.148 -7.878 18.617 1.00 0.00 H new ATOM 0 HB2 ASP A 2 7.524 -7.586 17.752 1.00 0.00 H new ATOM 0 HB3 ASP A 2 6.941 -6.324 16.685 1.00 0.00 H new ATOM 25 N PRO A 3 3.524 -5.923 18.354 1.00 0.00 N ATOM 26 CA PRO A 3 2.453 -4.945 18.152 1.00 0.00 C ATOM 27 C PRO A 3 2.936 -3.629 17.525 1.00 0.00 C ATOM 28 O PRO A 3 2.255 -3.082 16.661 1.00 0.00 O ATOM 29 CB PRO A 3 1.800 -4.741 19.524 1.00 0.00 C ATOM 30 CG PRO A 3 2.893 -5.143 20.511 1.00 0.00 C ATOM 31 CD PRO A 3 3.629 -6.256 19.769 1.00 0.00 C ATOM 0 HA PRO A 3 1.732 -5.320 17.426 1.00 0.00 H new ATOM 0 HB2 PRO A 3 1.490 -3.706 19.670 1.00 0.00 H new ATOM 0 HB3 PRO A 3 0.910 -5.359 19.639 1.00 0.00 H new ATOM 0 HG2 PRO A 3 3.553 -4.308 20.745 1.00 0.00 H new ATOM 0 HG3 PRO A 3 2.476 -5.494 21.455 1.00 0.00 H new ATOM 0 HD2 PRO A 3 4.672 -6.312 20.082 1.00 0.00 H new ATOM 0 HD3 PRO A 3 3.181 -7.228 19.977 1.00 0.00 H new ATOM 39 N GLU A 4 4.107 -3.112 17.905 1.00 0.00 N ATOM 40 CA GLU A 4 4.651 -1.880 17.318 1.00 0.00 C ATOM 41 C GLU A 4 5.068 -2.097 15.851 1.00 0.00 C ATOM 42 O GLU A 4 4.866 -1.212 15.020 1.00 0.00 O ATOM 43 CB GLU A 4 5.774 -1.260 18.159 1.00 0.00 C ATOM 44 CG GLU A 4 5.404 -1.129 19.646 1.00 0.00 C ATOM 45 CD GLU A 4 6.454 -0.313 20.429 1.00 0.00 C ATOM 46 OE1 GLU A 4 7.610 -0.777 20.587 1.00 0.00 O ATOM 47 OE2 GLU A 4 6.121 0.792 20.925 1.00 0.00 O ATOM 0 H GLU A 4 4.702 -3.529 18.621 1.00 0.00 H new ATOM 0 HA GLU A 4 3.845 -1.147 17.324 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.671 -1.872 18.065 1.00 0.00 H new ATOM 0 HB3 GLU A 4 6.017 -0.274 17.762 1.00 0.00 H new ATOM 0 HG2 GLU A 4 4.429 -0.649 19.737 1.00 0.00 H new ATOM 0 HG3 GLU A 4 5.313 -2.122 20.087 1.00 0.00 H new ATOM 54 N LYS A 5 5.566 -3.289 15.481 1.00 0.00 N ATOM 55 CA LYS A 5 5.813 -3.628 14.064 1.00 0.00 C ATOM 56 C LYS A 5 4.495 -3.574 13.284 1.00 0.00 C ATOM 57 O LYS A 5 4.466 -3.011 12.194 1.00 0.00 O ATOM 58 CB LYS A 5 6.532 -4.974 13.890 1.00 0.00 C ATOM 59 CG LYS A 5 8.013 -4.874 14.284 1.00 0.00 C ATOM 60 CD LYS A 5 8.731 -6.212 14.050 1.00 0.00 C ATOM 61 CE LYS A 5 10.205 -6.160 14.477 1.00 0.00 C ATOM 62 NZ LYS A 5 11.037 -5.356 13.544 1.00 0.00 N ATOM 0 H LYS A 5 5.805 -4.032 16.137 1.00 0.00 H new ATOM 0 HA LYS A 5 6.494 -2.883 13.654 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.042 -5.732 14.501 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.451 -5.300 12.853 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.497 -4.090 13.702 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.097 -4.590 15.333 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.221 -6.999 14.606 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.669 -6.476 12.994 1.00 0.00 H new ATOM 0 HE2 LYS A 5 10.275 -5.737 15.479 1.00 0.00 H new ATOM 0 HE3 LYS A 5 10.601 -7.174 14.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 12.004 -5.280 13.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 11.062 -5.820 12.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.628 -4.405 13.446 1.00 0.00 H new ATOM 76 N ARG A 6 3.387 -4.081 13.844 1.00 0.00 N ATOM 77 CA ARG A 6 2.040 -3.953 13.247 1.00 0.00 C ATOM 78 C ARG A 6 1.646 -2.475 13.070 1.00 0.00 C ATOM 79 O ARG A 6 1.190 -2.118 11.987 1.00 0.00 O ATOM 80 CB ARG A 6 0.995 -4.786 14.007 1.00 0.00 C ATOM 81 CG ARG A 6 1.199 -6.287 13.741 1.00 0.00 C ATOM 82 CD ARG A 6 0.157 -7.131 14.484 1.00 0.00 C ATOM 83 NE ARG A 6 0.218 -8.544 14.065 1.00 0.00 N ATOM 84 CZ ARG A 6 -0.343 -9.586 14.648 1.00 0.00 C ATOM 85 NH1 ARG A 6 -1.034 -9.489 15.750 1.00 0.00 N ATOM 86 NH2 ARG A 6 -0.215 -10.764 14.112 1.00 0.00 N ATOM 0 H ARG A 6 3.395 -4.593 14.726 1.00 0.00 H new ATOM 0 HA ARG A 6 2.072 -4.378 12.244 1.00 0.00 H new ATOM 0 HB2 ARG A 6 1.072 -4.587 15.076 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -0.008 -4.490 13.699 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.131 -6.481 12.671 1.00 0.00 H new ATOM 0 HG3 ARG A 6 2.200 -6.582 14.056 1.00 0.00 H new ATOM 0 HD2 ARG A 6 0.327 -7.060 15.558 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -0.840 -6.735 14.292 1.00 0.00 H new ATOM 0 HE ARG A 6 0.759 -8.739 13.223 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.158 -8.580 16.196 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -1.450 -10.322 16.166 1.00 0.00 H new ATOM 0 HH21 ARG A 6 0.316 -10.876 13.248 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -0.645 -11.576 14.556 1.00 0.00 H new ATOM 100 N LYS A 7 1.884 -1.598 14.061 1.00 0.00 N ATOM 101 CA LYS A 7 1.685 -0.128 13.946 1.00 0.00 C ATOM 102 C LYS A 7 2.446 0.437 12.735 1.00 0.00 C ATOM 103 O LYS A 7 1.877 1.167 11.922 1.00 0.00 O ATOM 104 CB LYS A 7 2.122 0.612 15.230 1.00 0.00 C ATOM 105 CG LYS A 7 1.018 0.876 16.259 1.00 0.00 C ATOM 106 CD LYS A 7 0.454 -0.391 16.909 1.00 0.00 C ATOM 107 CE LYS A 7 -0.576 -0.007 17.972 1.00 0.00 C ATOM 108 NZ LYS A 7 -1.199 -1.206 18.592 1.00 0.00 N ATOM 0 H LYS A 7 2.224 -1.886 14.979 1.00 0.00 H new ATOM 0 HA LYS A 7 0.617 0.038 13.804 1.00 0.00 H new ATOM 0 HB2 LYS A 7 2.909 0.031 15.711 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.561 1.568 14.944 1.00 0.00 H new ATOM 0 HG2 LYS A 7 1.411 1.528 17.039 1.00 0.00 H new ATOM 0 HG3 LYS A 7 0.205 1.415 15.773 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -0.008 -1.025 16.153 1.00 0.00 H new ATOM 0 HD3 LYS A 7 1.260 -0.970 17.361 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -0.095 0.594 18.744 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -1.350 0.614 17.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.892 -0.906 19.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -1.679 -1.766 17.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -0.463 -1.785 19.044 1.00 0.00 H new ATOM 122 N LEU A 8 3.729 0.092 12.602 1.00 0.00 N ATOM 123 CA LEU A 8 4.593 0.485 11.480 1.00 0.00 C ATOM 124 C LEU A 8 4.050 -0.042 10.135 1.00 0.00 C ATOM 125 O LEU A 8 4.028 0.693 9.149 1.00 0.00 O ATOM 126 CB LEU A 8 6.036 0.029 11.759 1.00 0.00 C ATOM 127 CG LEU A 8 6.708 0.749 12.946 1.00 0.00 C ATOM 128 CD1 LEU A 8 8.063 0.100 13.235 1.00 0.00 C ATOM 129 CD2 LEU A 8 6.900 2.245 12.685 1.00 0.00 C ATOM 0 H LEU A 8 4.212 -0.485 13.291 1.00 0.00 H new ATOM 0 HA LEU A 8 4.595 1.571 11.392 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.035 -1.044 11.952 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.636 0.191 10.863 1.00 0.00 H new ATOM 0 HG LEU A 8 6.048 0.650 13.808 1.00 0.00 H new ATOM 0 HD11 LEU A 8 8.538 0.608 14.074 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.917 -0.951 13.483 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.700 0.180 12.354 1.00 0.00 H new ATOM 0 HD21 LEU A 8 7.377 2.707 13.550 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.530 2.383 11.806 1.00 0.00 H new ATOM 0 HD23 LEU A 8 5.930 2.712 12.513 1.00 0.00 H new ATOM 141 N ILE A 9 3.578 -1.290 10.081 1.00 0.00 N ATOM 142 CA ILE A 9 2.940 -1.888 8.897 1.00 0.00 C ATOM 143 C ILE A 9 1.681 -1.087 8.511 1.00 0.00 C ATOM 144 O ILE A 9 1.520 -0.758 7.338 1.00 0.00 O ATOM 145 CB ILE A 9 2.675 -3.400 9.116 1.00 0.00 C ATOM 146 CG1 ILE A 9 4.020 -4.164 9.113 1.00 0.00 C ATOM 147 CG2 ILE A 9 1.754 -3.989 8.033 1.00 0.00 C ATOM 148 CD1 ILE A 9 3.947 -5.570 9.718 1.00 0.00 C ATOM 0 H ILE A 9 3.628 -1.930 10.874 1.00 0.00 H new ATOM 0 HA ILE A 9 3.618 -1.828 8.046 1.00 0.00 H new ATOM 0 HB ILE A 9 2.173 -3.512 10.077 1.00 0.00 H new ATOM 0 HG12 ILE A 9 4.379 -4.241 8.087 1.00 0.00 H new ATOM 0 HG13 ILE A 9 4.757 -3.581 9.665 1.00 0.00 H new ATOM 0 HG21 ILE A 9 1.596 -5.050 8.227 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.795 -3.471 8.049 1.00 0.00 H new ATOM 0 HG23 ILE A 9 2.217 -3.864 7.054 1.00 0.00 H new ATOM 0 HD11 ILE A 9 4.932 -6.036 9.677 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.621 -5.503 10.756 1.00 0.00 H new ATOM 0 HD13 ILE A 9 3.237 -6.173 9.153 1.00 0.00 H new ATOM 160 N GLN A 10 0.802 -0.742 9.464 1.00 0.00 N ATOM 161 CA GLN A 10 -0.424 0.046 9.236 1.00 0.00 C ATOM 162 C GLN A 10 -0.163 1.348 8.457 1.00 0.00 C ATOM 163 O GLN A 10 -0.773 1.551 7.404 1.00 0.00 O ATOM 164 CB GLN A 10 -1.161 0.341 10.557 1.00 0.00 C ATOM 165 CG GLN A 10 -1.892 -0.888 11.105 1.00 0.00 C ATOM 166 CD GLN A 10 -2.574 -0.617 12.446 1.00 0.00 C ATOM 167 OE1 GLN A 10 -1.941 -0.346 13.459 1.00 0.00 O ATOM 168 NE2 GLN A 10 -3.888 -0.693 12.521 1.00 0.00 N ATOM 0 H GLN A 10 0.925 -1.009 10.441 1.00 0.00 H new ATOM 0 HA GLN A 10 -1.068 -0.574 8.613 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.445 0.695 11.298 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.878 1.146 10.398 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -2.639 -1.215 10.381 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -1.182 -1.707 11.222 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -4.434 -0.917 11.689 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -4.358 -0.527 13.411 1.00 0.00 H new ATOM 177 N GLN A 11 0.728 2.228 8.942 1.00 0.00 N ATOM 178 CA GLN A 11 1.044 3.473 8.221 1.00 0.00 C ATOM 179 C GLN A 11 1.616 3.190 6.824 1.00 0.00 C ATOM 180 O GLN A 11 1.151 3.794 5.861 1.00 0.00 O ATOM 181 CB GLN A 11 1.872 4.474 9.050 1.00 0.00 C ATOM 182 CG GLN A 11 3.287 4.045 9.482 1.00 0.00 C ATOM 183 CD GLN A 11 4.406 4.670 8.646 1.00 0.00 C ATOM 184 OE1 GLN A 11 4.452 4.575 7.428 1.00 0.00 O ATOM 185 NE2 GLN A 11 5.369 5.306 9.276 1.00 0.00 N ATOM 0 H GLN A 11 1.236 2.104 9.818 1.00 0.00 H new ATOM 0 HA GLN A 11 0.098 3.990 8.061 1.00 0.00 H new ATOM 0 HB2 GLN A 11 1.962 5.394 8.473 1.00 0.00 H new ATOM 0 HB3 GLN A 11 1.305 4.715 9.949 1.00 0.00 H new ATOM 0 HG2 GLN A 11 3.434 4.314 10.528 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.362 2.959 9.419 1.00 0.00 H new ATOM 0 HE21 GLN A 11 5.343 5.393 10.292 1.00 0.00 H new ATOM 0 HE22 GLN A 11 6.142 5.713 8.749 1.00 0.00 H new ATOM 194 N GLN A 12 2.553 2.246 6.682 1.00 0.00 N ATOM 195 CA GLN A 12 3.110 1.854 5.378 1.00 0.00 C ATOM 196 C GLN A 12 2.013 1.430 4.384 1.00 0.00 C ATOM 197 O GLN A 12 2.031 1.869 3.234 1.00 0.00 O ATOM 198 CB GLN A 12 4.160 0.742 5.552 1.00 0.00 C ATOM 199 CG GLN A 12 5.451 1.231 6.226 1.00 0.00 C ATOM 200 CD GLN A 12 6.275 2.123 5.307 1.00 0.00 C ATOM 201 OE1 GLN A 12 7.080 1.674 4.504 1.00 0.00 O ATOM 202 NE2 GLN A 12 6.121 3.423 5.403 1.00 0.00 N ATOM 0 H GLN A 12 2.949 1.730 7.468 1.00 0.00 H new ATOM 0 HA GLN A 12 3.600 2.730 4.954 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.731 -0.065 6.146 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.403 0.324 4.575 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.200 1.780 7.134 1.00 0.00 H new ATOM 0 HG3 GLN A 12 6.049 0.372 6.528 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.452 3.810 6.069 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.670 4.047 4.811 1.00 0.00 H new ATOM 211 N LEU A 13 1.054 0.606 4.822 1.00 0.00 N ATOM 212 CA LEU A 13 -0.084 0.114 4.047 1.00 0.00 C ATOM 213 C LEU A 13 -0.894 1.301 3.494 1.00 0.00 C ATOM 214 O LEU A 13 -1.069 1.428 2.281 1.00 0.00 O ATOM 215 CB LEU A 13 -0.884 -0.870 4.935 1.00 0.00 C ATOM 216 CG LEU A 13 -1.600 -1.990 4.163 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.006 -3.128 5.095 1.00 0.00 C ATOM 218 CD2 LEU A 13 -2.825 -1.515 3.402 1.00 0.00 C ATOM 0 H LEU A 13 1.054 0.247 5.777 1.00 0.00 H new ATOM 0 HA LEU A 13 0.229 -0.445 3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.204 -1.322 5.658 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.625 -0.307 5.503 1.00 0.00 H new ATOM 0 HG LEU A 13 -0.874 -2.344 3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.510 -3.906 4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.117 -3.545 5.569 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.681 -2.747 5.862 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.279 -2.358 2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.545 -1.089 4.101 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.531 -0.756 2.677 1.00 0.00 H new ATOM 230 N VAL A 14 -1.337 2.204 4.374 1.00 0.00 N ATOM 231 CA VAL A 14 -2.091 3.423 4.039 1.00 0.00 C ATOM 232 C VAL A 14 -1.301 4.364 3.120 1.00 0.00 C ATOM 233 O VAL A 14 -1.829 4.776 2.086 1.00 0.00 O ATOM 234 CB VAL A 14 -2.557 4.128 5.324 1.00 0.00 C ATOM 235 CG1 VAL A 14 -3.128 5.528 5.075 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.643 3.279 6.000 1.00 0.00 C ATOM 0 H VAL A 14 -1.176 2.106 5.376 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.974 3.126 3.473 1.00 0.00 H new ATOM 0 HB VAL A 14 -1.676 4.239 5.956 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.438 5.969 6.023 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -2.365 6.156 4.615 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.988 5.457 4.410 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.977 3.774 6.912 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.487 3.161 5.321 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.237 2.298 6.248 1.00 0.00 H new ATOM 246 N LEU A 15 -0.052 4.709 3.462 1.00 0.00 N ATOM 247 CA LEU A 15 0.800 5.581 2.646 1.00 0.00 C ATOM 248 C LEU A 15 0.969 5.036 1.219 1.00 0.00 C ATOM 249 O LEU A 15 0.827 5.790 0.259 1.00 0.00 O ATOM 250 CB LEU A 15 2.189 5.799 3.275 1.00 0.00 C ATOM 251 CG LEU A 15 2.293 6.623 4.567 1.00 0.00 C ATOM 252 CD1 LEU A 15 3.779 6.870 4.839 1.00 0.00 C ATOM 253 CD2 LEU A 15 1.588 7.972 4.451 1.00 0.00 C ATOM 0 H LEU A 15 0.398 4.388 4.319 1.00 0.00 H new ATOM 0 HA LEU A 15 0.287 6.542 2.603 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.620 4.818 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 15 2.819 6.278 2.526 1.00 0.00 H new ATOM 0 HG LEU A 15 1.812 6.069 5.373 1.00 0.00 H new ATOM 0 HD11 LEU A 15 3.889 7.454 5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.291 5.915 4.955 1.00 0.00 H new ATOM 0 HD13 LEU A 15 4.216 7.417 4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.689 8.517 5.389 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.039 8.550 3.645 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.531 7.813 4.236 1.00 0.00 H new ATOM 265 N LEU A 16 1.269 3.742 1.071 1.00 0.00 N ATOM 266 CA LEU A 16 1.438 3.082 -0.225 1.00 0.00 C ATOM 267 C LEU A 16 0.174 3.182 -1.094 1.00 0.00 C ATOM 268 O LEU A 16 0.252 3.566 -2.263 1.00 0.00 O ATOM 269 CB LEU A 16 1.857 1.623 0.005 1.00 0.00 C ATOM 270 CG LEU A 16 2.155 0.874 -1.303 1.00 0.00 C ATOM 271 CD1 LEU A 16 3.352 1.481 -2.029 1.00 0.00 C ATOM 272 CD2 LEU A 16 2.492 -0.574 -0.976 1.00 0.00 C ATOM 0 H LEU A 16 1.403 3.114 1.863 1.00 0.00 H new ATOM 0 HA LEU A 16 2.223 3.595 -0.780 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.742 1.600 0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 16 1.064 1.103 0.543 1.00 0.00 H new ATOM 0 HG LEU A 16 1.275 0.945 -1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.537 0.929 -2.950 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.143 2.524 -2.267 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.233 1.425 -1.389 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.705 -1.115 -1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.366 -0.606 -0.326 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.646 -1.039 -0.470 1.00 0.00 H new ATOM 284 N LEU A 17 -0.989 2.857 -0.520 1.00 0.00 N ATOM 285 CA LEU A 17 -2.294 2.976 -1.178 1.00 0.00 C ATOM 286 C LEU A 17 -2.517 4.414 -1.653 1.00 0.00 C ATOM 287 O LEU A 17 -2.788 4.645 -2.835 1.00 0.00 O ATOM 288 CB LEU A 17 -3.408 2.540 -0.214 1.00 0.00 C ATOM 289 CG LEU A 17 -3.414 1.031 0.062 1.00 0.00 C ATOM 290 CD1 LEU A 17 -4.236 0.770 1.316 1.00 0.00 C ATOM 291 CD2 LEU A 17 -4.038 0.243 -1.086 1.00 0.00 C ATOM 0 H LEU A 17 -1.051 2.497 0.432 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.316 2.322 -2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.293 3.075 0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.373 2.830 -0.629 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.380 0.707 0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -4.250 -0.300 1.526 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -3.792 1.299 2.159 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.256 1.123 1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -4.022 -0.821 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.069 0.566 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.470 0.420 -1.999 1.00 0.00 H new ATOM 303 N HIS A 18 -2.370 5.374 -0.736 1.00 0.00 N ATOM 304 CA HIS A 18 -2.492 6.794 -1.030 1.00 0.00 C ATOM 305 C HIS A 18 -1.558 7.221 -2.175 1.00 0.00 C ATOM 306 O HIS A 18 -2.035 7.851 -3.107 1.00 0.00 O ATOM 307 CB HIS A 18 -2.290 7.650 0.228 1.00 0.00 C ATOM 308 CG HIS A 18 -2.457 9.112 -0.103 1.00 0.00 C ATOM 309 ND1 HIS A 18 -3.638 9.821 -0.128 1.00 0.00 N ATOM 310 CD2 HIS A 18 -1.491 9.900 -0.667 1.00 0.00 C ATOM 311 CE1 HIS A 18 -3.382 11.010 -0.706 1.00 0.00 C ATOM 312 NE2 HIS A 18 -2.087 11.102 -1.064 1.00 0.00 N ATOM 0 H HIS A 18 -2.160 5.178 0.243 1.00 0.00 H new ATOM 0 HA HIS A 18 -3.512 6.968 -1.374 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -3.009 7.359 0.994 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -1.296 7.474 0.640 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -4.540 9.504 0.226 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.450 9.639 -0.785 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -4.117 11.786 -0.862 1.00 0.00 H new ATOM 320 N ALA A 19 -0.264 6.884 -2.146 1.00 0.00 N ATOM 321 CA ALA A 19 0.728 7.249 -3.167 1.00 0.00 C ATOM 322 C ALA A 19 0.237 7.068 -4.618 1.00 0.00 C ATOM 323 O ALA A 19 0.388 7.970 -5.443 1.00 0.00 O ATOM 324 CB ALA A 19 2.024 6.481 -2.905 1.00 0.00 C ATOM 0 H ALA A 19 0.136 6.332 -1.387 1.00 0.00 H new ATOM 0 HA ALA A 19 0.908 8.320 -3.075 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.764 6.748 -3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.405 6.737 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.828 5.410 -2.952 1.00 0.00 H new ATOM 330 N HIS A 20 -0.374 5.921 -4.938 1.00 0.00 N ATOM 331 CA HIS A 20 -0.963 5.670 -6.262 1.00 0.00 C ATOM 332 C HIS A 20 -2.245 6.498 -6.475 1.00 0.00 C ATOM 333 O HIS A 20 -2.405 7.141 -7.513 1.00 0.00 O ATOM 334 CB HIS A 20 -1.189 4.167 -6.447 1.00 0.00 C ATOM 335 CG HIS A 20 -1.769 3.823 -7.797 1.00 0.00 C ATOM 336 ND1 HIS A 20 -3.081 3.462 -8.057 1.00 0.00 N ATOM 337 CD2 HIS A 20 -1.102 3.901 -8.989 1.00 0.00 C ATOM 338 CE1 HIS A 20 -3.207 3.328 -9.395 1.00 0.00 C ATOM 339 NE2 HIS A 20 -2.016 3.583 -9.980 1.00 0.00 N ATOM 0 H HIS A 20 -0.475 5.141 -4.289 1.00 0.00 H new ATOM 0 HA HIS A 20 -0.267 5.999 -7.033 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.241 3.644 -6.320 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -1.859 3.807 -5.667 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.063 4.160 -9.130 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -4.115 3.060 -9.915 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -1.823 3.547 -10.981 1.00 0.00 H new ATOM 348 N LYS A 21 -3.147 6.515 -5.484 1.00 0.00 N ATOM 349 CA LYS A 21 -4.407 7.294 -5.457 1.00 0.00 C ATOM 350 C LYS A 21 -4.172 8.790 -5.733 1.00 0.00 C ATOM 351 O LYS A 21 -4.928 9.416 -6.477 1.00 0.00 O ATOM 352 CB LYS A 21 -5.095 7.066 -4.097 1.00 0.00 C ATOM 353 CG LYS A 21 -6.625 7.117 -4.188 1.00 0.00 C ATOM 354 CD LYS A 21 -7.243 6.909 -2.794 1.00 0.00 C ATOM 355 CE LYS A 21 -8.691 6.409 -2.858 1.00 0.00 C ATOM 356 NZ LYS A 21 -9.625 7.399 -3.450 1.00 0.00 N ATOM 0 H LYS A 21 -3.018 5.962 -4.636 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.058 6.945 -6.258 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -4.792 6.098 -3.700 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -4.752 7.822 -3.391 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -6.941 8.077 -4.595 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -6.983 6.347 -4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -6.640 6.192 -2.237 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.211 7.849 -2.243 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.726 5.490 -3.444 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.027 6.158 -1.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -10.589 7.010 -3.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.605 8.274 -2.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.336 7.608 -4.427 1.00 0.00 H new ATOM 370 N CYS A 22 -3.107 9.343 -5.156 1.00 0.00 N ATOM 371 CA CYS A 22 -2.602 10.705 -5.269 1.00 0.00 C ATOM 372 C CYS A 22 -2.404 11.105 -6.741 1.00 0.00 C ATOM 373 O CYS A 22 -2.862 12.167 -7.154 1.00 0.00 O ATOM 374 CB CYS A 22 -1.307 10.774 -4.447 1.00 0.00 C ATOM 375 SG CYS A 22 -0.762 12.474 -4.150 1.00 0.00 S ATOM 0 H CYS A 22 -2.518 8.789 -4.534 1.00 0.00 H new ATOM 0 HA CYS A 22 -3.318 11.426 -4.875 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -1.461 10.273 -3.491 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -0.520 10.230 -4.969 1.00 0.00 H new ATOM 380 N GLN A 23 -1.780 10.241 -7.555 1.00 0.00 N ATOM 381 CA GLN A 23 -1.594 10.455 -8.998 1.00 0.00 C ATOM 382 C GLN A 23 -2.949 10.709 -9.687 1.00 0.00 C ATOM 383 O GLN A 23 -3.107 11.712 -10.384 1.00 0.00 O ATOM 384 CB GLN A 23 -0.855 9.270 -9.647 1.00 0.00 C ATOM 385 CG GLN A 23 0.515 8.973 -9.015 1.00 0.00 C ATOM 386 CD GLN A 23 1.204 7.792 -9.695 1.00 0.00 C ATOM 387 OE1 GLN A 23 1.065 6.640 -9.302 1.00 0.00 O ATOM 388 NE2 GLN A 23 1.972 8.021 -10.741 1.00 0.00 N ATOM 0 H GLN A 23 -1.384 9.361 -7.225 1.00 0.00 H new ATOM 0 HA GLN A 23 -0.973 11.341 -9.131 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.480 8.380 -9.573 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -0.718 9.476 -10.709 1.00 0.00 H new ATOM 0 HG2 GLN A 23 1.149 9.856 -9.088 1.00 0.00 H new ATOM 0 HG3 GLN A 23 0.388 8.759 -7.954 1.00 0.00 H new ATOM 0 HE21 GLN A 23 2.099 8.974 -11.082 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.440 7.245 -11.210 1.00 0.00 H new ATOM 397 N ARG A 24 -3.947 9.836 -9.463 1.00 0.00 N ATOM 398 CA ARG A 24 -5.319 9.994 -9.985 1.00 0.00 C ATOM 399 C ARG A 24 -5.932 11.322 -9.516 1.00 0.00 C ATOM 400 O ARG A 24 -6.405 12.098 -10.347 1.00 0.00 O ATOM 401 CB ARG A 24 -6.185 8.772 -9.615 1.00 0.00 C ATOM 402 CG ARG A 24 -7.596 8.861 -10.226 1.00 0.00 C ATOM 403 CD ARG A 24 -8.500 7.681 -9.834 1.00 0.00 C ATOM 404 NE ARG A 24 -8.105 6.404 -10.465 1.00 0.00 N ATOM 405 CZ ARG A 24 -8.348 6.001 -11.699 1.00 0.00 C ATOM 406 NH1 ARG A 24 -8.920 6.759 -12.593 1.00 0.00 N ATOM 407 NH2 ARG A 24 -8.019 4.798 -12.057 1.00 0.00 N ATOM 0 H ARG A 24 -3.823 8.990 -8.907 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.281 10.036 -11.074 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.696 7.862 -9.962 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -6.263 8.698 -8.530 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -8.065 9.792 -9.907 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -7.513 8.902 -11.312 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.482 7.563 -8.751 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.528 7.912 -10.112 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.582 5.756 -9.876 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.201 7.709 -12.351 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.086 6.402 -13.534 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -7.575 4.170 -11.387 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -8.204 4.481 -13.009 1.00 0.00 H new ATOM 421 N ARG A 25 -5.911 11.593 -8.204 1.00 0.00 N ATOM 422 CA ARG A 25 -6.420 12.831 -7.577 1.00 0.00 C ATOM 423 C ARG A 25 -5.794 14.087 -8.190 1.00 0.00 C ATOM 424 O ARG A 25 -6.517 14.998 -8.573 1.00 0.00 O ATOM 425 CB ARG A 25 -6.262 12.749 -6.045 1.00 0.00 C ATOM 426 CG ARG A 25 -6.862 13.956 -5.293 1.00 0.00 C ATOM 427 CD ARG A 25 -5.861 15.076 -4.952 1.00 0.00 C ATOM 428 NE ARG A 25 -4.994 14.712 -3.811 1.00 0.00 N ATOM 429 CZ ARG A 25 -3.745 14.278 -3.836 1.00 0.00 C ATOM 430 NH1 ARG A 25 -3.059 14.174 -4.927 1.00 0.00 N ATOM 431 NH2 ARG A 25 -3.134 13.908 -2.758 1.00 0.00 N ATOM 0 H ARG A 25 -5.527 10.938 -7.523 1.00 0.00 H new ATOM 0 HA ARG A 25 -7.486 12.919 -7.787 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -6.739 11.836 -5.688 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.202 12.671 -5.802 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -7.664 14.379 -5.898 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -7.314 13.600 -4.367 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -5.243 15.288 -5.824 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.406 15.990 -4.717 1.00 0.00 H new ATOM 0 HE ARG A 25 -5.413 14.808 -2.886 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.479 14.432 -5.820 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.098 13.834 -4.895 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.616 13.947 -1.860 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -2.170 13.577 -2.806 1.00 0.00 H new ATOM 445 N GLU A 26 -4.470 14.124 -8.309 1.00 0.00 N ATOM 446 CA GLU A 26 -3.677 15.200 -8.917 1.00 0.00 C ATOM 447 C GLU A 26 -4.109 15.463 -10.371 1.00 0.00 C ATOM 448 O GLU A 26 -4.397 16.606 -10.731 1.00 0.00 O ATOM 449 CB GLU A 26 -2.180 14.848 -8.813 1.00 0.00 C ATOM 450 CG GLU A 26 -1.265 15.880 -9.481 1.00 0.00 C ATOM 451 CD GLU A 26 0.221 15.515 -9.296 1.00 0.00 C ATOM 452 OE1 GLU A 26 0.742 14.681 -10.076 1.00 0.00 O ATOM 453 OE2 GLU A 26 0.883 16.081 -8.393 1.00 0.00 O ATOM 0 H GLU A 26 -3.884 13.363 -7.966 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.854 16.128 -8.373 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.908 14.758 -7.761 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -2.011 13.873 -9.270 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.497 15.940 -10.544 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.455 16.866 -9.057 1.00 0.00 H new ATOM 460 N GLN A 27 -4.178 14.417 -11.205 1.00 0.00 N ATOM 461 CA GLN A 27 -4.629 14.513 -12.601 1.00 0.00 C ATOM 462 C GLN A 27 -6.071 15.051 -12.698 1.00 0.00 C ATOM 463 O GLN A 27 -6.351 15.913 -13.534 1.00 0.00 O ATOM 464 CB GLN A 27 -4.489 13.154 -13.310 1.00 0.00 C ATOM 465 CG GLN A 27 -3.027 12.744 -13.566 1.00 0.00 C ATOM 466 CD GLN A 27 -2.298 13.693 -14.516 1.00 0.00 C ATOM 467 OE1 GLN A 27 -2.601 13.792 -15.700 1.00 0.00 O ATOM 468 NE2 GLN A 27 -1.308 14.425 -14.048 1.00 0.00 N ATOM 0 H GLN A 27 -3.920 13.470 -10.927 1.00 0.00 H new ATOM 0 HA GLN A 27 -3.986 15.230 -13.111 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -4.973 12.386 -12.706 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -5.019 13.193 -14.261 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -2.494 12.709 -12.616 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -3.005 11.736 -13.981 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.042 14.355 -13.066 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -0.807 15.061 -14.668 1.00 0.00 H new ATOM 477 N ALA A 28 -6.982 14.565 -11.845 1.00 0.00 N ATOM 478 CA ALA A 28 -8.375 15.013 -11.766 1.00 0.00 C ATOM 479 C ALA A 28 -8.480 16.503 -11.362 1.00 0.00 C ATOM 480 O ALA A 28 -9.128 17.290 -12.058 1.00 0.00 O ATOM 481 CB ALA A 28 -9.139 14.094 -10.803 1.00 0.00 C ATOM 0 H ALA A 28 -6.763 13.829 -11.173 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.831 14.944 -12.754 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.177 14.419 -10.737 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.102 13.069 -11.172 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -8.681 14.141 -9.815 1.00 0.00 H new ATOM 487 N ASN A 29 -7.847 16.892 -10.249 1.00 0.00 N ATOM 488 CA ASN A 29 -7.800 18.258 -9.716 1.00 0.00 C ATOM 489 C ASN A 29 -6.457 18.550 -9.007 1.00 0.00 C ATOM 490 O ASN A 29 -6.162 18.004 -7.940 1.00 0.00 O ATOM 491 CB ASN A 29 -8.995 18.476 -8.771 1.00 0.00 C ATOM 492 CG ASN A 29 -8.977 19.875 -8.172 1.00 0.00 C ATOM 493 OD1 ASN A 29 -8.997 20.877 -8.875 1.00 0.00 O ATOM 494 ND2 ASN A 29 -8.926 19.999 -6.864 1.00 0.00 N ATOM 0 H ASN A 29 -7.330 16.232 -9.669 1.00 0.00 H new ATOM 0 HA ASN A 29 -7.870 18.961 -10.546 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -9.926 18.324 -9.317 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.969 17.735 -7.972 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -8.903 20.926 -6.440 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -8.909 19.168 -6.273 1.00 0.00 H new ATOM 501 N GLY A 30 -5.655 19.440 -9.594 1.00 0.00 N ATOM 502 CA GLY A 30 -4.349 19.872 -9.086 1.00 0.00 C ATOM 503 C GLY A 30 -3.708 20.925 -9.998 1.00 0.00 C ATOM 504 O GLY A 30 -3.792 20.825 -11.224 1.00 0.00 O ATOM 0 H GLY A 30 -5.906 19.898 -10.470 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.466 20.282 -8.083 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.687 19.010 -9.003 1.00 0.00 H new ATOM 508 N GLU A 31 -3.069 21.939 -9.411 1.00 0.00 N ATOM 509 CA GLU A 31 -2.406 23.037 -10.135 1.00 0.00 C ATOM 510 C GLU A 31 -1.132 23.481 -9.390 1.00 0.00 C ATOM 511 O GLU A 31 -0.042 22.979 -9.675 1.00 0.00 O ATOM 512 CB GLU A 31 -3.424 24.175 -10.373 1.00 0.00 C ATOM 513 CG GLU A 31 -2.893 25.344 -11.215 1.00 0.00 C ATOM 514 CD GLU A 31 -2.591 24.927 -12.668 1.00 0.00 C ATOM 515 OE1 GLU A 31 -3.510 24.971 -13.522 1.00 0.00 O ATOM 516 OE2 GLU A 31 -1.428 24.565 -12.969 1.00 0.00 O ATOM 0 H GLU A 31 -2.994 22.026 -8.397 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.069 22.703 -11.116 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -4.304 23.760 -10.865 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.751 24.560 -9.407 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.626 26.151 -11.216 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.986 25.737 -10.756 1.00 0.00 H new ATOM 523 N VAL A 32 -1.256 24.392 -8.415 1.00 0.00 N ATOM 524 CA VAL A 32 -0.147 24.887 -7.575 1.00 0.00 C ATOM 525 C VAL A 32 0.320 23.777 -6.623 1.00 0.00 C ATOM 526 O VAL A 32 1.516 23.491 -6.519 1.00 0.00 O ATOM 527 CB VAL A 32 -0.563 26.151 -6.790 1.00 0.00 C ATOM 528 CG1 VAL A 32 0.600 26.719 -5.966 1.00 0.00 C ATOM 529 CG2 VAL A 32 -1.046 27.261 -7.734 1.00 0.00 C ATOM 0 H VAL A 32 -2.152 24.819 -8.179 1.00 0.00 H new ATOM 0 HA VAL A 32 0.683 25.166 -8.224 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.370 25.839 -6.127 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.266 27.607 -5.429 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.940 25.969 -5.251 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.422 26.985 -6.631 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.331 28.136 -7.150 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.244 27.529 -8.421 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -1.907 26.907 -8.301 1.00 0.00 H new ATOM 539 N ARG A 33 -0.641 23.140 -5.942 1.00 0.00 N ATOM 540 CA ARG A 33 -0.486 22.022 -4.997 1.00 0.00 C ATOM 541 C ARG A 33 -1.704 21.089 -5.081 1.00 0.00 C ATOM 542 O ARG A 33 -2.786 21.510 -5.497 1.00 0.00 O ATOM 543 CB ARG A 33 -0.280 22.605 -3.582 1.00 0.00 C ATOM 544 CG ARG A 33 0.110 21.552 -2.533 1.00 0.00 C ATOM 545 CD ARG A 33 0.528 22.205 -1.211 1.00 0.00 C ATOM 546 NE ARG A 33 0.975 21.186 -0.243 1.00 0.00 N ATOM 547 CZ ARG A 33 1.717 21.376 0.832 1.00 0.00 C ATOM 548 NH1 ARG A 33 2.072 22.565 1.235 1.00 0.00 N ATOM 549 NH2 ARG A 33 2.129 20.359 1.534 1.00 0.00 N ATOM 0 H ARG A 33 -1.619 23.411 -6.043 1.00 0.00 H new ATOM 0 HA ARG A 33 0.386 21.418 -5.248 1.00 0.00 H new ATOM 0 HB2 ARG A 33 0.496 23.370 -3.623 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -1.198 23.099 -3.265 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.731 20.881 -2.359 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.930 20.943 -2.914 1.00 0.00 H new ATOM 0 HD2 ARG A 33 1.331 22.920 -1.391 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.310 22.765 -0.796 1.00 0.00 H new ATOM 0 HE ARG A 33 0.678 20.227 -0.425 1.00 0.00 H new ATOM 0 HH11 ARG A 33 1.775 23.390 0.714 1.00 0.00 H new ATOM 0 HH12 ARG A 33 2.646 22.670 2.071 1.00 0.00 H new ATOM 0 HH21 ARG A 33 1.878 19.411 1.254 1.00 0.00 H new ATOM 0 HH22 ARG A 33 2.702 20.511 2.364 1.00 0.00 H new ATOM 563 N ALA A 34 -1.525 19.831 -4.678 1.00 0.00 N ATOM 564 CA ALA A 34 -2.560 18.794 -4.638 1.00 0.00 C ATOM 565 C ALA A 34 -2.525 18.049 -3.291 1.00 0.00 C ATOM 566 O ALA A 34 -3.488 18.106 -2.521 1.00 0.00 O ATOM 567 CB ALA A 34 -2.400 17.864 -5.851 1.00 0.00 C ATOM 0 H ALA A 34 -0.618 19.491 -4.357 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.549 19.247 -4.707 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.169 17.092 -5.822 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.501 18.443 -6.769 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.416 17.396 -5.823 1.00 0.00 H new ATOM 573 N CYS A 35 -1.414 17.362 -3.016 1.00 0.00 N ATOM 574 CA CYS A 35 -1.187 16.583 -1.800 1.00 0.00 C ATOM 575 C CYS A 35 -0.721 17.419 -0.582 1.00 0.00 C ATOM 576 O CYS A 35 -0.389 18.607 -0.682 1.00 0.00 O ATOM 577 CB CYS A 35 -0.223 15.441 -2.152 1.00 0.00 C ATOM 578 SG CYS A 35 -0.375 14.099 -0.939 1.00 0.00 S ATOM 0 H CYS A 35 -0.621 17.333 -3.657 1.00 0.00 H new ATOM 0 HA CYS A 35 -2.140 16.178 -1.461 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -0.442 15.065 -3.151 1.00 0.00 H new ATOM 0 HB3 CYS A 35 0.802 15.812 -2.169 1.00 0.00 H new ATOM 583 N SER A 36 -0.692 16.759 0.575 1.00 0.00 N ATOM 584 CA SER A 36 -0.322 17.272 1.905 1.00 0.00 C ATOM 585 C SER A 36 0.645 16.356 2.674 1.00 0.00 C ATOM 586 O SER A 36 1.451 16.855 3.463 1.00 0.00 O ATOM 587 CB SER A 36 -1.573 17.505 2.765 1.00 0.00 C ATOM 588 OG SER A 36 -2.440 18.467 2.181 1.00 0.00 O ATOM 0 H SER A 36 -0.946 15.772 0.616 1.00 0.00 H new ATOM 0 HA SER A 36 0.197 18.212 1.719 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.107 16.564 2.893 1.00 0.00 H new ATOM 0 HB3 SER A 36 -1.275 17.840 3.759 1.00 0.00 H new ATOM 0 HG SER A 36 -3.226 18.589 2.753 1.00 0.00 H new ATOM 594 N LEU A 37 0.593 15.033 2.466 1.00 0.00 N ATOM 595 CA LEU A 37 1.473 14.054 3.120 1.00 0.00 C ATOM 596 C LEU A 37 2.944 14.247 2.667 1.00 0.00 C ATOM 597 O LEU A 37 3.206 14.324 1.463 1.00 0.00 O ATOM 598 CB LEU A 37 0.981 12.625 2.802 1.00 0.00 C ATOM 599 CG LEU A 37 -0.268 12.175 3.583 1.00 0.00 C ATOM 600 CD1 LEU A 37 -0.839 10.893 2.976 1.00 0.00 C ATOM 601 CD2 LEU A 37 0.047 11.881 5.052 1.00 0.00 C ATOM 0 H LEU A 37 -0.075 14.605 1.826 1.00 0.00 H new ATOM 0 HA LEU A 37 1.438 14.208 4.198 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.766 12.560 1.735 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.791 11.925 3.007 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.983 12.996 3.521 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.721 10.586 3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.115 11.074 1.937 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.088 10.104 3.020 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -0.863 11.567 5.564 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.790 11.086 5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.439 12.780 5.527 1.00 0.00 H new ATOM 613 N PRO A 38 3.926 14.326 3.591 1.00 0.00 N ATOM 614 CA PRO A 38 5.335 14.542 3.245 1.00 0.00 C ATOM 615 C PRO A 38 5.956 13.339 2.512 1.00 0.00 C ATOM 616 O PRO A 38 6.539 13.487 1.436 1.00 0.00 O ATOM 617 CB PRO A 38 6.038 14.860 4.570 1.00 0.00 C ATOM 618 CG PRO A 38 5.169 14.182 5.630 1.00 0.00 C ATOM 619 CD PRO A 38 3.761 14.255 5.038 1.00 0.00 C ATOM 0 HA PRO A 38 5.447 15.362 2.536 1.00 0.00 H new ATOM 0 HB2 PRO A 38 7.057 14.472 4.583 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.104 15.935 4.738 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.478 13.151 5.803 1.00 0.00 H new ATOM 0 HG3 PRO A 38 5.229 14.698 6.588 1.00 0.00 H new ATOM 0 HD2 PRO A 38 3.175 13.380 5.320 1.00 0.00 H new ATOM 0 HD3 PRO A 38 3.228 15.129 5.411 1.00 0.00 H new ATOM 627 N HIS A 39 5.830 12.139 3.091 1.00 0.00 N ATOM 628 CA HIS A 39 6.363 10.872 2.564 1.00 0.00 C ATOM 629 C HIS A 39 5.594 10.265 1.382 1.00 0.00 C ATOM 630 O HIS A 39 5.990 9.209 0.887 1.00 0.00 O ATOM 631 CB HIS A 39 6.594 9.886 3.717 1.00 0.00 C ATOM 632 CG HIS A 39 7.806 10.281 4.526 1.00 0.00 C ATOM 633 ND1 HIS A 39 9.086 10.429 4.018 1.00 0.00 N ATOM 634 CD2 HIS A 39 7.830 10.603 5.854 1.00 0.00 C ATOM 635 CE1 HIS A 39 9.879 10.838 5.028 1.00 0.00 C ATOM 636 NE2 HIS A 39 9.138 10.952 6.153 1.00 0.00 N ATOM 0 H HIS A 39 5.335 12.017 3.974 1.00 0.00 H new ATOM 0 HA HIS A 39 7.323 11.111 2.107 1.00 0.00 H new ATOM 0 HB2 HIS A 39 5.715 9.860 4.360 1.00 0.00 H new ATOM 0 HB3 HIS A 39 6.729 8.880 3.320 1.00 0.00 H new ATOM 0 HD2 HIS A 39 6.994 10.588 6.537 1.00 0.00 H new ATOM 0 HE1 HIS A 39 10.937 11.042 4.951 1.00 0.00 H new ATOM 0 HE2 HIS A 39 9.483 11.245 7.067 1.00 0.00 H new ATOM 645 N CYS A 40 4.543 10.928 0.896 1.00 0.00 N ATOM 646 CA CYS A 40 3.800 10.531 -0.299 1.00 0.00 C ATOM 647 C CYS A 40 4.777 10.351 -1.484 1.00 0.00 C ATOM 648 O CYS A 40 4.824 9.293 -2.114 1.00 0.00 O ATOM 649 CB CYS A 40 2.720 11.592 -0.542 1.00 0.00 C ATOM 650 SG CYS A 40 1.499 11.009 -1.744 1.00 0.00 S ATOM 0 H CYS A 40 4.178 11.774 1.333 1.00 0.00 H new ATOM 0 HA CYS A 40 3.305 9.568 -0.177 1.00 0.00 H new ATOM 0 HB2 CYS A 40 2.224 11.833 0.398 1.00 0.00 H new ATOM 0 HB3 CYS A 40 3.182 12.511 -0.904 1.00 0.00 H new ATOM 655 N ARG A 41 5.636 11.359 -1.725 1.00 0.00 N ATOM 656 CA ARG A 41 6.720 11.344 -2.727 1.00 0.00 C ATOM 657 C ARG A 41 7.646 10.136 -2.523 1.00 0.00 C ATOM 658 O ARG A 41 7.940 9.423 -3.481 1.00 0.00 O ATOM 659 CB ARG A 41 7.465 12.696 -2.708 1.00 0.00 C ATOM 660 CG ARG A 41 8.070 13.101 -4.066 1.00 0.00 C ATOM 661 CD ARG A 41 9.368 12.389 -4.470 1.00 0.00 C ATOM 662 NE ARG A 41 10.516 12.805 -3.637 1.00 0.00 N ATOM 663 CZ ARG A 41 11.796 12.613 -3.902 1.00 0.00 C ATOM 664 NH1 ARG A 41 12.193 11.926 -4.937 1.00 0.00 N ATOM 665 NH2 ARG A 41 12.714 13.093 -3.116 1.00 0.00 N ATOM 0 H ARG A 41 5.593 12.238 -1.209 1.00 0.00 H new ATOM 0 HA ARG A 41 6.295 11.224 -3.724 1.00 0.00 H new ATOM 0 HB2 ARG A 41 6.774 13.474 -2.384 1.00 0.00 H new ATOM 0 HB3 ARG A 41 8.263 12.648 -1.967 1.00 0.00 H new ATOM 0 HG2 ARG A 41 7.325 12.920 -4.841 1.00 0.00 H new ATOM 0 HG3 ARG A 41 8.259 14.174 -4.050 1.00 0.00 H new ATOM 0 HD2 ARG A 41 9.231 11.311 -4.384 1.00 0.00 H new ATOM 0 HD3 ARG A 41 9.586 12.600 -5.517 1.00 0.00 H new ATOM 0 HE ARG A 41 10.297 13.291 -2.767 1.00 0.00 H new ATOM 0 HH11 ARG A 41 11.507 11.517 -5.572 1.00 0.00 H new ATOM 0 HH12 ARG A 41 13.190 11.797 -5.112 1.00 0.00 H new ATOM 0 HH21 ARG A 41 12.449 13.623 -2.286 1.00 0.00 H new ATOM 0 HH22 ARG A 41 13.700 12.939 -3.329 1.00 0.00 H new ATOM 679 N THR A 42 8.065 9.866 -1.281 1.00 0.00 N ATOM 680 CA THR A 42 8.881 8.691 -0.917 1.00 0.00 C ATOM 681 C THR A 42 8.198 7.400 -1.381 1.00 0.00 C ATOM 682 O THR A 42 8.802 6.605 -2.100 1.00 0.00 O ATOM 683 CB THR A 42 9.180 8.610 0.594 1.00 0.00 C ATOM 684 OG1 THR A 42 9.505 9.876 1.139 1.00 0.00 O ATOM 685 CG2 THR A 42 10.361 7.677 0.867 1.00 0.00 C ATOM 0 H THR A 42 7.846 10.464 -0.485 1.00 0.00 H new ATOM 0 HA THR A 42 9.837 8.809 -1.428 1.00 0.00 H new ATOM 0 HB THR A 42 8.271 8.231 1.062 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.301 9.882 2.098 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.552 7.637 1.939 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.127 6.677 0.502 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.247 8.052 0.354 1.00 0.00 H new ATOM 693 N MET A 43 6.925 7.196 -1.024 1.00 0.00 N ATOM 694 CA MET A 43 6.145 6.036 -1.470 1.00 0.00 C ATOM 695 C MET A 43 5.981 5.991 -3.001 1.00 0.00 C ATOM 696 O MET A 43 6.035 4.906 -3.569 1.00 0.00 O ATOM 697 CB MET A 43 4.786 5.952 -0.774 1.00 0.00 C ATOM 698 CG MET A 43 4.852 5.582 0.709 1.00 0.00 C ATOM 699 SD MET A 43 5.731 4.053 1.148 1.00 0.00 S ATOM 700 CE MET A 43 7.302 4.744 1.735 1.00 0.00 C ATOM 0 H MET A 43 6.406 7.831 -0.417 1.00 0.00 H new ATOM 0 HA MET A 43 6.721 5.158 -1.178 1.00 0.00 H new ATOM 0 HB2 MET A 43 4.282 6.913 -0.873 1.00 0.00 H new ATOM 0 HB3 MET A 43 4.172 5.215 -1.292 1.00 0.00 H new ATOM 0 HG2 MET A 43 5.324 6.407 1.242 1.00 0.00 H new ATOM 0 HG3 MET A 43 3.831 5.503 1.083 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.962 3.934 2.045 1.00 0.00 H new ATOM 0 HE2 MET A 43 7.774 5.309 0.931 1.00 0.00 H new ATOM 0 HE3 MET A 43 7.115 5.404 2.582 1.00 0.00 H new ATOM 710 N LYS A 44 5.816 7.125 -3.699 1.00 0.00 N ATOM 711 CA LYS A 44 5.758 7.173 -5.178 1.00 0.00 C ATOM 712 C LYS A 44 7.059 6.646 -5.809 1.00 0.00 C ATOM 713 O LYS A 44 6.994 5.892 -6.782 1.00 0.00 O ATOM 714 CB LYS A 44 5.402 8.577 -5.700 1.00 0.00 C ATOM 715 CG LYS A 44 3.927 8.947 -5.462 1.00 0.00 C ATOM 716 CD LYS A 44 3.592 10.277 -6.157 1.00 0.00 C ATOM 717 CE LYS A 44 2.150 10.735 -5.894 1.00 0.00 C ATOM 718 NZ LYS A 44 1.998 11.434 -4.601 1.00 0.00 N ATOM 0 H LYS A 44 5.718 8.039 -3.258 1.00 0.00 H new ATOM 0 HA LYS A 44 4.950 6.509 -5.487 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.040 9.314 -5.211 1.00 0.00 H new ATOM 0 HB3 LYS A 44 5.617 8.628 -6.767 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.281 8.157 -5.843 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.733 9.029 -4.392 1.00 0.00 H new ATOM 0 HD2 LYS A 44 4.282 11.047 -5.812 1.00 0.00 H new ATOM 0 HD3 LYS A 44 3.745 10.170 -7.231 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.831 11.397 -6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 44 1.489 9.868 -5.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 1.104 11.965 -4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 1.991 10.738 -3.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.792 12.092 -4.467 1.00 0.00 H new ATOM 732 N ASN A 45 8.230 6.983 -5.251 1.00 0.00 N ATOM 733 CA ASN A 45 9.526 6.444 -5.702 1.00 0.00 C ATOM 734 C ASN A 45 9.520 4.904 -5.589 1.00 0.00 C ATOM 735 O ASN A 45 9.866 4.191 -6.532 1.00 0.00 O ATOM 736 CB ASN A 45 10.700 7.011 -4.878 1.00 0.00 C ATOM 737 CG ASN A 45 10.864 8.521 -4.886 1.00 0.00 C ATOM 738 OD1 ASN A 45 10.519 9.230 -5.823 1.00 0.00 O ATOM 739 ND2 ASN A 45 11.455 9.055 -3.841 1.00 0.00 N ATOM 0 H ASN A 45 8.308 7.638 -4.473 1.00 0.00 H new ATOM 0 HA ASN A 45 9.664 6.744 -6.741 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.580 6.686 -3.845 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.623 6.565 -5.248 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.626 10.060 -3.810 1.00 0.00 H new ATOM 0 HD22 ASN A 45 11.742 8.465 -3.061 1.00 0.00 H new ATOM 746 N VAL A 46 9.105 4.402 -4.421 1.00 0.00 N ATOM 747 CA VAL A 46 8.960 2.974 -4.090 1.00 0.00 C ATOM 748 C VAL A 46 7.999 2.288 -5.080 1.00 0.00 C ATOM 749 O VAL A 46 8.359 1.264 -5.659 1.00 0.00 O ATOM 750 CB VAL A 46 8.553 2.823 -2.608 1.00 0.00 C ATOM 751 CG1 VAL A 46 8.221 1.388 -2.200 1.00 0.00 C ATOM 752 CG2 VAL A 46 9.682 3.317 -1.690 1.00 0.00 C ATOM 0 H VAL A 46 8.848 5.007 -3.641 1.00 0.00 H new ATOM 0 HA VAL A 46 9.914 2.458 -4.202 1.00 0.00 H new ATOM 0 HB VAL A 46 7.650 3.424 -2.498 1.00 0.00 H new ATOM 0 HG11 VAL A 46 7.945 1.364 -1.146 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.389 1.022 -2.802 1.00 0.00 H new ATOM 0 HG13 VAL A 46 9.092 0.753 -2.361 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.380 3.204 -0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 46 10.582 2.730 -1.872 1.00 0.00 H new ATOM 0 HG23 VAL A 46 9.886 4.368 -1.897 1.00 0.00 H new ATOM 762 N LEU A 47 6.817 2.867 -5.329 1.00 0.00 N ATOM 763 CA LEU A 47 5.791 2.415 -6.285 1.00 0.00 C ATOM 764 C LEU A 47 6.375 2.170 -7.684 1.00 0.00 C ATOM 765 O LEU A 47 6.204 1.098 -8.266 1.00 0.00 O ATOM 766 CB LEU A 47 4.616 3.418 -6.270 1.00 0.00 C ATOM 767 CG LEU A 47 3.327 3.020 -7.013 1.00 0.00 C ATOM 768 CD1 LEU A 47 3.369 3.205 -8.528 1.00 0.00 C ATOM 769 CD2 LEU A 47 2.921 1.581 -6.729 1.00 0.00 C ATOM 0 H LEU A 47 6.532 3.715 -4.840 1.00 0.00 H new ATOM 0 HA LEU A 47 5.405 1.443 -5.977 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.357 3.615 -5.230 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.971 4.357 -6.694 1.00 0.00 H new ATOM 0 HG LEU A 47 2.590 3.718 -6.615 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.416 2.897 -8.959 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.551 4.254 -8.762 1.00 0.00 H new ATOM 0 HD13 LEU A 47 4.170 2.596 -8.947 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.007 1.346 -7.275 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.717 0.909 -7.049 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.748 1.456 -5.660 1.00 0.00 H new ATOM 781 N ASN A 48 7.094 3.162 -8.208 1.00 0.00 N ATOM 782 CA ASN A 48 7.791 3.095 -9.495 1.00 0.00 C ATOM 783 C ASN A 48 8.790 1.928 -9.543 1.00 0.00 C ATOM 784 O ASN A 48 8.864 1.210 -10.538 1.00 0.00 O ATOM 785 CB ASN A 48 8.514 4.425 -9.747 1.00 0.00 C ATOM 786 CG ASN A 48 9.213 4.427 -11.099 1.00 0.00 C ATOM 787 OD1 ASN A 48 8.594 4.329 -12.150 1.00 0.00 O ATOM 788 ND2 ASN A 48 10.524 4.518 -11.120 1.00 0.00 N ATOM 0 H ASN A 48 7.212 4.059 -7.737 1.00 0.00 H new ATOM 0 HA ASN A 48 7.052 2.920 -10.277 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.797 5.245 -9.705 1.00 0.00 H new ATOM 0 HB3 ASN A 48 9.245 4.600 -8.957 1.00 0.00 H new ATOM 0 HD21 ASN A 48 11.022 4.507 -12.010 1.00 0.00 H new ATOM 0 HD22 ASN A 48 11.044 4.600 -10.246 1.00 0.00 H new ATOM 795 N HIS A 49 9.582 1.742 -8.485 1.00 0.00 N ATOM 796 CA HIS A 49 10.542 0.647 -8.395 1.00 0.00 C ATOM 797 C HIS A 49 9.831 -0.726 -8.370 1.00 0.00 C ATOM 798 O HIS A 49 10.158 -1.583 -9.190 1.00 0.00 O ATOM 799 CB HIS A 49 11.473 0.880 -7.199 1.00 0.00 C ATOM 800 CG HIS A 49 12.468 -0.242 -7.016 1.00 0.00 C ATOM 801 ND1 HIS A 49 13.715 -0.333 -7.600 1.00 0.00 N ATOM 802 CD2 HIS A 49 12.231 -1.426 -6.369 1.00 0.00 C ATOM 803 CE1 HIS A 49 14.206 -1.557 -7.326 1.00 0.00 C ATOM 804 NE2 HIS A 49 13.340 -2.258 -6.573 1.00 0.00 N ATOM 0 H HIS A 49 9.573 2.350 -7.666 1.00 0.00 H new ATOM 0 HA HIS A 49 11.164 0.629 -9.290 1.00 0.00 H new ATOM 0 HB2 HIS A 49 12.010 1.819 -7.337 1.00 0.00 H new ATOM 0 HB3 HIS A 49 10.876 0.984 -6.293 1.00 0.00 H new ATOM 0 HD1 HIS A 49 14.181 0.395 -8.141 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.346 -1.674 -5.802 1.00 0.00 H new ATOM 0 HE1 HIS A 49 15.163 -1.925 -7.664 1.00 0.00 H new ATOM 812 N MET A 50 8.852 -0.933 -7.474 1.00 0.00 N ATOM 813 CA MET A 50 8.065 -2.172 -7.299 1.00 0.00 C ATOM 814 C MET A 50 7.625 -2.846 -8.610 1.00 0.00 C ATOM 815 O MET A 50 7.812 -4.053 -8.777 1.00 0.00 O ATOM 816 CB MET A 50 6.795 -1.899 -6.483 1.00 0.00 C ATOM 817 CG MET A 50 6.967 -1.659 -4.986 1.00 0.00 C ATOM 818 SD MET A 50 5.765 -0.486 -4.298 1.00 0.00 S ATOM 819 CE MET A 50 4.199 -1.210 -4.819 1.00 0.00 C ATOM 0 H MET A 50 8.571 -0.205 -6.817 1.00 0.00 H new ATOM 0 HA MET A 50 8.747 -2.850 -6.785 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.300 -1.027 -6.910 1.00 0.00 H new ATOM 0 HB3 MET A 50 6.121 -2.745 -6.614 1.00 0.00 H new ATOM 0 HG2 MET A 50 6.876 -2.610 -4.461 1.00 0.00 H new ATOM 0 HG3 MET A 50 7.974 -1.286 -4.799 1.00 0.00 H new ATOM 0 HE1 MET A 50 3.388 -0.514 -4.605 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.230 -1.413 -5.889 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.031 -2.141 -4.278 1.00 0.00 H new ATOM 829 N THR A 51 7.007 -2.094 -9.529 1.00 0.00 N ATOM 830 CA THR A 51 6.516 -2.607 -10.823 1.00 0.00 C ATOM 831 C THR A 51 7.638 -3.161 -11.704 1.00 0.00 C ATOM 832 O THR A 51 7.499 -4.241 -12.282 1.00 0.00 O ATOM 833 CB THR A 51 5.747 -1.538 -11.615 1.00 0.00 C ATOM 834 OG1 THR A 51 6.456 -0.318 -11.636 1.00 0.00 O ATOM 835 CG2 THR A 51 4.371 -1.278 -11.008 1.00 0.00 C ATOM 0 H THR A 51 6.829 -1.098 -9.397 1.00 0.00 H new ATOM 0 HA THR A 51 5.839 -3.422 -10.566 1.00 0.00 H new ATOM 0 HB THR A 51 5.633 -1.921 -12.629 1.00 0.00 H new ATOM 0 HG1 THR A 51 5.948 0.347 -12.147 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.854 -0.517 -11.592 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.789 -2.200 -11.017 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.486 -0.931 -9.981 1.00 0.00 H new ATOM 843 N HIS A 52 8.744 -2.421 -11.818 1.00 0.00 N ATOM 844 CA HIS A 52 9.930 -2.774 -12.609 1.00 0.00 C ATOM 845 C HIS A 52 10.776 -3.896 -11.980 1.00 0.00 C ATOM 846 O HIS A 52 11.391 -4.674 -12.716 1.00 0.00 O ATOM 847 CB HIS A 52 10.760 -1.508 -12.861 1.00 0.00 C ATOM 848 CG HIS A 52 10.017 -0.485 -13.688 1.00 0.00 C ATOM 849 ND1 HIS A 52 9.350 0.625 -13.208 1.00 0.00 N ATOM 850 CD2 HIS A 52 9.836 -0.531 -15.042 1.00 0.00 C ATOM 851 CE1 HIS A 52 8.791 1.260 -14.255 1.00 0.00 C ATOM 852 NE2 HIS A 52 9.075 0.576 -15.384 1.00 0.00 N ATOM 0 H HIS A 52 8.844 -1.524 -11.344 1.00 0.00 H new ATOM 0 HA HIS A 52 9.587 -3.183 -13.559 1.00 0.00 H new ATOM 0 HB2 HIS A 52 11.040 -1.064 -11.905 1.00 0.00 H new ATOM 0 HB3 HIS A 52 11.685 -1.779 -13.369 1.00 0.00 H new ATOM 0 HD1 HIS A 52 9.291 0.913 -12.231 1.00 0.00 H new ATOM 0 HD2 HIS A 52 10.214 -1.285 -15.716 1.00 0.00 H new ATOM 0 HE1 HIS A 52 8.210 2.169 -14.201 1.00 0.00 H new ATOM 861 N CYS A 53 10.830 -3.975 -10.648 1.00 0.00 N ATOM 862 CA CYS A 53 11.581 -4.968 -9.879 1.00 0.00 C ATOM 863 C CYS A 53 11.145 -6.418 -10.198 1.00 0.00 C ATOM 864 O CYS A 53 9.960 -6.716 -10.401 1.00 0.00 O ATOM 865 CB CYS A 53 11.433 -4.635 -8.387 1.00 0.00 C ATOM 866 SG CYS A 53 12.585 -5.618 -7.371 1.00 0.00 S ATOM 0 H CYS A 53 10.328 -3.318 -10.050 1.00 0.00 H new ATOM 0 HA CYS A 53 12.633 -4.919 -10.162 1.00 0.00 H new ATOM 0 HB2 CYS A 53 11.621 -3.573 -8.229 1.00 0.00 H new ATOM 0 HB3 CYS A 53 10.409 -4.828 -8.069 1.00 0.00 H new ATOM 871 N GLN A 54 12.130 -7.318 -10.249 1.00 0.00 N ATOM 872 CA GLN A 54 11.999 -8.756 -10.532 1.00 0.00 C ATOM 873 C GLN A 54 12.761 -9.637 -9.521 1.00 0.00 C ATOM 874 O GLN A 54 12.598 -10.860 -9.519 1.00 0.00 O ATOM 875 CB GLN A 54 12.497 -9.044 -11.961 1.00 0.00 C ATOM 876 CG GLN A 54 11.621 -8.391 -13.042 1.00 0.00 C ATOM 877 CD GLN A 54 12.197 -8.594 -14.441 1.00 0.00 C ATOM 878 OE1 GLN A 54 12.147 -9.674 -15.020 1.00 0.00 O ATOM 879 NE2 GLN A 54 12.759 -7.567 -15.047 1.00 0.00 N ATOM 0 H GLN A 54 13.100 -7.050 -10.084 1.00 0.00 H new ATOM 0 HA GLN A 54 10.943 -9.011 -10.439 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.521 -8.684 -12.063 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.521 -10.122 -12.122 1.00 0.00 H new ATOM 0 HG2 GLN A 54 10.617 -8.812 -12.998 1.00 0.00 H new ATOM 0 HG3 GLN A 54 11.529 -7.324 -12.839 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.808 -6.662 -14.578 1.00 0.00 H new ATOM 0 HE22 GLN A 54 13.145 -7.677 -15.985 1.00 0.00 H new ATOM 888 N ALA A 55 13.586 -9.037 -8.656 1.00 0.00 N ATOM 889 CA ALA A 55 14.375 -9.725 -7.635 1.00 0.00 C ATOM 890 C ALA A 55 13.494 -10.354 -6.533 1.00 0.00 C ATOM 891 O ALA A 55 13.808 -11.436 -6.027 1.00 0.00 O ATOM 892 CB ALA A 55 15.392 -8.729 -7.066 1.00 0.00 C ATOM 0 H ALA A 55 13.726 -8.027 -8.649 1.00 0.00 H new ATOM 0 HA ALA A 55 14.901 -10.565 -8.090 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.993 -9.220 -6.301 1.00 0.00 H new ATOM 0 HB2 ALA A 55 16.042 -8.375 -7.866 1.00 0.00 H new ATOM 0 HB3 ALA A 55 14.865 -7.883 -6.625 1.00 0.00 H new ATOM 898 N GLY A 56 12.396 -9.690 -6.155 1.00 0.00 N ATOM 899 CA GLY A 56 11.437 -10.154 -5.147 1.00 0.00 C ATOM 900 C GLY A 56 12.070 -10.310 -3.764 1.00 0.00 C ATOM 901 O GLY A 56 12.419 -9.323 -3.111 1.00 0.00 O ATOM 0 H GLY A 56 12.143 -8.787 -6.555 1.00 0.00 H new ATOM 0 HA2 GLY A 56 10.609 -9.448 -5.086 1.00 0.00 H new ATOM 0 HA3 GLY A 56 11.019 -11.110 -5.461 1.00 0.00 H new ATOM 905 N LYS A 57 12.240 -11.558 -3.317 1.00 0.00 N ATOM 906 CA LYS A 57 12.876 -11.924 -2.037 1.00 0.00 C ATOM 907 C LYS A 57 14.317 -11.404 -1.944 1.00 0.00 C ATOM 908 O LYS A 57 14.760 -10.979 -0.877 1.00 0.00 O ATOM 909 CB LYS A 57 12.862 -13.455 -1.867 1.00 0.00 C ATOM 910 CG LYS A 57 11.467 -14.102 -1.859 1.00 0.00 C ATOM 911 CD LYS A 57 10.634 -13.744 -0.621 1.00 0.00 C ATOM 912 CE LYS A 57 9.337 -14.559 -0.643 1.00 0.00 C ATOM 913 NZ LYS A 57 8.728 -14.691 0.702 1.00 0.00 N ATOM 0 H LYS A 57 11.931 -12.371 -3.849 1.00 0.00 H new ATOM 0 HA LYS A 57 12.303 -11.456 -1.236 1.00 0.00 H new ATOM 0 HB2 LYS A 57 13.446 -13.899 -2.673 1.00 0.00 H new ATOM 0 HB3 LYS A 57 13.366 -13.705 -0.933 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.926 -13.792 -2.753 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.577 -15.185 -1.912 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.198 -13.957 0.287 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.409 -12.678 -0.614 1.00 0.00 H new ATOM 0 HE2 LYS A 57 8.624 -14.083 -1.316 1.00 0.00 H new ATOM 0 HE3 LYS A 57 9.542 -15.551 -1.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.731 -14.971 0.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.240 -15.415 1.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 8.785 -13.780 1.200 1.00 0.00 H new ATOM 927 N ALA A 58 15.047 -11.457 -3.061 1.00 0.00 N ATOM 928 CA ALA A 58 16.440 -11.033 -3.192 1.00 0.00 C ATOM 929 C ALA A 58 16.659 -9.503 -3.167 1.00 0.00 C ATOM 930 O ALA A 58 17.794 -9.068 -2.947 1.00 0.00 O ATOM 931 CB ALA A 58 17.008 -11.656 -4.474 1.00 0.00 C ATOM 0 H ALA A 58 14.664 -11.813 -3.937 1.00 0.00 H new ATOM 0 HA ALA A 58 16.973 -11.388 -2.310 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.048 -11.354 -4.595 1.00 0.00 H new ATOM 0 HB2 ALA A 58 16.951 -12.742 -4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 58 16.429 -11.314 -5.332 1.00 0.00 H new ATOM 937 N CYS A 59 15.620 -8.681 -3.385 1.00 0.00 N ATOM 938 CA CYS A 59 15.737 -7.220 -3.381 1.00 0.00 C ATOM 939 C CYS A 59 16.155 -6.712 -1.983 1.00 0.00 C ATOM 940 O CYS A 59 15.467 -6.933 -0.980 1.00 0.00 O ATOM 941 CB CYS A 59 14.419 -6.595 -3.864 1.00 0.00 C ATOM 942 SG CYS A 59 14.680 -4.889 -4.458 1.00 0.00 S ATOM 0 H CYS A 59 14.674 -9.015 -3.569 1.00 0.00 H new ATOM 0 HA CYS A 59 16.522 -6.913 -4.072 1.00 0.00 H new ATOM 0 HB2 CYS A 59 13.997 -7.202 -4.665 1.00 0.00 H new ATOM 0 HB3 CYS A 59 13.694 -6.593 -3.050 1.00 0.00 H new ATOM 947 N GLN A 60 17.320 -6.063 -1.917 1.00 0.00 N ATOM 948 CA GLN A 60 17.919 -5.544 -0.682 1.00 0.00 C ATOM 949 C GLN A 60 17.180 -4.316 -0.113 1.00 0.00 C ATOM 950 O GLN A 60 17.297 -4.025 1.080 1.00 0.00 O ATOM 951 CB GLN A 60 19.403 -5.213 -0.928 1.00 0.00 C ATOM 952 CG GLN A 60 20.242 -6.413 -1.408 1.00 0.00 C ATOM 953 CD GLN A 60 20.248 -7.572 -0.410 1.00 0.00 C ATOM 954 OE1 GLN A 60 20.896 -7.532 0.630 1.00 0.00 O ATOM 955 NE2 GLN A 60 19.538 -8.649 -0.675 1.00 0.00 N ATOM 0 H GLN A 60 17.889 -5.878 -2.743 1.00 0.00 H new ATOM 0 HA GLN A 60 17.828 -6.327 0.071 1.00 0.00 H new ATOM 0 HB2 GLN A 60 19.469 -4.417 -1.670 1.00 0.00 H new ATOM 0 HB3 GLN A 60 19.836 -4.826 -0.006 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.851 -6.764 -2.363 1.00 0.00 H new ATOM 0 HG3 GLN A 60 21.267 -6.086 -1.584 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.992 -8.701 -1.535 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.534 -9.431 -0.020 1.00 0.00 H new ATOM 964 N VAL A 61 16.427 -3.590 -0.947 1.00 0.00 N ATOM 965 CA VAL A 61 15.664 -2.391 -0.570 1.00 0.00 C ATOM 966 C VAL A 61 14.515 -2.750 0.386 1.00 0.00 C ATOM 967 O VAL A 61 13.589 -3.481 0.028 1.00 0.00 O ATOM 968 CB VAL A 61 15.126 -1.656 -1.819 1.00 0.00 C ATOM 969 CG1 VAL A 61 14.416 -0.347 -1.435 1.00 0.00 C ATOM 970 CG2 VAL A 61 16.260 -1.284 -2.787 1.00 0.00 C ATOM 0 H VAL A 61 16.328 -3.827 -1.934 1.00 0.00 H new ATOM 0 HA VAL A 61 16.343 -1.716 -0.049 1.00 0.00 H new ATOM 0 HB VAL A 61 14.429 -2.345 -2.296 1.00 0.00 H new ATOM 0 HG11 VAL A 61 14.049 0.146 -2.335 1.00 0.00 H new ATOM 0 HG12 VAL A 61 13.577 -0.568 -0.775 1.00 0.00 H new ATOM 0 HG13 VAL A 61 15.118 0.311 -0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 61 15.845 -0.769 -3.653 1.00 0.00 H new ATOM 0 HG22 VAL A 61 16.970 -0.629 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 61 16.771 -2.190 -3.114 1.00 0.00 H new ATOM 980 N ALA A 62 14.569 -2.202 1.606 1.00 0.00 N ATOM 981 CA ALA A 62 13.579 -2.370 2.676 1.00 0.00 C ATOM 982 C ALA A 62 12.142 -2.142 2.178 1.00 0.00 C ATOM 983 O ALA A 62 11.265 -3.004 2.300 1.00 0.00 O ATOM 984 CB ALA A 62 13.942 -1.385 3.800 1.00 0.00 C ATOM 0 H ALA A 62 15.343 -1.600 1.887 1.00 0.00 H new ATOM 0 HA ALA A 62 13.606 -3.396 3.042 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.225 -1.482 4.615 1.00 0.00 H new ATOM 0 HB2 ALA A 62 14.943 -1.607 4.169 1.00 0.00 H new ATOM 0 HB3 ALA A 62 13.916 -0.366 3.414 1.00 0.00 H new ATOM 990 N HIS A 63 11.920 -0.957 1.602 1.00 0.00 N ATOM 991 CA HIS A 63 10.645 -0.493 1.054 1.00 0.00 C ATOM 992 C HIS A 63 10.047 -1.455 0.020 1.00 0.00 C ATOM 993 O HIS A 63 8.885 -1.823 0.163 1.00 0.00 O ATOM 994 CB HIS A 63 10.807 0.922 0.485 1.00 0.00 C ATOM 995 CG HIS A 63 11.394 1.926 1.451 1.00 0.00 C ATOM 996 ND1 HIS A 63 12.666 2.468 1.386 1.00 0.00 N ATOM 997 CD2 HIS A 63 10.756 2.459 2.536 1.00 0.00 C ATOM 998 CE1 HIS A 63 12.804 3.305 2.435 1.00 0.00 C ATOM 999 NE2 HIS A 63 11.658 3.311 3.150 1.00 0.00 N ATOM 0 H HIS A 63 12.661 -0.263 1.501 1.00 0.00 H new ATOM 0 HA HIS A 63 9.927 -0.466 1.874 1.00 0.00 H new ATOM 0 HB2 HIS A 63 11.443 0.873 -0.399 1.00 0.00 H new ATOM 0 HB3 HIS A 63 9.832 1.281 0.156 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.744 2.255 2.853 1.00 0.00 H new ATOM 0 HE1 HIS A 63 13.689 3.879 2.666 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.486 3.851 3.998 1.00 0.00 H new ATOM 1008 N CYS A 64 10.811 -1.869 -0.998 1.00 0.00 N ATOM 1009 CA CYS A 64 10.388 -2.798 -2.055 1.00 0.00 C ATOM 1010 C CYS A 64 9.860 -4.125 -1.464 1.00 0.00 C ATOM 1011 O CYS A 64 8.705 -4.512 -1.668 1.00 0.00 O ATOM 1012 CB CYS A 64 11.577 -3.005 -3.007 1.00 0.00 C ATOM 1013 SG CYS A 64 11.091 -3.978 -4.463 1.00 0.00 S ATOM 0 H CYS A 64 11.775 -1.556 -1.113 1.00 0.00 H new ATOM 0 HA CYS A 64 9.552 -2.379 -2.615 1.00 0.00 H new ATOM 0 HB2 CYS A 64 11.964 -2.037 -3.326 1.00 0.00 H new ATOM 0 HB3 CYS A 64 12.384 -3.513 -2.480 1.00 0.00 H new ATOM 1018 N ALA A 65 10.697 -4.804 -0.673 1.00 0.00 N ATOM 1019 CA ALA A 65 10.361 -6.051 0.008 1.00 0.00 C ATOM 1020 C ALA A 65 9.075 -5.930 0.855 1.00 0.00 C ATOM 1021 O ALA A 65 8.202 -6.801 0.795 1.00 0.00 O ATOM 1022 CB ALA A 65 11.582 -6.478 0.833 1.00 0.00 C ATOM 0 H ALA A 65 11.650 -4.491 -0.486 1.00 0.00 H new ATOM 0 HA ALA A 65 10.132 -6.825 -0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 65 11.361 -7.409 1.355 1.00 0.00 H new ATOM 0 HB2 ALA A 65 12.435 -6.627 0.171 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.819 -5.702 1.561 1.00 0.00 H new ATOM 1028 N SER A 66 8.951 -4.848 1.629 1.00 0.00 N ATOM 1029 CA SER A 66 7.790 -4.541 2.479 1.00 0.00 C ATOM 1030 C SER A 66 6.519 -4.260 1.668 1.00 0.00 C ATOM 1031 O SER A 66 5.508 -4.931 1.857 1.00 0.00 O ATOM 1032 CB SER A 66 8.083 -3.341 3.386 1.00 0.00 C ATOM 1033 OG SER A 66 9.244 -3.579 4.152 1.00 0.00 O ATOM 0 H SER A 66 9.679 -4.136 1.685 1.00 0.00 H new ATOM 0 HA SER A 66 7.612 -5.431 3.083 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.215 -2.443 2.782 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.235 -3.159 4.046 1.00 0.00 H new ATOM 0 HG SER A 66 10.038 -3.426 3.599 1.00 0.00 H new ATOM 1039 N SER A 67 6.552 -3.273 0.766 1.00 0.00 N ATOM 1040 CA SER A 67 5.444 -2.832 -0.101 1.00 0.00 C ATOM 1041 C SER A 67 4.797 -3.970 -0.892 1.00 0.00 C ATOM 1042 O SER A 67 3.570 -4.086 -0.918 1.00 0.00 O ATOM 1043 CB SER A 67 5.879 -1.694 -1.026 1.00 0.00 C ATOM 1044 OG SER A 67 7.011 -2.057 -1.775 1.00 0.00 O ATOM 0 H SER A 67 7.399 -2.727 0.609 1.00 0.00 H new ATOM 0 HA SER A 67 4.673 -2.455 0.571 1.00 0.00 H new ATOM 0 HB2 SER A 67 5.061 -1.435 -1.699 1.00 0.00 H new ATOM 0 HB3 SER A 67 6.099 -0.805 -0.435 1.00 0.00 H new ATOM 0 HG SER A 67 7.799 -2.069 -1.192 1.00 0.00 H new ATOM 1050 N ARG A 68 5.590 -4.849 -1.512 1.00 0.00 N ATOM 1051 CA ARG A 68 5.058 -6.035 -2.205 1.00 0.00 C ATOM 1052 C ARG A 68 4.253 -6.912 -1.236 1.00 0.00 C ATOM 1053 O ARG A 68 3.151 -7.342 -1.574 1.00 0.00 O ATOM 1054 CB ARG A 68 6.194 -6.780 -2.919 1.00 0.00 C ATOM 1055 CG ARG A 68 6.701 -5.947 -4.110 1.00 0.00 C ATOM 1056 CD ARG A 68 7.820 -6.631 -4.899 1.00 0.00 C ATOM 1057 NE ARG A 68 9.152 -6.367 -4.333 1.00 0.00 N ATOM 1058 CZ ARG A 68 9.914 -7.129 -3.587 1.00 0.00 C ATOM 1059 NH1 ARG A 68 9.507 -8.242 -3.042 1.00 0.00 N ATOM 1060 NH2 ARG A 68 11.140 -6.780 -3.389 1.00 0.00 N ATOM 0 H ARG A 68 6.606 -4.765 -1.550 1.00 0.00 H new ATOM 0 HA ARG A 68 4.356 -5.729 -2.980 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.011 -6.969 -2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 68 5.841 -7.751 -3.267 1.00 0.00 H new ATOM 0 HG2 ARG A 68 5.867 -5.741 -4.781 1.00 0.00 H new ATOM 0 HG3 ARG A 68 7.060 -4.985 -3.744 1.00 0.00 H new ATOM 0 HD2 ARG A 68 7.643 -7.706 -4.916 1.00 0.00 H new ATOM 0 HD3 ARG A 68 7.794 -6.287 -5.933 1.00 0.00 H new ATOM 0 HE ARG A 68 9.542 -5.451 -4.555 1.00 0.00 H new ATOM 0 HH11 ARG A 68 8.549 -8.561 -3.188 1.00 0.00 H new ATOM 0 HH12 ARG A 68 10.147 -8.794 -2.470 1.00 0.00 H new ATOM 0 HH21 ARG A 68 11.501 -5.924 -3.810 1.00 0.00 H new ATOM 0 HH22 ARG A 68 11.748 -7.360 -2.811 1.00 0.00 H new ATOM 1074 N GLN A 69 4.756 -7.134 -0.020 1.00 0.00 N ATOM 1075 CA GLN A 69 4.092 -7.893 1.049 1.00 0.00 C ATOM 1076 C GLN A 69 2.748 -7.278 1.476 1.00 0.00 C ATOM 1077 O GLN A 69 1.734 -7.975 1.446 1.00 0.00 O ATOM 1078 CB GLN A 69 5.035 -8.033 2.257 1.00 0.00 C ATOM 1079 CG GLN A 69 4.792 -9.308 3.073 1.00 0.00 C ATOM 1080 CD GLN A 69 3.468 -9.416 3.836 1.00 0.00 C ATOM 1081 OE1 GLN A 69 2.910 -10.490 3.976 1.00 0.00 O ATOM 1082 NE2 GLN A 69 2.916 -8.356 4.391 1.00 0.00 N ATOM 0 H GLN A 69 5.670 -6.778 0.260 1.00 0.00 H new ATOM 0 HA GLN A 69 3.863 -8.880 0.648 1.00 0.00 H new ATOM 0 HB2 GLN A 69 6.067 -8.026 1.906 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.913 -7.166 2.906 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.861 -10.159 2.396 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.604 -9.407 3.793 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.357 -7.441 4.293 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.048 -8.450 4.918 1.00 0.00 H new ATOM 1091 N ILE A 70 2.718 -6.001 1.893 1.00 0.00 N ATOM 1092 CA ILE A 70 1.472 -5.333 2.332 1.00 0.00 C ATOM 1093 C ILE A 70 0.348 -5.454 1.291 1.00 0.00 C ATOM 1094 O ILE A 70 -0.784 -5.794 1.647 1.00 0.00 O ATOM 1095 CB ILE A 70 1.645 -3.867 2.812 1.00 0.00 C ATOM 1096 CG1 ILE A 70 2.715 -3.037 2.090 1.00 0.00 C ATOM 1097 CG2 ILE A 70 1.872 -3.854 4.330 1.00 0.00 C ATOM 1098 CD1 ILE A 70 2.687 -1.523 2.341 1.00 0.00 C ATOM 0 H ILE A 70 3.544 -5.405 1.937 1.00 0.00 H new ATOM 0 HA ILE A 70 1.175 -5.888 3.222 1.00 0.00 H new ATOM 0 HB ILE A 70 0.714 -3.366 2.547 1.00 0.00 H new ATOM 0 HG12 ILE A 70 3.695 -3.414 2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.615 -3.208 1.018 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.994 -2.826 4.671 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.014 -4.303 4.830 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.770 -4.424 4.569 1.00 0.00 H new ATOM 0 HD11 ILE A 70 3.489 -1.046 1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.727 -1.119 2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 70 2.825 -1.328 3.405 1.00 0.00 H new ATOM 1110 N ILE A 71 0.651 -5.218 0.011 1.00 0.00 N ATOM 1111 CA ILE A 71 -0.325 -5.372 -1.080 1.00 0.00 C ATOM 1112 C ILE A 71 -0.703 -6.842 -1.285 1.00 0.00 C ATOM 1113 O ILE A 71 -1.882 -7.125 -1.494 1.00 0.00 O ATOM 1114 CB ILE A 71 0.150 -4.658 -2.360 1.00 0.00 C ATOM 1115 CG1 ILE A 71 0.401 -3.158 -2.083 1.00 0.00 C ATOM 1116 CG2 ILE A 71 -0.860 -4.803 -3.512 1.00 0.00 C ATOM 1117 CD1 ILE A 71 -0.703 -2.426 -1.291 1.00 0.00 C ATOM 0 H ILE A 71 1.574 -4.916 -0.301 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.250 -4.872 -0.795 1.00 0.00 H new ATOM 0 HB ILE A 71 1.081 -5.137 -2.663 1.00 0.00 H new ATOM 0 HG12 ILE A 71 1.339 -3.061 -1.536 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.535 -2.649 -3.038 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.483 -4.284 -4.394 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -0.998 -5.859 -3.744 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.815 -4.369 -3.216 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.422 -1.382 -1.155 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.642 -2.480 -1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.826 -2.898 -0.316 1.00 0.00 H new ATOM 1129 N SER A 72 0.245 -7.781 -1.162 1.00 0.00 N ATOM 1130 CA SER A 72 -0.040 -9.225 -1.207 1.00 0.00 C ATOM 1131 C SER A 72 -1.120 -9.583 -0.187 1.00 0.00 C ATOM 1132 O SER A 72 -2.133 -10.168 -0.574 1.00 0.00 O ATOM 1133 CB SER A 72 1.198 -10.101 -0.972 1.00 0.00 C ATOM 1134 OG SER A 72 2.214 -9.816 -1.908 1.00 0.00 O ATOM 0 H SER A 72 1.232 -7.563 -1.028 1.00 0.00 H new ATOM 0 HA SER A 72 -0.389 -9.434 -2.218 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.575 -9.938 0.038 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.920 -11.153 -1.043 1.00 0.00 H new ATOM 0 HG SER A 72 2.702 -9.014 -1.627 1.00 0.00 H new ATOM 1140 N HIS A 73 -0.947 -9.201 1.088 1.00 0.00 N ATOM 1141 CA HIS A 73 -1.959 -9.428 2.124 1.00 0.00 C ATOM 1142 C HIS A 73 -3.292 -8.771 1.742 1.00 0.00 C ATOM 1143 O HIS A 73 -4.282 -9.487 1.622 1.00 0.00 O ATOM 1144 CB HIS A 73 -1.508 -8.987 3.528 1.00 0.00 C ATOM 1145 CG HIS A 73 -2.535 -9.352 4.588 1.00 0.00 C ATOM 1146 ND1 HIS A 73 -2.477 -10.430 5.447 1.00 0.00 N ATOM 1147 CD2 HIS A 73 -3.753 -8.748 4.792 1.00 0.00 C ATOM 1148 CE1 HIS A 73 -3.635 -10.478 6.134 1.00 0.00 C ATOM 1149 NE2 HIS A 73 -4.454 -9.476 5.767 1.00 0.00 N ATOM 0 H HIS A 73 -0.107 -8.730 1.425 1.00 0.00 H new ATOM 0 HA HIS A 73 -2.101 -10.507 2.178 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -0.554 -9.457 3.768 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -1.344 -7.909 3.536 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -1.695 -11.077 5.545 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.111 -7.863 4.287 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -3.874 -11.222 6.880 1.00 0.00 H new ATOM 1157 N TRP A 74 -3.349 -7.442 1.554 1.00 0.00 N ATOM 1158 CA TRP A 74 -4.607 -6.741 1.248 1.00 0.00 C ATOM 1159 C TRP A 74 -5.379 -7.328 0.050 1.00 0.00 C ATOM 1160 O TRP A 74 -6.599 -7.502 0.124 1.00 0.00 O ATOM 1161 CB TRP A 74 -4.394 -5.226 1.110 1.00 0.00 C ATOM 1162 CG TRP A 74 -5.682 -4.453 1.138 1.00 0.00 C ATOM 1163 CD1 TRP A 74 -6.607 -4.547 2.119 1.00 0.00 C ATOM 1164 CD2 TRP A 74 -6.238 -3.514 0.165 1.00 0.00 C ATOM 1165 NE1 TRP A 74 -7.719 -3.796 1.795 1.00 0.00 N ATOM 1166 CE2 TRP A 74 -7.551 -3.150 0.592 1.00 0.00 C ATOM 1167 CE3 TRP A 74 -5.775 -2.931 -1.035 1.00 0.00 C ATOM 1168 CZ2 TRP A 74 -8.382 -2.300 -0.152 1.00 0.00 C ATOM 1169 CZ3 TRP A 74 -6.577 -2.026 -1.756 1.00 0.00 C ATOM 1170 CH2 TRP A 74 -7.884 -1.732 -1.333 1.00 0.00 C ATOM 0 H TRP A 74 -2.535 -6.830 1.609 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.251 -6.910 2.111 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.750 -4.879 1.918 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.872 -5.021 0.175 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.493 -5.125 3.024 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -8.557 -3.729 2.373 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -4.792 -3.183 -1.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -9.388 -2.087 0.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -6.183 -1.553 -2.643 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.505 -1.069 -1.917 1.00 0.00 H new ATOM 1181 N LYS A 75 -4.686 -7.666 -1.049 1.00 0.00 N ATOM 1182 CA LYS A 75 -5.272 -8.304 -2.241 1.00 0.00 C ATOM 1183 C LYS A 75 -5.836 -9.699 -1.915 1.00 0.00 C ATOM 1184 O LYS A 75 -6.944 -10.025 -2.339 1.00 0.00 O ATOM 1185 CB LYS A 75 -4.225 -8.337 -3.369 1.00 0.00 C ATOM 1186 CG LYS A 75 -4.711 -8.888 -4.722 1.00 0.00 C ATOM 1187 CD LYS A 75 -5.796 -8.059 -5.436 1.00 0.00 C ATOM 1188 CE LYS A 75 -7.220 -8.491 -5.057 1.00 0.00 C ATOM 1189 NZ LYS A 75 -8.248 -7.825 -5.898 1.00 0.00 N ATOM 0 H LYS A 75 -3.683 -7.501 -1.137 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.121 -7.714 -2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.854 -7.324 -3.524 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -3.380 -8.939 -3.036 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.852 -8.975 -5.387 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.096 -9.896 -4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.663 -7.006 -5.189 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.668 -8.153 -6.514 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -7.311 -9.572 -5.162 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -7.403 -8.257 -4.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -9.168 -8.288 -5.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.319 -6.822 -5.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -7.978 -7.898 -6.900 1.00 0.00 H new ATOM 1203 N ASN A 76 -5.090 -10.516 -1.164 1.00 0.00 N ATOM 1204 CA ASN A 76 -5.504 -11.855 -0.726 1.00 0.00 C ATOM 1205 C ASN A 76 -6.695 -11.826 0.253 1.00 0.00 C ATOM 1206 O ASN A 76 -7.577 -12.679 0.157 1.00 0.00 O ATOM 1207 CB ASN A 76 -4.324 -12.586 -0.050 1.00 0.00 C ATOM 1208 CG ASN A 76 -3.440 -13.356 -1.012 1.00 0.00 C ATOM 1209 OD1 ASN A 76 -3.447 -14.578 -1.045 1.00 0.00 O ATOM 1210 ND2 ASN A 76 -2.619 -12.685 -1.781 1.00 0.00 N ATOM 0 H ASN A 76 -4.159 -10.259 -0.836 1.00 0.00 H new ATOM 0 HA ASN A 76 -5.822 -12.385 -1.624 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.714 -11.855 0.481 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -4.718 -13.276 0.697 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -1.986 -13.182 -2.407 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.613 -11.665 -1.754 1.00 0.00 H new ATOM 1217 N CYS A 77 -6.677 -10.921 1.234 1.00 0.00 N ATOM 1218 CA CYS A 77 -7.626 -10.796 2.338 1.00 0.00 C ATOM 1219 C CYS A 77 -9.101 -10.654 1.908 1.00 0.00 C ATOM 1220 O CYS A 77 -9.515 -9.696 1.246 1.00 0.00 O ATOM 1221 CB CYS A 77 -7.158 -9.646 3.250 1.00 0.00 C ATOM 1222 SG CYS A 77 -7.991 -9.664 4.874 1.00 0.00 S ATOM 0 H CYS A 77 -5.949 -10.208 1.279 1.00 0.00 H new ATOM 0 HA CYS A 77 -7.623 -11.736 2.890 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -6.080 -9.718 3.397 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -7.350 -8.693 2.757 1.00 0.00 H new ATOM 1227 N THR A 78 -9.900 -11.629 2.341 1.00 0.00 N ATOM 1228 CA THR A 78 -11.363 -11.746 2.176 1.00 0.00 C ATOM 1229 C THR A 78 -12.054 -11.982 3.530 1.00 0.00 C ATOM 1230 O THR A 78 -13.249 -12.282 3.595 1.00 0.00 O ATOM 1231 CB THR A 78 -11.736 -12.856 1.174 1.00 0.00 C ATOM 1232 OG1 THR A 78 -11.149 -14.091 1.545 1.00 0.00 O ATOM 1233 CG2 THR A 78 -11.289 -12.519 -0.249 1.00 0.00 C ATOM 0 H THR A 78 -9.520 -12.422 2.857 1.00 0.00 H new ATOM 0 HA THR A 78 -11.720 -10.800 1.769 1.00 0.00 H new ATOM 0 HB THR A 78 -12.823 -12.935 1.195 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.650 -14.458 0.785 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.573 -13.329 -0.921 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.769 -11.595 -0.572 1.00 0.00 H new ATOM 0 HG23 THR A 78 -10.207 -12.392 -0.270 1.00 0.00 H new ATOM 1241 N ARG A 79 -11.304 -11.810 4.631 1.00 0.00 N ATOM 1242 CA ARG A 79 -11.727 -11.949 6.032 1.00 0.00 C ATOM 1243 C ARG A 79 -12.866 -10.985 6.382 1.00 0.00 C ATOM 1244 O ARG A 79 -12.866 -9.842 5.913 1.00 0.00 O ATOM 1245 CB ARG A 79 -10.493 -11.688 6.920 1.00 0.00 C ATOM 1246 CG ARG A 79 -10.739 -12.000 8.401 1.00 0.00 C ATOM 1247 CD ARG A 79 -9.443 -11.873 9.209 1.00 0.00 C ATOM 1248 NE ARG A 79 -9.719 -11.952 10.654 1.00 0.00 N ATOM 1249 CZ ARG A 79 -9.543 -12.963 11.484 1.00 0.00 C ATOM 1250 NH1 ARG A 79 -9.056 -14.111 11.100 1.00 0.00 N ATOM 1251 NH2 ARG A 79 -9.865 -12.841 12.739 1.00 0.00 N ATOM 0 H ARG A 79 -10.320 -11.553 4.560 1.00 0.00 H new ATOM 0 HA ARG A 79 -12.115 -12.954 6.200 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -9.660 -12.293 6.561 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -10.195 -10.644 6.820 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -11.490 -11.318 8.801 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -11.138 -13.009 8.503 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -8.751 -12.665 8.922 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -8.956 -10.925 8.978 1.00 0.00 H new ATOM 0 HE ARG A 79 -10.101 -11.104 11.073 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.795 -14.253 10.124 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -8.937 -14.866 11.775 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -10.254 -11.963 13.083 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -9.728 -13.623 13.379 1.00 0.00 H new ATOM 1265 N HIS A 80 -13.798 -11.436 7.232 1.00 0.00 N ATOM 1266 CA HIS A 80 -14.946 -10.660 7.739 1.00 0.00 C ATOM 1267 C HIS A 80 -14.504 -9.312 8.329 1.00 0.00 C ATOM 1268 O HIS A 80 -15.048 -8.272 7.963 1.00 0.00 O ATOM 1269 CB HIS A 80 -15.744 -11.492 8.760 1.00 0.00 C ATOM 1270 CG HIS A 80 -16.191 -12.840 8.241 1.00 0.00 C ATOM 1271 ND1 HIS A 80 -15.929 -14.063 8.835 1.00 0.00 N ATOM 1272 CD2 HIS A 80 -16.923 -13.064 7.107 1.00 0.00 C ATOM 1273 CE1 HIS A 80 -16.492 -15.018 8.067 1.00 0.00 C ATOM 1274 NE2 HIS A 80 -17.101 -14.434 7.011 1.00 0.00 N ATOM 0 H HIS A 80 -13.776 -12.386 7.601 1.00 0.00 H new ATOM 0 HA HIS A 80 -15.601 -10.434 6.898 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -15.132 -11.642 9.649 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -16.622 -10.924 9.069 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -17.291 -12.317 6.420 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -16.461 -16.079 8.264 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -17.606 -14.920 6.270 1.00 0.00 H new ATOM 1283 N ASP A 81 -13.501 -9.334 9.211 1.00 0.00 N ATOM 1284 CA ASP A 81 -12.866 -8.156 9.812 1.00 0.00 C ATOM 1285 C ASP A 81 -11.369 -8.407 10.101 1.00 0.00 C ATOM 1286 O ASP A 81 -11.003 -9.389 10.752 1.00 0.00 O ATOM 1287 CB ASP A 81 -13.630 -7.675 11.059 1.00 0.00 C ATOM 1288 CG ASP A 81 -13.416 -8.534 12.319 1.00 0.00 C ATOM 1289 OD1 ASP A 81 -14.009 -9.636 12.419 1.00 0.00 O ATOM 1290 OD2 ASP A 81 -12.695 -8.079 13.242 1.00 0.00 O ATOM 0 H ASP A 81 -13.092 -10.209 9.540 1.00 0.00 H new ATOM 0 HA ASP A 81 -12.915 -7.346 9.084 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.329 -6.651 11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.695 -7.652 10.829 1.00 0.00 H new ATOM 1295 N CYS A 82 -10.518 -7.507 9.605 1.00 0.00 N ATOM 1296 CA CYS A 82 -9.057 -7.470 9.730 1.00 0.00 C ATOM 1297 C CYS A 82 -8.699 -6.032 10.199 1.00 0.00 C ATOM 1298 O CYS A 82 -9.377 -5.084 9.783 1.00 0.00 O ATOM 1299 CB CYS A 82 -8.472 -7.802 8.340 1.00 0.00 C ATOM 1300 SG CYS A 82 -6.860 -8.655 8.318 1.00 0.00 S ATOM 0 H CYS A 82 -10.861 -6.717 9.059 1.00 0.00 H new ATOM 0 HA CYS A 82 -8.652 -8.186 10.445 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -9.193 -8.421 7.805 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -8.373 -6.872 7.780 1.00 0.00 H new ATOM 1305 N PRO A 83 -7.689 -5.816 11.063 1.00 0.00 N ATOM 1306 CA PRO A 83 -7.362 -4.500 11.637 1.00 0.00 C ATOM 1307 C PRO A 83 -6.944 -3.382 10.661 1.00 0.00 C ATOM 1308 O PRO A 83 -6.802 -2.236 11.098 1.00 0.00 O ATOM 1309 CB PRO A 83 -6.273 -4.777 12.683 1.00 0.00 C ATOM 1310 CG PRO A 83 -5.625 -6.065 12.179 1.00 0.00 C ATOM 1311 CD PRO A 83 -6.819 -6.833 11.629 1.00 0.00 C ATOM 0 HA PRO A 83 -8.278 -4.078 12.050 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.554 -3.960 12.741 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -6.695 -4.902 13.680 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -4.877 -5.871 11.410 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.125 -6.609 12.980 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -6.510 -7.554 10.872 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -7.325 -7.393 12.416 1.00 0.00 H new ATOM 1319 N VAL A 84 -6.757 -3.662 9.366 1.00 0.00 N ATOM 1320 CA VAL A 84 -6.394 -2.650 8.348 1.00 0.00 C ATOM 1321 C VAL A 84 -7.213 -2.817 7.072 1.00 0.00 C ATOM 1322 O VAL A 84 -7.673 -1.830 6.501 1.00 0.00 O ATOM 1323 CB VAL A 84 -4.899 -2.642 7.969 1.00 0.00 C ATOM 1324 CG1 VAL A 84 -4.522 -1.205 7.576 1.00 0.00 C ATOM 1325 CG2 VAL A 84 -3.974 -3.147 9.076 1.00 0.00 C ATOM 0 H VAL A 84 -6.852 -4.603 8.985 1.00 0.00 H new ATOM 0 HA VAL A 84 -6.621 -1.697 8.826 1.00 0.00 H new ATOM 0 HB VAL A 84 -4.761 -3.337 7.141 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.468 -1.167 7.302 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -5.129 -0.889 6.728 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.702 -0.538 8.419 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.941 -3.110 8.732 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -4.085 -2.517 9.959 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.236 -4.175 9.328 1.00 0.00 H new ATOM 1335 N CYS A 85 -7.379 -4.053 6.609 1.00 0.00 N ATOM 1336 CA CYS A 85 -8.108 -4.413 5.408 1.00 0.00 C ATOM 1337 C CYS A 85 -9.566 -3.940 5.475 1.00 0.00 C ATOM 1338 O CYS A 85 -9.991 -3.206 4.590 1.00 0.00 O ATOM 1339 CB CYS A 85 -7.984 -5.930 5.202 1.00 0.00 C ATOM 1340 SG CYS A 85 -6.270 -6.494 5.474 1.00 0.00 S ATOM 0 H CYS A 85 -6.989 -4.865 7.087 1.00 0.00 H new ATOM 0 HA CYS A 85 -7.678 -3.908 4.543 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -8.654 -6.449 5.888 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -8.299 -6.190 4.191 1.00 0.00 H new ATOM 1345 N LEU A 86 -10.319 -4.341 6.510 1.00 0.00 N ATOM 1346 CA LEU A 86 -11.731 -3.995 6.749 1.00 0.00 C ATOM 1347 C LEU A 86 -12.123 -2.544 6.375 1.00 0.00 C ATOM 1348 O LEU A 86 -12.977 -2.405 5.496 1.00 0.00 O ATOM 1349 CB LEU A 86 -12.124 -4.424 8.178 1.00 0.00 C ATOM 1350 CG LEU A 86 -13.609 -4.339 8.586 1.00 0.00 C ATOM 1351 CD1 LEU A 86 -14.073 -2.922 8.930 1.00 0.00 C ATOM 1352 CD2 LEU A 86 -14.537 -4.952 7.540 1.00 0.00 C ATOM 0 H LEU A 86 -9.942 -4.945 7.240 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.338 -4.566 6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.800 -5.456 8.316 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -11.552 -3.814 8.877 1.00 0.00 H new ATOM 0 HG LEU A 86 -13.674 -4.930 9.499 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -15.127 -2.942 9.207 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -13.485 -2.539 9.764 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -13.938 -2.274 8.064 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -15.570 -4.866 7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -14.418 -4.424 6.594 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -14.286 -6.004 7.403 1.00 0.00 H new ATOM 1364 N PRO A 87 -11.557 -1.471 6.973 1.00 0.00 N ATOM 1365 CA PRO A 87 -11.919 -0.090 6.630 1.00 0.00 C ATOM 1366 C PRO A 87 -11.754 0.243 5.134 1.00 0.00 C ATOM 1367 O PRO A 87 -12.582 0.949 4.565 1.00 0.00 O ATOM 1368 CB PRO A 87 -11.079 0.817 7.542 1.00 0.00 C ATOM 1369 CG PRO A 87 -9.940 -0.071 8.034 1.00 0.00 C ATOM 1370 CD PRO A 87 -10.559 -1.468 8.035 1.00 0.00 C ATOM 0 HA PRO A 87 -12.984 0.069 6.799 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -10.699 1.682 6.998 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -11.671 1.198 8.374 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -9.073 -0.015 7.375 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.603 0.221 9.029 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -9.800 -2.230 7.858 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.016 -1.691 8.999 1.00 0.00 H new ATOM 1378 N LEU A 88 -10.707 -0.267 4.479 1.00 0.00 N ATOM 1379 CA LEU A 88 -10.440 -0.075 3.047 1.00 0.00 C ATOM 1380 C LEU A 88 -11.408 -0.902 2.172 1.00 0.00 C ATOM 1381 O LEU A 88 -12.061 -0.380 1.266 1.00 0.00 O ATOM 1382 CB LEU A 88 -8.987 -0.481 2.751 1.00 0.00 C ATOM 1383 CG LEU A 88 -7.900 0.230 3.574 1.00 0.00 C ATOM 1384 CD1 LEU A 88 -6.589 -0.515 3.353 1.00 0.00 C ATOM 1385 CD2 LEU A 88 -7.736 1.689 3.148 1.00 0.00 C ATOM 0 H LEU A 88 -10.001 -0.841 4.941 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.595 0.976 2.803 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.892 -1.555 2.914 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -8.790 -0.300 1.694 1.00 0.00 H new ATOM 0 HG LEU A 88 -8.186 0.227 4.626 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.796 -0.034 3.925 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.698 -1.548 3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.334 -0.497 2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.959 2.159 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -7.454 1.731 2.096 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -8.678 2.218 3.292 1.00 0.00 H new ATOM 1397 N LYS A 89 -11.481 -2.207 2.461 1.00 0.00 N ATOM 1398 CA LYS A 89 -12.283 -3.282 1.853 1.00 0.00 C ATOM 1399 C LYS A 89 -13.773 -2.933 1.818 1.00 0.00 C ATOM 1400 O LYS A 89 -14.407 -3.024 0.766 1.00 0.00 O ATOM 1401 CB LYS A 89 -11.987 -4.558 2.662 1.00 0.00 C ATOM 1402 CG LYS A 89 -12.692 -5.848 2.217 1.00 0.00 C ATOM 1403 CD LYS A 89 -12.488 -6.953 3.271 1.00 0.00 C ATOM 1404 CE LYS A 89 -11.030 -7.454 3.340 1.00 0.00 C ATOM 1405 NZ LYS A 89 -10.754 -8.256 4.561 1.00 0.00 N ATOM 0 H LYS A 89 -10.910 -2.582 3.219 1.00 0.00 H new ATOM 0 HA LYS A 89 -12.013 -3.430 0.807 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -10.912 -4.734 2.635 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -12.253 -4.369 3.702 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -13.757 -5.660 2.077 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -12.297 -6.175 1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -12.784 -6.574 4.249 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -13.145 -7.792 3.042 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.816 -8.058 2.458 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -10.355 -6.599 3.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -9.915 -8.851 4.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -10.580 -7.618 5.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -11.573 -8.861 4.771 1.00 0.00 H new ATOM 1419 N ASN A 90 -14.316 -2.517 2.963 1.00 0.00 N ATOM 1420 CA ASN A 90 -15.698 -2.084 3.147 1.00 0.00 C ATOM 1421 C ASN A 90 -15.731 -0.703 3.843 1.00 0.00 C ATOM 1422 O ASN A 90 -15.916 -0.599 5.059 1.00 0.00 O ATOM 1423 CB ASN A 90 -16.503 -3.176 3.876 1.00 0.00 C ATOM 1424 CG ASN A 90 -17.988 -2.843 3.903 1.00 0.00 C ATOM 1425 OD1 ASN A 90 -18.766 -3.287 3.068 1.00 0.00 O ATOM 1426 ND2 ASN A 90 -18.423 -2.024 4.829 1.00 0.00 N ATOM 0 H ASN A 90 -13.776 -2.471 3.827 1.00 0.00 H new ATOM 0 HA ASN A 90 -16.185 -1.947 2.182 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -16.352 -4.135 3.380 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -16.134 -3.283 4.896 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -19.407 -1.758 4.853 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -17.777 -1.653 5.526 1.00 0.00 H new ATOM 1433 N ALA A 91 -15.550 0.362 3.055 1.00 0.00 N ATOM 1434 CA ALA A 91 -15.568 1.752 3.521 1.00 0.00 C ATOM 1435 C ALA A 91 -17.005 2.258 3.757 1.00 0.00 C ATOM 1436 O ALA A 91 -17.330 2.760 4.838 1.00 0.00 O ATOM 1437 CB ALA A 91 -14.820 2.621 2.499 1.00 0.00 C ATOM 0 H ALA A 91 -15.383 0.279 2.052 1.00 0.00 H new ATOM 0 HA ALA A 91 -15.065 1.815 4.486 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -14.825 3.659 2.832 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -13.791 2.273 2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -15.313 2.548 1.530 1.00 0.00 H new ATOM 1443 N SER A 92 -17.858 2.144 2.735 1.00 0.00 N ATOM 1444 CA SER A 92 -19.265 2.571 2.732 1.00 0.00 C ATOM 1445 C SER A 92 -20.121 1.831 3.769 1.00 0.00 C ATOM 1446 O SER A 92 -19.931 0.637 4.013 1.00 0.00 O ATOM 1447 CB SER A 92 -19.877 2.331 1.344 1.00 0.00 C ATOM 1448 OG SER A 92 -19.113 2.977 0.334 1.00 0.00 O ATOM 0 H SER A 92 -17.576 1.733 1.845 1.00 0.00 H new ATOM 0 HA SER A 92 -19.266 3.630 2.990 1.00 0.00 H new ATOM 0 HB2 SER A 92 -19.923 1.261 1.142 1.00 0.00 H new ATOM 0 HB3 SER A 92 -20.901 2.703 1.325 1.00 0.00 H new ATOM 0 HG SER A 92 -19.520 2.809 -0.542 1.00 0.00 H new ATOM 1454 N ASP A 93 -21.095 2.528 4.357 1.00 0.00 N ATOM 1455 CA ASP A 93 -22.048 1.962 5.323 1.00 0.00 C ATOM 1456 C ASP A 93 -22.907 0.846 4.690 1.00 0.00 C ATOM 1457 O ASP A 93 -23.314 0.946 3.525 1.00 0.00 O ATOM 1458 CB ASP A 93 -22.939 3.091 5.869 1.00 0.00 C ATOM 1459 CG ASP A 93 -24.005 2.564 6.842 1.00 0.00 C ATOM 1460 OD1 ASP A 93 -23.664 2.283 8.015 1.00 0.00 O ATOM 1461 OD2 ASP A 93 -25.177 2.401 6.422 1.00 0.00 O ATOM 0 H ASP A 93 -21.249 3.520 4.174 1.00 0.00 H new ATOM 0 HA ASP A 93 -21.489 1.507 6.141 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -22.318 3.829 6.377 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -23.427 3.601 5.039 1.00 0.00 H new ATOM 1466 N LYS A 94 -23.209 -0.201 5.470 1.00 0.00 N ATOM 1467 CA LYS A 94 -24.037 -1.362 5.095 1.00 0.00 C ATOM 1468 C LYS A 94 -25.022 -1.691 6.228 1.00 0.00 C ATOM 1469 O LYS A 94 -24.598 -1.941 7.360 1.00 0.00 O ATOM 1470 CB LYS A 94 -23.142 -2.584 4.790 1.00 0.00 C ATOM 1471 CG LYS A 94 -22.117 -2.406 3.656 1.00 0.00 C ATOM 1472 CD LYS A 94 -22.749 -2.262 2.262 1.00 0.00 C ATOM 1473 CE LYS A 94 -21.703 -1.961 1.178 1.00 0.00 C ATOM 1474 NZ LYS A 94 -20.737 -3.077 0.988 1.00 0.00 N ATOM 0 H LYS A 94 -22.866 -0.267 6.428 1.00 0.00 H new ATOM 0 HA LYS A 94 -24.603 -1.116 4.196 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -22.604 -2.851 5.700 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -23.786 -3.427 4.541 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -21.511 -1.524 3.862 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -21.442 -3.262 3.652 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -23.278 -3.181 2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -23.490 -1.462 2.282 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -22.211 -1.760 0.234 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -21.158 -1.056 1.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -20.210 -2.933 0.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -20.072 -3.100 1.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -21.253 -3.979 0.941 1.00 0.00 H new ATOM 1488 N ARG A 95 -26.328 -1.688 5.928 1.00 0.00 N ATOM 1489 CA ARG A 95 -27.427 -2.003 6.868 1.00 0.00 C ATOM 1490 C ARG A 95 -27.410 -3.482 7.286 1.00 0.00 C ATOM 1491 O ARG A 95 -27.247 -4.360 6.408 1.00 0.00 O ATOM 1492 CB ARG A 95 -28.793 -1.624 6.257 1.00 0.00 C ATOM 1493 CG ARG A 95 -29.199 -0.146 6.440 1.00 0.00 C ATOM 1494 CD ARG A 95 -28.286 0.882 5.757 1.00 0.00 C ATOM 1495 NE ARG A 95 -28.217 0.685 4.297 1.00 0.00 N ATOM 1496 CZ ARG A 95 -27.179 0.913 3.516 1.00 0.00 C ATOM 1497 NH1 ARG A 95 -26.075 1.427 3.962 1.00 0.00 N ATOM 1498 NH2 ARG A 95 -27.223 0.601 2.256 1.00 0.00 N ATOM 1499 OXT ARG A 95 -27.576 -3.756 8.498 1.00 0.00 O ATOM 0 H ARG A 95 -26.666 -1.459 4.993 1.00 0.00 H new ATOM 0 HA ARG A 95 -27.271 -1.406 7.767 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -28.773 -1.851 5.191 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -29.562 -2.255 6.703 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -30.212 -0.016 6.058 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -29.230 0.074 7.507 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -28.651 1.887 5.969 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -27.283 0.812 6.179 1.00 0.00 H new ATOM 0 HE ARG A 95 -29.061 0.336 3.843 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -25.988 1.670 4.949 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -25.294 1.588 3.326 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -28.064 0.177 1.865 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -26.417 0.780 1.658 1.00 0.00 H new TER 1513 ARG A 95 ATOM 1514 N SER B 99 -14.295 13.773 2.811 1.00 0.00 N ATOM 1515 CA SER B 99 -14.438 12.434 3.425 1.00 0.00 C ATOM 1516 C SER B 99 -13.123 11.665 3.378 1.00 0.00 C ATOM 1517 O SER B 99 -12.472 11.599 2.333 1.00 0.00 O ATOM 1518 CB SER B 99 -15.539 11.624 2.737 1.00 0.00 C ATOM 1519 OG SER B 99 -16.768 12.332 2.809 1.00 0.00 O ATOM 0 HA SER B 99 -14.717 12.584 4.468 1.00 0.00 H new ATOM 0 HB2 SER B 99 -15.273 11.442 1.696 1.00 0.00 H new ATOM 0 HB3 SER B 99 -15.640 10.650 3.215 1.00 0.00 H new ATOM 0 HG SER B 99 -16.597 13.293 2.726 1.00 0.00 H new ATOM 1527 N ASP B 100 -12.720 11.070 4.504 1.00 0.00 N ATOM 1528 CA ASP B 100 -11.499 10.262 4.666 1.00 0.00 C ATOM 1529 C ASP B 100 -11.714 9.127 5.688 1.00 0.00 C ATOM 1530 O ASP B 100 -12.530 9.244 6.608 1.00 0.00 O ATOM 1531 CB ASP B 100 -10.333 11.178 5.078 1.00 0.00 C ATOM 1532 CG ASP B 100 -9.012 10.417 5.297 1.00 0.00 C ATOM 1533 OD1 ASP B 100 -8.690 9.507 4.495 1.00 0.00 O ATOM 1534 OD2 ASP B 100 -8.305 10.727 6.283 1.00 0.00 O ATOM 0 H ASP B 100 -13.257 11.139 5.369 1.00 0.00 H new ATOM 0 HA ASP B 100 -11.255 9.789 3.715 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -10.185 11.936 4.308 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -10.599 11.703 5.995 1.00 0.00 H new ATOM 1539 N LEU B 101 -10.970 8.029 5.525 1.00 0.00 N ATOM 1540 CA LEU B 101 -10.987 6.830 6.371 1.00 0.00 C ATOM 1541 C LEU B 101 -9.602 6.171 6.449 1.00 0.00 C ATOM 1542 O LEU B 101 -9.145 5.826 7.537 1.00 0.00 O ATOM 1543 CB LEU B 101 -12.071 5.864 5.852 1.00 0.00 C ATOM 1544 CG LEU B 101 -12.174 4.529 6.617 1.00 0.00 C ATOM 1545 CD1 LEU B 101 -12.394 4.708 8.120 1.00 0.00 C ATOM 1546 CD2 LEU B 101 -13.348 3.727 6.063 1.00 0.00 C ATOM 0 H LEU B 101 -10.303 7.948 4.758 1.00 0.00 H new ATOM 0 HA LEU B 101 -11.237 7.113 7.394 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -13.037 6.367 5.898 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -11.873 5.649 4.802 1.00 0.00 H new ATOM 0 HG LEU B 101 -11.223 4.015 6.478 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -12.457 3.730 8.597 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -11.560 5.266 8.546 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -13.321 5.255 8.289 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -13.428 2.781 6.599 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -14.269 4.295 6.191 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -13.187 3.531 5.003 1.00 0.00 H new ATOM 1558 N ALA B 102 -8.924 5.986 5.312 1.00 0.00 N ATOM 1559 CA ALA B 102 -7.591 5.388 5.249 1.00 0.00 C ATOM 1560 C ALA B 102 -6.563 6.195 6.067 1.00 0.00 C ATOM 1561 O ALA B 102 -5.942 5.669 6.992 1.00 0.00 O ATOM 1562 CB ALA B 102 -7.170 5.264 3.779 1.00 0.00 C ATOM 0 H ALA B 102 -9.292 6.252 4.399 1.00 0.00 H new ATOM 0 HA ALA B 102 -7.626 4.395 5.697 1.00 0.00 H new ATOM 0 HB1 ALA B 102 -6.177 4.819 3.721 1.00 0.00 H new ATOM 0 HB2 ALA B 102 -7.882 4.632 3.249 1.00 0.00 H new ATOM 0 HB3 ALA B 102 -7.152 6.253 3.321 1.00 0.00 H new ATOM 1568 N CYS B 103 -6.388 7.477 5.739 1.00 0.00 N ATOM 1569 CA CYS B 103 -5.435 8.394 6.372 1.00 0.00 C ATOM 1570 C CYS B 103 -5.903 8.989 7.722 1.00 0.00 C ATOM 1571 O CYS B 103 -5.259 9.917 8.221 1.00 0.00 O ATOM 1572 CB CYS B 103 -5.098 9.499 5.355 1.00 0.00 C ATOM 1573 SG CYS B 103 -4.379 8.790 3.839 1.00 0.00 S ATOM 0 H CYS B 103 -6.927 7.923 4.996 1.00 0.00 H new ATOM 0 HA CYS B 103 -4.549 7.818 6.638 1.00 0.00 H new ATOM 0 HB2 CYS B 103 -6.000 10.058 5.107 1.00 0.00 H new ATOM 0 HB3 CYS B 103 -4.397 10.206 5.799 1.00 0.00 H new ATOM 0 HG CYS B 103 -4.107 9.745 3.000 1.00 0.00 H new ATOM 1579 N ARG B 104 -6.982 8.452 8.325 1.00 0.00 N ATOM 1580 CA ARG B 104 -7.640 8.854 9.592 1.00 0.00 C ATOM 1581 C ARG B 104 -6.730 9.564 10.604 1.00 0.00 C ATOM 1582 O ARG B 104 -6.884 10.766 10.828 1.00 0.00 O ATOM 1583 CB ARG B 104 -8.450 7.679 10.189 1.00 0.00 C ATOM 1584 CG ARG B 104 -7.686 6.350 10.375 1.00 0.00 C ATOM 1585 CD ARG B 104 -8.635 5.231 10.826 1.00 0.00 C ATOM 1586 NE ARG B 104 -7.966 3.913 10.844 1.00 0.00 N ATOM 1587 CZ ARG B 104 -7.743 3.102 9.825 1.00 0.00 C ATOM 1588 NH1 ARG B 104 -8.064 3.407 8.599 1.00 0.00 N ATOM 1589 NH2 ARG B 104 -7.182 1.943 10.020 1.00 0.00 N ATOM 0 H ARG B 104 -7.460 7.656 7.904 1.00 0.00 H new ATOM 0 HA ARG B 104 -8.349 9.639 9.328 1.00 0.00 H new ATOM 0 HB2 ARG B 104 -8.840 7.989 11.159 1.00 0.00 H new ATOM 0 HB3 ARG B 104 -9.309 7.493 9.545 1.00 0.00 H new ATOM 0 HG2 ARG B 104 -7.205 6.069 9.438 1.00 0.00 H new ATOM 0 HG3 ARG B 104 -6.895 6.481 11.113 1.00 0.00 H new ATOM 0 HD2 ARG B 104 -9.016 5.458 11.822 1.00 0.00 H new ATOM 0 HD3 ARG B 104 -9.494 5.192 10.157 1.00 0.00 H new ATOM 0 HE ARG B 104 -7.636 3.590 11.754 1.00 0.00 H new ATOM 0 HH11 ARG B 104 -8.506 4.303 8.396 1.00 0.00 H new ATOM 0 HH12 ARG B 104 -7.873 2.749 7.843 1.00 0.00 H new ATOM 0 HH21 ARG B 104 -6.913 1.659 10.962 1.00 0.00 H new ATOM 0 HH22 ARG B 104 -7.012 1.320 9.231 1.00 0.00 H new ATOM 1603 N LEU B 105 -5.784 8.833 11.195 1.00 0.00 N ATOM 1604 CA LEU B 105 -4.772 9.327 12.133 1.00 0.00 C ATOM 1605 C LEU B 105 -3.431 8.632 11.834 1.00 0.00 C ATOM 1606 O LEU B 105 -2.955 7.796 12.604 1.00 0.00 O ATOM 1607 CB LEU B 105 -5.195 9.145 13.610 1.00 0.00 C ATOM 1608 CG LEU B 105 -6.299 10.073 14.149 1.00 0.00 C ATOM 1609 CD1 LEU B 105 -7.707 9.491 13.991 1.00 0.00 C ATOM 1610 CD2 LEU B 105 -6.093 10.311 15.649 1.00 0.00 C ATOM 0 H LEU B 105 -5.698 7.831 11.025 1.00 0.00 H new ATOM 0 HA LEU B 105 -4.662 10.402 11.990 1.00 0.00 H new ATOM 0 HB2 LEU B 105 -5.527 8.115 13.741 1.00 0.00 H new ATOM 0 HB3 LEU B 105 -4.310 9.277 14.233 1.00 0.00 H new ATOM 0 HG LEU B 105 -6.224 10.991 13.566 1.00 0.00 H new ATOM 0 HD11 LEU B 105 -8.438 10.194 14.390 1.00 0.00 H new ATOM 0 HD12 LEU B 105 -7.912 9.315 12.935 1.00 0.00 H new ATOM 0 HD13 LEU B 105 -7.775 8.549 14.535 1.00 0.00 H new ATOM 0 HD21 LEU B 105 -6.877 10.968 16.024 1.00 0.00 H new ATOM 0 HD22 LEU B 105 -6.134 9.359 16.178 1.00 0.00 H new ATOM 0 HD23 LEU B 105 -5.121 10.776 15.814 1.00 0.00 H new ATOM 1622 N LEU B 106 -2.809 8.988 10.709 1.00 0.00 N ATOM 1623 CA LEU B 106 -1.493 8.476 10.297 1.00 0.00 C ATOM 1624 C LEU B 106 -0.394 8.827 11.316 1.00 0.00 C ATOM 1625 O LEU B 106 0.463 7.993 11.616 1.00 0.00 O ATOM 1626 CB LEU B 106 -1.151 9.016 8.897 1.00 0.00 C ATOM 1627 CG LEU B 106 -1.621 8.111 7.744 1.00 0.00 C ATOM 1628 CD1 LEU B 106 -1.521 8.878 6.430 1.00 0.00 C ATOM 1629 CD2 LEU B 106 -0.730 6.868 7.634 1.00 0.00 C ATOM 0 H LEU B 106 -3.209 9.651 10.045 1.00 0.00 H new ATOM 0 HA LEU B 106 -1.542 7.388 10.259 1.00 0.00 H new ATOM 0 HB2 LEU B 106 -1.602 10.001 8.779 1.00 0.00 H new ATOM 0 HB3 LEU B 106 -0.072 9.149 8.824 1.00 0.00 H new ATOM 0 HG LEU B 106 -2.649 7.808 7.943 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -1.853 8.241 5.610 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -2.152 9.766 6.478 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.486 9.177 6.261 1.00 0.00 H new ATOM 0 HD21 LEU B 106 -1.079 6.242 6.813 1.00 0.00 H new ATOM 0 HD22 LEU B 106 0.299 7.174 7.445 1.00 0.00 H new ATOM 0 HD23 LEU B 106 -0.776 6.304 8.566 1.00 0.00 H new ATOM 1641 N GLY B 107 -0.441 10.053 11.858 1.00 0.00 N ATOM 1642 CA GLY B 107 0.465 10.612 12.874 1.00 0.00 C ATOM 1643 C GLY B 107 0.867 9.622 13.974 1.00 0.00 C ATOM 1644 O GLY B 107 2.040 9.560 14.340 1.00 0.00 O ATOM 0 H GLY B 107 -1.158 10.724 11.581 1.00 0.00 H new ATOM 0 HA2 GLY B 107 1.367 10.974 12.380 1.00 0.00 H new ATOM 0 HA3 GLY B 107 -0.014 11.475 13.336 1.00 0.00 H new ATOM 1648 N GLN B 108 -0.095 8.826 14.460 1.00 0.00 N ATOM 1649 CA GLN B 108 0.059 7.759 15.460 1.00 0.00 C ATOM 1650 C GLN B 108 1.350 6.941 15.285 1.00 0.00 C ATOM 1651 O GLN B 108 2.155 6.823 16.212 1.00 0.00 O ATOM 1652 CB GLN B 108 -1.135 6.796 15.340 1.00 0.00 C ATOM 1653 CG GLN B 108 -2.457 7.372 15.868 1.00 0.00 C ATOM 1654 CD GLN B 108 -3.581 6.338 15.783 1.00 0.00 C ATOM 1655 OE1 GLN B 108 -4.055 5.807 16.781 1.00 0.00 O ATOM 1656 NE2 GLN B 108 -4.046 6.008 14.597 1.00 0.00 N ATOM 0 H GLN B 108 -1.062 8.915 14.146 1.00 0.00 H new ATOM 0 HA GLN B 108 0.105 8.243 16.436 1.00 0.00 H new ATOM 0 HB2 GLN B 108 -1.263 6.521 14.293 1.00 0.00 H new ATOM 0 HB3 GLN B 108 -0.906 5.880 15.885 1.00 0.00 H new ATOM 0 HG2 GLN B 108 -2.331 7.692 16.902 1.00 0.00 H new ATOM 0 HG3 GLN B 108 -2.728 8.256 15.291 1.00 0.00 H new ATOM 0 HE21 GLN B 108 -3.660 6.443 13.759 1.00 0.00 H new ATOM 0 HE22 GLN B 108 -4.792 5.318 14.516 1.00 0.00 H new ATOM 1665 N SER B 109 1.517 6.359 14.095 1.00 0.00 N ATOM 1666 CA SER B 109 2.635 5.487 13.717 1.00 0.00 C ATOM 1667 C SER B 109 3.709 6.213 12.898 1.00 0.00 C ATOM 1668 O SER B 109 4.873 5.817 12.936 1.00 0.00 O ATOM 1669 CB SER B 109 2.101 4.277 12.954 1.00 0.00 C ATOM 1670 OG SER B 109 1.125 3.578 13.706 1.00 0.00 O ATOM 0 H SER B 109 0.849 6.487 13.335 1.00 0.00 H new ATOM 0 HA SER B 109 3.122 5.161 14.636 1.00 0.00 H new ATOM 0 HB2 SER B 109 1.668 4.604 12.009 1.00 0.00 H new ATOM 0 HB3 SER B 109 2.925 3.606 12.712 1.00 0.00 H new ATOM 0 HG SER B 109 1.067 2.653 13.387 1.00 0.00 H new ATOM 1676 N MET B 110 3.358 7.282 12.167 1.00 0.00 N ATOM 1677 CA MET B 110 4.325 8.101 11.411 1.00 0.00 C ATOM 1678 C MET B 110 5.346 8.797 12.326 1.00 0.00 C ATOM 1679 O MET B 110 6.485 9.023 11.922 1.00 0.00 O ATOM 1680 CB MET B 110 3.617 9.127 10.522 1.00 0.00 C ATOM 1681 CG MET B 110 2.922 8.450 9.335 1.00 0.00 C ATOM 1682 SD MET B 110 2.481 9.573 7.975 1.00 0.00 S ATOM 1683 CE MET B 110 4.119 10.011 7.327 1.00 0.00 C ATOM 0 H MET B 110 2.394 7.606 12.082 1.00 0.00 H new ATOM 0 HA MET B 110 4.876 7.412 10.771 1.00 0.00 H new ATOM 0 HB2 MET B 110 2.883 9.676 11.111 1.00 0.00 H new ATOM 0 HB3 MET B 110 4.341 9.855 10.156 1.00 0.00 H new ATOM 0 HG2 MET B 110 3.575 7.669 8.946 1.00 0.00 H new ATOM 0 HG3 MET B 110 2.016 7.960 9.692 1.00 0.00 H new ATOM 0 HE1 MET B 110 4.011 10.469 6.344 1.00 0.00 H new ATOM 0 HE2 MET B 110 4.602 10.715 8.005 1.00 0.00 H new ATOM 0 HE3 MET B 110 4.729 9.112 7.243 1.00 0.00 H new ATOM 1693 N ASP B 111 4.960 9.118 13.566 1.00 0.00 N ATOM 1694 CA ASP B 111 5.827 9.714 14.592 1.00 0.00 C ATOM 1695 C ASP B 111 7.113 8.893 14.835 1.00 0.00 C ATOM 1696 O ASP B 111 8.174 9.458 15.108 1.00 0.00 O ATOM 1697 CB ASP B 111 5.017 9.867 15.885 1.00 0.00 C ATOM 1698 CG ASP B 111 5.840 10.509 17.015 1.00 0.00 C ATOM 1699 OD1 ASP B 111 6.096 11.736 16.954 1.00 0.00 O ATOM 1700 OD2 ASP B 111 6.208 9.799 17.981 1.00 0.00 O ATOM 0 H ASP B 111 4.006 8.966 13.895 1.00 0.00 H new ATOM 0 HA ASP B 111 6.160 10.690 14.240 1.00 0.00 H new ATOM 0 HB2 ASP B 111 4.135 10.477 15.689 1.00 0.00 H new ATOM 0 HB3 ASP B 111 4.662 8.888 16.207 1.00 0.00 H new ATOM 1705 N GLU B 112 7.035 7.562 14.718 1.00 0.00 N ATOM 1706 CA GLU B 112 8.160 6.632 14.876 1.00 0.00 C ATOM 1707 C GLU B 112 9.116 6.686 13.663 1.00 0.00 C ATOM 1708 O GLU B 112 8.967 5.952 12.682 1.00 0.00 O ATOM 1709 CB GLU B 112 7.643 5.203 15.120 1.00 0.00 C ATOM 1710 CG GLU B 112 6.860 5.078 16.434 1.00 0.00 C ATOM 1711 CD GLU B 112 6.476 3.612 16.712 1.00 0.00 C ATOM 1712 OE1 GLU B 112 7.355 2.829 17.151 1.00 0.00 O ATOM 1713 OE2 GLU B 112 5.294 3.242 16.516 1.00 0.00 O ATOM 0 H GLU B 112 6.158 7.087 14.504 1.00 0.00 H new ATOM 0 HA GLU B 112 8.735 6.941 15.749 1.00 0.00 H new ATOM 0 HB2 GLU B 112 7.003 4.905 14.290 1.00 0.00 H new ATOM 0 HB3 GLU B 112 8.486 4.513 15.136 1.00 0.00 H new ATOM 0 HG2 GLU B 112 7.462 5.462 17.258 1.00 0.00 H new ATOM 0 HG3 GLU B 112 5.960 5.690 16.384 1.00 0.00 H new ATOM 1720 N SER B 113 10.120 7.567 13.746 1.00 0.00 N ATOM 1721 CA SER B 113 11.194 7.805 12.760 1.00 0.00 C ATOM 1722 C SER B 113 10.739 8.149 11.325 1.00 0.00 C ATOM 1723 O SER B 113 11.525 8.028 10.381 1.00 0.00 O ATOM 1724 CB SER B 113 12.178 6.618 12.761 1.00 0.00 C ATOM 1725 OG SER B 113 12.683 6.372 14.068 1.00 0.00 O ATOM 0 H SER B 113 10.215 8.177 14.558 1.00 0.00 H new ATOM 0 HA SER B 113 11.688 8.717 13.096 1.00 0.00 H new ATOM 0 HB2 SER B 113 11.676 5.725 12.388 1.00 0.00 H new ATOM 0 HB3 SER B 113 13.005 6.826 12.082 1.00 0.00 H new ATOM 0 HG SER B 113 13.303 5.614 14.042 1.00 0.00 H new ATOM 1731 N GLY B 114 9.493 8.598 11.125 1.00 0.00 N ATOM 1732 CA GLY B 114 8.934 8.958 9.815 1.00 0.00 C ATOM 1733 C GLY B 114 8.476 7.728 9.025 1.00 0.00 C ATOM 1734 O GLY B 114 7.281 7.528 8.799 1.00 0.00 O ATOM 0 H GLY B 114 8.829 8.724 11.889 1.00 0.00 H new ATOM 0 HA2 GLY B 114 8.090 9.633 9.955 1.00 0.00 H new ATOM 0 HA3 GLY B 114 9.683 9.500 9.238 1.00 0.00 H new ATOM 1738 N LEU B 115 9.438 6.895 8.619 1.00 0.00 N ATOM 1739 CA LEU B 115 9.264 5.636 7.887 1.00 0.00 C ATOM 1740 C LEU B 115 10.194 4.557 8.481 1.00 0.00 C ATOM 1741 O LEU B 115 11.355 4.860 8.784 1.00 0.00 O ATOM 1742 CB LEU B 115 9.589 5.822 6.392 1.00 0.00 C ATOM 1743 CG LEU B 115 8.784 6.897 5.642 1.00 0.00 C ATOM 1744 CD1 LEU B 115 9.336 6.994 4.222 1.00 0.00 C ATOM 1745 CD2 LEU B 115 7.294 6.580 5.533 1.00 0.00 C ATOM 0 H LEU B 115 10.421 7.094 8.804 1.00 0.00 H new ATOM 0 HA LEU B 115 8.224 5.324 7.983 1.00 0.00 H new ATOM 0 HB2 LEU B 115 10.648 6.064 6.301 1.00 0.00 H new ATOM 0 HB3 LEU B 115 9.435 4.868 5.888 1.00 0.00 H new ATOM 0 HG LEU B 115 8.884 7.824 6.207 1.00 0.00 H new ATOM 0 HD11 LEU B 115 8.782 7.751 3.667 1.00 0.00 H new ATOM 0 HD12 LEU B 115 10.390 7.271 4.259 1.00 0.00 H new ATOM 0 HD13 LEU B 115 9.231 6.030 3.724 1.00 0.00 H new ATOM 0 HD21 LEU B 115 6.790 7.381 4.992 1.00 0.00 H new ATOM 0 HD22 LEU B 115 7.160 5.640 4.997 1.00 0.00 H new ATOM 0 HD23 LEU B 115 6.867 6.492 6.532 1.00 0.00 H new ATOM 1757 N PRO B 116 9.726 3.308 8.652 1.00 0.00 N ATOM 1758 CA PRO B 116 10.531 2.222 9.209 1.00 0.00 C ATOM 1759 C PRO B 116 11.450 1.558 8.167 1.00 0.00 C ATOM 1760 O PRO B 116 11.412 1.867 6.972 1.00 0.00 O ATOM 1761 CB PRO B 116 9.479 1.229 9.707 1.00 0.00 C ATOM 1762 CG PRO B 116 8.399 1.325 8.630 1.00 0.00 C ATOM 1763 CD PRO B 116 8.384 2.827 8.338 1.00 0.00 C ATOM 0 HA PRO B 116 11.210 2.579 9.984 1.00 0.00 H new ATOM 0 HB2 PRO B 116 9.881 0.219 9.790 1.00 0.00 H new ATOM 0 HB3 PRO B 116 9.097 1.502 10.691 1.00 0.00 H new ATOM 0 HG2 PRO B 116 8.649 0.739 7.746 1.00 0.00 H new ATOM 0 HG3 PRO B 116 7.433 0.968 8.986 1.00 0.00 H new ATOM 0 HD2 PRO B 116 8.134 3.020 7.295 1.00 0.00 H new ATOM 0 HD3 PRO B 116 7.635 3.336 8.945 1.00 0.00 H new ATOM 1771 N GLN B 117 12.227 0.574 8.626 1.00 0.00 N ATOM 1772 CA GLN B 117 13.078 -0.298 7.808 1.00 0.00 C ATOM 1773 C GLN B 117 12.617 -1.753 7.988 1.00 0.00 C ATOM 1774 O GLN B 117 13.363 -2.635 8.421 1.00 0.00 O ATOM 1775 CB GLN B 117 14.569 -0.067 8.113 1.00 0.00 C ATOM 1776 CG GLN B 117 15.083 1.181 7.387 1.00 0.00 C ATOM 1777 CD GLN B 117 16.541 1.480 7.731 1.00 0.00 C ATOM 1778 OE1 GLN B 117 16.854 2.289 8.597 1.00 0.00 O ATOM 1779 NE2 GLN B 117 17.492 0.847 7.073 1.00 0.00 N ATOM 0 H GLN B 117 12.284 0.353 9.620 1.00 0.00 H new ATOM 0 HA GLN B 117 12.971 -0.053 6.751 1.00 0.00 H new ATOM 0 HB2 GLN B 117 14.712 0.046 9.188 1.00 0.00 H new ATOM 0 HB3 GLN B 117 15.148 -0.938 7.804 1.00 0.00 H new ATOM 0 HG2 GLN B 117 14.985 1.041 6.310 1.00 0.00 H new ATOM 0 HG3 GLN B 117 14.464 2.037 7.654 1.00 0.00 H new ATOM 0 HE21 GLN B 117 17.248 0.171 6.349 1.00 0.00 H new ATOM 0 HE22 GLN B 117 18.472 1.034 7.288 1.00 0.00 H new ATOM 1788 N LEU B 118 11.356 -1.987 7.614 1.00 0.00 N ATOM 1789 CA LEU B 118 10.731 -3.310 7.581 1.00 0.00 C ATOM 1790 C LEU B 118 11.317 -4.115 6.401 1.00 0.00 C ATOM 1791 O LEU B 118 12.048 -3.589 5.555 1.00 0.00 O ATOM 1792 CB LEU B 118 9.203 -3.163 7.432 1.00 0.00 C ATOM 1793 CG LEU B 118 8.466 -2.483 8.598 1.00 0.00 C ATOM 1794 CD1 LEU B 118 7.027 -2.187 8.178 1.00 0.00 C ATOM 1795 CD2 LEU B 118 8.422 -3.335 9.867 1.00 0.00 C ATOM 0 H LEU B 118 10.726 -1.241 7.318 1.00 0.00 H new ATOM 0 HA LEU B 118 10.935 -3.840 8.511 1.00 0.00 H new ATOM 0 HB2 LEU B 118 9.001 -2.596 6.523 1.00 0.00 H new ATOM 0 HB3 LEU B 118 8.776 -4.156 7.290 1.00 0.00 H new ATOM 0 HG LEU B 118 9.021 -1.573 8.827 1.00 0.00 H new ATOM 0 HD11 LEU B 118 6.500 -1.705 9.001 1.00 0.00 H new ATOM 0 HD12 LEU B 118 7.030 -1.526 7.312 1.00 0.00 H new ATOM 0 HD13 LEU B 118 6.524 -3.119 7.921 1.00 0.00 H new ATOM 0 HD21 LEU B 118 7.888 -2.795 10.649 1.00 0.00 H new ATOM 0 HD22 LEU B 118 7.908 -4.273 9.658 1.00 0.00 H new ATOM 0 HD23 LEU B 118 9.439 -3.544 10.200 1.00 0.00 H new ATOM 1807 N THR B 119 10.989 -5.402 6.336 1.00 0.00 N ATOM 1808 CA THR B 119 11.421 -6.328 5.280 1.00 0.00 C ATOM 1809 C THR B 119 10.285 -7.283 4.917 1.00 0.00 C ATOM 1810 O THR B 119 9.279 -7.364 5.629 1.00 0.00 O ATOM 1811 CB THR B 119 12.662 -7.133 5.714 1.00 0.00 C ATOM 1812 OG1 THR B 119 12.379 -7.904 6.866 1.00 0.00 O ATOM 1813 CG2 THR B 119 13.875 -6.242 6.008 1.00 0.00 C ATOM 0 H THR B 119 10.397 -5.849 7.036 1.00 0.00 H new ATOM 0 HA THR B 119 11.688 -5.735 4.405 1.00 0.00 H new ATOM 0 HB THR B 119 12.910 -7.781 4.873 1.00 0.00 H new ATOM 0 HG1 THR B 119 13.177 -8.409 7.126 1.00 0.00 H new ATOM 0 HG21 THR B 119 14.719 -6.863 6.309 1.00 0.00 H new ATOM 0 HG22 THR B 119 14.139 -5.680 5.112 1.00 0.00 H new ATOM 0 HG23 THR B 119 13.630 -5.548 6.812 1.00 0.00 H new ATOM 1821 N SER B 120 10.453 -8.045 3.832 1.00 0.00 N ATOM 1822 CA SER B 120 9.510 -9.090 3.408 1.00 0.00 C ATOM 1823 C SER B 120 9.274 -10.068 4.563 1.00 0.00 C ATOM 1824 O SER B 120 8.130 -10.292 4.950 1.00 0.00 O ATOM 1825 CB SER B 120 10.022 -9.822 2.161 1.00 0.00 C ATOM 1826 OG SER B 120 11.400 -10.147 2.301 1.00 0.00 O ATOM 0 H SER B 120 11.259 -7.954 3.213 1.00 0.00 H new ATOM 0 HA SER B 120 8.562 -8.622 3.143 1.00 0.00 H new ATOM 0 HB2 SER B 120 9.443 -10.732 2.003 1.00 0.00 H new ATOM 0 HB3 SER B 120 9.878 -9.196 1.281 1.00 0.00 H new ATOM 0 HG SER B 120 11.709 -10.615 1.497 1.00 0.00 H new ATOM 1832 N TYR B 121 10.357 -10.590 5.153 1.00 0.00 N ATOM 1833 CA TYR B 121 10.340 -11.475 6.322 1.00 0.00 C ATOM 1834 C TYR B 121 9.516 -10.881 7.476 1.00 0.00 C ATOM 1835 O TYR B 121 8.545 -11.501 7.906 1.00 0.00 O ATOM 1836 CB TYR B 121 11.776 -11.797 6.764 1.00 0.00 C ATOM 1837 CG TYR B 121 11.836 -12.757 7.940 1.00 0.00 C ATOM 1838 CD1 TYR B 121 11.803 -12.264 9.260 1.00 0.00 C ATOM 1839 CD2 TYR B 121 11.875 -14.147 7.711 1.00 0.00 C ATOM 1840 CE1 TYR B 121 11.786 -13.157 10.350 1.00 0.00 C ATOM 1841 CE2 TYR B 121 11.878 -15.044 8.799 1.00 0.00 C ATOM 1842 CZ TYR B 121 11.829 -14.550 10.122 1.00 0.00 C ATOM 1843 OH TYR B 121 11.812 -15.409 11.179 1.00 0.00 O ATOM 0 H TYR B 121 11.301 -10.400 4.817 1.00 0.00 H new ATOM 0 HA TYR B 121 9.851 -12.406 6.035 1.00 0.00 H new ATOM 0 HB2 TYR B 121 12.321 -12.227 5.923 1.00 0.00 H new ATOM 0 HB3 TYR B 121 12.284 -10.871 7.033 1.00 0.00 H new ATOM 0 HD1 TYR B 121 11.791 -11.199 9.437 1.00 0.00 H new ATOM 0 HD2 TYR B 121 11.903 -14.526 6.700 1.00 0.00 H new ATOM 0 HE1 TYR B 121 11.740 -12.776 11.360 1.00 0.00 H new ATOM 0 HE2 TYR B 121 11.918 -16.109 8.621 1.00 0.00 H new ATOM 0 HH TYR B 121 11.846 -16.332 10.851 1.00 0.00 H new ATOM 1853 N ASP B 122 9.877 -9.688 7.970 1.00 0.00 N ATOM 1854 CA ASP B 122 9.174 -9.000 9.064 1.00 0.00 C ATOM 1855 C ASP B 122 7.670 -8.867 8.784 1.00 0.00 C ATOM 1856 O ASP B 122 6.845 -9.236 9.624 1.00 0.00 O ATOM 1857 CB ASP B 122 9.788 -7.611 9.327 1.00 0.00 C ATOM 1858 CG ASP B 122 10.942 -7.609 10.345 1.00 0.00 C ATOM 1859 OD1 ASP B 122 11.677 -8.616 10.479 1.00 0.00 O ATOM 1860 OD2 ASP B 122 11.099 -6.580 11.045 1.00 0.00 O ATOM 0 H ASP B 122 10.678 -9.165 7.616 1.00 0.00 H new ATOM 0 HA ASP B 122 9.296 -9.614 9.956 1.00 0.00 H new ATOM 0 HB2 ASP B 122 10.151 -7.203 8.384 1.00 0.00 H new ATOM 0 HB3 ASP B 122 9.004 -6.942 9.683 1.00 0.00 H new ATOM 1865 N CYS B 123 7.307 -8.349 7.611 1.00 0.00 N ATOM 1866 CA CYS B 123 5.921 -8.159 7.191 1.00 0.00 C ATOM 1867 C CYS B 123 5.149 -9.493 7.102 1.00 0.00 C ATOM 1868 O CYS B 123 4.062 -9.598 7.669 1.00 0.00 O ATOM 1869 CB CYS B 123 5.893 -7.357 5.885 1.00 0.00 C ATOM 1870 SG CYS B 123 6.576 -5.693 6.125 1.00 0.00 S ATOM 0 H CYS B 123 7.984 -8.043 6.912 1.00 0.00 H new ATOM 0 HA CYS B 123 5.394 -7.583 7.952 1.00 0.00 H new ATOM 0 HB2 CYS B 123 6.466 -7.882 5.120 1.00 0.00 H new ATOM 0 HB3 CYS B 123 4.868 -7.284 5.522 1.00 0.00 H new ATOM 0 HG CYS B 123 7.871 -5.737 6.022 1.00 0.00 H new ATOM 1876 N GLU B 124 5.699 -10.522 6.441 1.00 0.00 N ATOM 1877 CA GLU B 124 5.110 -11.873 6.341 1.00 0.00 C ATOM 1878 C GLU B 124 4.861 -12.481 7.733 1.00 0.00 C ATOM 1879 O GLU B 124 3.791 -13.030 7.995 1.00 0.00 O ATOM 1880 CB GLU B 124 6.001 -12.820 5.511 1.00 0.00 C ATOM 1881 CG GLU B 124 5.914 -12.553 4.003 1.00 0.00 C ATOM 1882 CD GLU B 124 6.860 -13.453 3.191 1.00 0.00 C ATOM 1883 OE1 GLU B 124 6.552 -14.654 2.999 1.00 0.00 O ATOM 1884 OE2 GLU B 124 7.899 -12.961 2.686 1.00 0.00 O ATOM 0 H GLU B 124 6.588 -10.440 5.948 1.00 0.00 H new ATOM 0 HA GLU B 124 4.153 -11.762 5.831 1.00 0.00 H new ATOM 0 HB2 GLU B 124 7.036 -12.713 5.835 1.00 0.00 H new ATOM 0 HB3 GLU B 124 5.710 -13.851 5.710 1.00 0.00 H new ATOM 0 HG2 GLU B 124 4.889 -12.712 3.668 1.00 0.00 H new ATOM 0 HG3 GLU B 124 6.155 -11.508 3.808 1.00 0.00 H new ATOM 1891 N VAL B 125 5.842 -12.374 8.635 1.00 0.00 N ATOM 1892 CA VAL B 125 5.790 -12.844 10.029 1.00 0.00 C ATOM 1893 C VAL B 125 4.679 -12.146 10.825 1.00 0.00 C ATOM 1894 O VAL B 125 3.896 -12.808 11.510 1.00 0.00 O ATOM 1895 CB VAL B 125 7.179 -12.654 10.683 1.00 0.00 C ATOM 1896 CG1 VAL B 125 7.185 -12.611 12.215 1.00 0.00 C ATOM 1897 CG2 VAL B 125 8.104 -13.791 10.235 1.00 0.00 C ATOM 0 H VAL B 125 6.735 -11.938 8.406 1.00 0.00 H new ATOM 0 HA VAL B 125 5.542 -13.905 10.036 1.00 0.00 H new ATOM 0 HB VAL B 125 7.519 -11.674 10.350 1.00 0.00 H new ATOM 0 HG11 VAL B 125 8.206 -12.475 12.571 1.00 0.00 H new ATOM 0 HG12 VAL B 125 6.567 -11.781 12.558 1.00 0.00 H new ATOM 0 HG13 VAL B 125 6.786 -13.547 12.607 1.00 0.00 H new ATOM 0 HG21 VAL B 125 9.085 -13.663 10.692 1.00 0.00 H new ATOM 0 HG22 VAL B 125 7.681 -14.747 10.544 1.00 0.00 H new ATOM 0 HG23 VAL B 125 8.204 -13.772 9.150 1.00 0.00 H new ATOM 1907 N ASN B 126 4.619 -10.814 10.770 1.00 0.00 N ATOM 1908 CA ASN B 126 3.656 -9.996 11.513 1.00 0.00 C ATOM 1909 C ASN B 126 2.219 -10.061 10.967 1.00 0.00 C ATOM 1910 O ASN B 126 1.278 -10.070 11.766 1.00 0.00 O ATOM 1911 CB ASN B 126 4.185 -8.557 11.610 1.00 0.00 C ATOM 1912 CG ASN B 126 5.259 -8.444 12.677 1.00 0.00 C ATOM 1913 OD1 ASN B 126 4.989 -8.111 13.818 1.00 0.00 O ATOM 1914 ND2 ASN B 126 6.492 -8.772 12.380 1.00 0.00 N ATOM 0 H ASN B 126 5.253 -10.260 10.194 1.00 0.00 H new ATOM 0 HA ASN B 126 3.572 -10.418 12.514 1.00 0.00 H new ATOM 0 HB2 ASN B 126 4.591 -8.249 10.646 1.00 0.00 H new ATOM 0 HB3 ASN B 126 3.364 -7.879 11.842 1.00 0.00 H new ATOM 0 HD21 ASN B 126 7.214 -8.747 13.100 1.00 0.00 H new ATOM 0 HD22 ASN B 126 6.730 -9.052 11.429 1.00 0.00 H new ATOM 1921 N ALA B 127 2.030 -10.104 9.646 1.00 0.00 N ATOM 1922 CA ALA B 127 0.722 -10.173 8.985 1.00 0.00 C ATOM 1923 C ALA B 127 0.710 -11.225 7.844 1.00 0.00 C ATOM 1924 O ALA B 127 0.764 -10.857 6.664 1.00 0.00 O ATOM 1925 CB ALA B 127 0.350 -8.757 8.519 1.00 0.00 C ATOM 0 H ALA B 127 2.807 -10.091 8.985 1.00 0.00 H new ATOM 0 HA ALA B 127 -0.040 -10.518 9.683 1.00 0.00 H new ATOM 0 HB1 ALA B 127 -0.620 -8.780 8.023 1.00 0.00 H new ATOM 0 HB2 ALA B 127 0.301 -8.091 9.381 1.00 0.00 H new ATOM 0 HB3 ALA B 127 1.105 -8.393 7.822 1.00 0.00 H new ATOM 1931 N PRO B 128 0.628 -12.534 8.171 1.00 0.00 N ATOM 1932 CA PRO B 128 0.610 -13.629 7.192 1.00 0.00 C ATOM 1933 C PRO B 128 -0.479 -13.493 6.119 1.00 0.00 C ATOM 1934 O PRO B 128 -1.601 -13.060 6.389 1.00 0.00 O ATOM 1935 CB PRO B 128 0.416 -14.918 8.002 1.00 0.00 C ATOM 1936 CG PRO B 128 0.933 -14.557 9.392 1.00 0.00 C ATOM 1937 CD PRO B 128 0.568 -13.081 9.521 1.00 0.00 C ATOM 0 HA PRO B 128 1.544 -13.622 6.630 1.00 0.00 H new ATOM 0 HB2 PRO B 128 -0.631 -15.219 8.031 1.00 0.00 H new ATOM 0 HB3 PRO B 128 0.974 -15.749 7.571 1.00 0.00 H new ATOM 0 HG2 PRO B 128 0.460 -15.159 10.168 1.00 0.00 H new ATOM 0 HG3 PRO B 128 2.008 -14.716 9.477 1.00 0.00 H new ATOM 0 HD2 PRO B 128 -0.428 -12.961 9.947 1.00 0.00 H new ATOM 0 HD3 PRO B 128 1.262 -12.564 10.183 1.00 0.00 H new ATOM 1945 N ILE B 129 -0.140 -13.879 4.890 1.00 0.00 N ATOM 1946 CA ILE B 129 -1.013 -13.846 3.706 1.00 0.00 C ATOM 1947 C ILE B 129 -1.880 -15.121 3.665 1.00 0.00 C ATOM 1948 O ILE B 129 -1.432 -16.185 4.105 1.00 0.00 O ATOM 1949 CB ILE B 129 -0.146 -13.708 2.430 1.00 0.00 C ATOM 1950 CG1 ILE B 129 0.874 -12.545 2.501 1.00 0.00 C ATOM 1951 CG2 ILE B 129 -1.056 -13.477 1.216 1.00 0.00 C ATOM 1952 CD1 ILE B 129 2.038 -12.734 1.523 1.00 0.00 C ATOM 0 H ILE B 129 0.790 -14.240 4.678 1.00 0.00 H new ATOM 0 HA ILE B 129 -1.681 -12.987 3.758 1.00 0.00 H new ATOM 0 HB ILE B 129 0.418 -14.636 2.340 1.00 0.00 H new ATOM 0 HG12 ILE B 129 0.367 -11.605 2.282 1.00 0.00 H new ATOM 0 HG13 ILE B 129 1.264 -12.468 3.516 1.00 0.00 H new ATOM 0 HG21 ILE B 129 -0.446 -13.380 0.318 1.00 0.00 H new ATOM 0 HG22 ILE B 129 -1.735 -14.322 1.104 1.00 0.00 H new ATOM 0 HG23 ILE B 129 -1.634 -12.565 1.363 1.00 0.00 H new ATOM 0 HD11 ILE B 129 2.726 -11.893 1.610 1.00 0.00 H new ATOM 0 HD12 ILE B 129 2.564 -13.659 1.758 1.00 0.00 H new ATOM 0 HD13 ILE B 129 1.653 -12.784 0.504 1.00 0.00 H new ATOM 1964 N GLN B 130 -3.119 -15.036 3.154 1.00 0.00 N ATOM 1965 CA GLN B 130 -4.055 -16.174 3.091 1.00 0.00 C ATOM 1966 C GLN B 130 -3.492 -17.415 2.372 1.00 0.00 C ATOM 1967 O GLN B 130 -3.486 -18.504 2.954 1.00 0.00 O ATOM 1968 CB GLN B 130 -5.426 -15.772 2.516 1.00 0.00 C ATOM 1969 CG GLN B 130 -6.153 -14.718 3.372 1.00 0.00 C ATOM 1970 CD GLN B 130 -7.674 -14.878 3.305 1.00 0.00 C ATOM 1971 OE1 GLN B 130 -8.304 -15.441 4.192 1.00 0.00 O ATOM 1972 NE2 GLN B 130 -8.328 -14.403 2.269 1.00 0.00 N ATOM 0 H GLN B 130 -3.503 -14.172 2.771 1.00 0.00 H new ATOM 0 HA GLN B 130 -4.198 -16.470 4.130 1.00 0.00 H new ATOM 0 HB2 GLN B 130 -5.290 -15.382 1.507 1.00 0.00 H new ATOM 0 HB3 GLN B 130 -6.053 -16.660 2.433 1.00 0.00 H new ATOM 0 HG2 GLN B 130 -5.824 -14.802 4.408 1.00 0.00 H new ATOM 0 HG3 GLN B 130 -5.878 -13.720 3.030 1.00 0.00 H new ATOM 0 HE21 GLN B 130 -7.822 -13.931 1.519 1.00 0.00 H new ATOM 0 HE22 GLN B 130 -9.341 -14.506 2.214 1.00 0.00 H new ATOM 1981 N GLY B 131 -3.019 -17.272 1.128 1.00 0.00 N ATOM 1982 CA GLY B 131 -2.426 -18.392 0.376 1.00 0.00 C ATOM 1983 C GLY B 131 -2.393 -18.285 -1.154 1.00 0.00 C ATOM 1984 O GLY B 131 -1.561 -18.945 -1.780 1.00 0.00 O ATOM 0 H GLY B 131 -3.034 -16.390 0.617 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -1.402 -18.526 0.725 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -2.973 -19.298 0.637 1.00 0.00 H new ATOM 1988 N SER B 132 -3.282 -17.499 -1.774 1.00 0.00 N ATOM 1989 CA SER B 132 -3.386 -17.333 -3.239 1.00 0.00 C ATOM 1990 C SER B 132 -2.059 -16.917 -3.894 1.00 0.00 C ATOM 1991 O SER B 132 -1.672 -17.476 -4.924 1.00 0.00 O ATOM 1992 CB SER B 132 -4.498 -16.340 -3.607 1.00 0.00 C ATOM 1993 OG SER B 132 -5.724 -16.710 -2.991 1.00 0.00 O ATOM 0 H SER B 132 -3.969 -16.945 -1.263 1.00 0.00 H new ATOM 0 HA SER B 132 -3.642 -18.315 -3.636 1.00 0.00 H new ATOM 0 HB2 SER B 132 -4.215 -15.336 -3.292 1.00 0.00 H new ATOM 0 HB3 SER B 132 -4.623 -16.311 -4.689 1.00 0.00 H new ATOM 0 HG SER B 132 -6.420 -16.065 -3.235 1.00 0.00 H new ATOM 1999 N ARG B 133 -1.346 -15.964 -3.277 1.00 0.00 N ATOM 2000 CA ARG B 133 -0.007 -15.462 -3.658 1.00 0.00 C ATOM 2001 C ARG B 133 0.824 -15.139 -2.409 1.00 0.00 C ATOM 2002 O ARG B 133 0.281 -15.025 -1.312 1.00 0.00 O ATOM 2003 CB ARG B 133 -0.110 -14.219 -4.571 1.00 0.00 C ATOM 2004 CG ARG B 133 -0.588 -14.555 -5.995 1.00 0.00 C ATOM 2005 CD ARG B 133 -0.515 -13.360 -6.957 1.00 0.00 C ATOM 2006 NE ARG B 133 0.876 -12.919 -7.214 1.00 0.00 N ATOM 2007 CZ ARG B 133 1.381 -12.435 -8.336 1.00 0.00 C ATOM 2008 NH1 ARG B 133 0.670 -12.280 -9.416 1.00 0.00 N ATOM 2009 NH2 ARG B 133 2.632 -12.077 -8.393 1.00 0.00 N ATOM 0 H ARG B 133 -1.706 -15.491 -2.448 1.00 0.00 H new ATOM 0 HA ARG B 133 0.495 -16.250 -4.219 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -0.798 -13.502 -4.123 1.00 0.00 H new ATOM 0 HB3 ARG B 133 0.865 -13.734 -4.626 1.00 0.00 H new ATOM 0 HG2 ARG B 133 0.018 -15.370 -6.392 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -1.616 -14.915 -5.951 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -0.987 -13.630 -7.902 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -1.085 -12.529 -6.542 1.00 0.00 H new ATOM 0 HE ARG B 133 1.523 -12.999 -6.430 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -0.317 -12.536 -9.418 1.00 0.00 H new ATOM 0 HH12 ARG B 133 1.100 -11.903 -10.260 1.00 0.00 H new ATOM 0 HH21 ARG B 133 3.227 -12.169 -7.570 1.00 0.00 H new ATOM 0 HH22 ARG B 133 3.017 -11.704 -9.261 1.00 0.00 H new ATOM 2023 N ASN B 134 2.135 -14.969 -2.587 1.00 0.00 N ATOM 2024 CA ASN B 134 3.097 -14.606 -1.534 1.00 0.00 C ATOM 2025 C ASN B 134 3.825 -13.277 -1.832 1.00 0.00 C ATOM 2026 O ASN B 134 4.081 -12.501 -0.913 1.00 0.00 O ATOM 2027 CB ASN B 134 4.032 -15.791 -1.272 1.00 0.00 C ATOM 2028 CG ASN B 134 5.058 -15.486 -0.193 1.00 0.00 C ATOM 2029 OD1 ASN B 134 6.210 -15.194 -0.474 1.00 0.00 O ATOM 2030 ND2 ASN B 134 4.686 -15.557 1.063 1.00 0.00 N ATOM 0 H ASN B 134 2.576 -15.083 -3.499 1.00 0.00 H new ATOM 0 HA ASN B 134 2.559 -14.405 -0.607 1.00 0.00 H new ATOM 0 HB2 ASN B 134 3.442 -16.658 -0.975 1.00 0.00 H new ATOM 0 HB3 ASN B 134 4.547 -16.057 -2.195 1.00 0.00 H new ATOM 0 HD21 ASN B 134 5.359 -15.368 1.806 1.00 0.00 H new ATOM 0 HD22 ASN B 134 3.724 -15.801 1.297 1.00 0.00 H new ATOM 2037 N LEU B 135 4.108 -12.996 -3.110 1.00 0.00 N ATOM 2038 CA LEU B 135 4.672 -11.732 -3.592 1.00 0.00 C ATOM 2039 C LEU B 135 3.915 -11.260 -4.845 1.00 0.00 C ATOM 2040 O LEU B 135 4.195 -11.670 -5.977 1.00 0.00 O ATOM 2041 CB LEU B 135 6.192 -11.825 -3.845 1.00 0.00 C ATOM 2042 CG LEU B 135 7.120 -11.763 -2.613 1.00 0.00 C ATOM 2043 CD1 LEU B 135 8.566 -11.697 -3.113 1.00 0.00 C ATOM 2044 CD2 LEU B 135 6.886 -10.523 -1.743 1.00 0.00 C ATOM 0 H LEU B 135 3.945 -13.666 -3.861 1.00 0.00 H new ATOM 0 HA LEU B 135 4.542 -10.988 -2.807 1.00 0.00 H new ATOM 0 HB2 LEU B 135 6.390 -12.760 -4.370 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.472 -11.016 -4.519 1.00 0.00 H new ATOM 0 HG LEU B 135 6.913 -12.645 -2.008 1.00 0.00 H new ATOM 0 HD11 LEU B 135 9.244 -11.652 -2.261 1.00 0.00 H new ATOM 0 HD12 LEU B 135 8.787 -12.584 -3.706 1.00 0.00 H new ATOM 0 HD13 LEU B 135 8.698 -10.807 -3.729 1.00 0.00 H new ATOM 0 HD21 LEU B 135 7.570 -10.540 -0.894 1.00 0.00 H new ATOM 0 HD22 LEU B 135 7.064 -9.625 -2.334 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.858 -10.521 -1.381 1.00 0.00 H new ATOM 2056 N LEU B 136 2.952 -10.371 -4.627 1.00 0.00 N ATOM 2057 CA LEU B 136 2.144 -9.669 -5.623 1.00 0.00 C ATOM 2058 C LEU B 136 3.082 -8.661 -6.322 1.00 0.00 C ATOM 2059 O LEU B 136 3.712 -7.840 -5.653 1.00 0.00 O ATOM 2060 CB LEU B 136 0.971 -9.025 -4.852 1.00 0.00 C ATOM 2061 CG LEU B 136 -0.243 -8.523 -5.646 1.00 0.00 C ATOM 2062 CD1 LEU B 136 0.138 -7.528 -6.728 1.00 0.00 C ATOM 2063 CD2 LEU B 136 -1.039 -9.651 -6.297 1.00 0.00 C ATOM 0 H LEU B 136 2.695 -10.100 -3.678 1.00 0.00 H new ATOM 0 HA LEU B 136 1.715 -10.300 -6.402 1.00 0.00 H new ATOM 0 HB2 LEU B 136 0.613 -9.754 -4.125 1.00 0.00 H new ATOM 0 HB3 LEU B 136 1.369 -8.182 -4.288 1.00 0.00 H new ATOM 0 HG LEU B 136 -0.867 -8.030 -4.900 1.00 0.00 H new ATOM 0 HD11 LEU B 136 -0.758 -7.206 -7.258 1.00 0.00 H new ATOM 0 HD12 LEU B 136 0.621 -6.663 -6.273 1.00 0.00 H new ATOM 0 HD13 LEU B 136 0.825 -8.000 -7.430 1.00 0.00 H new ATOM 0 HD21 LEU B 136 -1.884 -9.232 -6.843 1.00 0.00 H new ATOM 0 HD22 LEU B 136 -0.397 -10.199 -6.987 1.00 0.00 H new ATOM 0 HD23 LEU B 136 -1.406 -10.329 -5.527 1.00 0.00 H new ATOM 2075 N GLN B 137 3.248 -8.770 -7.646 1.00 0.00 N ATOM 2076 CA GLN B 137 4.219 -7.988 -8.437 1.00 0.00 C ATOM 2077 C GLN B 137 3.665 -7.474 -9.783 1.00 0.00 C ATOM 2078 O GLN B 137 2.673 -7.983 -10.308 1.00 0.00 O ATOM 2079 CB GLN B 137 5.451 -8.883 -8.695 1.00 0.00 C ATOM 2080 CG GLN B 137 6.312 -9.139 -7.446 1.00 0.00 C ATOM 2081 CD GLN B 137 7.235 -10.335 -7.643 1.00 0.00 C ATOM 2082 OE1 GLN B 137 8.377 -10.223 -8.069 1.00 0.00 O ATOM 2083 NE2 GLN B 137 6.770 -11.527 -7.333 1.00 0.00 N ATOM 0 H GLN B 137 2.701 -9.417 -8.214 1.00 0.00 H new ATOM 0 HA GLN B 137 4.470 -7.098 -7.860 1.00 0.00 H new ATOM 0 HB2 GLN B 137 5.115 -9.840 -9.094 1.00 0.00 H new ATOM 0 HB3 GLN B 137 6.071 -8.418 -9.462 1.00 0.00 H new ATOM 0 HG2 GLN B 137 6.905 -8.252 -7.223 1.00 0.00 H new ATOM 0 HG3 GLN B 137 5.665 -9.314 -6.586 1.00 0.00 H new ATOM 0 HE21 GLN B 137 5.819 -11.627 -6.978 1.00 0.00 H new ATOM 0 HE22 GLN B 137 7.361 -12.351 -7.448 1.00 0.00 H new ATOM 2092 N GLY B 138 4.344 -6.471 -10.354 1.00 0.00 N ATOM 2093 CA GLY B 138 4.050 -5.839 -11.648 1.00 0.00 C ATOM 2094 C GLY B 138 2.697 -5.133 -11.739 1.00 0.00 C ATOM 2095 O GLY B 138 2.261 -4.500 -10.783 1.00 0.00 O ATOM 0 H GLY B 138 5.158 -6.055 -9.901 1.00 0.00 H new ATOM 0 HA2 GLY B 138 4.835 -5.114 -11.866 1.00 0.00 H new ATOM 0 HA3 GLY B 138 4.096 -6.602 -12.425 1.00 0.00 H new ATOM 2099 N GLU B 139 2.035 -5.198 -12.898 1.00 0.00 N ATOM 2100 CA GLU B 139 0.747 -4.525 -13.161 1.00 0.00 C ATOM 2101 C GLU B 139 -0.330 -4.837 -12.105 1.00 0.00 C ATOM 2102 O GLU B 139 -1.121 -3.964 -11.740 1.00 0.00 O ATOM 2103 CB GLU B 139 0.265 -4.872 -14.579 1.00 0.00 C ATOM 2104 CG GLU B 139 -0.881 -3.963 -15.042 1.00 0.00 C ATOM 2105 CD GLU B 139 -1.337 -4.323 -16.466 1.00 0.00 C ATOM 2106 OE1 GLU B 139 -0.677 -3.910 -17.450 1.00 0.00 O ATOM 2107 OE2 GLU B 139 -2.380 -5.009 -16.603 1.00 0.00 O ATOM 0 H GLU B 139 2.380 -5.728 -13.698 1.00 0.00 H new ATOM 0 HA GLU B 139 0.918 -3.451 -13.090 1.00 0.00 H new ATOM 0 HB2 GLU B 139 1.099 -4.785 -15.275 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -0.065 -5.911 -14.604 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -1.722 -4.055 -14.354 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -0.557 -2.923 -15.013 1.00 0.00 H new ATOM 2114 N GLU B 140 -0.336 -6.066 -11.576 1.00 0.00 N ATOM 2115 CA GLU B 140 -1.239 -6.510 -10.507 1.00 0.00 C ATOM 2116 C GLU B 140 -1.173 -5.592 -9.274 1.00 0.00 C ATOM 2117 O GLU B 140 -2.205 -5.370 -8.639 1.00 0.00 O ATOM 2118 CB GLU B 140 -0.929 -7.956 -10.090 1.00 0.00 C ATOM 2119 CG GLU B 140 -1.071 -9.003 -11.200 1.00 0.00 C ATOM 2120 CD GLU B 140 -2.509 -9.088 -11.748 1.00 0.00 C ATOM 2121 OE1 GLU B 140 -3.395 -9.643 -11.055 1.00 0.00 O ATOM 2122 OE2 GLU B 140 -2.759 -8.612 -12.882 1.00 0.00 O ATOM 0 H GLU B 140 0.303 -6.798 -11.887 1.00 0.00 H new ATOM 0 HA GLU B 140 -2.250 -6.461 -10.912 1.00 0.00 H new ATOM 0 HB2 GLU B 140 0.090 -7.995 -9.705 1.00 0.00 H new ATOM 0 HB3 GLU B 140 -1.591 -8.230 -9.268 1.00 0.00 H new ATOM 0 HG2 GLU B 140 -0.389 -8.760 -12.014 1.00 0.00 H new ATOM 0 HG3 GLU B 140 -0.773 -9.979 -10.816 1.00 0.00 H new ATOM 2129 N LEU B 141 0.005 -5.028 -8.951 1.00 0.00 N ATOM 2130 CA LEU B 141 0.190 -4.069 -7.855 1.00 0.00 C ATOM 2131 C LEU B 141 -0.752 -2.883 -8.063 1.00 0.00 C ATOM 2132 O LEU B 141 -1.604 -2.610 -7.225 1.00 0.00 O ATOM 2133 CB LEU B 141 1.637 -3.535 -7.798 1.00 0.00 C ATOM 2134 CG LEU B 141 2.726 -4.538 -7.390 1.00 0.00 C ATOM 2135 CD1 LEU B 141 4.075 -4.042 -7.909 1.00 0.00 C ATOM 2136 CD2 LEU B 141 2.838 -4.635 -5.868 1.00 0.00 C ATOM 0 H LEU B 141 0.868 -5.232 -9.455 1.00 0.00 H new ATOM 0 HA LEU B 141 -0.026 -4.587 -6.920 1.00 0.00 H new ATOM 0 HB2 LEU B 141 1.892 -3.137 -8.780 1.00 0.00 H new ATOM 0 HB3 LEU B 141 1.664 -2.700 -7.098 1.00 0.00 H new ATOM 0 HG LEU B 141 2.463 -5.511 -7.805 1.00 0.00 H new ATOM 0 HD11 LEU B 141 4.856 -4.747 -7.625 1.00 0.00 H new ATOM 0 HD12 LEU B 141 4.039 -3.959 -8.995 1.00 0.00 H new ATOM 0 HD13 LEU B 141 4.294 -3.065 -7.478 1.00 0.00 H new ATOM 0 HD21 LEU B 141 3.616 -5.352 -5.605 1.00 0.00 H new ATOM 0 HD22 LEU B 141 3.092 -3.657 -5.459 1.00 0.00 H new ATOM 0 HD23 LEU B 141 1.886 -4.965 -5.453 1.00 0.00 H new ATOM 2148 N LEU B 142 -0.600 -2.185 -9.190 1.00 0.00 N ATOM 2149 CA LEU B 142 -1.379 -1.001 -9.549 1.00 0.00 C ATOM 2150 C LEU B 142 -2.885 -1.297 -9.548 1.00 0.00 C ATOM 2151 O LEU B 142 -3.658 -0.518 -8.989 1.00 0.00 O ATOM 2152 CB LEU B 142 -0.894 -0.408 -10.883 1.00 0.00 C ATOM 2153 CG LEU B 142 0.631 -0.214 -11.029 1.00 0.00 C ATOM 2154 CD1 LEU B 142 0.896 0.779 -12.159 1.00 0.00 C ATOM 2155 CD2 LEU B 142 1.332 0.330 -9.781 1.00 0.00 C ATOM 0 H LEU B 142 0.089 -2.436 -9.898 1.00 0.00 H new ATOM 0 HA LEU B 142 -1.215 -0.241 -8.785 1.00 0.00 H new ATOM 0 HB2 LEU B 142 -1.236 -1.056 -11.690 1.00 0.00 H new ATOM 0 HB3 LEU B 142 -1.377 0.559 -11.024 1.00 0.00 H new ATOM 0 HG LEU B 142 1.034 -1.209 -11.221 1.00 0.00 H new ATOM 0 HD11 LEU B 142 1.970 0.924 -12.271 1.00 0.00 H new ATOM 0 HD12 LEU B 142 0.483 0.390 -13.090 1.00 0.00 H new ATOM 0 HD13 LEU B 142 0.424 1.733 -11.923 1.00 0.00 H new ATOM 0 HD21 LEU B 142 2.399 0.433 -9.979 1.00 0.00 H new ATOM 0 HD22 LEU B 142 0.915 1.304 -9.525 1.00 0.00 H new ATOM 0 HD23 LEU B 142 1.182 -0.359 -8.950 1.00 0.00 H new ATOM 2167 N ARG B 143 -3.297 -2.437 -10.122 1.00 0.00 N ATOM 2168 CA ARG B 143 -4.691 -2.922 -10.119 1.00 0.00 C ATOM 2169 C ARG B 143 -5.217 -3.064 -8.684 1.00 0.00 C ATOM 2170 O ARG B 143 -6.293 -2.550 -8.375 1.00 0.00 O ATOM 2171 CB ARG B 143 -4.807 -4.240 -10.904 1.00 0.00 C ATOM 2172 CG ARG B 143 -4.589 -4.033 -12.411 1.00 0.00 C ATOM 2173 CD ARG B 143 -4.661 -5.366 -13.165 1.00 0.00 C ATOM 2174 NE ARG B 143 -4.530 -5.174 -14.623 1.00 0.00 N ATOM 2175 CZ ARG B 143 -5.474 -4.926 -15.508 1.00 0.00 C ATOM 2176 NH1 ARG B 143 -6.734 -4.796 -15.193 1.00 0.00 N ATOM 2177 NH2 ARG B 143 -5.144 -4.799 -16.758 1.00 0.00 N ATOM 0 H ARG B 143 -2.659 -3.063 -10.613 1.00 0.00 H new ATOM 0 HA ARG B 143 -5.317 -2.184 -10.621 1.00 0.00 H new ATOM 0 HB2 ARG B 143 -4.074 -4.953 -10.526 1.00 0.00 H new ATOM 0 HB3 ARG B 143 -5.792 -4.676 -10.737 1.00 0.00 H new ATOM 0 HG2 ARG B 143 -5.343 -3.350 -12.801 1.00 0.00 H new ATOM 0 HG3 ARG B 143 -3.618 -3.567 -12.581 1.00 0.00 H new ATOM 0 HD2 ARG B 143 -3.870 -6.027 -12.812 1.00 0.00 H new ATOM 0 HD3 ARG B 143 -5.609 -5.858 -12.946 1.00 0.00 H new ATOM 0 HE ARG B 143 -3.583 -5.242 -14.995 1.00 0.00 H new ATOM 0 HH11 ARG B 143 -7.029 -4.886 -14.221 1.00 0.00 H new ATOM 0 HH12 ARG B 143 -7.424 -4.604 -15.919 1.00 0.00 H new ATOM 0 HH21 ARG B 143 -4.168 -4.891 -17.040 1.00 0.00 H new ATOM 0 HH22 ARG B 143 -5.861 -4.607 -17.458 1.00 0.00 H new ATOM 2191 N ALA B 144 -4.455 -3.722 -7.807 1.00 0.00 N ATOM 2192 CA ALA B 144 -4.764 -3.873 -6.385 1.00 0.00 C ATOM 2193 C ALA B 144 -4.879 -2.495 -5.696 1.00 0.00 C ATOM 2194 O ALA B 144 -5.885 -2.236 -5.043 1.00 0.00 O ATOM 2195 CB ALA B 144 -3.727 -4.789 -5.720 1.00 0.00 C ATOM 0 H ALA B 144 -3.582 -4.177 -8.075 1.00 0.00 H new ATOM 0 HA ALA B 144 -5.737 -4.351 -6.274 1.00 0.00 H new ATOM 0 HB1 ALA B 144 -3.963 -4.897 -4.661 1.00 0.00 H new ATOM 0 HB2 ALA B 144 -3.747 -5.768 -6.198 1.00 0.00 H new ATOM 0 HB3 ALA B 144 -2.734 -4.353 -5.828 1.00 0.00 H new ATOM 2201 N LEU B 145 -3.898 -1.592 -5.851 1.00 0.00 N ATOM 2202 CA LEU B 145 -3.925 -0.232 -5.281 1.00 0.00 C ATOM 2203 C LEU B 145 -5.176 0.563 -5.705 1.00 0.00 C ATOM 2204 O LEU B 145 -5.824 1.208 -4.883 1.00 0.00 O ATOM 2205 CB LEU B 145 -2.665 0.574 -5.668 1.00 0.00 C ATOM 2206 CG LEU B 145 -1.305 0.033 -5.199 1.00 0.00 C ATOM 2207 CD1 LEU B 145 -0.198 1.011 -5.548 1.00 0.00 C ATOM 2208 CD2 LEU B 145 -1.233 -0.200 -3.698 1.00 0.00 C ATOM 0 H LEU B 145 -3.050 -1.787 -6.384 1.00 0.00 H new ATOM 0 HA LEU B 145 -3.952 -0.369 -4.200 1.00 0.00 H new ATOM 0 HB2 LEU B 145 -2.638 0.655 -6.755 1.00 0.00 H new ATOM 0 HB3 LEU B 145 -2.778 1.585 -5.276 1.00 0.00 H new ATOM 0 HG LEU B 145 -1.183 -0.922 -5.711 1.00 0.00 H new ATOM 0 HD11 LEU B 145 0.759 0.614 -5.209 1.00 0.00 H new ATOM 0 HD12 LEU B 145 -0.169 1.157 -6.628 1.00 0.00 H new ATOM 0 HD13 LEU B 145 -0.388 1.966 -5.058 1.00 0.00 H new ATOM 0 HD21 LEU B 145 -0.246 -0.582 -3.436 1.00 0.00 H new ATOM 0 HD22 LEU B 145 -1.409 0.740 -3.175 1.00 0.00 H new ATOM 0 HD23 LEU B 145 -1.992 -0.926 -3.406 1.00 0.00 H new ATOM 2220 N ASP B 146 -5.501 0.551 -6.998 1.00 0.00 N ATOM 2221 CA ASP B 146 -6.629 1.274 -7.598 1.00 0.00 C ATOM 2222 C ASP B 146 -8.018 0.851 -7.076 1.00 0.00 C ATOM 2223 O ASP B 146 -8.942 1.667 -7.083 1.00 0.00 O ATOM 2224 CB ASP B 146 -6.549 1.120 -9.123 1.00 0.00 C ATOM 2225 CG ASP B 146 -7.447 2.125 -9.858 1.00 0.00 C ATOM 2226 OD1 ASP B 146 -7.100 3.331 -9.877 1.00 0.00 O ATOM 2227 OD2 ASP B 146 -8.461 1.715 -10.468 1.00 0.00 O ATOM 0 H ASP B 146 -4.967 0.018 -7.685 1.00 0.00 H new ATOM 0 HA ASP B 146 -6.533 2.318 -7.301 1.00 0.00 H new ATOM 0 HB2 ASP B 146 -5.517 1.255 -9.446 1.00 0.00 H new ATOM 0 HB3 ASP B 146 -6.840 0.106 -9.399 1.00 0.00 H new ATOM 2232 N GLN B 147 -8.186 -0.401 -6.623 1.00 0.00 N ATOM 2233 CA GLN B 147 -9.463 -0.957 -6.139 1.00 0.00 C ATOM 2234 C GLN B 147 -10.103 -0.201 -4.948 1.00 0.00 C ATOM 2235 O GLN B 147 -11.286 -0.406 -4.664 1.00 0.00 O ATOM 2236 CB GLN B 147 -9.325 -2.470 -5.867 1.00 0.00 C ATOM 2237 CG GLN B 147 -8.893 -2.824 -4.434 1.00 0.00 C ATOM 2238 CD GLN B 147 -8.349 -4.247 -4.282 1.00 0.00 C ATOM 2239 OE1 GLN B 147 -8.532 -5.127 -5.114 1.00 0.00 O ATOM 2240 NE2 GLN B 147 -7.659 -4.540 -3.202 1.00 0.00 N ATOM 0 H GLN B 147 -7.420 -1.073 -6.581 1.00 0.00 H new ATOM 0 HA GLN B 147 -10.176 -0.806 -6.950 1.00 0.00 H new ATOM 0 HB2 GLN B 147 -10.280 -2.952 -6.074 1.00 0.00 H new ATOM 0 HB3 GLN B 147 -8.599 -2.887 -6.565 1.00 0.00 H new ATOM 0 HG2 GLN B 147 -8.129 -2.117 -4.111 1.00 0.00 H new ATOM 0 HG3 GLN B 147 -9.746 -2.699 -3.767 1.00 0.00 H new ATOM 0 HE21 GLN B 147 -7.492 -3.825 -2.494 1.00 0.00 H new ATOM 0 HE22 GLN B 147 -7.290 -5.482 -3.072 1.00 0.00 H new ATOM 2249 N VAL B 148 -9.353 0.669 -4.254 1.00 0.00 N ATOM 2250 CA VAL B 148 -9.846 1.508 -3.141 1.00 0.00 C ATOM 2251 C VAL B 148 -11.005 2.406 -3.602 1.00 0.00 C ATOM 2252 O VAL B 148 -12.055 2.442 -2.958 1.00 0.00 O ATOM 2253 CB VAL B 148 -8.726 2.400 -2.556 1.00 0.00 C ATOM 2254 CG1 VAL B 148 -9.254 3.277 -1.414 1.00 0.00 C ATOM 2255 CG2 VAL B 148 -7.550 1.606 -1.984 1.00 0.00 C ATOM 0 H VAL B 148 -8.363 0.815 -4.453 1.00 0.00 H new ATOM 0 HA VAL B 148 -10.195 0.826 -2.366 1.00 0.00 H new ATOM 0 HB VAL B 148 -8.384 2.998 -3.401 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -8.444 3.892 -1.023 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -10.051 3.920 -1.788 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -9.644 2.642 -0.618 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -6.802 2.295 -1.591 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -7.904 0.959 -1.182 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -7.105 0.998 -2.771 1.00 0.00 H new ATOM 2265 N ASN B 149 -10.781 3.138 -4.705 1.00 0.00 N ATOM 2266 CA ASN B 149 -11.664 4.114 -5.363 1.00 0.00 C ATOM 2267 C ASN B 149 -12.511 4.995 -4.409 1.00 0.00 C ATOM 2268 O ASN B 149 -13.762 4.922 -4.417 1.00 0.00 O ATOM 2269 CB ASN B 149 -12.420 3.435 -6.532 1.00 0.00 C ATOM 2270 CG ASN B 149 -13.299 2.227 -6.212 1.00 0.00 C ATOM 2271 OD1 ASN B 149 -13.177 1.166 -6.810 1.00 0.00 O ATOM 2272 ND2 ASN B 149 -14.239 2.358 -5.308 1.00 0.00 N ATOM 2273 OXT ASN B 149 -11.895 5.826 -3.702 1.00 0.00 O ATOM 0 H ASN B 149 -9.896 3.054 -5.205 1.00 0.00 H new ATOM 0 HA ASN B 149 -11.036 4.886 -5.808 1.00 0.00 H new ATOM 0 HB2 ASN B 149 -13.048 4.189 -7.006 1.00 0.00 H new ATOM 0 HB3 ASN B 149 -11.682 3.124 -7.271 1.00 0.00 H new ATOM 0 HD21 ASN B 149 -14.864 1.578 -5.106 1.00 0.00 H new ATOM 0 HD22 ASN B 149 -14.345 3.240 -4.807 1.00 0.00 H new TER 2280 ASN B 149 HETATM 2281 ZN ZN A 96 -0.485 12.089 -1.941 1.00 0.00 ZN HETATM 2282 ZN ZN A 97 12.962 -4.112 -5.720 1.00 0.00 ZN HETATM 2283 ZN ZN A 98 -6.345 -8.665 6.100 1.00 0.00 ZN