USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1367 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 50 ASN : amide:sc= 0.574 K(o=0.98,f=-1.5) USER MOD Set 1.2: B 53 ASN : amide:sc= 0.411 K(o=0.98,f=-1.1) USER MOD Set 2.1: B 47 THR OG1 : rot -120:sc= 0.748 USER MOD Set 2.2: B 49 SER OG : rot 180:sc= 0.623 USER MOD Set 3.1: B 35 CYS SG : rot 180:sc= -0.207 USER MOD Set 3.2: B 39 GLN :FLIP amide:sc= -1.84 X(o=-3.1,f=-2.7) USER MOD Set 3.3: B 43 HIS :FLIP no HD1:sc= -0.667 F(o=-6.9!,f=-2.7) USER MOD Set 4.1: A 102 CYS SG : rot 88:sc= 0.221 USER MOD Set 4.2: B 57 CYS SG : rot 180:sc= 0.189 USER MOD Set 4.3: B 61 CYS SG : rot 108:sc= 0.436 USER MOD Set 5.1: A 98 THR OG1 : rot 164:sc= 1.45 USER MOD Set 5.2: A 100 GLN : amide:sc= 0.269 K(o=1.7,f=-0.024!) USER MOD Set 6.1: A 81 HIS : no HE2:sc= -1.03 K(o=-1.3,f=-4.2) USER MOD Set 6.2: B 91 GLN : amide:sc= -0.286 K(o=-1.3,f=-5.6!) USER MOD Set 7.1: A 57 CYS SG : rot 180:sc= 0.361 USER MOD Set 7.2: A 61 CYS SG : rot 114:sc= 0.39 USER MOD Set 8.1: A 50 ASN : amide:sc= 0.313 K(o=0.6,f=-1.2) USER MOD Set 8.2: A 53 ASN : amide:sc= 0.29 K(o=0.6,f=-1.1) USER MOD Set 9.1: A 47 THR OG1 : rot -117:sc= 0.741 USER MOD Set 9.2: A 49 SER OG : rot 180:sc= 0.646 USER MOD Set10.1: A 35 CYS SG : rot -27:sc= 0.693 USER MOD Set10.2: A 39 GLN : amide:sc= -1.45 K(o=-1.7,f=-4.7!) USER MOD Set10.3: A 43 HIS :FLIP no HD1:sc= -0.958 F(o=-4.1,f=-1.7) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot 86:sc= -0.807 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -73:sc= 1.02 USER MOD Single : A 54 HIS : no HD1:sc= -0.0368 X(o=-0.037,f=-0.049) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.192 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.81 K(o=-0.81,f=-1.6) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.0518 K(o=-0.052,f=-3.1!) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.109 USER MOD Single : B 24 CYS SG : rot 123:sc= -0.534 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot -78:sc= 0.155 USER MOD Single : B 54 HIS : no HD1:sc= 0 X(o=0,f=-0.078) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 75:sc= 0.347 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= -0.87 X(o=-0.87,f=-1.2) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 81 HIS : no HD1:sc= -0.79 X(o=-0.79,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 5.770 -0.807 -8.601 1.00 0.00 N ATOM 12 CA LEU A 11 4.646 -1.174 -7.721 1.00 0.00 C ATOM 13 C LEU A 11 5.087 -2.191 -6.664 1.00 0.00 C ATOM 14 O LEU A 11 4.863 -1.983 -5.472 1.00 0.00 O ATOM 15 CB LEU A 11 3.494 -1.679 -8.599 1.00 0.00 C ATOM 16 CG LEU A 11 2.340 -2.425 -7.903 1.00 0.00 C ATOM 17 CD1 LEU A 11 1.588 -1.526 -6.912 1.00 0.00 C ATOM 18 CD2 LEU A 11 1.396 -2.940 -8.995 1.00 0.00 C ATOM 0 HA LEU A 11 4.297 -0.306 -7.162 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.072 -0.822 -9.124 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.914 -2.341 -9.356 1.00 0.00 H new ATOM 0 HG LEU A 11 2.742 -3.252 -7.318 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.783 -2.093 -6.445 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.277 -1.174 -6.144 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.169 -0.671 -7.442 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.565 -3.475 -8.535 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.011 -2.098 -9.570 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.939 -3.614 -9.657 1.00 0.00 H new ATOM 30 N ALA A 12 5.853 -3.197 -7.091 1.00 0.00 N ATOM 31 CA ALA A 12 6.377 -4.266 -6.249 1.00 0.00 C ATOM 32 C ALA A 12 7.449 -3.860 -5.225 1.00 0.00 C ATOM 33 O ALA A 12 7.870 -4.715 -4.443 1.00 0.00 O ATOM 34 CB ALA A 12 6.840 -5.395 -7.181 1.00 0.00 C ATOM 0 H ALA A 12 6.133 -3.290 -8.067 1.00 0.00 H new ATOM 0 HA ALA A 12 5.570 -4.597 -5.595 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.240 -6.216 -6.587 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.994 -5.751 -7.769 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.615 -5.020 -7.850 1.00 0.00 H new ATOM 40 N ARG A 13 7.887 -2.594 -5.209 1.00 0.00 N ATOM 41 CA ARG A 13 8.889 -2.056 -4.270 1.00 0.00 C ATOM 42 C ARG A 13 8.346 -0.842 -3.515 1.00 0.00 C ATOM 43 O ARG A 13 8.519 -0.771 -2.299 1.00 0.00 O ATOM 44 CB ARG A 13 10.195 -1.735 -5.006 1.00 0.00 C ATOM 45 CG ARG A 13 10.646 -2.966 -5.806 1.00 0.00 C ATOM 46 CD ARG A 13 11.960 -2.739 -6.525 1.00 0.00 C ATOM 47 NE ARG A 13 12.157 -3.778 -7.538 1.00 0.00 N ATOM 48 CZ ARG A 13 12.942 -4.835 -7.479 1.00 0.00 C ATOM 49 NH1 ARG A 13 13.625 -5.166 -6.410 1.00 0.00 N ATOM 50 NH2 ARG A 13 13.064 -5.593 -8.537 1.00 0.00 N ATOM 0 H ARG A 13 7.546 -1.893 -5.867 1.00 0.00 H new ATOM 0 HA ARG A 13 9.108 -2.820 -3.524 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.049 -0.887 -5.675 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.967 -1.449 -4.292 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.746 -3.817 -5.132 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.877 -3.225 -6.534 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.963 -1.755 -6.994 1.00 0.00 H new ATOM 0 HD3 ARG A 13 12.783 -2.754 -5.811 1.00 0.00 H new ATOM 0 HE ARG A 13 11.619 -3.670 -8.398 1.00 0.00 H new ATOM 0 HH11 ARG A 13 13.564 -4.594 -5.568 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.218 -5.996 -6.420 1.00 0.00 H new ATOM 0 HH21 ARG A 13 12.556 -5.363 -9.391 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.667 -6.415 -8.509 1.00 0.00 H new ATOM 64 N LEU A 14 7.579 0.018 -4.190 1.00 0.00 N ATOM 65 CA LEU A 14 6.754 1.073 -3.601 1.00 0.00 C ATOM 66 C LEU A 14 5.896 0.442 -2.501 1.00 0.00 C ATOM 67 O LEU A 14 6.018 0.800 -1.329 1.00 0.00 O ATOM 68 CB LEU A 14 5.895 1.683 -4.738 1.00 0.00 C ATOM 69 CG LEU A 14 4.979 2.878 -4.401 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.930 2.562 -3.324 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.802 4.113 -4.020 1.00 0.00 C ATOM 0 H LEU A 14 7.514 -0.004 -5.208 1.00 0.00 H new ATOM 0 HA LEU A 14 7.347 1.869 -3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.571 1.996 -5.534 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.269 0.889 -5.145 1.00 0.00 H new ATOM 0 HG LEU A 14 4.421 3.095 -5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.322 3.447 -3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.291 1.748 -3.666 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.432 2.266 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.131 4.940 -3.788 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.415 3.887 -3.148 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.446 4.392 -4.854 1.00 0.00 H new ATOM 83 N GLY A 15 5.088 -0.557 -2.863 1.00 0.00 N ATOM 84 CA GLY A 15 4.190 -1.236 -1.945 1.00 0.00 C ATOM 85 C GLY A 15 4.954 -2.095 -0.944 1.00 0.00 C ATOM 86 O GLY A 15 4.454 -2.294 0.149 1.00 0.00 O ATOM 0 H GLY A 15 5.043 -0.917 -3.816 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.591 -0.499 -1.410 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.498 -1.862 -2.508 1.00 0.00 H new ATOM 90 N ARG A 16 6.195 -2.518 -1.245 1.00 0.00 N ATOM 91 CA ARG A 16 7.069 -3.194 -0.273 1.00 0.00 C ATOM 92 C ARG A 16 7.527 -2.242 0.833 1.00 0.00 C ATOM 93 O ARG A 16 7.575 -2.636 1.992 1.00 0.00 O ATOM 94 CB ARG A 16 8.310 -3.820 -0.932 1.00 0.00 C ATOM 95 CG ARG A 16 8.861 -4.969 -0.063 1.00 0.00 C ATOM 96 CD ARG A 16 10.367 -5.258 -0.206 1.00 0.00 C ATOM 97 NE ARG A 16 10.898 -5.369 -1.577 1.00 0.00 N ATOM 98 CZ ARG A 16 10.399 -5.957 -2.659 1.00 0.00 C ATOM 99 NH1 ARG A 16 9.213 -6.525 -2.702 1.00 0.00 N ATOM 100 NH2 ARG A 16 11.103 -5.957 -3.761 1.00 0.00 N ATOM 0 H ARG A 16 6.618 -2.401 -2.166 1.00 0.00 H new ATOM 0 HA ARG A 16 6.464 -3.991 0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.053 -4.196 -1.922 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.079 -3.059 -1.070 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.652 -4.740 0.982 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.312 -5.878 -0.306 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.914 -4.467 0.307 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.585 -6.188 0.319 1.00 0.00 H new ATOM 0 HE ARG A 16 11.802 -4.918 -1.719 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.620 -6.530 -1.872 1.00 0.00 H new ATOM 0 HH12 ARG A 16 8.887 -6.960 -3.565 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.020 -5.510 -3.781 1.00 0.00 H new ATOM 0 HH22 ARG A 16 10.735 -6.404 -4.601 1.00 0.00 H new ATOM 114 N ALA A 17 7.843 -0.986 0.520 1.00 0.00 N ATOM 115 CA ALA A 17 8.199 0.011 1.523 1.00 0.00 C ATOM 116 C ALA A 17 7.004 0.361 2.424 1.00 0.00 C ATOM 117 O ALA A 17 7.193 0.554 3.623 1.00 0.00 O ATOM 118 CB ALA A 17 8.771 1.225 0.785 1.00 0.00 C ATOM 0 H ALA A 17 7.859 -0.633 -0.437 1.00 0.00 H new ATOM 0 HA ALA A 17 8.955 -0.382 2.203 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.049 1.992 1.508 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.652 0.924 0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.020 1.623 0.103 1.00 0.00 H new ATOM 124 N LEU A 18 5.783 0.380 1.871 1.00 0.00 N ATOM 125 CA LEU A 18 4.545 0.520 2.645 1.00 0.00 C ATOM 126 C LEU A 18 4.012 -0.861 3.131 1.00 0.00 C ATOM 127 O LEU A 18 2.907 -0.949 3.652 1.00 0.00 O ATOM 128 CB LEU A 18 3.549 1.471 1.912 1.00 0.00 C ATOM 129 CG LEU A 18 3.989 2.972 1.917 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.127 3.282 0.931 1.00 0.00 C ATOM 131 CD2 LEU A 18 2.859 3.979 1.601 1.00 0.00 C ATOM 0 H LEU A 18 5.627 0.298 0.866 1.00 0.00 H new ATOM 0 HA LEU A 18 4.733 1.032 3.589 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.437 1.139 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.569 1.388 2.382 1.00 0.00 H new ATOM 0 HG LEU A 18 4.319 3.102 2.948 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.380 4.341 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.003 2.685 1.187 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.806 3.040 -0.082 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.258 4.993 1.627 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.455 3.773 0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.067 3.881 2.343 1.00 0.00 H new ATOM 143 N ALA A 19 4.806 -1.939 2.994 1.00 0.00 N ATOM 144 CA ALA A 19 4.602 -3.256 3.629 1.00 0.00 C ATOM 145 C ALA A 19 5.664 -3.594 4.709 1.00 0.00 C ATOM 146 O ALA A 19 5.691 -4.706 5.233 1.00 0.00 O ATOM 147 CB ALA A 19 4.614 -4.343 2.545 1.00 0.00 C ATOM 0 H ALA A 19 5.644 -1.916 2.413 1.00 0.00 H new ATOM 0 HA ALA A 19 3.640 -3.217 4.139 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.464 -5.319 3.007 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.814 -4.153 1.830 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.573 -4.330 2.027 1.00 0.00 H new ATOM 153 N ASP A 20 6.598 -2.680 4.986 1.00 0.00 N ATOM 154 CA ASP A 20 7.765 -2.875 5.842 1.00 0.00 C ATOM 155 C ASP A 20 7.549 -2.168 7.191 1.00 0.00 C ATOM 156 O ASP A 20 7.104 -1.013 7.202 1.00 0.00 O ATOM 157 CB ASP A 20 9.009 -2.339 5.117 1.00 0.00 C ATOM 158 CG ASP A 20 10.274 -2.280 5.983 1.00 0.00 C ATOM 159 OD1 ASP A 20 10.511 -1.241 6.641 1.00 0.00 O ATOM 160 OD2 ASP A 20 11.108 -3.196 5.849 1.00 0.00 O ATOM 0 H ASP A 20 6.556 -1.737 4.598 1.00 0.00 H new ATOM 0 HA ASP A 20 7.911 -3.936 6.046 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.207 -2.968 4.249 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.793 -1.338 4.743 1.00 0.00 H new ATOM 165 N PRO A 21 7.897 -2.827 8.313 1.00 0.00 N ATOM 166 CA PRO A 21 7.618 -2.377 9.677 1.00 0.00 C ATOM 167 C PRO A 21 8.180 -0.978 9.923 1.00 0.00 C ATOM 168 O PRO A 21 7.436 -0.022 10.156 1.00 0.00 O ATOM 169 CB PRO A 21 8.286 -3.430 10.583 1.00 0.00 C ATOM 170 CG PRO A 21 9.400 -3.993 9.690 1.00 0.00 C ATOM 171 CD PRO A 21 8.678 -4.056 8.360 1.00 0.00 C ATOM 0 HA PRO A 21 6.549 -2.296 9.875 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.685 -2.984 11.494 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.583 -4.205 10.889 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.274 -3.343 9.657 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.744 -4.973 10.023 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.381 -4.112 7.529 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.038 -4.936 8.297 1.00 0.00 H new ATOM 179 N THR A 22 9.508 -0.862 9.834 1.00 0.00 N ATOM 180 CA THR A 22 10.250 0.348 10.135 1.00 0.00 C ATOM 181 C THR A 22 9.840 1.451 9.185 1.00 0.00 C ATOM 182 O THR A 22 9.621 2.557 9.662 1.00 0.00 O ATOM 183 CB THR A 22 11.750 0.054 10.056 1.00 0.00 C ATOM 184 OG1 THR A 22 12.042 -0.973 10.972 1.00 0.00 O ATOM 185 CG2 THR A 22 12.612 1.268 10.408 1.00 0.00 C ATOM 0 H THR A 22 10.106 -1.634 9.541 1.00 0.00 H new ATOM 0 HA THR A 22 10.025 0.686 11.146 1.00 0.00 H new ATOM 0 HB THR A 22 11.980 -0.227 9.028 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.999 -1.180 10.937 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.666 0.999 10.335 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.396 2.081 9.715 1.00 0.00 H new ATOM 0 HG23 THR A 22 12.389 1.590 11.425 1.00 0.00 H new ATOM 193 N ARG A 23 9.707 1.181 7.880 1.00 0.00 N ATOM 194 CA ARG A 23 9.400 2.199 6.869 1.00 0.00 C ATOM 195 C ARG A 23 7.991 2.751 7.009 1.00 0.00 C ATOM 196 O ARG A 23 7.856 3.966 6.925 1.00 0.00 O ATOM 197 CB ARG A 23 9.670 1.685 5.453 1.00 0.00 C ATOM 198 CG ARG A 23 11.171 1.789 5.142 1.00 0.00 C ATOM 199 CD ARG A 23 11.560 0.994 3.896 1.00 0.00 C ATOM 200 NE ARG A 23 11.914 -0.396 4.213 1.00 0.00 N ATOM 201 CZ ARG A 23 12.639 -1.198 3.444 1.00 0.00 C ATOM 202 NH1 ARG A 23 13.230 -0.762 2.352 1.00 0.00 N ATOM 203 NH2 ARG A 23 12.791 -2.457 3.766 1.00 0.00 N ATOM 0 H ARG A 23 9.810 0.243 7.494 1.00 0.00 H new ATOM 0 HA ARG A 23 10.078 3.033 7.049 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.341 0.650 5.363 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.098 2.266 4.730 1.00 0.00 H new ATOM 0 HG2 ARG A 23 11.439 2.836 5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.743 1.426 5.996 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.732 1.004 3.188 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.404 1.479 3.406 1.00 0.00 H new ATOM 0 HE ARG A 23 11.575 -0.776 5.097 1.00 0.00 H new ATOM 0 HH11 ARG A 23 13.137 0.216 2.077 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.781 -1.402 1.780 1.00 0.00 H new ATOM 0 HH21 ARG A 23 12.352 -2.824 4.610 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.349 -3.071 3.173 1.00 0.00 H new ATOM 217 N CYS A 24 6.984 1.944 7.339 1.00 0.00 N ATOM 218 CA CYS A 24 5.662 2.470 7.687 1.00 0.00 C ATOM 219 C CYS A 24 5.750 3.439 8.875 1.00 0.00 C ATOM 220 O CYS A 24 5.327 4.597 8.766 1.00 0.00 O ATOM 221 CB CYS A 24 4.728 1.281 7.930 1.00 0.00 C ATOM 222 SG CYS A 24 4.432 0.514 6.320 1.00 0.00 S ATOM 0 H CYS A 24 7.056 0.927 7.373 1.00 0.00 H new ATOM 0 HA CYS A 24 5.251 3.063 6.870 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.180 0.569 8.620 1.00 0.00 H new ATOM 0 HB3 CYS A 24 3.791 1.610 8.380 1.00 0.00 H new ATOM 0 HG CYS A 24 5.377 -0.342 6.067 1.00 0.00 H new ATOM 228 N ARG A 25 6.421 3.012 9.958 1.00 0.00 N ATOM 229 CA ARG A 25 6.635 3.860 11.137 1.00 0.00 C ATOM 230 C ARG A 25 7.477 5.118 10.810 1.00 0.00 C ATOM 231 O ARG A 25 7.132 6.198 11.280 1.00 0.00 O ATOM 232 CB ARG A 25 7.170 3.035 12.331 1.00 0.00 C ATOM 233 CG ARG A 25 6.649 3.631 13.655 1.00 0.00 C ATOM 234 CD ARG A 25 7.355 3.171 14.942 1.00 0.00 C ATOM 235 NE ARG A 25 7.072 1.785 15.357 1.00 0.00 N ATOM 236 CZ ARG A 25 7.507 1.239 16.492 1.00 0.00 C ATOM 237 NH1 ARG A 25 8.131 1.942 17.416 1.00 0.00 N ATOM 238 NH2 ARG A 25 7.339 -0.041 16.712 1.00 0.00 N ATOM 0 H ARG A 25 6.825 2.079 10.039 1.00 0.00 H new ATOM 0 HA ARG A 25 5.667 4.249 11.452 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.851 1.997 12.239 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.260 3.036 12.326 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.726 4.717 13.594 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.589 3.391 13.743 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.431 3.279 14.805 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.069 3.841 15.753 1.00 0.00 H new ATOM 0 HE ARG A 25 6.507 1.207 14.735 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.295 2.939 17.274 1.00 0.00 H new ATOM 0 HH12 ARG A 25 8.450 1.489 18.273 1.00 0.00 H new ATOM 0 HH21 ARG A 25 6.875 -0.622 16.014 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.673 -0.457 17.581 1.00 0.00 H new ATOM 252 N ILE A 26 8.499 5.036 9.932 1.00 0.00 N ATOM 253 CA ILE A 26 9.241 6.201 9.370 1.00 0.00 C ATOM 254 C ILE A 26 8.269 7.183 8.741 1.00 0.00 C ATOM 255 O ILE A 26 8.218 8.339 9.138 1.00 0.00 O ATOM 256 CB ILE A 26 10.320 5.848 8.285 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.425 4.910 8.809 1.00 0.00 C ATOM 258 CG2 ILE A 26 10.911 7.140 7.680 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.864 5.076 8.305 1.00 0.00 C ATOM 0 H ILE A 26 8.844 4.142 9.582 1.00 0.00 H new ATOM 0 HA ILE A 26 9.770 6.623 10.225 1.00 0.00 H new ATOM 0 HB ILE A 26 9.812 5.290 7.498 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.447 5.007 9.894 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.118 3.888 8.586 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.658 6.882 6.929 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.115 7.721 7.215 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.378 7.730 8.468 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.504 4.332 8.780 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.889 4.939 7.224 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.223 6.075 8.552 1.00 0.00 H new ATOM 271 N LEU A 27 7.552 6.718 7.720 1.00 0.00 N ATOM 272 CA LEU A 27 6.738 7.562 6.846 1.00 0.00 C ATOM 273 C LEU A 27 5.710 8.382 7.650 1.00 0.00 C ATOM 274 O LEU A 27 5.589 9.581 7.409 1.00 0.00 O ATOM 275 CB LEU A 27 6.113 6.695 5.728 1.00 0.00 C ATOM 276 CG LEU A 27 7.086 6.126 4.662 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.328 5.156 3.746 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.720 7.199 3.773 1.00 0.00 C ATOM 0 H LEU A 27 7.519 5.729 7.472 1.00 0.00 H new ATOM 0 HA LEU A 27 7.369 8.305 6.359 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.594 5.859 6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.358 7.292 5.216 1.00 0.00 H new ATOM 0 HG LEU A 27 7.885 5.634 5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.010 4.755 2.996 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.920 4.338 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.514 5.685 3.250 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.388 6.727 3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.937 7.740 3.242 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.287 7.895 4.391 1.00 0.00 H new ATOM 290 N VAL A 28 5.059 7.795 8.664 1.00 0.00 N ATOM 291 CA VAL A 28 4.127 8.526 9.552 1.00 0.00 C ATOM 292 C VAL A 28 4.832 9.390 10.611 1.00 0.00 C ATOM 293 O VAL A 28 4.330 10.457 10.948 1.00 0.00 O ATOM 294 CB VAL A 28 3.081 7.588 10.197 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.669 6.650 11.263 1.00 0.00 C ATOM 296 CG2 VAL A 28 1.890 8.365 10.779 1.00 0.00 C ATOM 0 H VAL A 28 5.158 6.807 8.896 1.00 0.00 H new ATOM 0 HA VAL A 28 3.597 9.220 8.900 1.00 0.00 H new ATOM 0 HB VAL A 28 2.726 6.961 9.379 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.877 6.022 11.671 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.435 6.020 10.811 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.112 7.242 12.064 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.181 7.666 11.222 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.245 9.055 11.544 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.398 8.926 9.984 1.00 0.00 H new ATOM 306 N ALA A 29 6.006 8.985 11.111 1.00 0.00 N ATOM 307 CA ALA A 29 6.793 9.810 12.028 1.00 0.00 C ATOM 308 C ALA A 29 7.379 11.057 11.343 1.00 0.00 C ATOM 309 O ALA A 29 7.511 12.108 11.971 1.00 0.00 O ATOM 310 CB ALA A 29 7.878 8.914 12.632 1.00 0.00 C ATOM 0 H ALA A 29 6.432 8.084 10.892 1.00 0.00 H new ATOM 0 HA ALA A 29 6.151 10.204 12.816 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.487 9.496 13.323 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.411 8.087 13.167 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.509 8.520 11.836 1.00 0.00 H new ATOM 316 N LEU A 30 7.678 10.988 10.040 1.00 0.00 N ATOM 317 CA LEU A 30 8.187 12.120 9.290 1.00 0.00 C ATOM 318 C LEU A 30 7.178 13.252 9.202 1.00 0.00 C ATOM 319 O LEU A 30 7.573 14.393 9.414 1.00 0.00 O ATOM 320 CB LEU A 30 8.599 11.636 7.904 1.00 0.00 C ATOM 321 CG LEU A 30 9.853 12.360 7.404 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.063 12.362 8.355 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.213 11.603 6.149 1.00 0.00 C ATOM 0 H LEU A 30 7.570 10.140 9.484 1.00 0.00 H new ATOM 0 HA LEU A 30 9.052 12.529 9.812 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.785 10.562 7.933 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.780 11.798 7.203 1.00 0.00 H new ATOM 0 HG LEU A 30 9.628 13.420 7.281 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.888 12.903 7.893 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.789 12.849 9.291 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.370 11.335 8.556 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.106 12.041 5.703 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.406 10.559 6.396 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.388 11.661 5.439 1.00 0.00 H new ATOM 335 N LEU A 31 5.918 12.890 8.938 1.00 0.00 N ATOM 336 CA LEU A 31 4.711 13.720 8.893 1.00 0.00 C ATOM 337 C LEU A 31 4.595 14.717 10.061 1.00 0.00 C ATOM 338 O LEU A 31 4.120 15.828 9.855 1.00 0.00 O ATOM 339 CB LEU A 31 3.519 12.730 8.878 1.00 0.00 C ATOM 340 CG LEU A 31 2.456 12.962 7.792 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.509 11.755 7.786 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.676 14.266 7.999 1.00 0.00 C ATOM 0 H LEU A 31 5.698 11.916 8.731 1.00 0.00 H new ATOM 0 HA LEU A 31 4.735 14.354 8.007 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.914 11.721 8.761 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.029 12.770 9.851 1.00 0.00 H new ATOM 0 HG LEU A 31 2.956 13.062 6.829 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.744 11.896 7.022 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.075 10.849 7.569 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.034 11.661 8.762 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.939 14.379 7.204 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.168 14.237 8.963 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.366 15.110 7.977 1.00 0.00 H new ATOM 354 N ASP A 32 5.039 14.307 11.251 1.00 0.00 N ATOM 355 CA ASP A 32 5.087 15.106 12.485 1.00 0.00 C ATOM 356 C ASP A 32 6.424 15.853 12.659 1.00 0.00 C ATOM 357 O ASP A 32 6.461 17.019 13.050 1.00 0.00 O ATOM 358 CB ASP A 32 4.891 14.116 13.649 1.00 0.00 C ATOM 359 CG ASP A 32 5.136 14.740 15.028 1.00 0.00 C ATOM 360 OD1 ASP A 32 6.305 14.697 15.486 1.00 0.00 O ATOM 361 OD2 ASP A 32 4.142 15.204 15.628 1.00 0.00 O ATOM 0 H ASP A 32 5.394 13.361 11.391 1.00 0.00 H new ATOM 0 HA ASP A 32 4.313 15.873 12.453 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.876 13.721 13.613 1.00 0.00 H new ATOM 0 HB3 ASP A 32 5.567 13.271 13.515 1.00 0.00 H new ATOM 366 N GLY A 33 7.529 15.174 12.336 1.00 0.00 N ATOM 367 CA GLY A 33 8.878 15.612 12.661 1.00 0.00 C ATOM 368 C GLY A 33 9.458 16.526 11.606 1.00 0.00 C ATOM 369 O GLY A 33 9.739 17.692 11.866 1.00 0.00 O ATOM 0 H GLY A 33 7.504 14.288 11.831 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.868 16.130 13.620 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.522 14.740 12.776 1.00 0.00 H new ATOM 373 N VAL A 34 9.750 15.941 10.444 1.00 0.00 N ATOM 374 CA VAL A 34 10.555 16.542 9.364 1.00 0.00 C ATOM 375 C VAL A 34 11.756 17.390 9.848 1.00 0.00 C ATOM 376 O VAL A 34 12.091 18.392 9.220 1.00 0.00 O ATOM 377 CB VAL A 34 9.697 17.298 8.316 1.00 0.00 C ATOM 378 CG1 VAL A 34 8.827 16.398 7.444 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.781 18.371 8.921 1.00 0.00 C ATOM 0 H VAL A 34 9.424 15.002 10.214 1.00 0.00 H new ATOM 0 HA VAL A 34 10.997 15.683 8.859 1.00 0.00 H new ATOM 0 HB VAL A 34 10.460 17.769 7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.262 17.009 6.741 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.460 15.703 6.893 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.136 15.838 8.075 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.214 18.855 8.126 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.093 17.906 9.627 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.385 19.115 9.440 1.00 0.00 H new ATOM 389 N CYS A 35 12.398 17.031 10.974 1.00 0.00 N ATOM 390 CA CYS A 35 13.420 17.880 11.597 1.00 0.00 C ATOM 391 C CYS A 35 14.797 17.683 10.965 1.00 0.00 C ATOM 392 O CYS A 35 15.340 18.597 10.360 1.00 0.00 O ATOM 393 CB CYS A 35 13.479 17.686 13.133 1.00 0.00 C ATOM 394 SG CYS A 35 11.936 17.117 13.897 1.00 0.00 S ATOM 0 H CYS A 35 12.224 16.156 11.469 1.00 0.00 H new ATOM 0 HA CYS A 35 13.119 18.910 11.407 1.00 0.00 H new ATOM 0 HB2 CYS A 35 14.266 16.968 13.363 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.766 18.632 13.592 1.00 0.00 H new ATOM 0 HG CYS A 35 10.926 17.502 13.174 1.00 0.00 H new ATOM 400 N TYR A 36 15.357 16.482 11.102 1.00 0.00 N ATOM 401 CA TYR A 36 16.759 16.213 10.740 1.00 0.00 C ATOM 402 C TYR A 36 17.043 14.732 10.440 1.00 0.00 C ATOM 403 O TYR A 36 16.306 13.867 10.933 1.00 0.00 O ATOM 404 CB TYR A 36 17.716 16.804 11.803 1.00 0.00 C ATOM 405 CG TYR A 36 17.475 16.420 13.247 1.00 0.00 C ATOM 406 CD1 TYR A 36 18.046 15.251 13.784 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.708 17.267 14.071 1.00 0.00 C ATOM 408 CE1 TYR A 36 17.813 14.903 15.128 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.454 16.917 15.410 1.00 0.00 C ATOM 410 CZ TYR A 36 17.001 15.724 15.939 1.00 0.00 C ATOM 411 OH TYR A 36 16.744 15.357 17.224 1.00 0.00 O ATOM 0 H TYR A 36 14.860 15.668 11.464 1.00 0.00 H new ATOM 0 HA TYR A 36 16.950 16.723 9.796 1.00 0.00 H new ATOM 0 HB2 TYR A 36 18.733 16.510 11.541 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.670 17.891 11.731 1.00 0.00 H new ATOM 0 HD1 TYR A 36 18.664 14.619 13.163 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.313 18.190 13.673 1.00 0.00 H new ATOM 0 HE1 TYR A 36 18.256 14.008 15.538 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.844 17.556 16.031 1.00 0.00 H new ATOM 0 HH TYR A 36 16.171 16.029 17.648 1.00 0.00 H new ATOM 421 N PRO A 37 18.103 14.395 9.671 1.00 0.00 N ATOM 422 CA PRO A 37 18.531 13.013 9.500 1.00 0.00 C ATOM 423 C PRO A 37 18.869 12.436 10.874 1.00 0.00 C ATOM 424 O PRO A 37 19.719 12.963 11.586 1.00 0.00 O ATOM 425 CB PRO A 37 19.741 13.052 8.558 1.00 0.00 C ATOM 426 CG PRO A 37 20.298 14.458 8.745 1.00 0.00 C ATOM 427 CD PRO A 37 19.034 15.279 8.983 1.00 0.00 C ATOM 0 HA PRO A 37 17.762 12.373 9.068 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.477 12.292 8.819 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.449 12.871 7.523 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.985 14.514 9.590 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.845 14.799 7.866 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.250 16.162 9.584 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.614 15.630 8.041 1.00 0.00 H new ATOM 435 N GLY A 38 18.146 11.385 11.270 1.00 0.00 N ATOM 436 CA GLY A 38 18.280 10.786 12.595 1.00 0.00 C ATOM 437 C GLY A 38 17.350 11.366 13.662 1.00 0.00 C ATOM 438 O GLY A 38 17.393 10.864 14.779 1.00 0.00 O ATOM 0 H GLY A 38 17.452 10.927 10.679 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.093 9.715 12.514 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.311 10.905 12.929 1.00 0.00 H new ATOM 442 N GLN A 39 16.465 12.333 13.363 1.00 0.00 N ATOM 443 CA GLN A 39 15.406 12.745 14.313 1.00 0.00 C ATOM 444 C GLN A 39 14.475 11.572 14.617 1.00 0.00 C ATOM 445 O GLN A 39 14.068 11.375 15.759 1.00 0.00 O ATOM 446 CB GLN A 39 14.624 13.973 13.813 1.00 0.00 C ATOM 447 CG GLN A 39 13.566 13.726 12.719 1.00 0.00 C ATOM 448 CD GLN A 39 12.218 13.169 13.192 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.683 12.255 12.596 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.621 13.658 14.255 1.00 0.00 N ATOM 0 H GLN A 39 16.458 12.843 12.480 1.00 0.00 H new ATOM 0 HA GLN A 39 15.893 13.045 15.241 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.127 14.431 14.669 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.341 14.701 13.434 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.384 14.667 12.200 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.985 13.034 11.988 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.049 14.425 14.773 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.729 13.270 14.563 1.00 0.00 H new ATOM 459 N LEU A 40 14.236 10.747 13.592 1.00 0.00 N ATOM 460 CA LEU A 40 13.479 9.507 13.648 1.00 0.00 C ATOM 461 C LEU A 40 14.018 8.550 14.720 1.00 0.00 C ATOM 462 O LEU A 40 13.290 7.702 15.205 1.00 0.00 O ATOM 463 CB LEU A 40 13.564 8.854 12.260 1.00 0.00 C ATOM 464 CG LEU A 40 12.800 9.598 11.152 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.363 9.169 9.791 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.290 9.322 11.233 1.00 0.00 C ATOM 0 H LEU A 40 14.587 10.943 12.655 1.00 0.00 H new ATOM 0 HA LEU A 40 12.446 9.725 13.919 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.613 8.779 11.972 1.00 0.00 H new ATOM 0 HB3 LEU A 40 13.179 7.837 12.328 1.00 0.00 H new ATOM 0 HG LEU A 40 12.935 10.672 11.282 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.829 9.690 8.996 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.423 9.419 9.741 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.237 8.093 9.668 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.778 9.862 10.437 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.109 8.253 11.121 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.911 9.655 12.199 1.00 0.00 H new ATOM 478 N ALA A 41 15.275 8.675 15.137 1.00 0.00 N ATOM 479 CA ALA A 41 15.835 7.784 16.156 1.00 0.00 C ATOM 480 C ALA A 41 15.122 7.934 17.518 1.00 0.00 C ATOM 481 O ALA A 41 15.066 6.976 18.284 1.00 0.00 O ATOM 482 CB ALA A 41 17.328 8.078 16.271 1.00 0.00 C ATOM 0 H ALA A 41 15.925 9.380 14.789 1.00 0.00 H new ATOM 0 HA ALA A 41 15.680 6.748 15.854 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.770 7.427 17.025 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.809 7.899 15.309 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.473 9.119 16.561 1.00 0.00 H new ATOM 488 N ALA A 42 14.551 9.112 17.808 1.00 0.00 N ATOM 489 CA ALA A 42 13.670 9.303 18.955 1.00 0.00 C ATOM 490 C ALA A 42 12.276 8.732 18.656 1.00 0.00 C ATOM 491 O ALA A 42 11.834 7.826 19.353 1.00 0.00 O ATOM 492 CB ALA A 42 13.650 10.796 19.314 1.00 0.00 C ATOM 0 H ALA A 42 14.691 9.955 17.251 1.00 0.00 H new ATOM 0 HA ALA A 42 14.038 8.757 19.824 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.995 10.956 20.171 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.659 11.124 19.563 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.281 11.370 18.464 1.00 0.00 H new ATOM 498 N HIS A 43 11.620 9.199 17.586 1.00 0.00 N ATOM 499 CA HIS A 43 10.256 8.777 17.208 1.00 0.00 C ATOM 500 C HIS A 43 10.066 7.252 17.048 1.00 0.00 C ATOM 501 O HIS A 43 8.972 6.724 17.250 1.00 0.00 O ATOM 502 CB HIS A 43 9.893 9.460 15.878 1.00 0.00 C ATOM 503 CG HIS A 43 9.430 10.891 15.970 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.119 11.671 14.893 1.00 0.00 N flip ATOM 505 CD2 HIS A 43 9.007 11.533 17.132 1.00 0.00 C flip ATOM 506 CE1 HIS A 43 8.464 12.783 15.389 1.00 0.00 C flip ATOM 507 NE2 HIS A 43 8.422 12.671 16.725 1.00 0.00 N flip ATOM 0 H HIS A 43 12.021 9.887 16.949 1.00 0.00 H new ATOM 0 HA HIS A 43 9.604 9.074 18.030 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.765 9.423 15.225 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.109 8.876 15.396 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.125 11.187 18.148 1.00 0.00 H new ATOM 0 HE1 HIS A 43 8.059 13.596 14.805 1.00 0.00 H new ATOM 0 HE2 HIS A 43 8.001 13.359 17.349 1.00 0.00 H new ATOM 515 N LEU A 44 11.124 6.548 16.631 1.00 0.00 N ATOM 516 CA LEU A 44 11.114 5.109 16.334 1.00 0.00 C ATOM 517 C LEU A 44 11.750 4.256 17.435 1.00 0.00 C ATOM 518 O LEU A 44 11.838 3.044 17.251 1.00 0.00 O ATOM 519 CB LEU A 44 11.823 4.858 14.987 1.00 0.00 C ATOM 520 CG LEU A 44 11.262 5.706 13.836 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.869 5.335 12.497 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.736 5.683 13.668 1.00 0.00 C ATOM 0 H LEU A 44 12.039 6.975 16.486 1.00 0.00 H new ATOM 0 HA LEU A 44 10.070 4.802 16.277 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.886 5.069 15.100 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.733 3.803 14.729 1.00 0.00 H new ATOM 0 HG LEU A 44 11.546 6.714 14.138 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.440 5.963 11.716 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.948 5.487 12.532 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.657 4.288 12.279 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.453 6.316 12.827 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.406 4.661 13.481 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.264 6.056 14.577 1.00 0.00 H new ATOM 534 N GLY A 45 12.288 4.867 18.501 1.00 0.00 N ATOM 535 CA GLY A 45 13.006 4.147 19.558 1.00 0.00 C ATOM 536 C GLY A 45 14.286 3.441 19.089 1.00 0.00 C ATOM 537 O GLY A 45 14.860 2.660 19.851 1.00 0.00 O ATOM 0 H GLY A 45 12.236 5.874 18.653 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.263 4.851 20.350 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.337 3.406 19.995 1.00 0.00 H new ATOM 541 N LEU A 46 14.719 3.665 17.839 1.00 0.00 N ATOM 542 CA LEU A 46 15.814 2.929 17.190 1.00 0.00 C ATOM 543 C LEU A 46 17.098 3.767 17.048 1.00 0.00 C ATOM 544 O LEU A 46 17.081 4.995 17.043 1.00 0.00 O ATOM 545 CB LEU A 46 15.321 2.431 15.812 1.00 0.00 C ATOM 546 CG LEU A 46 14.430 1.170 15.847 1.00 0.00 C ATOM 547 CD1 LEU A 46 13.816 0.952 14.454 1.00 0.00 C ATOM 548 CD2 LEU A 46 15.237 -0.076 16.247 1.00 0.00 C ATOM 0 H LEU A 46 14.308 4.379 17.238 1.00 0.00 H new ATOM 0 HA LEU A 46 16.083 2.084 17.824 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.765 3.236 15.331 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.189 2.225 15.186 1.00 0.00 H new ATOM 0 HG LEU A 46 13.648 1.321 16.591 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.185 0.063 14.469 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.215 1.819 14.182 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.613 0.819 13.722 1.00 0.00 H new ATOM 0 HD21 LEU A 46 14.580 -0.946 16.262 1.00 0.00 H new ATOM 0 HD22 LEU A 46 16.037 -0.238 15.525 1.00 0.00 H new ATOM 0 HD23 LEU A 46 15.666 0.071 17.238 1.00 0.00 H new ATOM 560 N THR A 47 18.239 3.089 16.859 1.00 0.00 N ATOM 561 CA THR A 47 19.517 3.734 16.508 1.00 0.00 C ATOM 562 C THR A 47 19.440 4.449 15.154 1.00 0.00 C ATOM 563 O THR A 47 18.832 3.966 14.193 1.00 0.00 O ATOM 564 CB THR A 47 20.717 2.777 16.617 1.00 0.00 C ATOM 565 OG1 THR A 47 21.824 3.363 15.969 1.00 0.00 O ATOM 566 CG2 THR A 47 20.476 1.405 15.994 1.00 0.00 C ATOM 0 H THR A 47 18.304 2.075 16.945 1.00 0.00 H new ATOM 0 HA THR A 47 19.696 4.507 17.256 1.00 0.00 H new ATOM 0 HB THR A 47 20.890 2.620 17.682 1.00 0.00 H new ATOM 0 HG1 THR A 47 22.095 2.802 15.213 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.368 0.790 16.112 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.634 0.923 16.491 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.253 1.521 14.933 1.00 0.00 H new ATOM 574 N ARG A 48 20.146 5.581 15.079 1.00 0.00 N ATOM 575 CA ARG A 48 20.330 6.432 13.895 1.00 0.00 C ATOM 576 C ARG A 48 20.902 5.633 12.704 1.00 0.00 C ATOM 577 O ARG A 48 20.574 5.919 11.551 1.00 0.00 O ATOM 578 CB ARG A 48 21.220 7.639 14.290 1.00 0.00 C ATOM 579 CG ARG A 48 20.529 8.532 15.345 1.00 0.00 C ATOM 580 CD ARG A 48 21.388 9.598 16.042 1.00 0.00 C ATOM 581 NE ARG A 48 20.620 10.179 17.164 1.00 0.00 N ATOM 582 CZ ARG A 48 21.089 10.594 18.342 1.00 0.00 C ATOM 583 NH1 ARG A 48 22.361 10.790 18.597 1.00 0.00 N ATOM 584 NH2 ARG A 48 20.278 10.830 19.345 1.00 0.00 N ATOM 0 H ARG A 48 20.636 5.953 15.893 1.00 0.00 H new ATOM 0 HA ARG A 48 19.365 6.807 13.555 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.170 7.278 14.684 1.00 0.00 H new ATOM 0 HB3 ARG A 48 21.447 8.231 13.403 1.00 0.00 H new ATOM 0 HG2 ARG A 48 19.692 9.037 14.863 1.00 0.00 H new ATOM 0 HG3 ARG A 48 20.110 7.882 16.113 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.313 9.154 16.409 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.668 10.378 15.334 1.00 0.00 H new ATOM 0 HE ARG A 48 19.615 10.274 17.021 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.058 10.624 17.871 1.00 0.00 H new ATOM 0 HH12 ARG A 48 22.653 11.109 19.521 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.273 10.697 19.231 1.00 0.00 H new ATOM 0 HH22 ARG A 48 20.652 11.147 20.240 1.00 0.00 H new ATOM 598 N SER A 49 21.683 4.579 12.966 1.00 0.00 N ATOM 599 CA SER A 49 22.096 3.607 11.942 1.00 0.00 C ATOM 600 C SER A 49 20.929 2.706 11.509 1.00 0.00 C ATOM 601 O SER A 49 20.566 2.725 10.340 1.00 0.00 O ATOM 602 CB SER A 49 23.303 2.781 12.420 1.00 0.00 C ATOM 603 OG SER A 49 23.113 2.179 13.695 1.00 0.00 O ATOM 0 H SER A 49 22.048 4.374 13.896 1.00 0.00 H new ATOM 0 HA SER A 49 22.407 4.169 11.061 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.512 2.002 11.687 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.181 3.426 12.459 1.00 0.00 H new ATOM 0 HG SER A 49 23.914 1.669 13.939 1.00 0.00 H new ATOM 609 N ASN A 50 20.265 1.968 12.405 1.00 0.00 N ATOM 610 CA ASN A 50 19.216 1.030 11.975 1.00 0.00 C ATOM 611 C ASN A 50 17.976 1.715 11.363 1.00 0.00 C ATOM 612 O ASN A 50 17.337 1.120 10.503 1.00 0.00 O ATOM 613 CB ASN A 50 18.848 0.028 13.075 1.00 0.00 C ATOM 614 CG ASN A 50 18.211 -1.214 12.459 1.00 0.00 C ATOM 615 OD1 ASN A 50 18.847 -1.926 11.698 1.00 0.00 O ATOM 616 ND2 ASN A 50 16.955 -1.500 12.750 1.00 0.00 N ATOM 0 H ASN A 50 20.428 1.998 13.411 1.00 0.00 H new ATOM 0 HA ASN A 50 19.657 0.460 11.157 1.00 0.00 H new ATOM 0 HB2 ASN A 50 19.739 -0.251 13.637 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.157 0.489 13.781 1.00 0.00 H new ATOM 0 HD21 ASN A 50 16.510 -2.320 12.338 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.430 -0.901 13.387 1.00 0.00 H new ATOM 623 N VAL A 51 17.654 2.968 11.709 1.00 0.00 N ATOM 624 CA VAL A 51 16.639 3.720 10.939 1.00 0.00 C ATOM 625 C VAL A 51 17.126 4.019 9.505 1.00 0.00 C ATOM 626 O VAL A 51 16.324 3.973 8.572 1.00 0.00 O ATOM 627 CB VAL A 51 16.248 5.024 11.673 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.331 5.922 10.834 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.534 4.728 13.008 1.00 0.00 C ATOM 0 H VAL A 51 18.064 3.476 12.493 1.00 0.00 H new ATOM 0 HA VAL A 51 15.751 3.093 10.861 1.00 0.00 H new ATOM 0 HB VAL A 51 17.187 5.546 11.855 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.088 6.823 11.398 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.839 6.198 9.910 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.413 5.384 10.597 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.274 5.667 13.497 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.627 4.155 12.816 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.196 4.153 13.655 1.00 0.00 H new ATOM 639 N SER A 52 18.420 4.284 9.282 1.00 0.00 N ATOM 640 CA SER A 52 18.922 4.550 7.924 1.00 0.00 C ATOM 641 C SER A 52 19.091 3.293 7.060 1.00 0.00 C ATOM 642 O SER A 52 18.962 3.415 5.838 1.00 0.00 O ATOM 643 CB SER A 52 20.151 5.469 7.893 1.00 0.00 C ATOM 644 OG SER A 52 21.112 5.209 8.900 1.00 0.00 O ATOM 0 H SER A 52 19.131 4.320 10.012 1.00 0.00 H new ATOM 0 HA SER A 52 18.121 5.114 7.447 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.632 5.377 6.919 1.00 0.00 H new ATOM 0 HB3 SER A 52 19.817 6.502 7.987 1.00 0.00 H new ATOM 0 HG SER A 52 20.771 5.518 9.765 1.00 0.00 H new ATOM 650 N ASN A 53 19.228 2.106 7.674 1.00 0.00 N ATOM 651 CA ASN A 53 19.143 0.774 7.033 1.00 0.00 C ATOM 652 C ASN A 53 18.026 0.735 5.979 1.00 0.00 C ATOM 653 O ASN A 53 18.183 0.306 4.838 1.00 0.00 O ATOM 654 CB ASN A 53 18.906 -0.273 8.140 1.00 0.00 C ATOM 655 CG ASN A 53 19.059 -1.734 7.724 1.00 0.00 C ATOM 656 OD1 ASN A 53 19.074 -2.092 6.555 1.00 0.00 O ATOM 657 ND2 ASN A 53 19.157 -2.619 8.698 1.00 0.00 N ATOM 0 H ASN A 53 19.409 2.041 8.676 1.00 0.00 H new ATOM 0 HA ASN A 53 20.073 0.554 6.508 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.601 -0.074 8.956 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.900 -0.132 8.536 1.00 0.00 H new ATOM 0 HD21 ASN A 53 19.246 -3.611 8.479 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.144 -2.311 9.670 1.00 0.00 H new ATOM 664 N HIS A 54 16.876 1.283 6.356 1.00 0.00 N ATOM 665 CA HIS A 54 15.664 1.231 5.564 1.00 0.00 C ATOM 666 C HIS A 54 15.324 2.563 4.847 1.00 0.00 C ATOM 667 O HIS A 54 14.529 2.558 3.904 1.00 0.00 O ATOM 668 CB HIS A 54 14.635 0.608 6.515 1.00 0.00 C ATOM 669 CG HIS A 54 15.024 -0.822 6.878 1.00 0.00 C ATOM 670 ND1 HIS A 54 15.751 -1.713 6.104 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.877 -1.418 8.103 1.00 0.00 C ATOM 672 CE1 HIS A 54 16.015 -2.801 6.845 1.00 0.00 C ATOM 673 NE2 HIS A 54 15.506 -2.663 8.073 1.00 0.00 N ATOM 0 H HIS A 54 16.764 1.784 7.238 1.00 0.00 H new ATOM 0 HA HIS A 54 15.732 0.611 4.670 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.560 1.210 7.421 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.651 0.614 6.046 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.360 -0.994 8.951 1.00 0.00 H new ATOM 0 HE1 HIS A 54 16.561 -3.665 6.498 1.00 0.00 H new ATOM 0 HE2 HIS A 54 15.566 -3.335 8.838 1.00 0.00 H new ATOM 681 N LEU A 55 16.001 3.682 5.171 1.00 0.00 N ATOM 682 CA LEU A 55 15.915 4.928 4.381 1.00 0.00 C ATOM 683 C LEU A 55 16.631 4.822 3.029 1.00 0.00 C ATOM 684 O LEU A 55 16.313 5.600 2.134 1.00 0.00 O ATOM 685 CB LEU A 55 16.488 6.145 5.139 1.00 0.00 C ATOM 686 CG LEU A 55 15.655 6.626 6.346 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.470 7.628 7.174 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.368 7.318 5.881 1.00 0.00 C ATOM 0 H LEU A 55 16.618 3.749 5.980 1.00 0.00 H new ATOM 0 HA LEU A 55 14.849 5.076 4.210 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.490 5.896 5.487 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.591 6.973 4.437 1.00 0.00 H new ATOM 0 HG LEU A 55 15.400 5.753 6.947 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.877 7.964 8.025 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.380 7.148 7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.732 8.485 6.553 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.798 7.648 6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.621 8.180 5.264 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.769 6.618 5.298 1.00 0.00 H new ATOM 700 N SER A 56 17.581 3.897 2.856 1.00 0.00 N ATOM 701 CA SER A 56 18.279 3.732 1.570 1.00 0.00 C ATOM 702 C SER A 56 17.333 3.603 0.361 1.00 0.00 C ATOM 703 O SER A 56 17.575 4.253 -0.658 1.00 0.00 O ATOM 704 CB SER A 56 19.230 2.529 1.624 1.00 0.00 C ATOM 705 OG SER A 56 20.039 2.502 0.460 1.00 0.00 O ATOM 0 H SER A 56 17.886 3.252 3.585 1.00 0.00 H new ATOM 0 HA SER A 56 18.848 4.650 1.420 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.858 2.590 2.513 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.657 1.605 1.701 1.00 0.00 H new ATOM 0 HG SER A 56 20.645 1.733 0.501 1.00 0.00 H new ATOM 711 N CYS A 57 16.239 2.832 0.475 1.00 0.00 N ATOM 712 CA CYS A 57 15.294 2.681 -0.634 1.00 0.00 C ATOM 713 C CYS A 57 14.184 3.750 -0.589 1.00 0.00 C ATOM 714 O CYS A 57 13.735 4.225 -1.628 1.00 0.00 O ATOM 715 CB CYS A 57 14.742 1.255 -0.604 1.00 0.00 C ATOM 716 SG CYS A 57 13.664 0.851 -2.021 1.00 0.00 S ATOM 0 H CYS A 57 15.992 2.310 1.316 1.00 0.00 H new ATOM 0 HA CYS A 57 15.807 2.841 -1.582 1.00 0.00 H new ATOM 0 HB2 CYS A 57 15.576 0.553 -0.582 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.181 1.112 0.320 1.00 0.00 H new ATOM 0 HG CYS A 57 13.246 -0.375 -1.912 1.00 0.00 H new ATOM 721 N LEU A 58 13.791 4.187 0.614 1.00 0.00 N ATOM 722 CA LEU A 58 12.795 5.245 0.812 1.00 0.00 C ATOM 723 C LEU A 58 13.205 6.541 0.091 1.00 0.00 C ATOM 724 O LEU A 58 12.361 7.209 -0.510 1.00 0.00 O ATOM 725 CB LEU A 58 12.599 5.449 2.333 1.00 0.00 C ATOM 726 CG LEU A 58 11.136 5.566 2.805 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.368 4.266 2.551 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.130 5.897 4.303 1.00 0.00 C ATOM 0 H LEU A 58 14.161 3.811 1.487 1.00 0.00 H new ATOM 0 HA LEU A 58 11.843 4.951 0.371 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.066 4.615 2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.132 6.351 2.632 1.00 0.00 H new ATOM 0 HG LEU A 58 10.641 6.357 2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.339 4.378 2.894 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.373 4.043 1.484 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.845 3.450 3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.101 5.983 4.652 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.635 5.103 4.853 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.650 6.841 4.469 1.00 0.00 H new ATOM 740 N ARG A 59 14.498 6.893 0.135 1.00 0.00 N ATOM 741 CA ARG A 59 15.063 8.044 -0.587 1.00 0.00 C ATOM 742 C ARG A 59 15.301 7.780 -2.089 1.00 0.00 C ATOM 743 O ARG A 59 15.461 8.739 -2.844 1.00 0.00 O ATOM 744 CB ARG A 59 16.363 8.486 0.081 1.00 0.00 C ATOM 745 CG ARG A 59 16.160 8.987 1.523 1.00 0.00 C ATOM 746 CD ARG A 59 17.430 9.626 2.086 1.00 0.00 C ATOM 747 NE ARG A 59 18.552 8.673 2.209 1.00 0.00 N ATOM 748 CZ ARG A 59 19.470 8.391 1.285 1.00 0.00 C ATOM 749 NH1 ARG A 59 19.523 9.004 0.118 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.375 7.468 1.532 1.00 0.00 N ATOM 0 H ARG A 59 15.191 6.380 0.680 1.00 0.00 H new ATOM 0 HA ARG A 59 14.319 8.839 -0.533 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.063 7.651 0.088 1.00 0.00 H new ATOM 0 HB3 ARG A 59 16.818 9.279 -0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.347 9.713 1.545 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.860 8.154 2.158 1.00 0.00 H new ATOM 0 HD2 ARG A 59 17.731 10.451 1.441 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.212 10.050 3.066 1.00 0.00 H new ATOM 0 HE ARG A 59 18.633 8.177 3.097 1.00 0.00 H new ATOM 0 HH11 ARG A 59 18.842 9.729 -0.109 1.00 0.00 H new ATOM 0 HH12 ARG A 59 20.245 8.753 -0.557 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.370 6.975 2.425 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.081 7.246 0.831 1.00 0.00 H new ATOM 764 N GLY A 60 15.310 6.513 -2.522 1.00 0.00 N ATOM 765 CA GLY A 60 15.575 6.074 -3.900 1.00 0.00 C ATOM 766 C GLY A 60 14.301 6.026 -4.736 1.00 0.00 C ATOM 767 O GLY A 60 14.170 6.768 -5.706 1.00 0.00 O ATOM 0 H GLY A 60 15.125 5.731 -1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.290 6.752 -4.366 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.036 5.087 -3.884 1.00 0.00 H new ATOM 771 N CYS A 61 13.311 5.268 -4.260 1.00 0.00 N ATOM 772 CA CYS A 61 11.938 5.268 -4.752 1.00 0.00 C ATOM 773 C CYS A 61 11.238 6.636 -4.520 1.00 0.00 C ATOM 774 O CYS A 61 10.107 6.849 -4.952 1.00 0.00 O ATOM 775 CB CYS A 61 11.250 4.077 -4.062 1.00 0.00 C ATOM 776 SG CYS A 61 11.731 2.479 -4.802 1.00 0.00 S ATOM 0 H CYS A 61 13.453 4.613 -3.491 1.00 0.00 H new ATOM 0 HA CYS A 61 11.887 5.145 -5.834 1.00 0.00 H new ATOM 0 HB2 CYS A 61 11.505 4.076 -3.002 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.169 4.196 -4.129 1.00 0.00 H new ATOM 0 HG CYS A 61 12.404 1.784 -3.934 1.00 0.00 H new ATOM 781 N GLY A 62 11.903 7.554 -3.803 1.00 0.00 N ATOM 782 CA GLY A 62 11.489 8.952 -3.635 1.00 0.00 C ATOM 783 C GLY A 62 10.343 9.149 -2.653 1.00 0.00 C ATOM 784 O GLY A 62 9.880 10.272 -2.508 1.00 0.00 O ATOM 0 H GLY A 62 12.769 7.336 -3.310 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.346 9.535 -3.298 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.194 9.351 -4.605 1.00 0.00 H new ATOM 788 N LEU A 63 9.917 8.093 -1.947 1.00 0.00 N ATOM 789 CA LEU A 63 8.971 8.149 -0.825 1.00 0.00 C ATOM 790 C LEU A 63 9.325 9.227 0.210 1.00 0.00 C ATOM 791 O LEU A 63 8.430 9.774 0.850 1.00 0.00 O ATOM 792 CB LEU A 63 8.902 6.767 -0.182 1.00 0.00 C ATOM 793 CG LEU A 63 8.115 5.781 -1.058 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.254 4.411 -0.439 1.00 0.00 C ATOM 795 CD2 LEU A 63 6.623 6.133 -1.156 1.00 0.00 C ATOM 0 H LEU A 63 10.232 7.144 -2.148 1.00 0.00 H new ATOM 0 HA LEU A 63 7.994 8.434 -1.215 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.911 6.388 -0.021 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.430 6.843 0.798 1.00 0.00 H new ATOM 0 HG LEU A 63 8.520 5.821 -2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.705 3.684 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.307 4.132 -0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.850 4.426 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.117 5.402 -1.787 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.180 6.120 -0.160 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.511 7.127 -1.590 1.00 0.00 H new ATOM 807 N VAL A 64 10.617 9.538 0.334 1.00 0.00 N ATOM 808 CA VAL A 64 11.173 10.622 1.155 1.00 0.00 C ATOM 809 C VAL A 64 12.188 11.469 0.385 1.00 0.00 C ATOM 810 O VAL A 64 12.964 10.951 -0.414 1.00 0.00 O ATOM 811 CB VAL A 64 11.826 10.089 2.448 1.00 0.00 C ATOM 812 CG1 VAL A 64 10.749 9.775 3.489 1.00 0.00 C ATOM 813 CG2 VAL A 64 12.652 8.842 2.237 1.00 0.00 C ATOM 0 H VAL A 64 11.342 9.016 -0.159 1.00 0.00 H new ATOM 0 HA VAL A 64 10.327 11.255 1.423 1.00 0.00 H new ATOM 0 HB VAL A 64 12.494 10.879 2.791 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.220 9.400 4.398 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.189 10.682 3.718 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.070 9.020 3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.080 8.524 3.188 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.018 8.048 1.841 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.454 9.052 1.530 1.00 0.00 H new ATOM 823 N VAL A 65 12.180 12.772 0.665 1.00 0.00 N ATOM 824 CA VAL A 65 12.979 13.826 0.017 1.00 0.00 C ATOM 825 C VAL A 65 13.751 14.629 1.077 1.00 0.00 C ATOM 826 O VAL A 65 13.251 14.866 2.175 1.00 0.00 O ATOM 827 CB VAL A 65 12.034 14.746 -0.798 1.00 0.00 C ATOM 828 CG1 VAL A 65 12.691 16.047 -1.280 1.00 0.00 C ATOM 829 CG2 VAL A 65 11.475 13.991 -2.016 1.00 0.00 C ATOM 0 H VAL A 65 11.578 13.150 1.397 1.00 0.00 H new ATOM 0 HA VAL A 65 13.707 13.378 -0.659 1.00 0.00 H new ATOM 0 HB VAL A 65 11.236 15.026 -0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 65 11.965 16.635 -1.842 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.035 16.621 -0.420 1.00 0.00 H new ATOM 0 HG13 VAL A 65 13.540 15.810 -1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 65 10.813 14.649 -2.579 1.00 0.00 H new ATOM 0 HG22 VAL A 65 12.298 13.671 -2.655 1.00 0.00 H new ATOM 0 HG23 VAL A 65 10.917 13.118 -1.678 1.00 0.00 H new ATOM 839 N ALA A 66 14.981 15.047 0.764 1.00 0.00 N ATOM 840 CA ALA A 66 15.815 15.930 1.600 1.00 0.00 C ATOM 841 C ALA A 66 15.611 17.431 1.315 1.00 0.00 C ATOM 842 O ALA A 66 15.193 17.848 0.235 1.00 0.00 O ATOM 843 CB ALA A 66 17.281 15.510 1.423 1.00 0.00 C ATOM 0 H ALA A 66 15.442 14.774 -0.104 1.00 0.00 H new ATOM 0 HA ALA A 66 15.507 15.809 2.639 1.00 0.00 H new ATOM 0 HB1 ALA A 66 17.919 16.150 2.033 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.403 14.473 1.735 1.00 0.00 H new ATOM 0 HB3 ALA A 66 17.564 15.609 0.375 1.00 0.00 H new ATOM 849 N THR A 67 15.883 18.261 2.326 1.00 0.00 N ATOM 850 CA THR A 67 15.646 19.718 2.332 1.00 0.00 C ATOM 851 C THR A 67 16.464 20.337 3.465 1.00 0.00 C ATOM 852 O THR A 67 16.844 19.620 4.378 1.00 0.00 O ATOM 853 CB THR A 67 14.148 20.009 2.531 1.00 0.00 C ATOM 854 OG1 THR A 67 13.309 19.259 1.692 1.00 0.00 O ATOM 855 CG2 THR A 67 13.752 21.469 2.382 1.00 0.00 C ATOM 0 H THR A 67 16.291 17.929 3.200 1.00 0.00 H new ATOM 0 HA THR A 67 15.951 20.150 1.379 1.00 0.00 H new ATOM 0 HB THR A 67 14.003 19.711 3.569 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.374 19.492 1.872 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.678 21.573 2.540 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.287 22.068 3.119 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.006 21.815 1.380 1.00 0.00 H new ATOM 863 N TYR A 68 16.716 21.645 3.458 1.00 0.00 N ATOM 864 CA TYR A 68 17.292 22.357 4.614 1.00 0.00 C ATOM 865 C TYR A 68 16.243 22.699 5.699 1.00 0.00 C ATOM 866 O TYR A 68 15.046 22.769 5.417 1.00 0.00 O ATOM 867 CB TYR A 68 18.025 23.618 4.131 1.00 0.00 C ATOM 868 CG TYR A 68 19.473 23.372 3.752 1.00 0.00 C ATOM 869 CD1 TYR A 68 19.803 22.888 2.472 1.00 0.00 C ATOM 870 CD2 TYR A 68 20.496 23.610 4.692 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.148 22.641 2.131 1.00 0.00 C ATOM 872 CE2 TYR A 68 21.839 23.356 4.365 1.00 0.00 C ATOM 873 CZ TYR A 68 22.170 22.873 3.077 1.00 0.00 C ATOM 874 OH TYR A 68 23.469 22.631 2.750 1.00 0.00 O ATOM 0 H TYR A 68 16.530 22.247 2.656 1.00 0.00 H new ATOM 0 HA TYR A 68 18.004 21.684 5.092 1.00 0.00 H new ATOM 0 HB2 TYR A 68 17.497 24.027 3.269 1.00 0.00 H new ATOM 0 HB3 TYR A 68 17.987 24.373 4.916 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.022 22.705 1.748 1.00 0.00 H new ATOM 0 HD2 TYR A 68 20.246 23.991 5.671 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.397 22.274 1.146 1.00 0.00 H new ATOM 0 HE2 TYR A 68 22.616 23.529 5.095 1.00 0.00 H new ATOM 0 HH TYR A 68 24.044 22.844 3.514 1.00 0.00 H new ATOM 884 N GLU A 69 16.683 22.892 6.942 1.00 0.00 N ATOM 885 CA GLU A 69 15.896 23.486 8.034 1.00 0.00 C ATOM 886 C GLU A 69 16.553 24.823 8.453 1.00 0.00 C ATOM 887 O GLU A 69 17.198 25.451 7.613 1.00 0.00 O ATOM 888 CB GLU A 69 15.604 22.447 9.141 1.00 0.00 C ATOM 889 CG GLU A 69 16.778 21.927 9.991 1.00 0.00 C ATOM 890 CD GLU A 69 17.168 22.870 11.128 1.00 0.00 C ATOM 891 OE1 GLU A 69 16.256 23.377 11.811 1.00 0.00 O ATOM 892 OE2 GLU A 69 18.381 23.157 11.256 1.00 0.00 O ATOM 0 H GLU A 69 17.626 22.633 7.231 1.00 0.00 H new ATOM 0 HA GLU A 69 14.891 23.762 7.715 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.871 22.883 9.820 1.00 0.00 H new ATOM 0 HB3 GLU A 69 15.129 21.586 8.670 1.00 0.00 H new ATOM 0 HG2 GLU A 69 16.512 20.956 10.409 1.00 0.00 H new ATOM 0 HG3 GLU A 69 17.643 21.770 9.346 1.00 0.00 H new ATOM 899 N GLY A 70 16.421 25.296 9.699 1.00 0.00 N ATOM 900 CA GLY A 70 16.942 26.603 10.136 1.00 0.00 C ATOM 901 C GLY A 70 18.465 26.771 10.020 1.00 0.00 C ATOM 902 O GLY A 70 18.940 27.903 9.937 1.00 0.00 O ATOM 0 H GLY A 70 15.946 24.780 10.440 1.00 0.00 H new ATOM 0 HA2 GLY A 70 16.460 27.384 9.547 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.653 26.763 11.175 1.00 0.00 H new ATOM 906 N ARG A 71 19.228 25.666 9.989 1.00 0.00 N ATOM 907 CA ARG A 71 20.669 25.647 9.659 1.00 0.00 C ATOM 908 C ARG A 71 21.184 24.271 9.192 1.00 0.00 C ATOM 909 O ARG A 71 22.223 24.206 8.526 1.00 0.00 O ATOM 910 CB ARG A 71 21.484 26.199 10.852 1.00 0.00 C ATOM 911 CG ARG A 71 22.920 26.627 10.494 1.00 0.00 C ATOM 912 CD ARG A 71 23.987 25.557 10.780 1.00 0.00 C ATOM 913 NE ARG A 71 25.292 25.932 10.201 1.00 0.00 N ATOM 914 CZ ARG A 71 25.646 25.790 8.926 1.00 0.00 C ATOM 915 NH1 ARG A 71 24.842 25.263 8.023 1.00 0.00 N ATOM 916 NH2 ARG A 71 26.837 26.187 8.532 1.00 0.00 N ATOM 0 H ARG A 71 18.855 24.739 10.197 1.00 0.00 H new ATOM 0 HA ARG A 71 20.811 26.299 8.797 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.956 27.055 11.273 1.00 0.00 H new ATOM 0 HB3 ARG A 71 21.528 25.437 11.631 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.957 26.887 9.436 1.00 0.00 H new ATOM 0 HG3 ARG A 71 23.168 27.530 11.053 1.00 0.00 H new ATOM 0 HD2 ARG A 71 24.090 25.422 11.857 1.00 0.00 H new ATOM 0 HD3 ARG A 71 23.665 24.601 10.368 1.00 0.00 H new ATOM 0 HE ARG A 71 25.983 26.335 10.834 1.00 0.00 H new ATOM 0 HH11 ARG A 71 23.910 24.947 8.292 1.00 0.00 H new ATOM 0 HH12 ARG A 71 25.152 25.172 7.055 1.00 0.00 H new ATOM 0 HH21 ARG A 71 27.484 26.601 9.203 1.00 0.00 H new ATOM 0 HH22 ARG A 71 27.113 26.080 7.556 1.00 0.00 H new ATOM 930 N GLN A 72 20.507 23.183 9.558 1.00 0.00 N ATOM 931 CA GLN A 72 20.834 21.798 9.215 1.00 0.00 C ATOM 932 C GLN A 72 20.042 21.364 7.974 1.00 0.00 C ATOM 933 O GLN A 72 19.399 22.180 7.322 1.00 0.00 O ATOM 934 CB GLN A 72 20.594 20.856 10.423 1.00 0.00 C ATOM 935 CG GLN A 72 21.686 20.946 11.498 1.00 0.00 C ATOM 936 CD GLN A 72 21.880 22.343 12.072 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.966 22.901 12.064 1.00 0.00 O ATOM 938 NE2 GLN A 72 20.833 22.996 12.512 1.00 0.00 N ATOM 0 H GLN A 72 19.668 23.247 10.134 1.00 0.00 H new ATOM 0 HA GLN A 72 21.895 21.732 8.972 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.631 21.095 10.874 1.00 0.00 H new ATOM 0 HB3 GLN A 72 20.532 19.828 10.065 1.00 0.00 H new ATOM 0 HG2 GLN A 72 21.439 20.262 12.310 1.00 0.00 H new ATOM 0 HG3 GLN A 72 22.630 20.606 11.071 1.00 0.00 H new ATOM 0 HE21 GLN A 72 19.919 22.544 12.525 1.00 0.00 H new ATOM 0 HE22 GLN A 72 20.932 23.956 12.841 1.00 0.00 H new ATOM 947 N VAL A 73 20.077 20.071 7.654 1.00 0.00 N ATOM 948 CA VAL A 73 19.217 19.439 6.653 1.00 0.00 C ATOM 949 C VAL A 73 18.202 18.519 7.341 1.00 0.00 C ATOM 950 O VAL A 73 18.363 18.197 8.519 1.00 0.00 O ATOM 951 CB VAL A 73 20.031 18.710 5.564 1.00 0.00 C ATOM 952 CG1 VAL A 73 20.926 19.687 4.785 1.00 0.00 C ATOM 953 CG2 VAL A 73 20.874 17.553 6.126 1.00 0.00 C ATOM 0 H VAL A 73 20.722 19.416 8.096 1.00 0.00 H new ATOM 0 HA VAL A 73 18.664 20.221 6.132 1.00 0.00 H new ATOM 0 HB VAL A 73 19.300 18.279 4.880 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.486 19.141 4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.306 20.444 4.305 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.622 20.170 5.472 1.00 0.00 H new ATOM 0 HG21 VAL A 73 21.425 17.077 5.315 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.577 17.940 6.864 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.219 16.821 6.598 1.00 0.00 H new ATOM 963 N ARG A 74 17.173 18.095 6.604 1.00 0.00 N ATOM 964 CA ARG A 74 15.983 17.371 7.046 1.00 0.00 C ATOM 965 C ARG A 74 15.599 16.306 6.021 1.00 0.00 C ATOM 966 O ARG A 74 16.094 16.279 4.894 1.00 0.00 O ATOM 967 CB ARG A 74 14.821 18.357 7.285 1.00 0.00 C ATOM 968 CG ARG A 74 13.895 18.616 6.081 1.00 0.00 C ATOM 969 CD ARG A 74 12.985 19.822 6.298 1.00 0.00 C ATOM 970 NE ARG A 74 11.950 19.901 5.241 1.00 0.00 N ATOM 971 CZ ARG A 74 10.632 20.003 5.383 1.00 0.00 C ATOM 972 NH1 ARG A 74 10.063 20.133 6.564 1.00 0.00 N ATOM 973 NH2 ARG A 74 9.856 19.972 4.319 1.00 0.00 N ATOM 0 H ARG A 74 17.151 18.265 5.598 1.00 0.00 H new ATOM 0 HA ARG A 74 16.202 16.868 7.988 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.215 17.980 8.109 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.240 19.310 7.607 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.500 18.776 5.188 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.285 17.732 5.898 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.508 19.751 7.275 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.580 20.736 6.299 1.00 0.00 H new ATOM 0 HE ARG A 74 12.293 19.874 4.281 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.637 20.158 7.407 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.048 20.209 6.636 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.267 19.870 3.391 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.844 20.050 4.423 1.00 0.00 H new ATOM 987 N TYR A 75 14.646 15.465 6.403 1.00 0.00 N ATOM 988 CA TYR A 75 13.941 14.540 5.515 1.00 0.00 C ATOM 989 C TYR A 75 12.437 14.816 5.640 1.00 0.00 C ATOM 990 O TYR A 75 11.949 15.056 6.741 1.00 0.00 O ATOM 991 CB TYR A 75 14.241 13.079 5.884 1.00 0.00 C ATOM 992 CG TYR A 75 15.667 12.588 5.703 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.410 12.902 4.547 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.233 11.749 6.686 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.717 12.400 4.385 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.534 11.239 6.529 1.00 0.00 C ATOM 997 CZ TYR A 75 18.281 11.564 5.374 1.00 0.00 C ATOM 998 OH TYR A 75 19.544 11.079 5.216 1.00 0.00 O ATOM 0 H TYR A 75 14.330 15.404 7.371 1.00 0.00 H new ATOM 0 HA TYR A 75 14.276 14.693 4.489 1.00 0.00 H new ATOM 0 HB2 TYR A 75 13.965 12.932 6.928 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.588 12.441 5.289 1.00 0.00 H new ATOM 0 HD1 TYR A 75 15.976 13.530 3.783 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.662 11.496 7.567 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.288 12.655 3.504 1.00 0.00 H new ATOM 0 HE2 TYR A 75 17.961 10.601 7.289 1.00 0.00 H new ATOM 0 HH TYR A 75 19.779 10.522 5.987 1.00 0.00 H new ATOM 1008 N ALA A 76 11.711 14.799 4.529 1.00 0.00 N ATOM 1009 CA ALA A 76 10.261 14.949 4.441 1.00 0.00 C ATOM 1010 C ALA A 76 9.686 13.851 3.542 1.00 0.00 C ATOM 1011 O ALA A 76 10.437 13.258 2.771 1.00 0.00 O ATOM 1012 CB ALA A 76 9.958 16.346 3.889 1.00 0.00 C ATOM 0 H ALA A 76 12.141 14.673 3.613 1.00 0.00 H new ATOM 0 HA ALA A 76 9.797 14.847 5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 76 8.879 16.482 3.814 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.373 17.100 4.558 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.406 16.452 2.901 1.00 0.00 H new ATOM 1018 N LEU A 77 8.382 13.572 3.623 1.00 0.00 N ATOM 1019 CA LEU A 77 7.707 12.711 2.646 1.00 0.00 C ATOM 1020 C LEU A 77 7.811 13.321 1.237 1.00 0.00 C ATOM 1021 O LEU A 77 8.031 14.524 1.111 1.00 0.00 O ATOM 1022 CB LEU A 77 6.243 12.532 3.078 1.00 0.00 C ATOM 1023 CG LEU A 77 6.034 11.597 4.274 1.00 0.00 C ATOM 1024 CD1 LEU A 77 4.607 11.789 4.783 1.00 0.00 C ATOM 1025 CD2 LEU A 77 6.266 10.143 3.878 1.00 0.00 C ATOM 0 H LEU A 77 7.771 13.931 4.357 1.00 0.00 H new ATOM 0 HA LEU A 77 8.186 11.733 2.610 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.829 13.510 3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.674 12.148 2.231 1.00 0.00 H new ATOM 0 HG LEU A 77 6.751 11.839 5.059 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.434 11.133 5.636 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.466 12.826 5.088 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.901 11.545 3.989 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.111 9.501 4.745 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.566 9.864 3.090 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.287 10.023 3.515 1.00 0.00 H new ATOM 1037 N ALA A 78 7.632 12.490 0.202 1.00 0.00 N ATOM 1038 CA ALA A 78 7.760 12.857 -1.223 1.00 0.00 C ATOM 1039 C ALA A 78 7.129 14.213 -1.588 1.00 0.00 C ATOM 1040 O ALA A 78 7.757 15.013 -2.272 1.00 0.00 O ATOM 1041 CB ALA A 78 7.122 11.746 -2.065 1.00 0.00 C ATOM 0 H ALA A 78 7.385 11.509 0.333 1.00 0.00 H new ATOM 0 HA ALA A 78 8.825 12.965 -1.431 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.206 11.997 -3.122 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.636 10.804 -1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.070 11.646 -1.798 1.00 0.00 H new ATOM 1047 N ASP A 79 5.919 14.432 -1.063 1.00 0.00 N ATOM 1048 CA ASP A 79 5.128 15.660 -1.032 1.00 0.00 C ATOM 1049 C ASP A 79 3.812 15.411 -0.249 1.00 0.00 C ATOM 1050 O ASP A 79 3.576 14.325 0.299 1.00 0.00 O ATOM 1051 CB ASP A 79 4.887 16.225 -2.454 1.00 0.00 C ATOM 1052 CG ASP A 79 4.429 17.681 -2.380 1.00 0.00 C ATOM 1053 OD1 ASP A 79 5.234 18.544 -1.971 1.00 0.00 O ATOM 1054 OD2 ASP A 79 3.204 17.893 -2.529 1.00 0.00 O ATOM 0 H ASP A 79 5.420 13.671 -0.602 1.00 0.00 H new ATOM 0 HA ASP A 79 5.689 16.432 -0.505 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.804 16.155 -3.040 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.134 15.626 -2.967 1.00 0.00 H new ATOM 1059 N SER A 80 2.904 16.389 -0.262 1.00 0.00 N ATOM 1060 CA SER A 80 1.552 16.351 0.294 1.00 0.00 C ATOM 1061 C SER A 80 0.722 15.167 -0.207 1.00 0.00 C ATOM 1062 O SER A 80 -0.252 14.802 0.450 1.00 0.00 O ATOM 1063 CB SER A 80 0.813 17.634 -0.104 1.00 0.00 C ATOM 1064 OG SER A 80 -0.413 17.756 0.599 1.00 0.00 O ATOM 0 H SER A 80 3.110 17.291 -0.692 1.00 0.00 H new ATOM 0 HA SER A 80 1.663 16.252 1.374 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.443 18.499 0.104 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.622 17.629 -1.177 1.00 0.00 H new ATOM 0 HG SER A 80 -0.864 18.583 0.329 1.00 0.00 H new ATOM 1070 N HIS A 81 1.091 14.572 -1.350 1.00 0.00 N ATOM 1071 CA HIS A 81 0.440 13.387 -1.908 1.00 0.00 C ATOM 1072 C HIS A 81 0.510 12.193 -0.943 1.00 0.00 C ATOM 1073 O HIS A 81 -0.509 11.541 -0.720 1.00 0.00 O ATOM 1074 CB HIS A 81 1.048 13.065 -3.300 1.00 0.00 C ATOM 1075 CG HIS A 81 0.157 13.359 -4.491 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -1.114 13.911 -4.463 1.00 0.00 N ATOM 1077 CD2 HIS A 81 0.376 12.906 -5.764 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -1.673 13.743 -5.677 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -0.762 13.184 -6.503 1.00 0.00 N ATOM 0 H HIS A 81 1.866 14.910 -1.921 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.621 13.596 -2.044 1.00 0.00 H new ATOM 0 HB2 HIS A 81 1.972 13.632 -3.412 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.317 12.009 -3.323 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -1.551 14.366 -3.661 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.271 12.421 -6.125 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -2.684 14.011 -5.946 1.00 0.00 H new ATOM 1088 N LEU A 82 1.677 11.894 -0.357 1.00 0.00 N ATOM 1089 CA LEU A 82 1.801 10.760 0.579 1.00 0.00 C ATOM 1090 C LEU A 82 1.441 11.175 1.996 1.00 0.00 C ATOM 1091 O LEU A 82 0.837 10.380 2.702 1.00 0.00 O ATOM 1092 CB LEU A 82 3.174 10.069 0.540 1.00 0.00 C ATOM 1093 CG LEU A 82 3.795 9.933 -0.859 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.139 9.221 -0.711 1.00 0.00 C ATOM 1095 CD2 LEU A 82 2.884 9.148 -1.813 1.00 0.00 C ATOM 0 H LEU A 82 2.542 12.413 -0.510 1.00 0.00 H new ATOM 0 HA LEU A 82 1.082 10.016 0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.863 10.628 1.174 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.076 9.075 0.975 1.00 0.00 H new ATOM 0 HG LEU A 82 3.927 10.926 -1.290 1.00 0.00 H new ATOM 0 HD11 LEU A 82 5.602 9.111 -1.691 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.792 9.807 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.982 8.236 -0.271 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.359 9.074 -2.791 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.716 8.147 -1.415 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.929 9.664 -1.911 1.00 0.00 H new ATOM 1107 N ALA A 83 1.698 12.427 2.391 1.00 0.00 N ATOM 1108 CA ALA A 83 1.191 12.953 3.663 1.00 0.00 C ATOM 1109 C ALA A 83 -0.352 12.900 3.764 1.00 0.00 C ATOM 1110 O ALA A 83 -0.872 12.727 4.860 1.00 0.00 O ATOM 1111 CB ALA A 83 1.746 14.364 3.869 1.00 0.00 C ATOM 0 H ALA A 83 2.251 13.092 1.851 1.00 0.00 H new ATOM 0 HA ALA A 83 1.541 12.312 4.472 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.376 14.766 4.812 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.835 14.327 3.893 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.423 15.005 3.049 1.00 0.00 H new ATOM 1117 N ARG A 84 -1.074 12.976 2.633 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.522 12.725 2.530 1.00 0.00 C ATOM 1119 C ARG A 84 -2.866 11.242 2.743 1.00 0.00 C ATOM 1120 O ARG A 84 -3.435 10.909 3.781 1.00 0.00 O ATOM 1121 CB ARG A 84 -3.027 13.221 1.151 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.627 14.634 1.175 1.00 0.00 C ATOM 1123 CD ARG A 84 -5.072 14.625 1.695 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.677 15.973 1.642 1.00 0.00 N ATOM 1125 CZ ARG A 84 -6.940 16.261 1.943 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.786 15.354 2.377 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -7.380 17.494 1.801 1.00 0.00 N ATOM 0 H ARG A 84 -0.653 13.222 1.737 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.026 13.277 3.323 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.198 13.202 0.444 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -3.779 12.525 0.779 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.016 15.279 1.807 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.604 15.057 0.171 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.669 13.934 1.100 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.088 14.258 2.721 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.077 16.745 1.351 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.482 14.387 2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.747 15.617 2.597 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.753 18.223 1.461 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.348 17.720 2.031 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.435 10.348 1.844 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.799 8.922 1.900 1.00 0.00 C ATOM 1143 C ALA A 85 -2.290 8.202 3.171 1.00 0.00 C ATOM 1144 O ALA A 85 -2.808 7.149 3.552 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.335 8.246 0.601 1.00 0.00 C ATOM 0 H ALA A 85 -1.828 10.588 1.061 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.884 8.845 1.977 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.598 7.188 0.627 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.823 8.720 -0.250 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.254 8.349 0.503 1.00 0.00 H new ATOM 1151 N LEU A 86 -1.288 8.757 3.862 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.895 8.314 5.201 1.00 0.00 C ATOM 1153 C LEU A 86 -1.687 9.046 6.307 1.00 0.00 C ATOM 1154 O LEU A 86 -2.102 8.403 7.267 1.00 0.00 O ATOM 1155 CB LEU A 86 0.626 8.478 5.351 1.00 0.00 C ATOM 1156 CG LEU A 86 1.299 7.287 6.051 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.780 7.628 6.197 1.00 0.00 C ATOM 1158 CD2 LEU A 86 0.700 6.915 7.413 1.00 0.00 C ATOM 0 H LEU A 86 -0.725 9.529 3.505 1.00 0.00 H new ATOM 0 HA LEU A 86 -1.144 7.260 5.322 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.070 8.609 4.364 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.833 9.387 5.916 1.00 0.00 H new ATOM 0 HG LEU A 86 1.134 6.404 5.434 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.296 6.805 6.691 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.215 7.789 5.211 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.888 8.534 6.793 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.241 6.064 7.828 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.783 7.764 8.091 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.350 6.652 7.289 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.952 10.348 6.147 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.634 11.221 7.108 1.00 0.00 C ATOM 1172 C GLY A 87 -4.124 10.920 7.288 1.00 0.00 C ATOM 1173 O GLY A 87 -4.560 10.706 8.415 1.00 0.00 O ATOM 0 H GLY A 87 -1.682 10.846 5.299 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.139 11.134 8.075 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.521 12.256 6.784 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.903 10.864 6.198 1.00 0.00 N ATOM 1178 CA GLU A 88 -6.295 10.363 6.226 1.00 0.00 C ATOM 1179 C GLU A 88 -6.369 8.822 6.260 1.00 0.00 C ATOM 1180 O GLU A 88 -7.439 8.239 6.438 1.00 0.00 O ATOM 1181 CB GLU A 88 -7.140 10.980 5.099 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.864 10.498 3.657 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.566 11.651 2.690 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -7.204 12.726 2.793 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.661 11.498 1.844 1.00 0.00 O ATOM 0 H GLU A 88 -4.592 11.162 5.273 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.737 10.696 7.165 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -8.190 10.790 5.322 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.999 12.061 5.126 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.019 9.809 3.665 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.727 9.940 3.294 1.00 0.00 H new ATOM 1192 N LEU A 89 -5.193 8.198 6.113 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.856 6.800 6.332 1.00 0.00 C ATOM 1194 C LEU A 89 -5.310 5.885 5.193 1.00 0.00 C ATOM 1195 O LEU A 89 -6.494 5.757 4.902 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.372 6.330 7.710 1.00 0.00 C ATOM 1197 CG LEU A 89 -4.796 4.982 8.177 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -3.305 5.075 8.537 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.587 4.475 9.387 1.00 0.00 C ATOM 0 H LEU A 89 -4.374 8.722 5.805 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.769 6.726 6.336 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.133 7.091 8.453 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.459 6.253 7.671 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.888 4.283 7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -2.947 4.098 8.860 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.739 5.398 7.663 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.170 5.796 9.343 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.177 3.520 9.716 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.515 5.199 10.198 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.633 4.344 9.109 1.00 0.00 H new ATOM 1211 N VAL A 90 -4.349 5.095 4.715 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.405 3.956 3.777 1.00 0.00 C ATOM 1213 C VAL A 90 -5.657 3.075 3.844 1.00 0.00 C ATOM 1214 O VAL A 90 -5.920 2.317 2.920 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.216 3.003 4.045 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -1.890 3.449 3.442 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -3.034 2.769 5.563 1.00 0.00 C ATOM 0 H VAL A 90 -3.386 5.253 5.010 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.393 4.437 2.799 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.485 2.075 3.540 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.117 2.719 3.682 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.991 3.528 2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.612 4.420 3.852 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.193 2.096 5.729 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.840 3.721 6.057 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.941 2.325 5.974 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.391 3.082 4.960 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.746 2.556 5.107 1.00 0.00 C ATOM 1229 C GLN A 91 -7.817 1.017 5.200 1.00 0.00 C ATOM 1230 O GLN A 91 -8.851 0.463 5.562 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.643 3.135 4.006 1.00 0.00 C ATOM 1232 CG GLN A 91 -10.093 3.123 4.482 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.886 4.367 4.121 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.961 4.285 3.546 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -10.443 5.527 4.552 1.00 0.00 N ATOM 0 H GLN A 91 -6.035 3.476 5.830 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.124 2.887 6.074 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.335 4.153 3.767 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.543 2.549 3.093 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -10.594 2.253 4.058 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.105 3.002 5.565 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.544 5.584 5.031 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.998 6.370 4.408 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.692 0.350 4.934 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.304 -1.082 5.104 1.00 0.00 C ATOM 1246 C VAL A 92 -6.275 -1.494 6.550 1.00 0.00 C ATOM 1247 O VAL A 92 -5.292 -1.927 7.137 1.00 0.00 O ATOM 1248 CB VAL A 92 -4.941 -1.362 4.441 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -5.279 -1.215 2.977 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -3.816 -0.419 4.879 1.00 0.00 C ATOM 0 H VAL A 92 -5.907 0.865 4.535 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.069 -1.680 4.608 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.534 -2.335 4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.386 -1.391 2.378 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -6.046 -1.940 2.706 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -5.650 -0.207 2.789 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.894 -0.688 4.364 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.084 0.608 4.630 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.668 -0.505 5.956 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.455 -1.271 7.071 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.881 -1.173 8.426 1.00 0.00 C ATOM 1262 C VAL A 93 -6.777 -0.899 9.472 1.00 0.00 C ATOM 1263 O VAL A 93 -6.726 -1.562 10.501 1.00 0.00 O ATOM 1264 CB VAL A 93 -8.939 -2.236 8.826 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -9.890 -1.607 9.855 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -9.792 -2.734 7.641 1.00 0.00 C ATOM 0 H VAL A 93 -8.251 -1.135 6.448 1.00 0.00 H new ATOM 0 HA VAL A 93 -8.425 -0.229 8.454 1.00 0.00 H new ATOM 0 HB VAL A 93 -8.394 -3.093 9.221 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -10.642 -2.338 10.150 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -9.323 -1.296 10.732 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.381 -0.739 9.414 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -10.509 -3.474 7.995 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.327 -1.893 7.199 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -9.144 -3.187 6.891 1.00 0.00 H new ATOM 1276 N LEU A 94 -5.873 0.054 9.165 1.00 0.00 N ATOM 1277 CA LEU A 94 -4.626 0.353 9.887 1.00 0.00 C ATOM 1278 C LEU A 94 -3.667 -0.852 9.889 1.00 0.00 C ATOM 1279 O LEU A 94 -3.593 -1.603 10.858 1.00 0.00 O ATOM 1280 CB LEU A 94 -4.926 0.893 11.308 1.00 0.00 C ATOM 1281 CG LEU A 94 -3.684 1.300 12.135 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -2.842 2.387 11.452 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -4.134 1.798 13.514 1.00 0.00 C ATOM 0 H LEU A 94 -6.004 0.668 8.361 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.104 1.148 9.353 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.583 1.758 11.219 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.476 0.131 11.860 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.054 0.415 12.227 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.985 2.631 12.079 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.493 2.023 10.486 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.450 3.280 11.305 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.261 2.086 14.100 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.790 2.660 13.393 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.671 1.003 14.031 1.00 0.00 H new ATOM 1295 N ALA A 95 -2.877 -1.020 8.825 1.00 0.00 N ATOM 1296 CA ALA A 95 -1.786 -1.993 8.783 1.00 0.00 C ATOM 1297 C ALA A 95 -0.674 -1.652 9.807 1.00 0.00 C ATOM 1298 O ALA A 95 0.305 -0.989 9.478 1.00 0.00 O ATOM 1299 CB ALA A 95 -1.285 -2.107 7.335 1.00 0.00 C ATOM 0 H ALA A 95 -2.978 -0.481 7.965 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.146 -2.975 9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.470 -2.830 7.288 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.101 -2.438 6.693 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.927 -1.135 6.996 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.869 -2.119 11.044 1.00 0.00 N ATOM 1306 CA VAL A 96 0.091 -2.136 12.169 1.00 0.00 C ATOM 1307 C VAL A 96 1.356 -2.930 11.808 1.00 0.00 C ATOM 1308 O VAL A 96 1.283 -3.879 11.033 1.00 0.00 O ATOM 1309 CB VAL A 96 -0.553 -2.783 13.429 1.00 0.00 C ATOM 1310 CG1 VAL A 96 0.375 -2.903 14.657 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.790 -2.008 13.897 1.00 0.00 C ATOM 0 H VAL A 96 -1.765 -2.526 11.312 1.00 0.00 H new ATOM 0 HA VAL A 96 0.360 -1.101 12.378 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.800 -3.787 13.083 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.169 -3.366 15.480 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.239 -3.517 14.402 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.711 -1.911 14.957 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.210 -2.492 14.779 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.506 -0.985 14.145 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.534 -1.995 13.101 1.00 0.00 H new ATOM 1321 N ASP A 97 2.476 -2.594 12.462 1.00 0.00 N ATOM 1322 CA ASP A 97 3.807 -3.239 12.533 1.00 0.00 C ATOM 1323 C ASP A 97 3.839 -4.795 12.694 1.00 0.00 C ATOM 1324 O ASP A 97 4.918 -5.379 12.827 1.00 0.00 O ATOM 1325 CB ASP A 97 4.582 -2.615 13.733 1.00 0.00 C ATOM 1326 CG ASP A 97 4.626 -1.073 13.861 1.00 0.00 C ATOM 1327 OD1 ASP A 97 3.550 -0.440 13.758 1.00 0.00 O ATOM 1328 OD2 ASP A 97 5.725 -0.525 14.138 1.00 0.00 O ATOM 0 H ASP A 97 2.475 -1.749 13.033 1.00 0.00 H new ATOM 0 HA ASP A 97 4.258 -3.052 11.558 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.148 -3.012 14.651 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.610 -2.973 13.686 1.00 0.00 H new ATOM 1333 N THR A 98 2.682 -5.477 12.724 1.00 0.00 N ATOM 1334 CA THR A 98 2.466 -6.893 13.076 1.00 0.00 C ATOM 1335 C THR A 98 2.371 -7.878 11.912 1.00 0.00 C ATOM 1336 O THR A 98 1.762 -7.622 10.873 1.00 0.00 O ATOM 1337 CB THR A 98 1.178 -7.058 13.895 1.00 0.00 C ATOM 1338 OG1 THR A 98 0.217 -6.114 13.495 1.00 0.00 O ATOM 1339 CG2 THR A 98 1.433 -6.836 15.385 1.00 0.00 C ATOM 0 H THR A 98 1.803 -5.018 12.484 1.00 0.00 H new ATOM 0 HA THR A 98 3.368 -7.141 13.634 1.00 0.00 H new ATOM 0 HB THR A 98 0.824 -8.074 13.722 1.00 0.00 H new ATOM 0 HG1 THR A 98 -0.665 -6.385 13.825 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.501 -6.960 15.936 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.164 -7.562 15.741 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.816 -5.828 15.542 1.00 0.00 H new ATOM 1347 N ASP A 99 2.859 -9.092 12.173 1.00 0.00 N ATOM 1348 CA ASP A 99 2.662 -10.293 11.356 1.00 0.00 C ATOM 1349 C ASP A 99 1.379 -11.031 11.811 1.00 0.00 C ATOM 1350 O ASP A 99 1.441 -12.049 12.504 1.00 0.00 O ATOM 1351 CB ASP A 99 3.931 -11.180 11.398 1.00 0.00 C ATOM 1352 CG ASP A 99 3.953 -12.274 10.316 1.00 0.00 C ATOM 1353 OD1 ASP A 99 3.428 -12.029 9.208 1.00 0.00 O ATOM 1354 OD2 ASP A 99 4.552 -13.357 10.519 1.00 0.00 O ATOM 0 H ASP A 99 3.429 -9.274 12.999 1.00 0.00 H new ATOM 0 HA ASP A 99 2.513 -10.020 10.311 1.00 0.00 H new ATOM 0 HB2 ASP A 99 4.811 -10.547 11.281 1.00 0.00 H new ATOM 0 HB3 ASP A 99 4.004 -11.649 12.379 1.00 0.00 H new ATOM 1359 N GLN A 100 0.192 -10.486 11.491 1.00 0.00 N ATOM 1360 CA GLN A 100 -1.067 -11.228 11.682 1.00 0.00 C ATOM 1361 C GLN A 100 -1.105 -12.455 10.738 1.00 0.00 C ATOM 1362 O GLN A 100 -0.631 -12.347 9.607 1.00 0.00 O ATOM 1363 CB GLN A 100 -2.345 -10.417 11.400 1.00 0.00 C ATOM 1364 CG GLN A 100 -2.858 -9.414 12.430 1.00 0.00 C ATOM 1365 CD GLN A 100 -1.928 -8.241 12.629 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -1.716 -7.817 13.752 1.00 0.00 O ATOM 1367 NE2 GLN A 100 -1.298 -7.729 11.588 1.00 0.00 N ATOM 0 H GLN A 100 0.078 -9.549 11.105 1.00 0.00 H new ATOM 0 HA GLN A 100 -1.067 -11.500 12.737 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -2.184 -9.872 10.470 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -3.148 -11.131 11.216 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -3.835 -9.046 12.115 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -3.001 -9.922 13.383 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -1.482 -8.090 10.652 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -0.627 -6.972 11.720 1.00 0.00 H new ATOM 1376 N PRO A 101 -1.725 -13.587 11.131 1.00 0.00 N ATOM 1377 CA PRO A 101 -1.773 -14.803 10.321 1.00 0.00 C ATOM 1378 C PRO A 101 -2.697 -14.668 9.101 1.00 0.00 C ATOM 1379 O PRO A 101 -3.891 -14.937 9.179 1.00 0.00 O ATOM 1380 CB PRO A 101 -2.193 -15.920 11.286 1.00 0.00 C ATOM 1381 CG PRO A 101 -3.032 -15.183 12.328 1.00 0.00 C ATOM 1382 CD PRO A 101 -2.334 -13.827 12.433 1.00 0.00 C ATOM 0 HA PRO A 101 -0.804 -15.024 9.874 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -2.769 -16.694 10.779 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.329 -16.409 11.737 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -4.070 -15.080 12.011 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -3.041 -15.707 13.283 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -3.046 -13.040 12.682 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -1.580 -13.836 13.221 1.00 0.00 H new ATOM 1390 N CYS A 102 -2.092 -14.360 7.949 1.00 0.00 N ATOM 1391 CA CYS A 102 -2.676 -14.137 6.616 1.00 0.00 C ATOM 1392 C CYS A 102 -3.561 -15.288 6.053 1.00 0.00 C ATOM 1393 O CYS A 102 -4.156 -15.188 4.981 1.00 0.00 O ATOM 1394 CB CYS A 102 -1.447 -13.787 5.742 1.00 0.00 C ATOM 1395 SG CYS A 102 -1.315 -14.451 4.038 1.00 0.00 S ATOM 0 H CYS A 102 -1.078 -14.249 7.921 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.421 -13.342 6.641 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -1.398 -12.700 5.671 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -0.560 -14.111 6.286 1.00 0.00 H new ATOM 0 HG CYS A 102 -1.916 -13.647 3.211 1.00 0.00 H new ATOM 1476 N LEU B 11 1.023 -6.614 8.004 1.00 0.00 N ATOM 1477 CA LEU B 11 1.492 -5.483 7.186 1.00 0.00 C ATOM 1478 C LEU B 11 2.351 -5.981 6.012 1.00 0.00 C ATOM 1479 O LEU B 11 2.068 -5.670 4.854 1.00 0.00 O ATOM 1480 CB LEU B 11 2.232 -4.507 8.115 1.00 0.00 C ATOM 1481 CG LEU B 11 3.137 -3.460 7.446 1.00 0.00 C ATOM 1482 CD1 LEU B 11 2.336 -2.505 6.556 1.00 0.00 C ATOM 1483 CD2 LEU B 11 3.898 -2.676 8.521 1.00 0.00 C ATOM 0 HA LEU B 11 0.657 -4.954 6.727 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.489 -3.980 8.714 1.00 0.00 H new ATOM 0 HB3 LEU B 11 2.842 -5.091 8.804 1.00 0.00 H new ATOM 0 HG LEU B 11 3.847 -3.984 6.805 1.00 0.00 H new ATOM 0 HD11 LEU B 11 3.011 -1.780 6.101 1.00 0.00 H new ATOM 0 HD12 LEU B 11 1.832 -3.073 5.774 1.00 0.00 H new ATOM 0 HD13 LEU B 11 1.594 -1.982 7.159 1.00 0.00 H new ATOM 0 HD21 LEU B 11 4.539 -1.934 8.045 1.00 0.00 H new ATOM 0 HD22 LEU B 11 3.187 -2.174 9.177 1.00 0.00 H new ATOM 0 HD23 LEU B 11 4.510 -3.362 9.107 1.00 0.00 H new ATOM 1495 N ALA B 12 3.295 -6.878 6.304 1.00 0.00 N ATOM 1496 CA ALA B 12 4.184 -7.499 5.324 1.00 0.00 C ATOM 1497 C ALA B 12 3.520 -8.417 4.282 1.00 0.00 C ATOM 1498 O ALA B 12 4.225 -8.914 3.402 1.00 0.00 O ATOM 1499 CB ALA B 12 5.312 -8.197 6.098 1.00 0.00 C ATOM 0 H ALA B 12 3.466 -7.201 7.256 1.00 0.00 H new ATOM 0 HA ALA B 12 4.573 -6.702 4.690 1.00 0.00 H new ATOM 0 HB1 ALA B 12 5.996 -8.672 5.395 1.00 0.00 H new ATOM 0 HB2 ALA B 12 5.855 -7.462 6.691 1.00 0.00 H new ATOM 0 HB3 ALA B 12 4.887 -8.953 6.758 1.00 0.00 H new ATOM 1505 N ARG B 13 2.201 -8.644 4.365 1.00 0.00 N ATOM 1506 CA ARG B 13 1.434 -9.505 3.452 1.00 0.00 C ATOM 1507 C ARG B 13 0.268 -8.727 2.820 1.00 0.00 C ATOM 1508 O ARG B 13 0.139 -8.751 1.599 1.00 0.00 O ATOM 1509 CB ARG B 13 0.996 -10.784 4.191 1.00 0.00 C ATOM 1510 CG ARG B 13 2.215 -11.494 4.827 1.00 0.00 C ATOM 1511 CD ARG B 13 1.850 -12.722 5.664 1.00 0.00 C ATOM 1512 NE ARG B 13 2.890 -13.007 6.667 1.00 0.00 N ATOM 1513 CZ ARG B 13 3.986 -13.738 6.542 1.00 0.00 C ATOM 1514 NH1 ARG B 13 4.334 -14.322 5.417 1.00 0.00 N ATOM 1515 NH2 ARG B 13 4.771 -13.883 7.588 1.00 0.00 N ATOM 0 H ARG B 13 1.621 -8.221 5.090 1.00 0.00 H new ATOM 0 HA ARG B 13 2.063 -9.820 2.620 1.00 0.00 H new ATOM 0 HB2 ARG B 13 0.271 -10.532 4.965 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.498 -11.459 3.495 1.00 0.00 H new ATOM 0 HG2 ARG B 13 2.901 -11.797 4.035 1.00 0.00 H new ATOM 0 HG3 ARG B 13 2.749 -10.783 5.457 1.00 0.00 H new ATOM 0 HD2 ARG B 13 0.895 -12.556 6.163 1.00 0.00 H new ATOM 0 HD3 ARG B 13 1.723 -13.586 5.012 1.00 0.00 H new ATOM 0 HE ARG B 13 2.746 -12.583 7.583 1.00 0.00 H new ATOM 0 HH11 ARG B 13 3.748 -14.222 4.588 1.00 0.00 H new ATOM 0 HH12 ARG B 13 5.190 -14.875 5.373 1.00 0.00 H new ATOM 0 HH21 ARG B 13 4.530 -13.436 8.473 1.00 0.00 H new ATOM 0 HH22 ARG B 13 5.621 -14.442 7.514 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.456 -7.905 3.591 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.437 -6.912 3.115 1.00 0.00 C ATOM 1531 C LEU B 14 -0.763 -6.011 2.086 1.00 0.00 C ATOM 1532 O LEU B 14 -1.228 -5.901 0.954 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.967 -6.108 4.333 1.00 0.00 C ATOM 1534 CG LEU B 14 -2.765 -4.791 4.120 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -1.897 -3.606 3.664 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.989 -4.926 3.202 1.00 0.00 C ATOM 0 H LEU B 14 -0.373 -7.912 4.608 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.288 -7.396 2.635 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.602 -6.780 4.911 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.107 -5.866 4.958 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.136 -4.573 5.121 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -2.524 -2.724 3.537 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.134 -3.404 4.415 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -1.417 -3.850 2.716 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -4.484 -3.959 3.111 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.669 -5.264 2.216 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.684 -5.651 3.626 1.00 0.00 H new ATOM 1548 N GLY B 15 0.382 -5.428 2.454 1.00 0.00 N ATOM 1549 CA GLY B 15 1.130 -4.519 1.595 1.00 0.00 C ATOM 1550 C GLY B 15 1.816 -5.266 0.460 1.00 0.00 C ATOM 1551 O GLY B 15 2.036 -4.671 -0.584 1.00 0.00 O ATOM 0 H GLY B 15 0.815 -5.578 3.365 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.456 -3.768 1.183 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.876 -3.988 2.186 1.00 0.00 H new ATOM 1555 N ARG B 16 2.082 -6.576 0.603 1.00 0.00 N ATOM 1556 CA ARG B 16 2.518 -7.406 -0.527 1.00 0.00 C ATOM 1557 C ARG B 16 1.381 -7.577 -1.537 1.00 0.00 C ATOM 1558 O ARG B 16 1.610 -7.418 -2.728 1.00 0.00 O ATOM 1559 CB ARG B 16 3.016 -8.794 -0.096 1.00 0.00 C ATOM 1560 CG ARG B 16 3.934 -9.374 -1.196 1.00 0.00 C ATOM 1561 CD ARG B 16 4.057 -10.907 -1.219 1.00 0.00 C ATOM 1562 NE ARG B 16 4.311 -11.559 0.078 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.075 -11.203 1.101 1.00 0.00 C ATOM 1564 NH1 ARG B 16 5.833 -10.128 1.115 1.00 0.00 N ATOM 1565 NH2 ARG B 16 5.073 -11.958 2.170 1.00 0.00 N ATOM 0 H ARG B 16 2.002 -7.079 1.487 1.00 0.00 H new ATOM 0 HA ARG B 16 3.356 -6.879 -0.984 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.560 -8.721 0.846 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.170 -9.459 0.075 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.563 -9.043 -2.166 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.930 -8.949 -1.074 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.137 -11.318 -1.635 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.863 -11.176 -1.901 1.00 0.00 H new ATOM 0 HE ARG B 16 3.811 -12.438 0.212 1.00 0.00 H new ATOM 0 HH11 ARG B 16 5.856 -9.510 0.304 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.397 -9.913 1.937 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.493 -12.797 2.201 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.651 -11.708 2.972 1.00 0.00 H new ATOM 1579 N ALA B 17 0.156 -7.852 -1.090 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.000 -8.039 -1.963 1.00 0.00 C ATOM 1581 C ALA B 17 -1.391 -6.751 -2.706 1.00 0.00 C ATOM 1582 O ALA B 17 -1.863 -6.843 -3.840 1.00 0.00 O ATOM 1583 CB ALA B 17 -2.141 -8.596 -1.112 1.00 0.00 C ATOM 0 H ALA B 17 -0.063 -7.952 -0.099 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.753 -8.747 -2.754 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -3.021 -8.747 -1.737 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.838 -9.548 -0.676 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.378 -7.891 -0.315 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.147 -5.569 -2.112 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.261 -4.261 -2.784 1.00 0.00 C ATOM 1591 C LEU B 18 0.084 -3.765 -3.385 1.00 0.00 C ATOM 1592 O LEU B 18 0.180 -2.627 -3.833 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.001 -3.229 -1.889 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.512 -3.542 -1.687 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.761 -4.505 -0.518 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.372 -2.288 -1.426 1.00 0.00 C ATOM 0 H LEU B 18 -0.860 -5.494 -1.136 1.00 0.00 H new ATOM 0 HA LEU B 18 -1.895 -4.392 -3.661 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.514 -3.192 -0.915 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.901 -2.239 -2.333 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.808 -3.998 -2.632 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.831 -4.690 -0.421 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.246 -5.447 -0.706 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.384 -4.063 0.404 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.413 -2.582 -1.295 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.020 -1.787 -0.524 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.291 -1.608 -2.274 1.00 0.00 H new ATOM 1608 N ALA B 19 1.115 -4.621 -3.412 1.00 0.00 N ATOM 1609 CA ALA B 19 2.357 -4.447 -4.191 1.00 0.00 C ATOM 1610 C ALA B 19 2.473 -5.475 -5.342 1.00 0.00 C ATOM 1611 O ALA B 19 3.492 -5.549 -6.023 1.00 0.00 O ATOM 1612 CB ALA B 19 3.563 -4.589 -3.251 1.00 0.00 C ATOM 0 H ALA B 19 1.110 -5.487 -2.873 1.00 0.00 H new ATOM 0 HA ALA B 19 2.335 -3.454 -4.641 1.00 0.00 H new ATOM 0 HB1 ALA B 19 4.484 -4.462 -3.819 1.00 0.00 H new ATOM 0 HB2 ALA B 19 3.509 -3.828 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.553 -5.578 -2.793 1.00 0.00 H new ATOM 1618 N ASP B 20 1.475 -6.335 -5.514 1.00 0.00 N ATOM 1619 CA ASP B 20 1.491 -7.495 -6.377 1.00 0.00 C ATOM 1620 C ASP B 20 1.357 -7.119 -7.871 1.00 0.00 C ATOM 1621 O ASP B 20 0.606 -6.197 -8.204 1.00 0.00 O ATOM 1622 CB ASP B 20 0.331 -8.358 -5.873 1.00 0.00 C ATOM 1623 CG ASP B 20 0.209 -9.696 -6.574 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.146 -9.685 -7.776 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.384 -10.747 -5.927 1.00 0.00 O ATOM 0 H ASP B 20 0.587 -6.229 -5.024 1.00 0.00 H new ATOM 0 HA ASP B 20 2.440 -8.029 -6.333 1.00 0.00 H new ATOM 0 HB2 ASP B 20 0.457 -8.530 -4.804 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.601 -7.807 -6.000 1.00 0.00 H new ATOM 1630 N PRO B 21 2.003 -7.873 -8.784 1.00 0.00 N ATOM 1631 CA PRO B 21 1.978 -7.660 -10.237 1.00 0.00 C ATOM 1632 C PRO B 21 0.598 -7.713 -10.902 1.00 0.00 C ATOM 1633 O PRO B 21 0.464 -7.263 -12.035 1.00 0.00 O ATOM 1634 CB PRO B 21 2.817 -8.829 -10.802 1.00 0.00 C ATOM 1635 CG PRO B 21 2.537 -9.918 -9.756 1.00 0.00 C ATOM 1636 CD PRO B 21 2.762 -9.085 -8.509 1.00 0.00 C ATOM 0 HA PRO B 21 2.344 -6.654 -10.441 1.00 0.00 H new ATOM 0 HB2 PRO B 21 2.495 -9.123 -11.801 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.877 -8.583 -10.868 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.526 -10.319 -9.821 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.221 -10.764 -9.830 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.402 -9.593 -7.614 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.819 -8.872 -8.351 1.00 0.00 H new ATOM 1644 N THR B 22 -0.414 -8.312 -10.262 1.00 0.00 N ATOM 1645 CA THR B 22 -1.750 -8.462 -10.859 1.00 0.00 C ATOM 1646 C THR B 22 -2.871 -8.306 -9.854 1.00 0.00 C ATOM 1647 O THR B 22 -3.929 -7.818 -10.249 1.00 0.00 O ATOM 1648 CB THR B 22 -1.926 -9.776 -11.646 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.756 -10.563 -11.671 1.00 0.00 O ATOM 1650 CG2 THR B 22 -2.320 -9.478 -13.092 1.00 0.00 C ATOM 0 H THR B 22 -0.333 -8.704 -9.324 1.00 0.00 H new ATOM 0 HA THR B 22 -1.818 -7.639 -11.570 1.00 0.00 H new ATOM 0 HB THR B 22 -2.707 -10.333 -11.129 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.924 -11.383 -12.181 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.441 -10.414 -13.637 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.260 -8.926 -13.107 1.00 0.00 H new ATOM 0 HG23 THR B 22 -1.541 -8.881 -13.566 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.687 -8.661 -8.570 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.733 -8.462 -7.553 1.00 0.00 C ATOM 1660 C ARG B 23 -4.110 -6.992 -7.373 1.00 0.00 C ATOM 1661 O ARG B 23 -5.285 -6.719 -7.166 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.420 -9.156 -6.222 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.923 -10.614 -6.210 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.825 -11.631 -5.938 1.00 0.00 C ATOM 1665 NE ARG B 23 -1.881 -11.792 -7.060 1.00 0.00 N ATOM 1666 CZ ARG B 23 -2.044 -11.999 -8.363 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -3.210 -12.244 -8.924 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.976 -11.969 -9.123 1.00 0.00 N ATOM 0 H ARG B 23 -1.830 -9.084 -8.214 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.620 -8.959 -7.945 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.344 -9.140 -6.047 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -3.884 -8.604 -5.405 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.699 -10.716 -5.451 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -4.386 -10.839 -7.171 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -2.272 -11.328 -5.049 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -3.281 -12.596 -5.716 1.00 0.00 H new ATOM 0 HE ARG B 23 -0.902 -11.732 -6.778 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -4.053 -12.283 -8.351 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -3.270 -12.395 -9.931 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -0.061 -11.791 -8.710 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -1.061 -12.123 -10.128 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.189 -6.059 -7.579 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.468 -4.625 -7.688 1.00 0.00 C ATOM 1684 C CYS B 24 -4.554 -4.347 -8.757 1.00 0.00 C ATOM 1685 O CYS B 24 -5.627 -3.809 -8.456 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.088 -4.014 -7.983 1.00 0.00 C ATOM 1687 SG CYS B 24 -1.118 -4.245 -6.468 1.00 0.00 S ATOM 0 H CYS B 24 -2.198 -6.281 -7.678 1.00 0.00 H new ATOM 0 HA CYS B 24 -3.898 -4.178 -6.791 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.614 -4.508 -8.831 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.173 -2.957 -8.236 1.00 0.00 H new ATOM 0 HG CYS B 24 -0.035 -4.910 -6.743 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.337 -4.874 -9.973 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.308 -4.843 -11.072 1.00 0.00 C ATOM 1695 C ARG B 25 -6.612 -5.591 -10.726 1.00 0.00 C ATOM 1696 O ARG B 25 -7.690 -5.054 -10.965 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.669 -5.364 -12.378 1.00 0.00 C ATOM 1698 CG ARG B 25 -5.291 -4.657 -13.595 1.00 0.00 C ATOM 1699 CD ARG B 25 -5.020 -5.345 -14.940 1.00 0.00 C ATOM 1700 NE ARG B 25 -3.591 -5.535 -15.238 1.00 0.00 N ATOM 1701 CZ ARG B 25 -3.107 -6.238 -16.255 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -3.882 -6.747 -17.191 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -1.815 -6.439 -16.331 1.00 0.00 N ATOM 0 H ARG B 25 -3.465 -5.341 -10.221 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.592 -3.803 -11.230 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.593 -5.191 -12.359 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -4.817 -6.441 -12.459 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -6.369 -4.588 -13.447 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -4.910 -3.637 -13.640 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -5.514 -6.317 -14.946 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -5.471 -4.753 -15.737 1.00 0.00 H new ATOM 0 HE ARG B 25 -2.919 -5.091 -14.613 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -4.891 -6.606 -17.150 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -3.473 -7.282 -17.957 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -1.197 -6.058 -15.615 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -1.427 -6.977 -17.106 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.550 -6.781 -10.100 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.730 -7.540 -9.602 1.00 0.00 C ATOM 1719 C ILE B 26 -8.614 -6.659 -8.742 1.00 0.00 C ATOM 1720 O ILE B 26 -9.793 -6.512 -9.028 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.342 -8.821 -8.802 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.561 -9.770 -9.726 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.583 -9.498 -8.198 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -6.624 -11.285 -9.475 1.00 0.00 C ATOM 0 H ILE B 26 -5.666 -7.257 -9.919 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.275 -7.861 -10.490 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.704 -8.546 -7.962 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.905 -9.592 -10.745 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.512 -9.475 -9.688 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.280 -10.388 -7.646 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.083 -8.805 -7.522 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.268 -9.782 -8.997 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.017 -11.802 -10.218 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -6.243 -11.505 -8.478 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -7.657 -11.624 -9.551 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.029 -6.107 -7.685 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.724 -5.308 -6.677 1.00 0.00 C ATOM 1738 C LEU B 27 -9.477 -4.117 -7.308 1.00 0.00 C ATOM 1739 O LEU B 27 -10.649 -3.928 -6.988 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.714 -4.899 -5.581 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.190 -6.044 -4.679 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.016 -5.544 -3.824 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.250 -6.614 -3.734 1.00 0.00 C ATOM 0 H LEU B 27 -7.031 -6.204 -7.499 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.504 -5.904 -6.204 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.860 -4.422 -6.062 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.182 -4.148 -4.945 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.884 -6.839 -5.359 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.654 -6.356 -3.193 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.211 -5.204 -4.475 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.349 -4.717 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -7.811 -7.411 -3.134 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.615 -5.824 -3.077 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.080 -7.013 -4.317 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.868 -3.376 -8.247 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.538 -2.240 -8.929 1.00 0.00 C ATOM 1757 C VAL B 28 -10.540 -2.687 -9.997 1.00 0.00 C ATOM 1758 O VAL B 28 -11.558 -2.031 -10.193 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.537 -1.207 -9.503 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.743 -1.704 -10.717 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -9.217 0.133 -9.831 1.00 0.00 C ATOM 0 H VAL B 28 -7.910 -3.538 -8.557 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.108 -1.739 -8.146 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.815 -1.055 -8.701 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.066 -0.919 -11.055 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.166 -2.586 -10.438 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.432 -1.961 -11.522 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.478 0.828 -10.231 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -10.001 -0.028 -10.571 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.654 0.551 -8.924 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.298 -3.822 -10.658 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.251 -4.377 -11.604 1.00 0.00 C ATOM 1773 C ALA B 29 -12.480 -4.969 -10.901 1.00 0.00 C ATOM 1774 O ALA B 29 -13.587 -4.883 -11.431 1.00 0.00 O ATOM 1775 CB ALA B 29 -10.522 -5.401 -12.468 1.00 0.00 C ATOM 0 H ALA B 29 -9.445 -4.371 -10.550 1.00 0.00 H new ATOM 0 HA ALA B 29 -11.642 -3.584 -12.241 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.219 -5.832 -13.187 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.706 -4.913 -13.001 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.120 -6.191 -11.834 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.340 -5.508 -9.681 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.472 -6.054 -8.947 1.00 0.00 C ATOM 1783 C LEU B 30 -14.547 -5.017 -8.664 1.00 0.00 C ATOM 1784 O LEU B 30 -15.722 -5.346 -8.812 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.973 -6.655 -7.640 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.876 -7.801 -7.167 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.149 -8.920 -8.190 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.095 -8.378 -6.010 1.00 0.00 C ATOM 0 H LEU B 30 -11.449 -5.574 -9.188 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.932 -6.820 -9.571 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.956 -7.023 -7.773 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.934 -5.881 -6.874 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.871 -7.414 -6.946 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.798 -9.672 -7.742 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.636 -8.498 -9.069 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -13.207 -9.382 -8.484 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.645 -9.216 -5.582 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.124 -8.724 -6.363 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.952 -7.611 -5.249 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.102 -3.809 -8.294 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.850 -2.568 -8.083 1.00 0.00 C ATOM 1802 C LEU B 31 -15.906 -2.296 -9.173 1.00 0.00 C ATOM 1803 O LEU B 31 -16.980 -1.798 -8.852 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.786 -1.444 -8.027 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.833 -0.488 -6.824 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.615 0.437 -6.919 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -15.137 0.315 -6.754 1.00 0.00 C ATOM 0 H LEU B 31 -13.108 -3.665 -8.118 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.430 -2.630 -7.162 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.801 -1.910 -8.049 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.877 -0.848 -8.935 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.804 -1.071 -5.903 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.618 1.130 -6.078 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.703 -0.159 -6.895 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -12.657 0.999 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -15.113 0.972 -5.885 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -15.245 0.913 -7.659 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.981 -0.369 -6.668 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.592 -2.639 -10.425 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.449 -2.494 -11.612 1.00 0.00 C ATOM 1821 C ASP B 32 -17.319 -3.739 -11.873 1.00 0.00 C ATOM 1822 O ASP B 32 -18.463 -3.638 -12.311 1.00 0.00 O ATOM 1823 CB ASP B 32 -15.495 -2.253 -12.799 1.00 0.00 C ATOM 1824 CG ASP B 32 -16.198 -2.077 -14.148 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -16.517 -0.912 -14.475 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -16.346 -3.094 -14.867 1.00 0.00 O ATOM 0 H ASP B 32 -14.686 -3.047 -10.654 1.00 0.00 H new ATOM 0 HA ASP B 32 -17.148 -1.670 -11.467 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -14.898 -1.364 -12.595 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -14.803 -3.092 -12.870 1.00 0.00 H new ATOM 1831 N GLY B 33 -16.784 -4.926 -11.564 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.367 -6.205 -11.959 1.00 0.00 C ATOM 1833 C GLY B 33 -18.289 -6.814 -10.918 1.00 0.00 C ATOM 1834 O GLY B 33 -19.474 -7.004 -11.170 1.00 0.00 O ATOM 0 H GLY B 33 -15.923 -5.022 -11.026 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.924 -6.067 -12.886 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.562 -6.909 -12.172 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.705 -7.238 -9.793 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.319 -8.094 -8.750 1.00 0.00 C ATOM 1840 C VAL B 34 -19.269 -9.193 -9.273 1.00 0.00 C ATOM 1841 O VAL B 34 -20.265 -9.506 -8.623 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.956 -7.282 -7.595 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.915 -6.507 -6.794 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.064 -6.321 -8.053 1.00 0.00 C ATOM 0 H VAL B 34 -16.743 -6.986 -9.565 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.468 -8.636 -8.338 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.416 -8.034 -6.955 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.409 -5.953 -5.995 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.196 -7.203 -6.362 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.395 -5.810 -7.451 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.462 -5.787 -7.190 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.653 -5.605 -8.765 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.863 -6.888 -8.530 1.00 0.00 H new ATOM 1854 N CYS B 35 -18.992 -9.771 -10.451 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.949 -10.646 -11.138 1.00 0.00 C ATOM 1856 C CYS B 35 -19.937 -12.082 -10.607 1.00 0.00 C ATOM 1857 O CYS B 35 -20.925 -12.554 -10.062 1.00 0.00 O ATOM 1858 CB CYS B 35 -19.759 -10.605 -12.677 1.00 0.00 C ATOM 1859 SG CYS B 35 -18.863 -9.158 -13.310 1.00 0.00 S ATOM 0 H CYS B 35 -18.110 -9.647 -10.948 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.938 -10.247 -10.914 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.226 -11.505 -12.985 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.741 -10.639 -13.149 1.00 0.00 H new ATOM 0 HG CYS B 35 -18.767 -9.239 -14.604 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.809 -12.776 -10.763 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.710 -14.220 -10.516 1.00 0.00 C ATOM 1867 C TYR B 36 -17.273 -14.723 -10.310 1.00 0.00 C ATOM 1868 O TYR B 36 -16.327 -14.041 -10.732 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.447 -15.022 -11.618 1.00 0.00 C ATOM 1870 CG TYR B 36 -19.349 -14.562 -13.059 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -18.311 -15.018 -13.895 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.373 -13.755 -13.590 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -18.281 -14.640 -15.253 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -20.354 -13.379 -14.943 1.00 0.00 C ATOM 1875 CZ TYR B 36 -19.308 -13.824 -15.781 1.00 0.00 C ATOM 1876 OH TYR B 36 -19.304 -13.482 -17.097 1.00 0.00 O ATOM 0 H TYR B 36 -17.932 -12.352 -11.066 1.00 0.00 H new ATOM 0 HA TYR B 36 -19.211 -14.397 -9.564 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.082 -16.048 -11.576 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.504 -15.048 -11.353 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -17.538 -15.657 -13.496 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -21.179 -13.423 -12.952 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -17.474 -14.973 -15.889 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -21.137 -12.751 -15.342 1.00 0.00 H new ATOM 0 HH TYR B 36 -20.082 -12.919 -17.291 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.065 -15.918 -9.711 1.00 0.00 N ATOM 1887 CA PRO B 37 -15.765 -16.573 -9.713 1.00 0.00 C ATOM 1888 C PRO B 37 -15.357 -16.787 -11.172 1.00 0.00 C ATOM 1889 O PRO B 37 -16.139 -17.289 -11.976 1.00 0.00 O ATOM 1890 CB PRO B 37 -15.946 -17.893 -8.954 1.00 0.00 C ATOM 1891 CG PRO B 37 -17.433 -18.195 -9.107 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.047 -16.798 -9.087 1.00 0.00 C ATOM 0 HA PRO B 37 -14.979 -15.992 -9.230 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.330 -18.686 -9.378 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -15.663 -17.795 -7.906 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -17.648 -18.722 -10.037 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -17.808 -18.817 -8.294 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -18.990 -16.779 -9.632 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.262 -16.481 -8.067 1.00 0.00 H new ATOM 1900 N GLY B 38 -14.157 -16.331 -11.532 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.686 -16.378 -12.914 1.00 0.00 C ATOM 1902 C GLY B 38 -14.197 -15.243 -13.805 1.00 0.00 C ATOM 1903 O GLY B 38 -13.830 -15.237 -14.974 1.00 0.00 O ATOM 0 H GLY B 38 -13.489 -15.922 -10.878 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -12.596 -16.357 -12.913 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -13.986 -17.329 -13.353 1.00 0.00 H new ATOM 1907 N GLN B 39 -14.968 -14.259 -13.309 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.282 -13.047 -14.096 1.00 0.00 C ATOM 1909 C GLN B 39 -14.002 -12.267 -14.408 1.00 0.00 C ATOM 1910 O GLN B 39 -13.807 -11.839 -15.542 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.347 -12.161 -13.422 1.00 0.00 C ATOM 1912 CG GLN B 39 -15.872 -11.228 -12.291 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.190 -9.915 -12.702 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -15.447 -9.336 -13.855 1.00 0.00 O flip ATOM 1915 NE2 GLN B 39 -14.388 -9.384 -11.955 1.00 0.00 N flip ATOM 0 H GLN B 39 -15.383 -14.275 -12.377 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.721 -13.373 -15.039 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -16.814 -11.548 -14.193 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.123 -12.812 -13.020 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -16.735 -10.981 -11.673 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.178 -11.786 -11.662 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -14.170 -9.811 -11.055 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -13.935 -8.512 -12.230 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.103 -12.171 -13.418 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.796 -11.532 -13.516 1.00 0.00 C ATOM 1926 C LEU B 40 -10.942 -12.088 -14.665 1.00 0.00 C ATOM 1927 O LEU B 40 -10.039 -11.404 -15.120 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.067 -11.708 -12.172 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.619 -10.873 -11.005 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.179 -11.522 -9.684 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.146 -9.415 -11.111 1.00 0.00 C ATOM 0 H LEU B 40 -13.281 -12.555 -12.490 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.950 -10.476 -13.738 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.106 -12.761 -11.893 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.016 -11.454 -12.312 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.708 -10.854 -11.041 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.564 -10.940 -8.847 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -11.570 -12.538 -9.630 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.090 -11.549 -9.637 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.547 -8.841 -10.276 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.057 -9.383 -11.083 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.498 -8.986 -12.049 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.240 -13.277 -15.191 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.561 -13.787 -16.387 1.00 0.00 C ATOM 1945 C ALA B 41 -10.708 -12.842 -17.600 1.00 0.00 C ATOM 1946 O ALA B 41 -9.781 -12.729 -18.397 1.00 0.00 O ATOM 1947 CB ALA B 41 -11.123 -15.175 -16.693 1.00 0.00 C ATOM 0 H ALA B 41 -11.946 -13.906 -14.809 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.491 -13.846 -16.190 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.634 -15.578 -17.580 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.941 -15.836 -15.846 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -12.196 -15.102 -16.872 1.00 0.00 H new ATOM 1953 N ALA B 42 -11.834 -12.126 -17.721 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.007 -11.061 -18.712 1.00 0.00 C ATOM 1955 C ALA B 42 -11.281 -9.768 -18.300 1.00 0.00 C ATOM 1956 O ALA B 42 -10.468 -9.256 -19.062 1.00 0.00 O ATOM 1957 CB ALA B 42 -13.509 -10.844 -18.937 1.00 0.00 C ATOM 0 H ALA B 42 -12.653 -12.272 -17.130 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.547 -11.362 -19.654 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -13.656 -10.053 -19.673 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -13.959 -11.767 -19.301 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -13.980 -10.557 -17.997 1.00 0.00 H new ATOM 1963 N HIS B 43 -11.501 -9.275 -17.077 1.00 0.00 N ATOM 1964 CA HIS B 43 -10.845 -8.053 -16.583 1.00 0.00 C ATOM 1965 C HIS B 43 -9.297 -8.076 -16.631 1.00 0.00 C ATOM 1966 O HIS B 43 -8.655 -7.022 -16.626 1.00 0.00 O ATOM 1967 CB HIS B 43 -11.308 -7.821 -15.142 1.00 0.00 C ATOM 1968 CG HIS B 43 -12.670 -7.188 -14.986 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -13.320 -7.026 -13.797 1.00 0.00 N flip ATOM 1970 CD2 HIS B 43 -13.336 -6.453 -15.966 1.00 0.00 C flip ATOM 1971 CE1 HIS B 43 -14.360 -6.148 -14.034 1.00 0.00 C flip ATOM 1972 NE2 HIS B 43 -14.347 -5.829 -15.338 1.00 0.00 N flip ATOM 0 H HIS B 43 -12.134 -9.706 -16.403 1.00 0.00 H new ATOM 0 HA HIS B 43 -11.138 -7.245 -17.253 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.311 -8.779 -14.622 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -10.574 -7.189 -14.641 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.090 -6.397 -17.016 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -15.061 -5.782 -13.299 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -15.012 -5.201 -15.789 1.00 0.00 H new ATOM 1980 N LEU B 44 -8.695 -9.270 -16.616 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.244 -9.502 -16.594 1.00 0.00 C ATOM 1982 C LEU B 44 -6.710 -10.134 -17.890 1.00 0.00 C ATOM 1983 O LEU B 44 -5.516 -10.413 -17.965 1.00 0.00 O ATOM 1984 CB LEU B 44 -6.920 -10.407 -15.395 1.00 0.00 C ATOM 1985 CG LEU B 44 -7.486 -9.896 -14.063 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.137 -10.860 -12.951 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.064 -8.472 -13.666 1.00 0.00 C ATOM 0 H LEU B 44 -9.228 -10.140 -16.619 1.00 0.00 H new ATOM 0 HA LEU B 44 -6.751 -8.534 -16.505 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.314 -11.405 -15.588 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -5.838 -10.503 -15.306 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.564 -9.842 -14.218 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.542 -10.491 -12.009 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.564 -11.839 -13.171 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.053 -10.946 -12.871 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.519 -8.211 -12.711 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.979 -8.426 -13.576 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -7.395 -7.768 -14.430 1.00 0.00 H new ATOM 1999 N GLY B 45 -7.584 -10.483 -18.846 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.223 -11.236 -20.054 1.00 0.00 C ATOM 2001 C GLY B 45 -6.645 -12.635 -19.793 1.00 0.00 C ATOM 2002 O GLY B 45 -6.144 -13.259 -20.730 1.00 0.00 O ATOM 0 H GLY B 45 -8.575 -10.246 -18.800 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.109 -11.336 -20.681 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.494 -10.657 -20.621 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.663 -13.116 -18.540 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.971 -14.327 -18.076 1.00 0.00 C ATOM 2008 C LEU B 46 -6.909 -15.534 -17.920 1.00 0.00 C ATOM 2009 O LEU B 46 -8.121 -15.399 -17.777 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.278 -14.012 -16.729 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.872 -13.391 -16.858 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.411 -12.872 -15.488 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.859 -14.434 -17.358 1.00 0.00 C ATOM 0 H LEU B 46 -7.181 -12.653 -17.793 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.239 -14.606 -18.834 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.911 -13.330 -16.161 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.202 -14.933 -16.151 1.00 0.00 H new ATOM 0 HG LEU B 46 -3.924 -12.572 -17.575 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.417 -12.433 -15.581 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.110 -12.115 -15.132 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.378 -13.698 -14.778 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.874 -13.974 -17.442 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -2.813 -15.264 -16.653 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -3.170 -14.805 -18.335 1.00 0.00 H new ATOM 2025 N THR B 47 -6.331 -16.745 -17.859 1.00 0.00 N ATOM 2026 CA THR B 47 -7.080 -17.975 -17.549 1.00 0.00 C ATOM 2027 C THR B 47 -7.706 -17.906 -16.156 1.00 0.00 C ATOM 2028 O THR B 47 -7.063 -17.516 -15.174 1.00 0.00 O ATOM 2029 CB THR B 47 -6.262 -19.262 -17.764 1.00 0.00 C ATOM 2030 OG1 THR B 47 -6.962 -20.341 -17.172 1.00 0.00 O ATOM 2031 CG2 THR B 47 -4.858 -19.209 -17.165 1.00 0.00 C ATOM 0 H THR B 47 -5.336 -16.899 -18.022 1.00 0.00 H new ATOM 0 HA THR B 47 -7.893 -18.032 -18.273 1.00 0.00 H new ATOM 0 HB THR B 47 -6.142 -19.385 -18.840 1.00 0.00 H new ATOM 0 HG1 THR B 47 -6.405 -20.751 -16.478 1.00 0.00 H new ATOM 0 HG21 THR B 47 -4.345 -20.151 -17.357 1.00 0.00 H new ATOM 0 HG22 THR B 47 -4.299 -18.391 -17.620 1.00 0.00 H new ATOM 0 HG23 THR B 47 -4.927 -19.047 -16.089 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.953 -18.389 -16.089 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.752 -18.581 -14.873 1.00 0.00 C ATOM 2041 C ARG B 48 -8.973 -19.345 -13.788 1.00 0.00 C ATOM 2042 O ARG B 48 -9.153 -19.059 -12.608 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.057 -19.325 -15.242 1.00 0.00 C ATOM 2044 CG ARG B 48 -11.978 -18.514 -16.179 1.00 0.00 C ATOM 2045 CD ARG B 48 -13.181 -19.307 -16.714 1.00 0.00 C ATOM 2046 NE ARG B 48 -13.972 -18.479 -17.646 1.00 0.00 N ATOM 2047 CZ ARG B 48 -14.432 -18.823 -18.849 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -14.312 -20.023 -19.368 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -15.032 -17.936 -19.607 1.00 0.00 N ATOM 0 H ARG B 48 -9.459 -18.672 -16.928 1.00 0.00 H new ATOM 0 HA ARG B 48 -9.991 -17.603 -14.455 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.805 -20.271 -15.721 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.601 -19.566 -14.328 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -12.343 -17.638 -15.643 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.391 -18.151 -17.023 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -12.834 -20.207 -17.222 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -13.809 -19.631 -15.884 1.00 0.00 H new ATOM 0 HE ARG B 48 -14.192 -17.534 -17.333 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -13.842 -20.761 -18.843 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -14.688 -20.217 -20.296 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -15.148 -16.978 -19.277 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -15.382 -18.204 -20.527 1.00 0.00 H new ATOM 2063 N SER B 49 -8.069 -20.256 -14.168 1.00 0.00 N ATOM 2064 CA SER B 49 -7.178 -20.939 -13.221 1.00 0.00 C ATOM 2065 C SER B 49 -6.077 -20.021 -12.676 1.00 0.00 C ATOM 2066 O SER B 49 -5.963 -19.888 -11.465 1.00 0.00 O ATOM 2067 CB SER B 49 -6.574 -22.209 -13.842 1.00 0.00 C ATOM 2068 OG SER B 49 -5.876 -21.964 -15.057 1.00 0.00 O ATOM 0 H SER B 49 -7.934 -20.540 -15.138 1.00 0.00 H new ATOM 0 HA SER B 49 -7.796 -21.230 -12.371 1.00 0.00 H new ATOM 0 HB2 SER B 49 -5.892 -22.667 -13.125 1.00 0.00 H new ATOM 0 HB3 SER B 49 -7.371 -22.929 -14.028 1.00 0.00 H new ATOM 0 HG SER B 49 -5.514 -22.807 -15.402 1.00 0.00 H new ATOM 2074 N ASN B 50 -5.292 -19.326 -13.510 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.227 -18.453 -12.989 1.00 0.00 C ATOM 2076 C ASN B 50 -4.766 -17.198 -12.265 1.00 0.00 C ATOM 2077 O ASN B 50 -4.109 -16.668 -11.369 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.211 -18.103 -14.082 1.00 0.00 C ATOM 2079 CG ASN B 50 -1.891 -17.656 -13.463 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -1.359 -18.298 -12.571 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.326 -16.550 -13.903 1.00 0.00 N ATOM 0 H ASN B 50 -5.369 -19.348 -14.527 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.703 -19.025 -12.223 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -3.044 -18.969 -14.722 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.609 -17.310 -14.716 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.446 -16.231 -13.499 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.769 -16.013 -14.648 1.00 0.00 H new ATOM 2088 N VAL B 51 -5.978 -16.745 -12.605 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.685 -15.741 -11.799 1.00 0.00 C ATOM 2090 C VAL B 51 -6.931 -16.299 -10.387 1.00 0.00 C ATOM 2091 O VAL B 51 -6.544 -15.650 -9.414 1.00 0.00 O ATOM 2092 CB VAL B 51 -8.001 -15.304 -12.492 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -8.952 -14.538 -11.565 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.717 -14.442 -13.745 1.00 0.00 C ATOM 0 H VAL B 51 -6.489 -17.056 -13.431 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.068 -14.847 -11.708 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.495 -16.232 -12.782 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.852 -14.263 -12.114 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -9.222 -15.169 -10.719 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -8.459 -13.636 -11.202 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.660 -14.152 -14.208 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.165 -13.548 -13.454 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.126 -15.018 -14.457 1.00 0.00 H new ATOM 2104 N SER B 52 -7.514 -17.498 -10.234 1.00 0.00 N ATOM 2105 CA SER B 52 -7.837 -18.022 -8.895 1.00 0.00 C ATOM 2106 C SER B 52 -6.655 -18.553 -8.088 1.00 0.00 C ATOM 2107 O SER B 52 -6.714 -18.437 -6.861 1.00 0.00 O ATOM 2108 CB SER B 52 -8.933 -19.074 -8.910 1.00 0.00 C ATOM 2109 OG SER B 52 -8.587 -20.183 -9.716 1.00 0.00 O ATOM 0 H SER B 52 -7.768 -18.115 -11.005 1.00 0.00 H new ATOM 0 HA SER B 52 -8.193 -17.127 -8.385 1.00 0.00 H new ATOM 0 HB2 SER B 52 -9.127 -19.411 -7.892 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.857 -18.630 -9.280 1.00 0.00 H new ATOM 0 HG SER B 52 -8.723 -19.957 -10.660 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.587 -19.037 -8.736 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.282 -19.355 -8.127 1.00 0.00 C ATOM 2117 C ASN B 53 -3.949 -18.326 -7.039 1.00 0.00 C ATOM 2118 O ASN B 53 -3.844 -18.599 -5.841 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.247 -19.381 -9.269 1.00 0.00 C ATOM 2120 CG ASN B 53 -1.791 -19.293 -8.824 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.433 -19.602 -7.699 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -0.922 -18.841 -9.706 1.00 0.00 N ATOM 0 H ASN B 53 -5.606 -19.226 -9.738 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.286 -20.325 -7.631 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.382 -20.300 -9.840 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -3.455 -18.552 -9.946 1.00 0.00 H new ATOM 0 HD21 ASN B 53 0.061 -18.746 -9.451 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -1.233 -18.586 -10.643 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.954 -17.076 -7.463 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.634 -15.957 -6.609 1.00 0.00 C ATOM 2131 C HIS B 54 -4.829 -15.317 -5.868 1.00 0.00 C ATOM 2132 O HIS B 54 -4.625 -14.452 -5.013 1.00 0.00 O ATOM 2133 CB HIS B 54 -2.824 -15.031 -7.482 1.00 0.00 C ATOM 2134 CG HIS B 54 -1.407 -15.516 -7.698 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -0.547 -16.061 -6.760 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -0.757 -15.573 -8.897 1.00 0.00 C ATOM 2137 CE1 HIS B 54 0.579 -16.428 -7.391 1.00 0.00 C ATOM 2138 NE2 HIS B 54 0.500 -16.139 -8.697 1.00 0.00 N ATOM 0 H HIS B 54 -4.183 -16.811 -8.421 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.058 -16.275 -5.740 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -3.318 -14.926 -8.448 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -2.799 -14.041 -7.027 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.152 -15.235 -9.844 1.00 0.00 H new ATOM 0 HE1 HIS B 54 1.430 -16.891 -6.913 1.00 0.00 H new ATOM 0 HE2 HIS B 54 1.217 -16.301 -9.404 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.070 -15.757 -6.114 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.179 -15.430 -5.205 1.00 0.00 C ATOM 2148 C LEU B 55 -7.015 -16.235 -3.907 1.00 0.00 C ATOM 2149 O LEU B 55 -7.625 -15.878 -2.909 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.563 -15.677 -5.838 1.00 0.00 C ATOM 2151 CG LEU B 55 -8.946 -14.753 -7.012 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.327 -15.158 -7.550 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -8.966 -13.268 -6.628 1.00 0.00 C ATOM 0 H LEU B 55 -6.330 -16.329 -6.918 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.136 -14.363 -4.989 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.602 -16.709 -6.187 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.319 -15.575 -5.060 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.179 -14.875 -7.777 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -10.600 -14.506 -8.380 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.294 -16.191 -7.896 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.068 -15.064 -6.756 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -9.242 -12.671 -7.497 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -9.693 -13.108 -5.832 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -7.977 -12.968 -6.282 1.00 0.00 H new ATOM 2165 N SER B 56 -6.196 -17.294 -3.877 1.00 0.00 N ATOM 2166 CA SER B 56 -5.812 -17.941 -2.618 1.00 0.00 C ATOM 2167 C SER B 56 -5.312 -16.940 -1.568 1.00 0.00 C ATOM 2168 O SER B 56 -5.738 -17.037 -0.419 1.00 0.00 O ATOM 2169 CB SER B 56 -4.752 -19.019 -2.868 1.00 0.00 C ATOM 2170 OG SER B 56 -4.522 -19.767 -1.689 1.00 0.00 O ATOM 0 H SER B 56 -5.788 -17.720 -4.709 1.00 0.00 H new ATOM 0 HA SER B 56 -6.712 -18.406 -2.216 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.080 -19.682 -3.669 1.00 0.00 H new ATOM 0 HB3 SER B 56 -3.823 -18.555 -3.199 1.00 0.00 H new ATOM 0 HG SER B 56 -3.844 -20.453 -1.864 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.493 -15.944 -1.942 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.026 -14.955 -0.962 1.00 0.00 C ATOM 2178 C CYS B 57 -5.036 -13.820 -0.765 1.00 0.00 C ATOM 2179 O CYS B 57 -5.332 -13.445 0.369 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.659 -14.390 -1.355 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.814 -13.615 0.072 1.00 0.00 S ATOM 0 H CYS B 57 -4.148 -15.805 -2.892 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.925 -15.477 -0.010 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.036 -15.189 -1.757 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.784 -13.653 -2.149 1.00 0.00 H new ATOM 0 HG CYS B 57 -0.660 -13.152 -0.306 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.582 -13.295 -1.868 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.509 -12.163 -1.847 1.00 0.00 C ATOM 2188 C LEU B 58 -7.735 -12.448 -0.960 1.00 0.00 C ATOM 2189 O LEU B 58 -8.250 -11.532 -0.320 1.00 0.00 O ATOM 2190 CB LEU B 58 -6.894 -11.820 -3.307 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.066 -10.310 -3.585 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.785 -9.507 -3.322 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.559 -10.136 -5.026 1.00 0.00 C ATOM 0 H LEU B 58 -5.390 -13.648 -2.806 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.025 -11.296 -1.398 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.128 -12.215 -3.974 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.825 -12.331 -3.554 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.803 -9.908 -2.890 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.966 -8.453 -3.534 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.491 -9.622 -2.279 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -4.986 -9.875 -3.966 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.687 -9.075 -5.241 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -6.828 -10.561 -5.714 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.513 -10.648 -5.148 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.202 -13.707 -0.923 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.290 -14.157 -0.044 1.00 0.00 C ATOM 2207 C ARG B 59 -8.832 -14.472 1.387 1.00 0.00 C ATOM 2208 O ARG B 59 -9.624 -14.275 2.305 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.977 -15.395 -0.633 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.630 -15.172 -2.010 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.269 -16.452 -2.567 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.298 -17.554 -2.753 1.00 0.00 N ATOM 2213 CZ ARG B 59 -10.041 -18.555 -1.913 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -10.646 -18.665 -0.744 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -9.152 -19.471 -2.250 1.00 0.00 N ATOM 0 H ARG B 59 -7.828 -14.451 -1.512 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.988 -13.322 0.015 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -9.242 -16.195 -0.719 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.741 -15.737 0.065 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.390 -14.395 -1.927 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.879 -14.809 -2.711 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.057 -16.781 -1.890 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.742 -16.228 -3.523 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.766 -17.546 -3.623 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -11.335 -17.969 -0.459 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -10.424 -19.446 -0.126 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -8.669 -19.408 -3.146 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -8.948 -20.242 -1.614 1.00 0.00 H new ATOM 2229 N GLY B 60 -7.592 -14.941 1.590 1.00 0.00 N ATOM 2230 CA GLY B 60 -7.025 -15.226 2.919 1.00 0.00 C ATOM 2231 C GLY B 60 -6.794 -13.949 3.727 1.00 0.00 C ATOM 2232 O GLY B 60 -7.336 -13.825 4.821 1.00 0.00 O ATOM 0 H GLY B 60 -6.945 -15.136 0.826 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -7.698 -15.885 3.467 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.081 -15.759 2.804 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.128 -12.963 3.116 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.941 -11.610 3.635 1.00 0.00 C ATOM 2238 C CYS B 61 -7.272 -10.805 3.739 1.00 0.00 C ATOM 2239 O CYS B 61 -7.247 -9.618 4.066 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.883 -10.928 2.730 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.166 -11.451 2.979 1.00 0.00 S ATOM 0 H CYS B 61 -5.686 -13.096 2.206 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.587 -11.646 4.665 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -5.151 -11.113 1.690 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.940 -9.851 2.887 1.00 0.00 H new ATOM 0 HG CYS B 61 -2.781 -12.173 1.969 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.413 -11.393 3.349 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.745 -10.780 3.380 1.00 0.00 C ATOM 2248 C GLY B 62 -9.994 -9.729 2.300 1.00 0.00 C ATOM 2249 O GLY B 62 -11.133 -9.305 2.150 1.00 0.00 O ATOM 0 H GLY B 62 -8.431 -12.347 2.989 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.493 -11.566 3.281 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.894 -10.319 4.356 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.968 -9.316 1.541 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.024 -8.262 0.520 1.00 0.00 C ATOM 2255 C LEU B 63 -10.145 -8.462 -0.508 1.00 0.00 C ATOM 2256 O LEU B 63 -10.677 -7.483 -1.031 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.656 -8.143 -0.140 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.510 -8.064 0.884 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.236 -7.773 0.136 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.691 -7.021 1.998 1.00 0.00 C ATOM 0 H LEU B 63 -8.038 -9.725 1.626 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.274 -7.325 1.017 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.496 -9.001 -0.793 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.637 -7.254 -0.770 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.491 -9.026 1.397 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.406 -7.712 0.840 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.045 -8.571 -0.581 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.333 -6.825 -0.393 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.829 -7.047 2.665 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.778 -6.028 1.556 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.595 -7.247 2.564 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.516 -9.724 -0.736 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.714 -10.169 -1.468 1.00 0.00 C ATOM 2274 C VAL B 64 -12.563 -11.137 -0.644 1.00 0.00 C ATOM 2275 O VAL B 64 -12.045 -12.007 0.051 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.401 -10.831 -2.826 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.090 -9.747 -3.856 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.257 -11.808 -2.768 1.00 0.00 C ATOM 0 H VAL B 64 -9.961 -10.510 -0.398 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.271 -9.251 -1.656 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.286 -11.401 -3.110 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.868 -10.211 -4.817 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.951 -9.088 -3.962 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.228 -9.168 -3.525 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.093 -12.235 -3.757 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.354 -11.292 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.495 -12.605 -2.064 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.879 -10.989 -0.768 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.932 -11.697 -0.022 1.00 0.00 C ATOM 2290 C VAL B 65 -15.999 -12.209 -1.000 1.00 0.00 C ATOM 2291 O VAL B 65 -16.316 -11.541 -1.982 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.554 -10.731 1.019 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.801 -11.297 1.708 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.519 -10.367 2.095 1.00 0.00 C ATOM 0 H VAL B 65 -14.272 -10.327 -1.437 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.509 -12.553 0.503 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.860 -9.847 0.459 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.184 -10.569 2.423 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.566 -11.508 0.960 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.542 -12.217 2.231 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.970 -9.688 2.819 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.189 -11.273 2.604 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.663 -9.881 1.627 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.533 -13.409 -0.755 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.587 -14.043 -1.561 1.00 0.00 C ATOM 2306 C ALA B 66 -18.989 -13.528 -1.231 1.00 0.00 C ATOM 2307 O ALA B 66 -19.220 -12.865 -0.223 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.492 -15.563 -1.367 1.00 0.00 C ATOM 0 H ALA B 66 -16.237 -13.985 0.033 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.425 -13.782 -2.607 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -18.266 -16.054 -1.957 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.512 -15.911 -1.693 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.631 -15.805 -0.313 1.00 0.00 H new ATOM 2314 N THR B 67 -19.951 -13.800 -2.111 1.00 0.00 N ATOM 2315 CA THR B 67 -21.359 -13.406 -1.949 1.00 0.00 C ATOM 2316 C THR B 67 -22.198 -14.178 -2.951 1.00 0.00 C ATOM 2317 O THR B 67 -21.638 -14.824 -3.824 1.00 0.00 O ATOM 2318 CB THR B 67 -21.583 -11.904 -2.215 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.428 -11.113 -2.058 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.652 -11.247 -1.385 1.00 0.00 C ATOM 0 H THR B 67 -19.775 -14.311 -2.976 1.00 0.00 H new ATOM 0 HA THR B 67 -21.642 -13.622 -0.919 1.00 0.00 H new ATOM 0 HB THR B 67 -21.901 -11.934 -3.257 1.00 0.00 H new ATOM 0 HG1 THR B 67 -19.832 -11.248 -2.824 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.725 -10.193 -1.654 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.608 -11.736 -1.570 1.00 0.00 H new ATOM 0 HG23 THR B 67 -22.398 -11.335 -0.329 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.518 -14.068 -2.872 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.425 -14.478 -3.951 1.00 0.00 C ATOM 2330 C TYR B 68 -24.775 -13.267 -4.842 1.00 0.00 C ATOM 2331 O TYR B 68 -24.648 -12.117 -4.412 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.680 -15.134 -3.363 1.00 0.00 C ATOM 2333 CG TYR B 68 -25.539 -16.630 -3.167 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -24.945 -17.141 -1.996 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -25.981 -17.512 -4.172 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -24.793 -18.530 -1.827 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -25.826 -18.903 -4.015 1.00 0.00 C ATOM 2338 CZ TYR B 68 -25.232 -19.414 -2.839 1.00 0.00 C ATOM 2339 OH TYR B 68 -25.073 -20.756 -2.686 1.00 0.00 O ATOM 0 H TYR B 68 -23.998 -13.690 -2.055 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.928 -15.217 -4.580 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.909 -14.669 -2.404 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -26.526 -14.939 -4.022 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -24.605 -16.465 -1.226 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -26.441 -17.120 -5.067 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -24.342 -18.920 -0.926 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -26.160 -19.577 -4.790 1.00 0.00 H new ATOM 0 HH TYR B 68 -25.429 -21.219 -3.473 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.179 -13.520 -6.085 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.797 -12.544 -6.991 1.00 0.00 C ATOM 2351 C GLU B 69 -27.203 -13.048 -7.406 1.00 0.00 C ATOM 2352 O GLU B 69 -27.836 -13.753 -6.620 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.809 -12.149 -8.110 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.386 -13.230 -9.122 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.422 -13.446 -10.219 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -25.898 -12.438 -10.778 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -25.821 -14.616 -10.433 1.00 0.00 O ATOM 0 H GLU B 69 -25.083 -14.443 -6.508 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.997 -11.590 -6.503 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.251 -11.324 -8.669 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.906 -11.765 -7.636 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.436 -12.946 -9.575 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -24.219 -14.170 -8.595 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.729 -12.710 -8.591 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.100 -13.052 -9.009 1.00 0.00 C ATOM 2366 C GLY B 70 -29.413 -14.554 -9.049 1.00 0.00 C ATOM 2367 O GLY B 70 -30.578 -14.928 -8.908 1.00 0.00 O ATOM 0 H GLY B 70 -27.211 -12.186 -9.296 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.802 -12.568 -8.329 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.276 -12.633 -10.000 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.399 -15.418 -9.211 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.522 -16.881 -9.035 1.00 0.00 C ATOM 2373 C ARG B 71 -27.187 -17.589 -8.741 1.00 0.00 C ATOM 2374 O ARG B 71 -27.198 -18.708 -8.214 1.00 0.00 O ATOM 2375 CB ARG B 71 -29.254 -17.503 -10.251 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.838 -18.904 -9.987 1.00 0.00 C ATOM 2377 CD ARG B 71 -28.948 -20.066 -10.457 1.00 0.00 C ATOM 2378 NE ARG B 71 -29.445 -21.365 -9.955 1.00 0.00 N ATOM 2379 CZ ARG B 71 -29.261 -21.850 -8.729 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.564 -21.205 -7.813 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -29.788 -23.014 -8.403 1.00 0.00 N ATOM 0 H ARG B 71 -27.458 -15.121 -9.471 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.122 -17.042 -8.140 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -30.061 -16.836 -10.555 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.558 -17.563 -11.088 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -30.020 -19.012 -8.918 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -30.805 -18.980 -10.484 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -28.916 -20.084 -11.546 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -27.927 -19.907 -10.110 1.00 0.00 H new ATOM 0 HE ARG B 71 -29.977 -21.942 -10.607 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -28.144 -20.302 -8.034 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -28.445 -21.609 -6.884 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -30.333 -23.537 -9.089 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -29.651 -23.391 -7.465 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.056 -16.984 -9.098 1.00 0.00 N ATOM 2396 CA GLN B 72 -24.703 -17.511 -8.932 1.00 0.00 C ATOM 2397 C GLN B 72 -24.075 -16.937 -7.654 1.00 0.00 C ATOM 2398 O GLN B 72 -24.727 -16.230 -6.891 1.00 0.00 O ATOM 2399 CB GLN B 72 -23.834 -17.231 -10.184 1.00 0.00 C ATOM 2400 CG GLN B 72 -24.170 -18.131 -11.385 1.00 0.00 C ATOM 2401 CD GLN B 72 -25.621 -18.046 -11.835 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -26.336 -19.034 -11.904 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -26.143 -16.867 -12.064 1.00 0.00 N ATOM 0 H GLN B 72 -26.059 -16.062 -9.535 1.00 0.00 H new ATOM 0 HA GLN B 72 -24.755 -18.595 -8.826 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -23.959 -16.188 -10.476 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -22.784 -17.365 -9.924 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -23.525 -17.860 -12.221 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -23.940 -19.165 -11.127 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -25.560 -16.032 -12.010 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -27.133 -16.784 -12.296 1.00 0.00 H new ATOM 2412 N VAL B 73 -22.796 -17.236 -7.434 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.961 -16.606 -6.409 1.00 0.00 C ATOM 2414 C VAL B 73 -20.986 -15.628 -7.074 1.00 0.00 C ATOM 2415 O VAL B 73 -20.760 -15.719 -8.281 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.247 -17.646 -5.519 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.259 -18.520 -4.765 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.268 -18.535 -6.304 1.00 0.00 C ATOM 0 H VAL B 73 -22.298 -17.941 -7.977 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.602 -16.041 -5.733 1.00 0.00 H new ATOM 0 HB VAL B 73 -20.661 -17.074 -4.800 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -21.726 -19.243 -4.147 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.883 -17.890 -4.131 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -22.888 -19.049 -5.481 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -19.797 -19.246 -5.625 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -20.810 -19.078 -7.078 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -19.502 -17.913 -6.766 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.409 -14.704 -6.300 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.584 -13.574 -6.742 1.00 0.00 C ATOM 2430 C ARG B 74 -18.361 -13.399 -5.837 1.00 0.00 C ATOM 2431 O ARG B 74 -18.232 -14.055 -4.806 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.443 -12.293 -6.790 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.463 -11.459 -5.498 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.512 -10.352 -5.523 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.301 -9.478 -4.354 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.365 -8.157 -4.270 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.736 -7.398 -5.281 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -21.026 -7.580 -3.135 1.00 0.00 N ATOM 0 H ARG B 74 -20.511 -14.726 -5.285 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.211 -13.777 -7.746 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -20.080 -11.663 -7.602 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.467 -12.573 -7.037 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -20.656 -12.116 -4.650 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.479 -11.017 -5.341 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -21.433 -9.776 -6.445 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.514 -10.780 -5.500 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.073 -9.960 -3.484 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.988 -7.824 -6.173 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.771 -6.384 -5.172 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -20.722 -8.149 -2.345 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -21.067 -6.565 -3.047 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.489 -12.461 -6.198 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.417 -11.947 -5.335 1.00 0.00 C ATOM 2454 C TYR B 75 -16.477 -10.411 -5.322 1.00 0.00 C ATOM 2455 O TYR B 75 -16.762 -9.805 -6.347 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.034 -12.443 -5.794 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.730 -13.886 -5.434 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.695 -14.276 -4.080 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.449 -14.837 -6.435 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.437 -15.613 -3.728 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.175 -16.177 -6.091 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.196 -16.573 -4.734 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.978 -17.873 -4.386 1.00 0.00 O ATOM 0 H TYR B 75 -17.505 -12.024 -7.119 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.567 -12.324 -4.323 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.962 -12.329 -6.876 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.269 -11.803 -5.354 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -14.868 -13.542 -3.307 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.443 -14.538 -7.473 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.423 -15.905 -2.688 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.950 -16.899 -6.862 1.00 0.00 H new ATOM 0 HH TYR B 75 -13.829 -18.407 -5.194 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.234 -9.782 -4.177 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.212 -8.334 -3.984 1.00 0.00 C ATOM 2475 C ALA B 76 -15.041 -7.941 -3.077 1.00 0.00 C ATOM 2476 O ALA B 76 -14.533 -8.793 -2.351 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.559 -7.910 -3.386 1.00 0.00 C ATOM 0 H ALA B 76 -16.037 -10.292 -3.316 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.067 -7.821 -4.935 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.566 -6.831 -3.233 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.363 -8.185 -4.069 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.707 -8.413 -2.430 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.612 -6.675 -3.116 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.621 -6.147 -2.178 1.00 0.00 C ATOM 2485 C LEU B 77 -14.095 -6.293 -0.720 1.00 0.00 C ATOM 2486 O LEU B 77 -15.297 -6.299 -0.461 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.336 -4.680 -2.545 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.441 -4.480 -3.770 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -12.498 -2.996 -4.123 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.005 -4.898 -3.484 1.00 0.00 C ATOM 0 H LEU B 77 -14.942 -5.991 -3.797 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.698 -6.721 -2.255 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.286 -4.175 -2.722 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -12.869 -4.192 -1.690 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.791 -5.099 -4.596 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -11.872 -2.805 -4.995 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -13.527 -2.714 -4.347 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.136 -2.407 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.397 -4.743 -4.375 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.608 -4.299 -2.665 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -10.981 -5.952 -3.207 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.140 -6.394 0.211 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.357 -6.662 1.645 1.00 0.00 C ATOM 2504 C ALA B 78 -14.463 -5.805 2.281 1.00 0.00 C ATOM 2505 O ALA B 78 -15.345 -6.298 2.981 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.035 -6.391 2.376 1.00 0.00 C ATOM 0 H ALA B 78 -12.152 -6.287 -0.019 1.00 0.00 H new ATOM 0 HA ALA B 78 -13.684 -7.698 1.738 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.163 -6.581 3.442 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.260 -7.048 1.981 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.742 -5.352 2.225 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.392 -4.511 1.979 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.296 -3.463 2.411 1.00 0.00 C ATOM 2514 C ASP B 79 -15.108 -2.245 1.493 1.00 0.00 C ATOM 2515 O ASP B 79 -14.109 -2.105 0.774 1.00 0.00 O ATOM 2516 CB ASP B 79 -15.058 -3.117 3.904 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.900 -1.915 4.356 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -17.127 -1.930 4.093 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -15.288 -0.875 4.698 1.00 0.00 O ATOM 0 H ASP B 79 -13.647 -4.148 1.384 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.330 -3.800 2.334 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.301 -3.983 4.520 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.002 -2.900 4.062 1.00 0.00 H new ATOM 2524 N SER B 80 -16.064 -1.322 1.585 1.00 0.00 N ATOM 2525 CA SER B 80 -15.997 0.014 1.003 1.00 0.00 C ATOM 2526 C SER B 80 -14.717 0.781 1.383 1.00 0.00 C ATOM 2527 O SER B 80 -14.343 1.705 0.663 1.00 0.00 O ATOM 2528 CB SER B 80 -17.228 0.808 1.450 1.00 0.00 C ATOM 2529 OG SER B 80 -17.388 1.962 0.647 1.00 0.00 O ATOM 0 H SER B 80 -16.937 -1.492 2.085 1.00 0.00 H new ATOM 0 HA SER B 80 -15.976 -0.102 -0.081 1.00 0.00 H new ATOM 0 HB2 SER B 80 -18.118 0.182 1.380 1.00 0.00 H new ATOM 0 HB3 SER B 80 -17.123 1.096 2.496 1.00 0.00 H new ATOM 0 HG SER B 80 -18.179 2.459 0.943 1.00 0.00 H new ATOM 2535 N HIS B 81 -14.027 0.389 2.465 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.702 0.871 2.858 1.00 0.00 C ATOM 2537 C HIS B 81 -11.627 0.635 1.792 1.00 0.00 C ATOM 2538 O HIS B 81 -10.884 1.568 1.485 1.00 0.00 O ATOM 2539 CB HIS B 81 -12.303 0.230 4.210 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.524 1.114 5.416 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -13.200 2.321 5.440 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -11.836 1.004 6.594 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -12.888 2.953 6.588 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -12.111 2.141 7.336 1.00 0.00 N ATOM 0 H HIS B 81 -14.397 -0.303 3.116 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.767 1.953 2.968 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.871 -0.691 4.342 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -11.250 -0.048 4.168 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -11.198 0.184 6.890 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -13.207 3.947 6.865 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -11.783 2.332 8.283 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.517 -0.572 1.219 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.547 -0.793 0.135 1.00 0.00 C ATOM 2555 C LEU B 82 -11.064 -0.185 -1.161 1.00 0.00 C ATOM 2556 O LEU B 82 -10.278 0.405 -1.887 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.162 -2.268 -0.071 1.00 0.00 C ATOM 2558 CG LEU B 82 -9.872 -3.072 1.209 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -9.481 -4.501 0.818 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.740 -2.442 2.031 1.00 0.00 C ATOM 0 H LEU B 82 -12.070 -1.389 1.478 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.629 -0.291 0.440 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.969 -2.762 -0.612 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.279 -2.307 -0.709 1.00 0.00 H new ATOM 0 HG LEU B 82 -10.771 -3.072 1.825 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -9.273 -5.080 1.718 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -10.300 -4.965 0.269 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -8.591 -4.476 0.189 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -8.565 -3.038 2.926 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.830 -2.411 1.432 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -9.020 -1.429 2.319 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.378 -0.221 -1.412 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.967 0.457 -2.570 1.00 0.00 C ATOM 2574 C ALA B 83 -12.701 1.985 -2.572 1.00 0.00 C ATOM 2575 O ALA B 83 -12.603 2.569 -3.644 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.463 0.127 -2.636 1.00 0.00 C ATOM 0 H ALA B 83 -13.053 -0.713 -0.827 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.481 0.085 -3.472 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.909 0.628 -3.495 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.594 -0.950 -2.736 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.952 0.469 -1.723 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.540 2.616 -1.398 1.00 0.00 N ATOM 2583 CA ARG B 84 -12.162 4.030 -1.227 1.00 0.00 C ATOM 2584 C ARG B 84 -10.666 4.270 -1.488 1.00 0.00 C ATOM 2585 O ARG B 84 -10.340 4.892 -2.496 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.568 4.487 0.195 1.00 0.00 C ATOM 2587 CG ARG B 84 -13.931 5.196 0.266 1.00 0.00 C ATOM 2588 CD ARG B 84 -13.842 6.671 -0.156 1.00 0.00 C ATOM 2589 NE ARG B 84 -15.142 7.364 -0.017 1.00 0.00 N ATOM 2590 CZ ARG B 84 -15.358 8.659 -0.246 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -14.403 9.471 -0.639 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -16.564 9.166 -0.074 1.00 0.00 N ATOM 0 H ARG B 84 -12.674 2.138 -0.507 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.694 4.626 -1.969 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -12.589 3.617 0.851 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.801 5.159 0.581 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -14.642 4.678 -0.378 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -14.318 5.134 1.283 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -13.093 7.178 0.453 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.506 6.733 -1.191 1.00 0.00 H new ATOM 0 HE ARG B 84 -15.941 6.803 0.279 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -13.457 9.116 -0.779 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -14.607 10.457 -0.804 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -17.330 8.567 0.234 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -16.730 10.157 -0.249 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.761 3.699 -0.678 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.308 3.905 -0.836 1.00 0.00 C ATOM 2608 C ALA B 85 -7.751 3.427 -2.194 1.00 0.00 C ATOM 2609 O ALA B 85 -6.707 3.904 -2.647 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.573 3.253 0.345 1.00 0.00 C ATOM 0 H ALA B 85 -10.010 3.087 0.099 1.00 0.00 H new ATOM 0 HA ALA B 85 -8.129 4.980 -0.831 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.499 3.403 0.233 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.907 3.708 1.277 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.790 2.185 0.364 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.445 2.508 -2.872 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.149 2.163 -4.256 1.00 0.00 C ATOM 2618 C LEU B 86 -8.837 3.140 -5.231 1.00 0.00 C ATOM 2619 O LEU B 86 -8.185 3.623 -6.151 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.557 0.700 -4.489 1.00 0.00 C ATOM 2621 CG LEU B 86 -7.587 -0.094 -5.373 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -8.275 -1.426 -5.667 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -7.164 0.617 -6.663 1.00 0.00 C ATOM 0 H LEU B 86 -9.225 1.986 -2.473 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.081 2.259 -4.450 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.642 0.201 -3.524 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.546 0.680 -4.946 1.00 0.00 H new ATOM 0 HG LEU B 86 -6.646 -0.222 -4.839 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.629 -2.038 -6.296 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -8.471 -1.949 -4.731 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -9.217 -1.243 -6.184 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -6.479 -0.020 -7.222 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -8.045 0.823 -7.271 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -6.667 1.555 -6.415 1.00 0.00 H new ATOM 2635 N GLY B 87 -10.118 3.461 -5.007 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.972 4.264 -5.892 1.00 0.00 C ATOM 2637 C GLY B 87 -10.587 5.744 -5.996 1.00 0.00 C ATOM 2638 O GLY B 87 -10.436 6.248 -7.106 1.00 0.00 O ATOM 0 H GLY B 87 -10.609 3.155 -4.167 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.948 3.827 -6.890 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -12.001 4.196 -5.539 1.00 0.00 H new ATOM 2642 N GLU B 88 -10.378 6.434 -4.867 1.00 0.00 N ATOM 2643 CA GLU B 88 -9.786 7.787 -4.854 1.00 0.00 C ATOM 2644 C GLU B 88 -8.252 7.755 -4.992 1.00 0.00 C ATOM 2645 O GLU B 88 -7.610 8.795 -5.142 1.00 0.00 O ATOM 2646 CB GLU B 88 -10.282 8.600 -3.649 1.00 0.00 C ATOM 2647 CG GLU B 88 -9.739 8.206 -2.260 1.00 0.00 C ATOM 2648 CD GLU B 88 -10.867 7.992 -1.242 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -11.888 8.722 -1.290 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -10.757 7.058 -0.420 1.00 0.00 O ATOM 0 H GLU B 88 -10.611 6.077 -3.940 1.00 0.00 H new ATOM 0 HA GLU B 88 -10.138 8.314 -5.741 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -10.035 9.647 -3.823 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -11.369 8.530 -3.619 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -9.150 7.293 -2.346 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -9.067 8.985 -1.899 1.00 0.00 H new ATOM 2657 N LEU B 89 -7.695 6.536 -4.990 1.00 0.00 N ATOM 2658 CA LEU B 89 -6.334 6.156 -5.327 1.00 0.00 C ATOM 2659 C LEU B 89 -5.329 6.461 -4.217 1.00 0.00 C ATOM 2660 O LEU B 89 -5.101 7.608 -3.849 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.922 6.769 -6.686 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.639 6.168 -7.287 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -4.843 4.729 -7.783 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -4.145 7.049 -8.440 1.00 0.00 C ATOM 0 H LEU B 89 -8.247 5.720 -4.726 1.00 0.00 H new ATOM 0 HA LEU B 89 -6.318 5.071 -5.428 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.739 6.635 -7.395 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.782 7.843 -6.560 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.892 6.135 -6.494 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -3.908 4.351 -8.198 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -5.152 4.097 -6.950 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -5.614 4.716 -8.554 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.237 6.620 -8.862 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.913 7.103 -9.211 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.933 8.051 -8.067 1.00 0.00 H new ATOM 2676 N VAL B 90 -4.578 5.415 -3.869 1.00 0.00 N ATOM 2677 CA VAL B 90 -3.362 5.323 -3.030 1.00 0.00 C ATOM 2678 C VAL B 90 -2.382 6.503 -3.134 1.00 0.00 C ATOM 2679 O VAL B 90 -1.495 6.652 -2.303 1.00 0.00 O ATOM 2680 CB VAL B 90 -2.545 4.073 -3.444 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -3.041 2.755 -2.864 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -2.464 3.954 -4.986 1.00 0.00 C ATOM 0 H VAL B 90 -4.834 4.488 -4.209 1.00 0.00 H new ATOM 0 HA VAL B 90 -3.750 5.297 -2.012 1.00 0.00 H new ATOM 0 HB VAL B 90 -1.557 4.240 -3.015 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -2.404 1.942 -3.212 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -3.008 2.801 -1.775 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -4.066 2.578 -3.189 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.886 3.069 -5.253 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -3.470 3.868 -5.398 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -1.979 4.841 -5.394 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.466 7.295 -4.204 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.831 8.597 -4.393 1.00 0.00 C ATOM 2694 C GLN B 91 -0.320 8.528 -4.689 1.00 0.00 C ATOM 2695 O GLN B 91 0.299 9.526 -5.058 1.00 0.00 O ATOM 2696 CB GLN B 91 -2.189 9.509 -3.210 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.072 10.969 -3.645 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.213 11.862 -3.178 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.995 12.939 -2.640 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.441 11.513 -3.486 1.00 0.00 N ATOM 0 H GLN B 91 -3.018 7.023 -5.017 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.234 9.038 -5.305 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -3.203 9.299 -2.868 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -1.522 9.313 -2.370 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -1.133 11.373 -3.266 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.020 11.007 -4.733 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.618 10.614 -3.934 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -5.217 12.141 -3.277 1.00 0.00 H new ATOM 2709 N VAL B 92 0.243 7.324 -4.583 1.00 0.00 N ATOM 2710 CA VAL B 92 1.619 6.841 -4.895 1.00 0.00 C ATOM 2711 C VAL B 92 1.890 6.826 -6.370 1.00 0.00 C ATOM 2712 O VAL B 92 2.140 5.831 -7.040 1.00 0.00 O ATOM 2713 CB VAL B 92 1.882 5.461 -4.283 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.968 5.817 -2.818 1.00 0.00 C ATOM 2715 CG2 VAL B 92 0.823 4.407 -4.602 1.00 0.00 C ATOM 0 H VAL B 92 -0.319 6.550 -4.230 1.00 0.00 H new ATOM 0 HA VAL B 92 2.310 7.552 -4.441 1.00 0.00 H new ATOM 0 HB VAL B 92 2.770 4.970 -4.681 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.157 4.916 -2.235 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.781 6.527 -2.663 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.028 6.266 -2.497 1.00 0.00 H new ATOM 0 HG21 VAL B 92 1.094 3.464 -4.127 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -0.145 4.738 -4.226 1.00 0.00 H new ATOM 0 HG23 VAL B 92 0.764 4.266 -5.681 1.00 0.00 H new ATOM 2725 N VAL B 93 1.760 8.051 -6.801 1.00 0.00 N ATOM 2726 CA VAL B 93 1.594 8.606 -8.103 1.00 0.00 C ATOM 2727 C VAL B 93 1.040 7.658 -9.190 1.00 0.00 C ATOM 2728 O VAL B 93 1.508 7.694 -10.321 1.00 0.00 O ATOM 2729 CB VAL B 93 2.772 9.516 -8.547 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.240 10.661 -9.427 1.00 0.00 C ATOM 2731 CG2 VAL B 93 3.529 10.147 -7.362 1.00 0.00 C ATOM 0 H VAL B 93 1.772 8.806 -6.116 1.00 0.00 H new ATOM 0 HA VAL B 93 0.752 9.287 -7.979 1.00 0.00 H new ATOM 0 HB VAL B 93 3.464 8.875 -9.093 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.069 11.297 -9.737 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.752 10.246 -10.309 1.00 0.00 H new ATOM 0 HG13 VAL B 93 1.521 11.252 -8.860 1.00 0.00 H new ATOM 0 HG21 VAL B 93 4.340 10.771 -7.739 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.843 10.758 -6.776 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.941 9.359 -6.732 1.00 0.00 H new ATOM 2741 N LEU B 94 0.076 6.790 -8.828 1.00 0.00 N ATOM 2742 CA LEU B 94 -0.426 5.666 -9.637 1.00 0.00 C ATOM 2743 C LEU B 94 0.671 4.609 -9.879 1.00 0.00 C ATOM 2744 O LEU B 94 1.195 4.467 -10.980 1.00 0.00 O ATOM 2745 CB LEU B 94 -1.105 6.169 -10.940 1.00 0.00 C ATOM 2746 CG LEU B 94 -1.806 5.085 -11.793 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -2.914 4.344 -11.029 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -2.404 5.735 -13.049 1.00 0.00 C ATOM 0 H LEU B 94 -0.393 6.857 -7.925 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.206 5.157 -9.071 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -1.841 6.928 -10.675 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -0.350 6.658 -11.556 1.00 0.00 H new ATOM 0 HG LEU B 94 -1.049 4.347 -12.058 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -3.368 3.597 -11.680 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -2.487 3.852 -10.155 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -3.674 5.056 -10.709 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -2.899 4.974 -13.652 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -3.130 6.494 -12.756 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -1.609 6.200 -13.632 1.00 0.00 H new ATOM 2760 N ALA B 95 1.012 3.823 -8.853 1.00 0.00 N ATOM 2761 CA ALA B 95 1.869 2.649 -9.002 1.00 0.00 C ATOM 2762 C ALA B 95 1.247 1.596 -9.954 1.00 0.00 C ATOM 2763 O ALA B 95 0.395 0.812 -9.547 1.00 0.00 O ATOM 2764 CB ALA B 95 2.152 2.101 -7.597 1.00 0.00 C ATOM 0 H ALA B 95 0.700 3.986 -7.896 1.00 0.00 H new ATOM 0 HA ALA B 95 2.812 2.923 -9.475 1.00 0.00 H new ATOM 0 HB1 ALA B 95 2.791 1.221 -7.672 1.00 0.00 H new ATOM 0 HB2 ALA B 95 2.654 2.865 -7.003 1.00 0.00 H new ATOM 0 HB3 ALA B 95 1.212 1.827 -7.117 1.00 0.00 H new