USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=33 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: A 81 HIS : no HE2:sc= -2.56 K(o=-4,f=-6.6) USER MOD Set 1.2: B 91 GLN : amide:sc= -1.44 K(o=-4,f=-4.6) USER MOD Set 2.1: A 91 GLN : amide:sc= -1.18 K(o=-3.4,f=-5) USER MOD Set 2.2: B 81 HIS : no HE2:sc= -2.2 K(o=-3.4,f=-6.2) USER MOD Set 3.1: B 50 ASN : amide:sc= -0.0227 K(o=-0.19,f=-2.7!) USER MOD Set 3.2: B 53 ASN : amide:sc= -0.167 X(o=-0.19,f=-0.56) USER MOD Set 4.1: A 102 CYS SG : rot -169:sc= 0.552 USER MOD Set 4.2: B 57 CYS SG : rot -72:sc= 0.715 USER MOD Set 4.3: B 61 CYS SG : rot -14:sc= 0.541 USER MOD Set 5.1: A 57 CYS SG : rot -63:sc= 0.884 USER MOD Set 5.2: A 61 CYS SG : rot 180:sc= 0.739 USER MOD Set 6.1: A 50 ASN : amide:sc= 0.367 K(o=0.69,f=-2.2!) USER MOD Set 6.2: A 53 ASN : amide:sc= 0.325 K(o=0.69,f=-0.6) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00107 USER MOD Single : A 24 CYS SG : rot 152:sc= 0.0221 USER MOD Single : A 35 CYS SG : rot 54:sc= 0.549 USER MOD Single : A 36 TYR OH : rot 180:sc= 0.36 USER MOD Single : A 39 GLN : amide:sc= 0.397 K(o=0.4,f=-7.5!) USER MOD Single : A 43 HIS : no HD1:sc= -0.437 X(o=-0.44,f=-0.73) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.736 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 69:sc= 1.24 USER MOD Single : A 54 HIS : no HD1:sc= -1.05 K(o=-1,f=-1.8) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.3 K(o=0.3,f=-4.5!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 79:sc= 1.11 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.00907 USER MOD Single : A 100 GLN : amide:sc= 0.599 K(o=0.6,f=0) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot 180:sc= 0 USER MOD Single : B 35 CYS SG : rot 50:sc= 0.55 USER MOD Single : B 36 TYR OH : rot 180:sc= 0.487 USER MOD Single : B 39 GLN : amide:sc= 0.0519 K(o=0.052,f=-8.6!) USER MOD Single : B 43 HIS : no HE2:sc= -0.758 X(o=-0.76,f=-0.55) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.544 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 63:sc= 1.28 USER MOD Single : B 54 HIS : no HD1:sc= -1.71 K(o=-1.7,f=-4.2!) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 180:sc= -0.153 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.732 K(o=0.73,f=-5.7!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 76:sc= 1.32 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 5.988 -0.364 -8.829 1.00 0.00 N ATOM 12 CA LEU A 11 4.904 -0.634 -7.867 1.00 0.00 C ATOM 13 C LEU A 11 5.135 -1.914 -7.055 1.00 0.00 C ATOM 14 O LEU A 11 4.965 -1.922 -5.838 1.00 0.00 O ATOM 15 CB LEU A 11 3.524 -0.549 -8.564 1.00 0.00 C ATOM 16 CG LEU A 11 3.091 -1.724 -9.473 1.00 0.00 C ATOM 17 CD1 LEU A 11 2.387 -2.851 -8.692 1.00 0.00 C ATOM 18 CD2 LEU A 11 2.108 -1.216 -10.539 1.00 0.00 C ATOM 0 HA LEU A 11 4.911 0.152 -7.112 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.766 -0.430 -7.789 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.510 0.360 -9.165 1.00 0.00 H new ATOM 0 HG LEU A 11 4.001 -2.124 -9.919 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.105 -3.649 -9.379 1.00 0.00 H new ATOM 0 HD12 LEU A 11 3.064 -3.247 -7.935 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.493 -2.456 -8.209 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.804 -2.045 -11.178 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.230 -0.793 -10.052 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.592 -0.449 -11.144 1.00 0.00 H new ATOM 30 N ALA A 12 5.668 -2.957 -7.698 1.00 0.00 N ATOM 31 CA ALA A 12 6.059 -4.201 -7.030 1.00 0.00 C ATOM 32 C ALA A 12 7.157 -3.994 -5.967 1.00 0.00 C ATOM 33 O ALA A 12 7.223 -4.747 -4.996 1.00 0.00 O ATOM 34 CB ALA A 12 6.478 -5.207 -8.108 1.00 0.00 C ATOM 0 H ALA A 12 5.841 -2.962 -8.703 1.00 0.00 H new ATOM 0 HA ALA A 12 5.207 -4.589 -6.472 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.774 -6.144 -7.636 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.640 -5.389 -8.781 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.318 -4.805 -8.675 1.00 0.00 H new ATOM 40 N ARG A 13 7.988 -2.953 -6.109 1.00 0.00 N ATOM 41 CA ARG A 13 8.901 -2.534 -5.045 1.00 0.00 C ATOM 42 C ARG A 13 8.163 -1.714 -3.983 1.00 0.00 C ATOM 43 O ARG A 13 8.370 -1.971 -2.801 1.00 0.00 O ATOM 44 CB ARG A 13 10.098 -1.751 -5.609 1.00 0.00 C ATOM 45 CG ARG A 13 10.940 -2.547 -6.619 1.00 0.00 C ATOM 46 CD ARG A 13 11.509 -3.840 -6.023 1.00 0.00 C ATOM 47 NE ARG A 13 12.947 -3.989 -6.277 1.00 0.00 N ATOM 48 CZ ARG A 13 13.570 -4.377 -7.373 1.00 0.00 C ATOM 49 NH1 ARG A 13 12.985 -4.562 -8.540 1.00 0.00 N ATOM 50 NH2 ARG A 13 14.851 -4.591 -7.243 1.00 0.00 N ATOM 0 H ARG A 13 8.044 -2.386 -6.955 1.00 0.00 H new ATOM 0 HA ARG A 13 9.290 -3.435 -4.570 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.733 -0.844 -6.090 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.737 -1.439 -4.783 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.326 -2.790 -7.486 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.760 -1.923 -6.974 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.330 -3.851 -4.948 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.978 -4.694 -6.443 1.00 0.00 H new ATOM 0 HE ARG A 13 13.554 -3.759 -5.490 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.982 -4.403 -8.639 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.535 -4.864 -9.344 1.00 0.00 H new ATOM 0 HH21 ARG A 13 15.301 -4.456 -6.338 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.402 -4.894 -8.047 1.00 0.00 H new ATOM 64 N LEU A 14 7.285 -0.783 -4.375 1.00 0.00 N ATOM 65 CA LEU A 14 6.541 0.128 -3.491 1.00 0.00 C ATOM 66 C LEU A 14 5.724 -0.616 -2.432 1.00 0.00 C ATOM 67 O LEU A 14 5.832 -0.296 -1.252 1.00 0.00 O ATOM 68 CB LEU A 14 5.658 1.044 -4.365 1.00 0.00 C ATOM 69 CG LEU A 14 4.872 2.175 -3.665 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.608 1.720 -2.917 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.765 3.025 -2.757 1.00 0.00 C ATOM 0 H LEU A 14 7.063 -0.636 -5.360 1.00 0.00 H new ATOM 0 HA LEU A 14 7.251 0.734 -2.929 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.296 1.500 -5.122 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.940 0.414 -4.890 1.00 0.00 H new ATOM 0 HG LEU A 14 4.518 2.796 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.126 2.584 -2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.919 1.249 -3.619 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.882 1.004 -2.142 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.168 3.806 -2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.207 2.393 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.558 3.481 -3.350 1.00 0.00 H new ATOM 83 N GLY A 15 4.956 -1.639 -2.823 1.00 0.00 N ATOM 84 CA GLY A 15 4.090 -2.369 -1.889 1.00 0.00 C ATOM 85 C GLY A 15 4.880 -3.268 -0.937 1.00 0.00 C ATOM 86 O GLY A 15 4.446 -3.486 0.187 1.00 0.00 O ATOM 0 H GLY A 15 4.916 -1.981 -3.783 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.505 -1.656 -1.308 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.383 -2.976 -2.454 1.00 0.00 H new ATOM 90 N ARG A 16 6.074 -3.730 -1.341 1.00 0.00 N ATOM 91 CA ARG A 16 7.020 -4.353 -0.406 1.00 0.00 C ATOM 92 C ARG A 16 7.585 -3.269 0.515 1.00 0.00 C ATOM 93 O ARG A 16 7.603 -3.443 1.722 1.00 0.00 O ATOM 94 CB ARG A 16 8.144 -5.104 -1.145 1.00 0.00 C ATOM 95 CG ARG A 16 9.152 -5.752 -0.166 1.00 0.00 C ATOM 96 CD ARG A 16 10.472 -4.974 0.004 1.00 0.00 C ATOM 97 NE ARG A 16 11.365 -5.225 -1.141 1.00 0.00 N ATOM 98 CZ ARG A 16 12.432 -4.530 -1.519 1.00 0.00 C ATOM 99 NH1 ARG A 16 12.897 -3.492 -0.859 1.00 0.00 N ATOM 100 NH2 ARG A 16 13.068 -4.889 -2.611 1.00 0.00 N ATOM 0 H ARG A 16 6.405 -3.684 -2.305 1.00 0.00 H new ATOM 0 HA ARG A 16 6.494 -5.099 0.189 1.00 0.00 H new ATOM 0 HB2 ARG A 16 7.708 -5.876 -1.779 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.671 -4.412 -1.802 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.677 -5.853 0.810 1.00 0.00 H new ATOM 0 HG3 ARG A 16 9.381 -6.759 -0.515 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.265 -3.907 0.085 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.963 -5.275 0.929 1.00 0.00 H new ATOM 0 HE ARG A 16 11.135 -6.035 -1.716 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.433 -3.180 -0.006 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.722 -2.998 -1.200 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.740 -5.689 -3.152 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.889 -4.368 -2.917 1.00 0.00 H new ATOM 114 N ALA A 17 7.980 -2.127 -0.046 1.00 0.00 N ATOM 115 CA ALA A 17 8.598 -1.015 0.666 1.00 0.00 C ATOM 116 C ALA A 17 7.678 -0.352 1.715 1.00 0.00 C ATOM 117 O ALA A 17 8.201 0.278 2.632 1.00 0.00 O ATOM 118 CB ALA A 17 9.119 -0.020 -0.382 1.00 0.00 C ATOM 0 H ALA A 17 7.874 -1.947 -1.044 1.00 0.00 H new ATOM 0 HA ALA A 17 9.425 -1.397 1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.588 0.826 0.121 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.851 -0.514 -1.021 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.288 0.336 -0.991 1.00 0.00 H new ATOM 124 N LEU A 18 6.348 -0.474 1.609 1.00 0.00 N ATOM 125 CA LEU A 18 5.401 -0.087 2.668 1.00 0.00 C ATOM 126 C LEU A 18 4.900 -1.286 3.501 1.00 0.00 C ATOM 127 O LEU A 18 4.218 -1.068 4.495 1.00 0.00 O ATOM 128 CB LEU A 18 4.277 0.820 2.105 1.00 0.00 C ATOM 129 CG LEU A 18 4.617 2.329 2.247 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.569 2.795 1.136 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.370 3.230 2.249 1.00 0.00 C ATOM 0 H LEU A 18 5.892 -0.848 0.777 1.00 0.00 H new ATOM 0 HA LEU A 18 5.944 0.520 3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.113 0.583 1.054 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.345 0.608 2.628 1.00 0.00 H new ATOM 0 HG LEU A 18 5.105 2.427 3.217 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.787 3.855 1.264 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.497 2.225 1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.100 2.636 0.165 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.674 4.272 2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.826 3.101 1.313 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.725 2.957 3.084 1.00 0.00 H new ATOM 143 N ALA A 19 5.283 -2.524 3.173 1.00 0.00 N ATOM 144 CA ALA A 19 5.088 -3.711 4.022 1.00 0.00 C ATOM 145 C ALA A 19 6.239 -3.928 5.043 1.00 0.00 C ATOM 146 O ALA A 19 6.244 -4.917 5.777 1.00 0.00 O ATOM 147 CB ALA A 19 4.916 -4.920 3.092 1.00 0.00 C ATOM 0 H ALA A 19 5.748 -2.737 2.291 1.00 0.00 H new ATOM 0 HA ALA A 19 4.199 -3.569 4.636 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.769 -5.820 3.689 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.049 -4.765 2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.808 -5.035 2.476 1.00 0.00 H new ATOM 153 N ASP A 20 7.228 -3.031 5.058 1.00 0.00 N ATOM 154 CA ASP A 20 8.473 -3.110 5.801 1.00 0.00 C ATOM 155 C ASP A 20 8.302 -3.010 7.333 1.00 0.00 C ATOM 156 O ASP A 20 7.319 -2.447 7.820 1.00 0.00 O ATOM 157 CB ASP A 20 9.385 -1.964 5.318 1.00 0.00 C ATOM 158 CG ASP A 20 10.468 -2.384 4.319 1.00 0.00 C ATOM 159 OD1 ASP A 20 10.133 -2.770 3.183 1.00 0.00 O ATOM 160 OD2 ASP A 20 11.652 -2.077 4.588 1.00 0.00 O ATOM 0 H ASP A 20 7.168 -2.173 4.510 1.00 0.00 H new ATOM 0 HA ASP A 20 8.903 -4.093 5.611 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.765 -1.194 4.859 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.866 -1.511 6.185 1.00 0.00 H new ATOM 165 N PRO A 21 9.323 -3.466 8.085 1.00 0.00 N ATOM 166 CA PRO A 21 9.444 -3.344 9.537 1.00 0.00 C ATOM 167 C PRO A 21 9.758 -1.880 9.924 1.00 0.00 C ATOM 168 O PRO A 21 9.016 -0.956 9.585 1.00 0.00 O ATOM 169 CB PRO A 21 10.560 -4.354 9.885 1.00 0.00 C ATOM 170 CG PRO A 21 11.498 -4.176 8.689 1.00 0.00 C ATOM 171 CD PRO A 21 10.502 -4.139 7.550 1.00 0.00 C ATOM 0 HA PRO A 21 8.535 -3.570 10.095 1.00 0.00 H new ATOM 0 HB2 PRO A 21 11.048 -4.119 10.831 1.00 0.00 H new ATOM 0 HB3 PRO A 21 10.183 -5.374 9.965 1.00 0.00 H new ATOM 0 HG2 PRO A 21 12.083 -3.259 8.756 1.00 0.00 H new ATOM 0 HG3 PRO A 21 12.206 -5.000 8.593 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.906 -3.601 6.693 1.00 0.00 H new ATOM 0 HD3 PRO A 21 10.259 -5.145 7.209 1.00 0.00 H new ATOM 179 N THR A 22 10.878 -1.636 10.615 1.00 0.00 N ATOM 180 CA THR A 22 11.321 -0.312 11.057 1.00 0.00 C ATOM 181 C THR A 22 11.477 0.691 9.911 1.00 0.00 C ATOM 182 O THR A 22 11.312 1.887 10.156 1.00 0.00 O ATOM 183 CB THR A 22 12.581 -0.459 11.919 1.00 0.00 C ATOM 184 OG1 THR A 22 12.279 -1.425 12.897 1.00 0.00 O ATOM 185 CG2 THR A 22 12.947 0.829 12.660 1.00 0.00 C ATOM 0 H THR A 22 11.520 -2.380 10.890 1.00 0.00 H new ATOM 0 HA THR A 22 10.536 0.124 11.675 1.00 0.00 H new ATOM 0 HB THR A 22 13.417 -0.723 11.271 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.058 -1.558 13.477 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.846 0.664 13.253 1.00 0.00 H new ATOM 0 HG22 THR A 22 13.129 1.625 11.938 1.00 0.00 H new ATOM 0 HG23 THR A 22 12.126 1.116 13.317 1.00 0.00 H new ATOM 193 N ARG A 23 11.635 0.265 8.645 1.00 0.00 N ATOM 194 CA ARG A 23 11.644 1.219 7.525 1.00 0.00 C ATOM 195 C ARG A 23 10.264 1.851 7.288 1.00 0.00 C ATOM 196 O ARG A 23 10.179 3.059 7.068 1.00 0.00 O ATOM 197 CB ARG A 23 12.187 0.597 6.228 1.00 0.00 C ATOM 198 CG ARG A 23 13.060 1.632 5.498 1.00 0.00 C ATOM 199 CD ARG A 23 13.410 1.272 4.037 1.00 0.00 C ATOM 200 NE ARG A 23 12.428 1.827 3.093 1.00 0.00 N ATOM 201 CZ ARG A 23 11.269 1.291 2.756 1.00 0.00 C ATOM 202 NH1 ARG A 23 10.995 0.039 2.969 1.00 0.00 N ATOM 203 NH2 ARG A 23 10.325 2.025 2.225 1.00 0.00 N ATOM 0 H ARG A 23 11.756 -0.712 8.377 1.00 0.00 H new ATOM 0 HA ARG A 23 12.328 2.015 7.819 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.772 -0.294 6.455 1.00 0.00 H new ATOM 0 HB3 ARG A 23 11.362 0.283 5.588 1.00 0.00 H new ATOM 0 HG2 ARG A 23 12.544 2.592 5.507 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.987 1.763 6.057 1.00 0.00 H new ATOM 0 HD2 ARG A 23 14.403 1.652 3.796 1.00 0.00 H new ATOM 0 HD3 ARG A 23 13.448 0.188 3.928 1.00 0.00 H new ATOM 0 HE ARG A 23 12.666 2.716 2.654 1.00 0.00 H new ATOM 0 HH11 ARG A 23 11.687 -0.566 3.411 1.00 0.00 H new ATOM 0 HH12 ARG A 23 10.088 -0.338 2.694 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.481 3.021 2.068 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.433 1.601 1.968 1.00 0.00 H new ATOM 217 N CYS A 24 9.163 1.098 7.397 1.00 0.00 N ATOM 218 CA CYS A 24 7.835 1.722 7.400 1.00 0.00 C ATOM 219 C CYS A 24 7.575 2.491 8.712 1.00 0.00 C ATOM 220 O CYS A 24 6.901 3.527 8.705 1.00 0.00 O ATOM 221 CB CYS A 24 6.756 0.686 7.064 1.00 0.00 C ATOM 222 SG CYS A 24 5.313 1.625 6.484 1.00 0.00 S ATOM 0 H CYS A 24 9.162 0.082 7.482 1.00 0.00 H new ATOM 0 HA CYS A 24 7.794 2.475 6.613 1.00 0.00 H new ATOM 0 HB2 CYS A 24 7.105 -0.004 6.296 1.00 0.00 H new ATOM 0 HB3 CYS A 24 6.505 0.088 7.940 1.00 0.00 H new ATOM 0 HG CYS A 24 4.619 0.892 5.664 1.00 0.00 H new ATOM 228 N ARG A 25 8.194 2.082 9.832 1.00 0.00 N ATOM 229 CA ARG A 25 8.154 2.879 11.069 1.00 0.00 C ATOM 230 C ARG A 25 8.808 4.268 10.878 1.00 0.00 C ATOM 231 O ARG A 25 8.244 5.271 11.299 1.00 0.00 O ATOM 232 CB ARG A 25 8.751 2.094 12.251 1.00 0.00 C ATOM 233 CG ARG A 25 8.024 2.386 13.576 1.00 0.00 C ATOM 234 CD ARG A 25 6.721 1.581 13.750 1.00 0.00 C ATOM 235 NE ARG A 25 6.996 0.162 14.047 1.00 0.00 N ATOM 236 CZ ARG A 25 6.110 -0.807 14.267 1.00 0.00 C ATOM 237 NH1 ARG A 25 4.806 -0.658 14.163 1.00 0.00 N ATOM 238 NH2 ARG A 25 6.527 -2.000 14.619 1.00 0.00 N ATOM 0 H ARG A 25 8.723 1.213 9.906 1.00 0.00 H new ATOM 0 HA ARG A 25 7.109 3.071 11.313 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.698 1.026 12.038 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.806 2.346 12.355 1.00 0.00 H new ATOM 0 HG2 ARG A 25 8.694 2.163 14.406 1.00 0.00 H new ATOM 0 HG3 ARG A 25 7.795 3.450 13.629 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.130 2.014 14.557 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.123 1.654 12.842 1.00 0.00 H new ATOM 0 HE ARG A 25 7.979 -0.108 14.089 1.00 0.00 H new ATOM 0 HH11 ARG A 25 4.416 0.246 13.898 1.00 0.00 H new ATOM 0 HH12 ARG A 25 4.186 -1.447 14.347 1.00 0.00 H new ATOM 0 HH21 ARG A 25 7.525 -2.181 14.723 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.853 -2.746 14.789 1.00 0.00 H new ATOM 252 N ILE A 26 9.928 4.364 10.152 1.00 0.00 N ATOM 253 CA ILE A 26 10.564 5.640 9.737 1.00 0.00 C ATOM 254 C ILE A 26 9.614 6.532 8.934 1.00 0.00 C ATOM 255 O ILE A 26 9.535 7.727 9.203 1.00 0.00 O ATOM 256 CB ILE A 26 11.851 5.345 8.932 1.00 0.00 C ATOM 257 CG1 ILE A 26 12.895 4.695 9.854 1.00 0.00 C ATOM 258 CG2 ILE A 26 12.403 6.570 8.188 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.949 5.602 10.486 1.00 0.00 C ATOM 0 H ILE A 26 10.437 3.543 9.824 1.00 0.00 H new ATOM 0 HA ILE A 26 10.820 6.192 10.641 1.00 0.00 H new ATOM 0 HB ILE A 26 11.594 4.641 8.140 1.00 0.00 H new ATOM 0 HG12 ILE A 26 12.362 4.189 10.659 1.00 0.00 H new ATOM 0 HG13 ILE A 26 13.414 3.926 9.282 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.306 6.290 7.645 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.655 6.936 7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.640 7.355 8.906 1.00 0.00 H new ATOM 0 HD11 ILE A 26 14.616 5.006 11.109 1.00 0.00 H new ATOM 0 HD12 ILE A 26 14.526 6.091 9.701 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.458 6.358 11.099 1.00 0.00 H new ATOM 271 N LEU A 27 8.863 5.954 7.991 1.00 0.00 N ATOM 272 CA LEU A 27 7.841 6.710 7.248 1.00 0.00 C ATOM 273 C LEU A 27 6.773 7.286 8.180 1.00 0.00 C ATOM 274 O LEU A 27 6.448 8.466 8.061 1.00 0.00 O ATOM 275 CB LEU A 27 7.166 5.863 6.146 1.00 0.00 C ATOM 276 CG LEU A 27 8.033 5.555 4.914 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.251 4.631 3.970 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.415 6.821 4.132 1.00 0.00 C ATOM 0 H LEU A 27 8.940 4.973 7.723 1.00 0.00 H new ATOM 0 HA LEU A 27 8.370 7.533 6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.844 4.919 6.586 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.267 6.383 5.814 1.00 0.00 H new ATOM 0 HG LEU A 27 8.949 5.086 5.273 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.859 4.408 3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.007 3.704 4.488 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.331 5.125 3.657 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.027 6.547 3.272 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.511 7.323 3.788 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.979 7.492 4.780 1.00 0.00 H new ATOM 290 N VAL A 28 6.240 6.484 9.108 1.00 0.00 N ATOM 291 CA VAL A 28 5.083 6.895 9.934 1.00 0.00 C ATOM 292 C VAL A 28 5.476 7.872 11.053 1.00 0.00 C ATOM 293 O VAL A 28 4.669 8.697 11.465 1.00 0.00 O ATOM 294 CB VAL A 28 4.274 5.681 10.461 1.00 0.00 C ATOM 295 CG1 VAL A 28 4.808 5.061 11.764 1.00 0.00 C ATOM 296 CG2 VAL A 28 2.792 6.038 10.649 1.00 0.00 C ATOM 0 H VAL A 28 6.586 5.546 9.311 1.00 0.00 H new ATOM 0 HA VAL A 28 4.414 7.446 9.273 1.00 0.00 H new ATOM 0 HB VAL A 28 4.393 4.926 9.684 1.00 0.00 H new ATOM 0 HG11 VAL A 28 4.177 4.220 12.052 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.829 4.712 11.609 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.797 5.811 12.555 1.00 0.00 H new ATOM 0 HG21 VAL A 28 2.252 5.167 11.019 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.702 6.853 11.368 1.00 0.00 H new ATOM 0 HG23 VAL A 28 2.369 6.348 9.694 1.00 0.00 H new ATOM 306 N ALA A 29 6.731 7.820 11.512 1.00 0.00 N ATOM 307 CA ALA A 29 7.280 8.775 12.467 1.00 0.00 C ATOM 308 C ALA A 29 7.751 10.079 11.815 1.00 0.00 C ATOM 309 O ALA A 29 7.798 11.094 12.498 1.00 0.00 O ATOM 310 CB ALA A 29 8.388 8.051 13.236 1.00 0.00 C ATOM 0 H ALA A 29 7.398 7.104 11.224 1.00 0.00 H new ATOM 0 HA ALA A 29 6.501 9.104 13.155 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.829 8.731 13.965 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.968 7.188 13.752 1.00 0.00 H new ATOM 0 HB3 ALA A 29 9.157 7.718 12.539 1.00 0.00 H new ATOM 316 N LEU A 30 8.049 10.128 10.512 1.00 0.00 N ATOM 317 CA LEU A 30 8.296 11.392 9.861 1.00 0.00 C ATOM 318 C LEU A 30 7.005 12.145 9.561 1.00 0.00 C ATOM 319 O LEU A 30 7.051 13.373 9.560 1.00 0.00 O ATOM 320 CB LEU A 30 9.066 11.090 8.603 1.00 0.00 C ATOM 321 CG LEU A 30 9.881 12.305 8.154 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.007 12.698 9.128 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.427 11.807 6.840 1.00 0.00 C ATOM 0 H LEU A 30 8.121 9.311 9.905 1.00 0.00 H new ATOM 0 HA LEU A 30 8.867 12.049 10.517 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.732 10.244 8.774 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.376 10.798 7.811 1.00 0.00 H new ATOM 0 HG LEU A 30 9.291 13.220 8.097 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.538 13.567 8.739 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.579 12.940 10.101 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.703 11.866 9.235 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.045 12.581 6.386 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.030 10.915 7.011 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.601 11.564 6.172 1.00 0.00 H new ATOM 335 N LEU A 31 5.899 11.421 9.339 1.00 0.00 N ATOM 336 CA LEU A 31 4.533 11.921 9.234 1.00 0.00 C ATOM 337 C LEU A 31 4.180 12.915 10.359 1.00 0.00 C ATOM 338 O LEU A 31 3.710 14.016 10.091 1.00 0.00 O ATOM 339 CB LEU A 31 3.632 10.686 9.316 1.00 0.00 C ATOM 340 CG LEU A 31 2.471 10.656 8.329 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.664 9.430 8.739 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.578 11.905 8.320 1.00 0.00 C ATOM 0 H LEU A 31 5.944 10.409 9.222 1.00 0.00 H new ATOM 0 HA LEU A 31 4.403 12.471 8.302 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.245 9.799 9.157 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.229 10.618 10.327 1.00 0.00 H new ATOM 0 HG LEU A 31 2.861 10.624 7.312 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.802 9.325 8.081 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.289 8.540 8.662 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.323 9.546 9.768 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.784 11.780 7.583 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.138 12.045 9.307 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.177 12.779 8.063 1.00 0.00 H new ATOM 354 N ASP A 32 4.475 12.497 11.593 1.00 0.00 N ATOM 355 CA ASP A 32 4.367 13.235 12.861 1.00 0.00 C ATOM 356 C ASP A 32 5.758 13.750 13.311 1.00 0.00 C ATOM 357 O ASP A 32 6.085 13.815 14.495 1.00 0.00 O ATOM 358 CB ASP A 32 3.705 12.292 13.888 1.00 0.00 C ATOM 359 CG ASP A 32 3.148 13.003 15.133 1.00 0.00 C ATOM 360 OD1 ASP A 32 2.462 14.034 14.952 1.00 0.00 O ATOM 361 OD2 ASP A 32 3.356 12.467 16.246 1.00 0.00 O ATOM 0 H ASP A 32 4.826 11.552 11.747 1.00 0.00 H new ATOM 0 HA ASP A 32 3.748 14.126 12.754 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.894 11.753 13.399 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.436 11.549 14.205 1.00 0.00 H new ATOM 366 N GLY A 33 6.630 14.025 12.334 1.00 0.00 N ATOM 367 CA GLY A 33 8.010 14.472 12.525 1.00 0.00 C ATOM 368 C GLY A 33 8.348 15.737 11.740 1.00 0.00 C ATOM 369 O GLY A 33 8.353 16.821 12.311 1.00 0.00 O ATOM 0 H GLY A 33 6.381 13.938 11.349 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.182 14.654 13.586 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.688 13.674 12.224 1.00 0.00 H new ATOM 373 N VAL A 34 8.717 15.571 10.464 1.00 0.00 N ATOM 374 CA VAL A 34 9.270 16.587 9.522 1.00 0.00 C ATOM 375 C VAL A 34 10.140 17.730 10.101 1.00 0.00 C ATOM 376 O VAL A 34 10.182 18.832 9.554 1.00 0.00 O ATOM 377 CB VAL A 34 8.180 17.137 8.584 1.00 0.00 C ATOM 378 CG1 VAL A 34 7.630 16.027 7.688 1.00 0.00 C ATOM 379 CG2 VAL A 34 7.007 17.713 9.387 1.00 0.00 C ATOM 0 H VAL A 34 8.636 14.658 10.016 1.00 0.00 H new ATOM 0 HA VAL A 34 10.000 16.002 8.963 1.00 0.00 H new ATOM 0 HB VAL A 34 8.640 17.919 7.980 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.861 16.436 7.033 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.438 15.612 7.085 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.199 15.240 8.307 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.250 18.095 8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.572 16.930 10.008 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.364 18.524 10.022 1.00 0.00 H new ATOM 389 N CYS A 35 10.873 17.464 11.183 1.00 0.00 N ATOM 390 CA CYS A 35 11.816 18.388 11.814 1.00 0.00 C ATOM 391 C CYS A 35 13.173 18.350 11.106 1.00 0.00 C ATOM 392 O CYS A 35 13.413 19.147 10.209 1.00 0.00 O ATOM 393 CB CYS A 35 11.915 18.121 13.325 1.00 0.00 C ATOM 394 SG CYS A 35 10.367 18.591 14.142 1.00 0.00 S ATOM 0 H CYS A 35 10.824 16.565 11.662 1.00 0.00 H new ATOM 0 HA CYS A 35 11.441 19.405 11.705 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.124 17.066 13.503 1.00 0.00 H new ATOM 0 HB3 CYS A 35 12.745 18.686 13.749 1.00 0.00 H new ATOM 0 HG CYS A 35 9.371 17.988 13.564 1.00 0.00 H new ATOM 400 N TYR A 36 14.073 17.438 11.503 1.00 0.00 N ATOM 401 CA TYR A 36 15.474 17.456 11.053 1.00 0.00 C ATOM 402 C TYR A 36 16.013 16.065 10.666 1.00 0.00 C ATOM 403 O TYR A 36 15.548 15.062 11.216 1.00 0.00 O ATOM 404 CB TYR A 36 16.379 18.105 12.130 1.00 0.00 C ATOM 405 CG TYR A 36 15.744 19.083 13.104 1.00 0.00 C ATOM 406 CD1 TYR A 36 15.142 20.266 12.641 1.00 0.00 C ATOM 407 CD2 TYR A 36 15.749 18.804 14.485 1.00 0.00 C ATOM 408 CE1 TYR A 36 14.543 21.161 13.542 1.00 0.00 C ATOM 409 CE2 TYR A 36 15.156 19.697 15.398 1.00 0.00 C ATOM 410 CZ TYR A 36 14.556 20.888 14.932 1.00 0.00 C ATOM 411 OH TYR A 36 14.000 21.758 15.822 1.00 0.00 O ATOM 0 H TYR A 36 13.853 16.672 12.140 1.00 0.00 H new ATOM 0 HA TYR A 36 15.496 18.057 10.144 1.00 0.00 H new ATOM 0 HB2 TYR A 36 16.833 17.303 12.712 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.189 18.624 11.617 1.00 0.00 H new ATOM 0 HD1 TYR A 36 15.140 20.488 11.584 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.212 17.897 14.846 1.00 0.00 H new ATOM 0 HE1 TYR A 36 14.071 22.060 13.174 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.160 19.471 16.454 1.00 0.00 H new ATOM 0 HH TYR A 36 14.101 21.406 16.731 1.00 0.00 H new ATOM 421 N PRO A 37 17.015 15.960 9.765 1.00 0.00 N ATOM 422 CA PRO A 37 17.679 14.690 9.492 1.00 0.00 C ATOM 423 C PRO A 37 18.241 14.128 10.799 1.00 0.00 C ATOM 424 O PRO A 37 18.783 14.865 11.620 1.00 0.00 O ATOM 425 CB PRO A 37 18.767 14.988 8.458 1.00 0.00 C ATOM 426 CG PRO A 37 19.062 16.470 8.665 1.00 0.00 C ATOM 427 CD PRO A 37 17.694 17.030 9.046 1.00 0.00 C ATOM 0 HA PRO A 37 17.003 13.933 9.095 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.654 14.376 8.622 1.00 0.00 H new ATOM 0 HB3 PRO A 37 18.423 14.786 7.444 1.00 0.00 H new ATOM 0 HG2 PRO A 37 19.799 16.631 9.451 1.00 0.00 H new ATOM 0 HG3 PRO A 37 19.454 16.936 7.761 1.00 0.00 H new ATOM 0 HD2 PRO A 37 17.795 17.918 9.670 1.00 0.00 H new ATOM 0 HD3 PRO A 37 17.131 17.325 8.160 1.00 0.00 H new ATOM 435 N GLY A 38 18.033 12.830 11.026 1.00 0.00 N ATOM 436 CA GLY A 38 18.415 12.174 12.277 1.00 0.00 C ATOM 437 C GLY A 38 17.418 12.350 13.427 1.00 0.00 C ATOM 438 O GLY A 38 17.583 11.673 14.439 1.00 0.00 O ATOM 0 H GLY A 38 17.596 12.205 10.349 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.544 11.108 12.087 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.384 12.561 12.593 1.00 0.00 H new ATOM 442 N GLN A 39 16.349 13.160 13.288 1.00 0.00 N ATOM 443 CA GLN A 39 15.339 13.311 14.344 1.00 0.00 C ATOM 444 C GLN A 39 14.690 11.976 14.726 1.00 0.00 C ATOM 445 O GLN A 39 14.255 11.804 15.858 1.00 0.00 O ATOM 446 CB GLN A 39 14.234 14.314 13.965 1.00 0.00 C ATOM 447 CG GLN A 39 13.201 13.806 12.923 1.00 0.00 C ATOM 448 CD GLN A 39 11.843 14.458 13.033 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.293 14.910 12.053 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.254 14.529 14.199 1.00 0.00 N ATOM 0 H GLN A 39 16.167 13.718 12.454 1.00 0.00 H new ATOM 0 HA GLN A 39 15.884 13.699 15.205 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.700 14.600 14.871 1.00 0.00 H new ATOM 0 HB3 GLN A 39 14.705 15.216 13.575 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.595 13.979 11.922 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.085 12.728 13.038 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.714 14.150 15.027 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.335 14.964 14.280 1.00 0.00 H new ATOM 459 N LEU A 40 14.621 11.037 13.770 1.00 0.00 N ATOM 460 CA LEU A 40 13.960 9.748 13.932 1.00 0.00 C ATOM 461 C LEU A 40 14.709 8.841 14.904 1.00 0.00 C ATOM 462 O LEU A 40 14.125 7.884 15.379 1.00 0.00 O ATOM 463 CB LEU A 40 13.787 9.057 12.570 1.00 0.00 C ATOM 464 CG LEU A 40 12.908 9.830 11.565 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.499 9.684 10.158 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.461 9.335 11.632 1.00 0.00 C ATOM 0 H LEU A 40 15.034 11.162 12.846 1.00 0.00 H new ATOM 0 HA LEU A 40 12.975 9.937 14.359 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.771 8.903 12.128 1.00 0.00 H new ATOM 0 HB3 LEU A 40 13.351 8.071 12.730 1.00 0.00 H new ATOM 0 HG LEU A 40 12.896 10.889 11.821 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.880 10.229 9.445 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.511 10.089 10.145 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.527 8.630 9.883 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.853 9.890 10.917 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.428 8.273 11.389 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.070 9.489 12.638 1.00 0.00 H new ATOM 478 N ALA A 41 15.968 9.122 15.234 1.00 0.00 N ATOM 479 CA ALA A 41 16.668 8.343 16.255 1.00 0.00 C ATOM 480 C ALA A 41 16.059 8.607 17.639 1.00 0.00 C ATOM 481 O ALA A 41 15.681 7.667 18.330 1.00 0.00 O ATOM 482 CB ALA A 41 18.170 8.645 16.165 1.00 0.00 C ATOM 0 H ALA A 41 16.519 9.872 14.817 1.00 0.00 H new ATOM 0 HA ALA A 41 16.545 7.274 16.083 1.00 0.00 H new ATOM 0 HB1 ALA A 41 18.703 8.070 16.922 1.00 0.00 H new ATOM 0 HB2 ALA A 41 18.537 8.372 15.176 1.00 0.00 H new ATOM 0 HB3 ALA A 41 18.338 9.709 16.333 1.00 0.00 H new ATOM 488 N ALA A 42 15.844 9.877 17.997 1.00 0.00 N ATOM 489 CA ALA A 42 15.125 10.231 19.222 1.00 0.00 C ATOM 490 C ALA A 42 13.639 9.833 19.148 1.00 0.00 C ATOM 491 O ALA A 42 13.084 9.334 20.120 1.00 0.00 O ATOM 492 CB ALA A 42 15.301 11.736 19.463 1.00 0.00 C ATOM 0 H ALA A 42 16.160 10.679 17.452 1.00 0.00 H new ATOM 0 HA ALA A 42 15.540 9.676 20.063 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.773 12.023 20.372 1.00 0.00 H new ATOM 0 HB2 ALA A 42 16.361 11.966 19.571 1.00 0.00 H new ATOM 0 HB3 ALA A 42 14.894 12.290 18.617 1.00 0.00 H new ATOM 498 N HIS A 43 13.003 10.023 17.989 1.00 0.00 N ATOM 499 CA HIS A 43 11.567 9.775 17.795 1.00 0.00 C ATOM 500 C HIS A 43 11.183 8.276 17.780 1.00 0.00 C ATOM 501 O HIS A 43 10.059 7.911 18.117 1.00 0.00 O ATOM 502 CB HIS A 43 11.179 10.457 16.477 1.00 0.00 C ATOM 503 CG HIS A 43 9.754 10.911 16.370 1.00 0.00 C ATOM 504 ND1 HIS A 43 8.965 11.409 17.404 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.110 11.082 15.186 1.00 0.00 C ATOM 506 CE1 HIS A 43 7.840 11.846 16.813 1.00 0.00 C ATOM 507 NE2 HIS A 43 7.900 11.673 15.481 1.00 0.00 N ATOM 0 H HIS A 43 13.474 10.357 17.148 1.00 0.00 H new ATOM 0 HA HIS A 43 11.019 10.184 18.644 1.00 0.00 H new ATOM 0 HB2 HIS A 43 11.827 11.321 16.333 1.00 0.00 H new ATOM 0 HB3 HIS A 43 11.382 9.766 15.659 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.474 10.809 14.207 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.001 12.278 17.337 1.00 0.00 H new ATOM 0 HE2 HIS A 43 7.179 11.933 14.808 1.00 0.00 H new ATOM 515 N LEU A 44 12.113 7.404 17.372 1.00 0.00 N ATOM 516 CA LEU A 44 11.958 5.944 17.422 1.00 0.00 C ATOM 517 C LEU A 44 12.589 5.337 18.685 1.00 0.00 C ATOM 518 O LEU A 44 12.215 4.233 19.062 1.00 0.00 O ATOM 519 CB LEU A 44 12.568 5.305 16.152 1.00 0.00 C ATOM 520 CG LEU A 44 11.904 5.708 14.816 1.00 0.00 C ATOM 521 CD1 LEU A 44 12.404 4.866 13.651 1.00 0.00 C ATOM 522 CD2 LEU A 44 10.370 5.602 14.844 1.00 0.00 C ATOM 0 H LEU A 44 13.012 7.699 16.990 1.00 0.00 H new ATOM 0 HA LEU A 44 10.891 5.726 17.461 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.625 5.569 16.106 1.00 0.00 H new ATOM 0 HB3 LEU A 44 12.514 4.221 16.251 1.00 0.00 H new ATOM 0 HG LEU A 44 12.187 6.752 14.677 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.910 5.185 12.733 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.481 4.993 13.546 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.179 3.816 13.838 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.967 5.899 13.876 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.080 4.573 15.057 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.974 6.259 15.619 1.00 0.00 H new ATOM 534 N GLY A 45 13.550 6.026 19.309 1.00 0.00 N ATOM 535 CA GLY A 45 14.412 5.476 20.361 1.00 0.00 C ATOM 536 C GLY A 45 15.536 4.605 19.786 1.00 0.00 C ATOM 537 O GLY A 45 16.201 3.899 20.540 1.00 0.00 O ATOM 0 H GLY A 45 13.755 7.002 19.093 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.845 6.293 20.938 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.810 4.883 21.050 1.00 0.00 H new ATOM 541 N LEU A 46 15.726 4.611 18.458 1.00 0.00 N ATOM 542 CA LEU A 46 16.596 3.681 17.729 1.00 0.00 C ATOM 543 C LEU A 46 17.869 4.357 17.208 1.00 0.00 C ATOM 544 O LEU A 46 17.996 5.580 17.240 1.00 0.00 O ATOM 545 CB LEU A 46 15.782 2.988 16.621 1.00 0.00 C ATOM 546 CG LEU A 46 14.562 2.198 17.147 1.00 0.00 C ATOM 547 CD1 LEU A 46 13.863 1.527 15.962 1.00 0.00 C ATOM 548 CD2 LEU A 46 14.942 1.156 18.211 1.00 0.00 C ATOM 0 H LEU A 46 15.264 5.283 17.846 1.00 0.00 H new ATOM 0 HA LEU A 46 16.952 2.916 18.418 1.00 0.00 H new ATOM 0 HB2 LEU A 46 15.438 3.740 15.911 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.435 2.308 16.074 1.00 0.00 H new ATOM 0 HG LEU A 46 13.889 2.901 17.637 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.000 0.966 16.319 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.534 2.289 15.255 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.557 0.848 15.467 1.00 0.00 H new ATOM 0 HD21 LEU A 46 14.046 0.632 18.544 1.00 0.00 H new ATOM 0 HD22 LEU A 46 15.644 0.439 17.784 1.00 0.00 H new ATOM 0 HD23 LEU A 46 15.406 1.656 19.061 1.00 0.00 H new ATOM 560 N THR A 47 18.844 3.556 16.757 1.00 0.00 N ATOM 561 CA THR A 47 20.196 4.062 16.481 1.00 0.00 C ATOM 562 C THR A 47 20.237 4.989 15.274 1.00 0.00 C ATOM 563 O THR A 47 19.592 4.744 14.249 1.00 0.00 O ATOM 564 CB THR A 47 21.272 2.967 16.415 1.00 0.00 C ATOM 565 OG1 THR A 47 21.228 2.271 15.197 1.00 0.00 O ATOM 566 CG2 THR A 47 21.125 1.899 17.497 1.00 0.00 C ATOM 0 H THR A 47 18.723 2.559 16.576 1.00 0.00 H new ATOM 0 HA THR A 47 20.455 4.664 17.352 1.00 0.00 H new ATOM 0 HB THR A 47 22.207 3.512 16.547 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.926 1.583 15.188 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.918 1.159 17.388 1.00 0.00 H new ATOM 0 HG22 THR A 47 21.195 2.365 18.480 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.156 1.409 17.396 1.00 0.00 H new ATOM 574 N ARG A 48 21.079 6.022 15.366 1.00 0.00 N ATOM 575 CA ARG A 48 21.397 6.935 14.261 1.00 0.00 C ATOM 576 C ARG A 48 21.939 6.169 13.049 1.00 0.00 C ATOM 577 O ARG A 48 21.681 6.539 11.904 1.00 0.00 O ATOM 578 CB ARG A 48 22.376 8.017 14.757 1.00 0.00 C ATOM 579 CG ARG A 48 23.816 7.513 14.999 1.00 0.00 C ATOM 580 CD ARG A 48 24.634 8.445 15.904 1.00 0.00 C ATOM 581 NE ARG A 48 24.135 8.382 17.285 1.00 0.00 N ATOM 582 CZ ARG A 48 24.442 9.154 18.315 1.00 0.00 C ATOM 583 NH1 ARG A 48 25.363 10.096 18.243 1.00 0.00 N ATOM 584 NH2 ARG A 48 23.807 8.979 19.449 1.00 0.00 N ATOM 0 H ARG A 48 21.570 6.253 16.229 1.00 0.00 H new ATOM 0 HA ARG A 48 20.486 7.430 13.926 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.405 8.826 14.027 1.00 0.00 H new ATOM 0 HB3 ARG A 48 21.991 8.440 15.685 1.00 0.00 H new ATOM 0 HG2 ARG A 48 23.777 6.521 15.449 1.00 0.00 H new ATOM 0 HG3 ARG A 48 24.324 7.408 14.040 1.00 0.00 H new ATOM 0 HD2 ARG A 48 25.685 8.159 15.877 1.00 0.00 H new ATOM 0 HD3 ARG A 48 24.572 9.468 15.534 1.00 0.00 H new ATOM 0 HE ARG A 48 23.460 7.642 17.476 1.00 0.00 H new ATOM 0 HH11 ARG A 48 25.868 10.250 17.370 1.00 0.00 H new ATOM 0 HH12 ARG A 48 25.570 10.670 19.060 1.00 0.00 H new ATOM 0 HH21 ARG A 48 23.090 8.257 19.526 1.00 0.00 H new ATOM 0 HH22 ARG A 48 24.030 9.564 20.254 1.00 0.00 H new ATOM 598 N SER A 49 22.634 5.059 13.284 1.00 0.00 N ATOM 599 CA SER A 49 23.056 4.120 12.246 1.00 0.00 C ATOM 600 C SER A 49 21.852 3.427 11.593 1.00 0.00 C ATOM 601 O SER A 49 21.691 3.530 10.379 1.00 0.00 O ATOM 602 CB SER A 49 24.021 3.082 12.838 1.00 0.00 C ATOM 603 OG SER A 49 25.044 3.728 13.580 1.00 0.00 O ATOM 0 H SER A 49 22.926 4.781 14.221 1.00 0.00 H new ATOM 0 HA SER A 49 23.572 4.683 11.468 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.475 2.393 13.482 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.462 2.488 12.038 1.00 0.00 H new ATOM 0 HG SER A 49 25.651 3.056 13.954 1.00 0.00 H new ATOM 609 N ASN A 50 20.963 2.784 12.364 1.00 0.00 N ATOM 610 CA ASN A 50 19.860 2.033 11.759 1.00 0.00 C ATOM 611 C ASN A 50 18.808 2.958 11.116 1.00 0.00 C ATOM 612 O ASN A 50 18.292 2.693 10.034 1.00 0.00 O ATOM 613 CB ASN A 50 19.243 1.000 12.726 1.00 0.00 C ATOM 614 CG ASN A 50 18.571 -0.135 11.944 1.00 0.00 C ATOM 615 OD1 ASN A 50 18.918 -0.398 10.799 1.00 0.00 O ATOM 616 ND2 ASN A 50 17.615 -0.848 12.503 1.00 0.00 N ATOM 0 H ASN A 50 20.986 2.769 13.384 1.00 0.00 H new ATOM 0 HA ASN A 50 20.291 1.452 10.944 1.00 0.00 H new ATOM 0 HB2 ASN A 50 20.018 0.593 13.375 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.512 1.488 13.370 1.00 0.00 H new ATOM 0 HD21 ASN A 50 17.175 -1.607 11.983 1.00 0.00 H new ATOM 0 HD22 ASN A 50 17.315 -0.641 13.456 1.00 0.00 H new ATOM 623 N VAL A 51 18.545 4.124 11.701 1.00 0.00 N ATOM 624 CA VAL A 51 17.726 5.157 11.043 1.00 0.00 C ATOM 625 C VAL A 51 18.370 5.651 9.729 1.00 0.00 C ATOM 626 O VAL A 51 17.644 5.881 8.763 1.00 0.00 O ATOM 627 CB VAL A 51 17.485 6.324 12.042 1.00 0.00 C ATOM 628 CG1 VAL A 51 17.103 7.666 11.398 1.00 0.00 C ATOM 629 CG2 VAL A 51 16.452 5.973 13.136 1.00 0.00 C ATOM 0 H VAL A 51 18.883 4.384 12.628 1.00 0.00 H new ATOM 0 HA VAL A 51 16.766 4.724 10.763 1.00 0.00 H new ATOM 0 HB VAL A 51 18.466 6.458 12.497 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.956 8.415 12.177 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.901 7.989 10.730 1.00 0.00 H new ATOM 0 HG13 VAL A 51 16.180 7.548 10.830 1.00 0.00 H new ATOM 0 HG21 VAL A 51 16.325 6.825 13.804 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.497 5.732 12.670 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.804 5.114 13.707 1.00 0.00 H new ATOM 639 N SER A 52 19.703 5.737 9.624 1.00 0.00 N ATOM 640 CA SER A 52 20.365 6.052 8.342 1.00 0.00 C ATOM 641 C SER A 52 20.205 4.931 7.307 1.00 0.00 C ATOM 642 O SER A 52 19.896 5.226 6.150 1.00 0.00 O ATOM 643 CB SER A 52 21.858 6.338 8.514 1.00 0.00 C ATOM 644 OG SER A 52 22.076 7.446 9.367 1.00 0.00 O ATOM 0 H SER A 52 20.345 5.595 10.404 1.00 0.00 H new ATOM 0 HA SER A 52 19.863 6.949 7.980 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.354 5.458 8.924 1.00 0.00 H new ATOM 0 HB3 SER A 52 22.307 6.532 7.540 1.00 0.00 H new ATOM 0 HG SER A 52 21.821 7.209 10.283 1.00 0.00 H new ATOM 650 N ASN A 53 20.340 3.661 7.723 1.00 0.00 N ATOM 651 CA ASN A 53 20.046 2.492 6.881 1.00 0.00 C ATOM 652 C ASN A 53 18.658 2.617 6.245 1.00 0.00 C ATOM 653 O ASN A 53 18.480 2.428 5.041 1.00 0.00 O ATOM 654 CB ASN A 53 20.059 1.200 7.718 1.00 0.00 C ATOM 655 CG ASN A 53 21.418 0.760 8.234 1.00 0.00 C ATOM 656 OD1 ASN A 53 22.466 1.155 7.746 1.00 0.00 O ATOM 657 ND2 ASN A 53 21.418 -0.094 9.240 1.00 0.00 N ATOM 0 H ASN A 53 20.659 3.416 8.660 1.00 0.00 H new ATOM 0 HA ASN A 53 20.814 2.451 6.109 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.394 1.335 8.571 1.00 0.00 H new ATOM 0 HB3 ASN A 53 19.642 0.394 7.114 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.301 -0.433 9.621 1.00 0.00 H new ATOM 0 HD22 ASN A 53 20.535 -0.415 9.637 1.00 0.00 H new ATOM 664 N HIS A 54 17.667 2.996 7.051 1.00 0.00 N ATOM 665 CA HIS A 54 16.296 3.141 6.595 1.00 0.00 C ATOM 666 C HIS A 54 16.072 4.323 5.626 1.00 0.00 C ATOM 667 O HIS A 54 15.232 4.205 4.733 1.00 0.00 O ATOM 668 CB HIS A 54 15.393 3.277 7.824 1.00 0.00 C ATOM 669 CG HIS A 54 15.375 2.088 8.763 1.00 0.00 C ATOM 670 ND1 HIS A 54 15.514 2.133 10.132 1.00 0.00 N ATOM 671 CD2 HIS A 54 15.207 0.770 8.436 1.00 0.00 C ATOM 672 CE1 HIS A 54 15.469 0.876 10.599 1.00 0.00 C ATOM 673 NE2 HIS A 54 15.253 0.010 9.602 1.00 0.00 N ATOM 0 H HIS A 54 17.798 3.210 8.040 1.00 0.00 H new ATOM 0 HA HIS A 54 16.049 2.251 6.017 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.707 4.156 8.387 1.00 0.00 H new ATOM 0 HB3 HIS A 54 14.374 3.463 7.484 1.00 0.00 H new ATOM 0 HD2 HIS A 54 15.063 0.383 7.438 1.00 0.00 H new ATOM 0 HE1 HIS A 54 15.590 0.601 11.636 1.00 0.00 H new ATOM 0 HE2 HIS A 54 15.144 -1.001 9.680 1.00 0.00 H new ATOM 681 N LEU A 55 16.798 5.442 5.790 1.00 0.00 N ATOM 682 CA LEU A 55 16.665 6.663 4.966 1.00 0.00 C ATOM 683 C LEU A 55 17.551 6.671 3.718 1.00 0.00 C ATOM 684 O LEU A 55 17.437 7.594 2.914 1.00 0.00 O ATOM 685 CB LEU A 55 16.969 7.933 5.788 1.00 0.00 C ATOM 686 CG LEU A 55 16.019 8.178 6.976 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.690 9.120 7.983 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.697 8.780 6.481 1.00 0.00 C ATOM 0 H LEU A 55 17.511 5.528 6.515 1.00 0.00 H new ATOM 0 HA LEU A 55 15.626 6.660 4.637 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.990 7.869 6.165 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.928 8.797 5.124 1.00 0.00 H new ATOM 0 HG LEU A 55 15.803 7.228 7.466 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.018 9.293 8.823 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.614 8.668 8.345 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.916 10.070 7.498 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.034 8.949 7.329 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.894 9.728 5.980 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.223 8.092 5.781 1.00 0.00 H new ATOM 700 N SER A 56 18.451 5.711 3.531 1.00 0.00 N ATOM 701 CA SER A 56 19.263 5.675 2.310 1.00 0.00 C ATOM 702 C SER A 56 18.391 5.377 1.081 1.00 0.00 C ATOM 703 O SER A 56 18.363 6.168 0.140 1.00 0.00 O ATOM 704 CB SER A 56 20.426 4.685 2.468 1.00 0.00 C ATOM 705 OG SER A 56 21.497 5.073 1.628 1.00 0.00 O ATOM 0 H SER A 56 18.638 4.958 4.193 1.00 0.00 H new ATOM 0 HA SER A 56 19.703 6.659 2.147 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.756 4.659 3.506 1.00 0.00 H new ATOM 0 HB3 SER A 56 20.097 3.678 2.213 1.00 0.00 H new ATOM 0 HG SER A 56 22.239 4.441 1.731 1.00 0.00 H new ATOM 711 N CYS A 57 17.579 4.315 1.144 1.00 0.00 N ATOM 712 CA CYS A 57 16.697 3.926 0.049 1.00 0.00 C ATOM 713 C CYS A 57 15.485 4.877 -0.076 1.00 0.00 C ATOM 714 O CYS A 57 15.095 5.245 -1.176 1.00 0.00 O ATOM 715 CB CYS A 57 16.269 2.490 0.365 1.00 0.00 C ATOM 716 SG CYS A 57 15.699 1.554 -1.085 1.00 0.00 S ATOM 0 H CYS A 57 17.519 3.704 1.958 1.00 0.00 H new ATOM 0 HA CYS A 57 17.202 3.987 -0.915 1.00 0.00 H new ATOM 0 HB2 CYS A 57 17.108 1.963 0.818 1.00 0.00 H new ATOM 0 HB3 CYS A 57 15.470 2.514 1.106 1.00 0.00 H new ATOM 0 HG CYS A 57 14.635 2.118 -1.574 1.00 0.00 H new ATOM 721 N LEU A 58 14.920 5.295 1.067 1.00 0.00 N ATOM 722 CA LEU A 58 13.691 6.098 1.202 1.00 0.00 C ATOM 723 C LEU A 58 13.730 7.415 0.417 1.00 0.00 C ATOM 724 O LEU A 58 12.707 7.843 -0.126 1.00 0.00 O ATOM 725 CB LEU A 58 13.485 6.385 2.711 1.00 0.00 C ATOM 726 CG LEU A 58 12.049 6.245 3.248 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.593 4.793 3.215 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.992 6.716 4.703 1.00 0.00 C ATOM 0 H LEU A 58 15.330 5.070 1.974 1.00 0.00 H new ATOM 0 HA LEU A 58 12.863 5.529 0.780 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.128 5.711 3.277 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.828 7.399 2.915 1.00 0.00 H new ATOM 0 HG LEU A 58 11.399 6.850 2.616 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.576 4.722 3.600 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.619 4.427 2.189 1.00 0.00 H new ATOM 0 HD13 LEU A 58 12.257 4.189 3.833 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.974 6.615 5.079 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.664 6.108 5.309 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.298 7.761 4.759 1.00 0.00 H new ATOM 740 N ARG A 59 14.907 8.052 0.406 1.00 0.00 N ATOM 741 CA ARG A 59 15.155 9.323 -0.278 1.00 0.00 C ATOM 742 C ARG A 59 15.348 9.139 -1.794 1.00 0.00 C ATOM 743 O ARG A 59 15.104 10.074 -2.552 1.00 0.00 O ATOM 744 CB ARG A 59 16.344 10.033 0.369 1.00 0.00 C ATOM 745 CG ARG A 59 16.070 10.370 1.852 1.00 0.00 C ATOM 746 CD ARG A 59 17.232 11.136 2.458 1.00 0.00 C ATOM 747 NE ARG A 59 18.414 10.270 2.583 1.00 0.00 N ATOM 748 CZ ARG A 59 19.669 10.564 2.278 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.020 11.744 1.805 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.601 9.656 2.456 1.00 0.00 N ATOM 0 H ARG A 59 15.731 7.688 0.884 1.00 0.00 H new ATOM 0 HA ARG A 59 14.272 9.952 -0.164 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.229 9.401 0.297 1.00 0.00 H new ATOM 0 HB3 ARG A 59 16.562 10.950 -0.178 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.158 10.962 1.932 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.903 9.450 2.413 1.00 0.00 H new ATOM 0 HD2 ARG A 59 17.470 11.998 1.835 1.00 0.00 H new ATOM 0 HD3 ARG A 59 16.950 11.519 3.439 1.00 0.00 H new ATOM 0 HE ARG A 59 18.248 9.332 2.948 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.315 12.467 1.663 1.00 0.00 H new ATOM 0 HH12 ARG A 59 20.997 11.934 1.581 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.354 8.738 2.825 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.571 9.869 2.225 1.00 0.00 H new ATOM 764 N GLY A 60 15.741 7.930 -2.225 1.00 0.00 N ATOM 765 CA GLY A 60 15.837 7.506 -3.628 1.00 0.00 C ATOM 766 C GLY A 60 14.468 7.114 -4.169 1.00 0.00 C ATOM 767 O GLY A 60 13.986 7.790 -5.072 1.00 0.00 O ATOM 0 H GLY A 60 16.012 7.191 -1.576 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.253 8.314 -4.229 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.522 6.662 -3.712 1.00 0.00 H new ATOM 771 N CYS A 61 13.777 6.170 -3.505 1.00 0.00 N ATOM 772 CA CYS A 61 12.400 5.735 -3.753 1.00 0.00 C ATOM 773 C CYS A 61 11.390 6.913 -3.821 1.00 0.00 C ATOM 774 O CYS A 61 10.221 6.746 -4.170 1.00 0.00 O ATOM 775 CB CYS A 61 12.041 4.795 -2.580 1.00 0.00 C ATOM 776 SG CYS A 61 12.776 3.140 -2.502 1.00 0.00 S ATOM 0 H CYS A 61 14.199 5.659 -2.729 1.00 0.00 H new ATOM 0 HA CYS A 61 12.337 5.244 -4.724 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.302 5.312 -1.656 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.958 4.671 -2.581 1.00 0.00 H new ATOM 0 HG CYS A 61 12.344 2.523 -1.442 1.00 0.00 H new ATOM 781 N GLY A 62 11.823 8.078 -3.325 1.00 0.00 N ATOM 782 CA GLY A 62 11.069 9.322 -3.286 1.00 0.00 C ATOM 783 C GLY A 62 10.064 9.388 -2.161 1.00 0.00 C ATOM 784 O GLY A 62 9.462 10.436 -1.979 1.00 0.00 O ATOM 0 H GLY A 62 12.755 8.176 -2.922 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.765 10.155 -3.189 1.00 0.00 H new ATOM 0 HA3 GLY A 62 10.548 9.451 -4.235 1.00 0.00 H new ATOM 788 N LEU A 63 9.914 8.314 -1.374 1.00 0.00 N ATOM 789 CA LEU A 63 8.961 8.236 -0.260 1.00 0.00 C ATOM 790 C LEU A 63 9.179 9.346 0.770 1.00 0.00 C ATOM 791 O LEU A 63 8.236 9.758 1.447 1.00 0.00 O ATOM 792 CB LEU A 63 9.048 6.858 0.375 1.00 0.00 C ATOM 793 CG LEU A 63 8.961 5.732 -0.667 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.969 4.437 0.107 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.742 5.784 -1.598 1.00 0.00 C ATOM 0 H LEU A 63 10.461 7.462 -1.496 1.00 0.00 H new ATOM 0 HA LEU A 63 7.956 8.388 -0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.986 6.771 0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.243 6.743 1.100 1.00 0.00 H new ATOM 0 HG LEU A 63 9.809 5.838 -1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.909 3.598 -0.587 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.890 4.364 0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.114 4.412 0.782 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.779 4.945 -2.293 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.829 5.725 -1.006 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.751 6.719 -2.158 1.00 0.00 H new ATOM 807 N VAL A 64 10.424 9.821 0.833 1.00 0.00 N ATOM 808 CA VAL A 64 10.863 11.012 1.553 1.00 0.00 C ATOM 809 C VAL A 64 11.766 11.884 0.687 1.00 0.00 C ATOM 810 O VAL A 64 12.413 11.401 -0.237 1.00 0.00 O ATOM 811 CB VAL A 64 11.620 10.687 2.855 1.00 0.00 C ATOM 812 CG1 VAL A 64 10.645 10.212 3.934 1.00 0.00 C ATOM 813 CG2 VAL A 64 12.693 9.649 2.632 1.00 0.00 C ATOM 0 H VAL A 64 11.195 9.356 0.354 1.00 0.00 H new ATOM 0 HA VAL A 64 9.947 11.545 1.806 1.00 0.00 H new ATOM 0 HB VAL A 64 12.106 11.603 3.190 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.195 9.986 4.848 1.00 0.00 H new ATOM 0 HG12 VAL A 64 9.914 10.996 4.135 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.130 9.315 3.590 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.205 9.447 3.573 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.239 8.730 2.261 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.412 10.020 1.901 1.00 0.00 H new ATOM 823 N VAL A 65 11.823 13.164 1.041 1.00 0.00 N ATOM 824 CA VAL A 65 12.478 14.244 0.284 1.00 0.00 C ATOM 825 C VAL A 65 13.025 15.330 1.220 1.00 0.00 C ATOM 826 O VAL A 65 12.506 15.524 2.319 1.00 0.00 O ATOM 827 CB VAL A 65 11.495 14.878 -0.733 1.00 0.00 C ATOM 828 CG1 VAL A 65 11.428 14.026 -2.014 1.00 0.00 C ATOM 829 CG2 VAL A 65 10.077 15.037 -0.148 1.00 0.00 C ATOM 0 H VAL A 65 11.395 13.500 1.904 1.00 0.00 H new ATOM 0 HA VAL A 65 13.314 13.801 -0.257 1.00 0.00 H new ATOM 0 HB VAL A 65 11.875 15.872 -0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 65 10.734 14.483 -2.719 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.419 13.969 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 65 11.084 13.022 -1.766 1.00 0.00 H new ATOM 0 HG21 VAL A 65 9.423 15.485 -0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 65 9.688 14.059 0.135 1.00 0.00 H new ATOM 0 HG23 VAL A 65 10.116 15.680 0.731 1.00 0.00 H new ATOM 839 N ALA A 66 14.092 16.018 0.795 1.00 0.00 N ATOM 840 CA ALA A 66 14.723 17.134 1.510 1.00 0.00 C ATOM 841 C ALA A 66 14.092 18.490 1.154 1.00 0.00 C ATOM 842 O ALA A 66 13.782 18.770 -0.002 1.00 0.00 O ATOM 843 CB ALA A 66 16.226 17.119 1.204 1.00 0.00 C ATOM 0 H ALA A 66 14.556 15.805 -0.088 1.00 0.00 H new ATOM 0 HA ALA A 66 14.560 17.004 2.580 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.712 17.942 1.727 1.00 0.00 H new ATOM 0 HB2 ALA A 66 16.656 16.174 1.536 1.00 0.00 H new ATOM 0 HB3 ALA A 66 16.380 17.230 0.131 1.00 0.00 H new ATOM 849 N THR A 67 13.927 19.360 2.156 1.00 0.00 N ATOM 850 CA THR A 67 13.343 20.709 2.039 1.00 0.00 C ATOM 851 C THR A 67 13.774 21.510 3.261 1.00 0.00 C ATOM 852 O THR A 67 14.091 20.893 4.260 1.00 0.00 O ATOM 853 CB THR A 67 11.816 20.606 1.988 1.00 0.00 C ATOM 854 OG1 THR A 67 11.390 19.799 0.919 1.00 0.00 O ATOM 855 CG2 THR A 67 11.122 21.957 1.846 1.00 0.00 C ATOM 0 H THR A 67 14.207 19.139 3.112 1.00 0.00 H new ATOM 0 HA THR A 67 13.685 21.199 1.128 1.00 0.00 H new ATOM 0 HB THR A 67 11.537 20.164 2.945 1.00 0.00 H new ATOM 0 HG1 THR A 67 10.411 19.752 0.915 1.00 0.00 H new ATOM 0 HG21 THR A 67 10.042 21.810 1.816 1.00 0.00 H new ATOM 0 HG22 THR A 67 11.379 22.589 2.696 1.00 0.00 H new ATOM 0 HG23 THR A 67 11.448 22.438 0.924 1.00 0.00 H new ATOM 863 N TYR A 68 13.769 22.841 3.259 1.00 0.00 N ATOM 864 CA TYR A 68 13.967 23.604 4.507 1.00 0.00 C ATOM 865 C TYR A 68 12.652 23.790 5.284 1.00 0.00 C ATOM 866 O TYR A 68 11.612 24.068 4.682 1.00 0.00 O ATOM 867 CB TYR A 68 14.671 24.940 4.229 1.00 0.00 C ATOM 868 CG TYR A 68 16.175 24.849 4.419 1.00 0.00 C ATOM 869 CD1 TYR A 68 16.981 24.262 3.425 1.00 0.00 C ATOM 870 CD2 TYR A 68 16.761 25.297 5.621 1.00 0.00 C ATOM 871 CE1 TYR A 68 18.368 24.120 3.627 1.00 0.00 C ATOM 872 CE2 TYR A 68 18.144 25.155 5.831 1.00 0.00 C ATOM 873 CZ TYR A 68 18.950 24.561 4.836 1.00 0.00 C ATOM 874 OH TYR A 68 20.285 24.413 5.049 1.00 0.00 O ATOM 0 H TYR A 68 13.633 23.414 2.426 1.00 0.00 H new ATOM 0 HA TYR A 68 14.622 23.018 5.152 1.00 0.00 H new ATOM 0 HB2 TYR A 68 14.454 25.257 3.209 1.00 0.00 H new ATOM 0 HB3 TYR A 68 14.269 25.705 4.893 1.00 0.00 H new ATOM 0 HD1 TYR A 68 16.534 23.919 2.504 1.00 0.00 H new ATOM 0 HD2 TYR A 68 16.145 25.751 6.383 1.00 0.00 H new ATOM 0 HE1 TYR A 68 18.984 23.675 2.860 1.00 0.00 H new ATOM 0 HE2 TYR A 68 18.589 25.500 6.753 1.00 0.00 H new ATOM 0 HH TYR A 68 20.517 24.771 5.931 1.00 0.00 H new ATOM 884 N GLU A 69 12.693 23.639 6.616 1.00 0.00 N ATOM 885 CA GLU A 69 11.575 23.995 7.503 1.00 0.00 C ATOM 886 C GLU A 69 11.548 25.486 7.918 1.00 0.00 C ATOM 887 O GLU A 69 10.524 25.953 8.413 1.00 0.00 O ATOM 888 CB GLU A 69 11.431 22.982 8.665 1.00 0.00 C ATOM 889 CG GLU A 69 12.593 22.691 9.628 1.00 0.00 C ATOM 890 CD GLU A 69 13.028 23.884 10.471 1.00 0.00 C ATOM 891 OE1 GLU A 69 13.649 24.790 9.888 1.00 0.00 O ATOM 892 OE2 GLU A 69 12.846 23.885 11.710 1.00 0.00 O ATOM 0 H GLU A 69 13.504 23.266 7.110 1.00 0.00 H new ATOM 0 HA GLU A 69 10.660 23.901 6.918 1.00 0.00 H new ATOM 0 HB2 GLU A 69 10.591 23.317 9.274 1.00 0.00 H new ATOM 0 HB3 GLU A 69 11.142 22.030 8.220 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.302 21.878 10.294 1.00 0.00 H new ATOM 0 HG3 GLU A 69 13.448 22.339 9.050 1.00 0.00 H new ATOM 899 N GLY A 70 12.615 26.246 7.626 1.00 0.00 N ATOM 900 CA GLY A 70 12.727 27.700 7.841 1.00 0.00 C ATOM 901 C GLY A 70 14.011 28.147 8.548 1.00 0.00 C ATOM 902 O GLY A 70 14.429 29.291 8.391 1.00 0.00 O ATOM 0 H GLY A 70 13.460 25.849 7.216 1.00 0.00 H new ATOM 0 HA2 GLY A 70 12.667 28.202 6.875 1.00 0.00 H new ATOM 0 HA3 GLY A 70 11.871 28.034 8.427 1.00 0.00 H new ATOM 906 N ARG A 71 14.659 27.248 9.293 1.00 0.00 N ATOM 907 CA ARG A 71 15.904 27.458 10.058 1.00 0.00 C ATOM 908 C ARG A 71 16.730 26.167 10.278 1.00 0.00 C ATOM 909 O ARG A 71 17.761 26.189 10.949 1.00 0.00 O ATOM 910 CB ARG A 71 15.637 28.268 11.351 1.00 0.00 C ATOM 911 CG ARG A 71 14.306 28.015 12.084 1.00 0.00 C ATOM 912 CD ARG A 71 14.100 26.575 12.563 1.00 0.00 C ATOM 913 NE ARG A 71 14.789 26.297 13.835 1.00 0.00 N ATOM 914 CZ ARG A 71 14.541 25.239 14.599 1.00 0.00 C ATOM 915 NH1 ARG A 71 13.668 24.318 14.261 1.00 0.00 N ATOM 916 NH2 ARG A 71 15.180 25.084 15.737 1.00 0.00 N ATOM 0 H ARG A 71 14.312 26.293 9.388 1.00 0.00 H new ATOM 0 HA ARG A 71 16.557 28.071 9.437 1.00 0.00 H new ATOM 0 HB2 ARG A 71 16.450 28.066 12.049 1.00 0.00 H new ATOM 0 HB3 ARG A 71 15.688 29.328 11.101 1.00 0.00 H new ATOM 0 HG2 ARG A 71 14.249 28.681 12.945 1.00 0.00 H new ATOM 0 HG3 ARG A 71 13.485 28.283 11.419 1.00 0.00 H new ATOM 0 HD2 ARG A 71 13.033 26.385 12.683 1.00 0.00 H new ATOM 0 HD3 ARG A 71 14.463 25.887 11.800 1.00 0.00 H new ATOM 0 HE ARG A 71 15.500 26.958 14.148 1.00 0.00 H new ATOM 0 HH11 ARG A 71 13.153 24.401 13.385 1.00 0.00 H new ATOM 0 HH12 ARG A 71 13.505 23.520 14.875 1.00 0.00 H new ATOM 0 HH21 ARG A 71 15.867 25.777 16.034 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.989 24.271 16.323 1.00 0.00 H new ATOM 930 N GLN A 72 16.316 25.056 9.677 1.00 0.00 N ATOM 931 CA GLN A 72 17.012 23.791 9.533 1.00 0.00 C ATOM 932 C GLN A 72 16.491 23.102 8.256 1.00 0.00 C ATOM 933 O GLN A 72 15.391 23.402 7.783 1.00 0.00 O ATOM 934 CB GLN A 72 16.785 22.919 10.797 1.00 0.00 C ATOM 935 CG GLN A 72 17.688 21.679 10.894 1.00 0.00 C ATOM 936 CD GLN A 72 19.114 22.004 10.474 1.00 0.00 C ATOM 937 OE1 GLN A 72 19.508 21.777 9.343 1.00 0.00 O ATOM 938 NE2 GLN A 72 19.875 22.706 11.280 1.00 0.00 N ATOM 0 H GLN A 72 15.396 25.020 9.238 1.00 0.00 H new ATOM 0 HA GLN A 72 18.087 23.944 9.438 1.00 0.00 H new ATOM 0 HB2 GLN A 72 16.943 23.537 11.681 1.00 0.00 H new ATOM 0 HB3 GLN A 72 15.744 22.596 10.816 1.00 0.00 H new ATOM 0 HG2 GLN A 72 17.684 21.302 11.917 1.00 0.00 H new ATOM 0 HG3 GLN A 72 17.291 20.886 10.260 1.00 0.00 H new ATOM 0 HE21 GLN A 72 19.563 22.907 12.230 1.00 0.00 H new ATOM 0 HE22 GLN A 72 20.779 23.051 10.956 1.00 0.00 H new ATOM 947 N VAL A 73 17.275 22.185 7.683 1.00 0.00 N ATOM 948 CA VAL A 73 16.787 21.297 6.617 1.00 0.00 C ATOM 949 C VAL A 73 15.987 20.149 7.246 1.00 0.00 C ATOM 950 O VAL A 73 16.316 19.674 8.333 1.00 0.00 O ATOM 951 CB VAL A 73 17.934 20.808 5.700 1.00 0.00 C ATOM 952 CG1 VAL A 73 18.814 19.719 6.337 1.00 0.00 C ATOM 953 CG2 VAL A 73 17.401 20.298 4.349 1.00 0.00 C ATOM 0 H VAL A 73 18.251 22.036 7.938 1.00 0.00 H new ATOM 0 HA VAL A 73 16.119 21.855 5.960 1.00 0.00 H new ATOM 0 HB VAL A 73 18.560 21.687 5.543 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.596 19.426 5.636 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.270 20.107 7.248 1.00 0.00 H new ATOM 0 HG13 VAL A 73 18.201 18.851 6.579 1.00 0.00 H new ATOM 0 HG21 VAL A 73 18.235 19.963 3.732 1.00 0.00 H new ATOM 0 HG22 VAL A 73 16.718 19.466 4.518 1.00 0.00 H new ATOM 0 HG23 VAL A 73 16.873 21.103 3.839 1.00 0.00 H new ATOM 963 N ARG A 74 14.947 19.690 6.548 1.00 0.00 N ATOM 964 CA ARG A 74 14.031 18.648 6.983 1.00 0.00 C ATOM 965 C ARG A 74 13.983 17.542 5.950 1.00 0.00 C ATOM 966 O ARG A 74 14.132 17.756 4.746 1.00 0.00 O ATOM 967 CB ARG A 74 12.601 19.174 7.252 1.00 0.00 C ATOM 968 CG ARG A 74 11.755 19.639 6.047 1.00 0.00 C ATOM 969 CD ARG A 74 10.275 19.751 6.398 1.00 0.00 C ATOM 970 NE ARG A 74 9.555 20.664 5.485 1.00 0.00 N ATOM 971 CZ ARG A 74 9.063 20.419 4.275 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.163 19.253 3.680 1.00 0.00 N ATOM 973 NH2 ARG A 74 8.440 21.372 3.621 1.00 0.00 N ATOM 0 H ARG A 74 14.715 20.054 5.624 1.00 0.00 H new ATOM 0 HA ARG A 74 14.413 18.266 7.930 1.00 0.00 H new ATOM 0 HB2 ARG A 74 12.047 18.386 7.763 1.00 0.00 H new ATOM 0 HB3 ARG A 74 12.679 20.011 7.946 1.00 0.00 H new ATOM 0 HG2 ARG A 74 12.119 20.606 5.700 1.00 0.00 H new ATOM 0 HG3 ARG A 74 11.880 18.936 5.223 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.817 18.763 6.357 1.00 0.00 H new ATOM 0 HD3 ARG A 74 10.172 20.108 7.423 1.00 0.00 H new ATOM 0 HE ARG A 74 9.417 21.613 5.832 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.637 18.481 4.148 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.767 19.120 2.750 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.336 22.295 4.042 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.061 21.189 2.692 1.00 0.00 H new ATOM 987 N TYR A 75 13.769 16.334 6.448 1.00 0.00 N ATOM 988 CA TYR A 75 13.372 15.198 5.621 1.00 0.00 C ATOM 989 C TYR A 75 11.857 15.059 5.818 1.00 0.00 C ATOM 990 O TYR A 75 11.386 15.167 6.949 1.00 0.00 O ATOM 991 CB TYR A 75 14.117 13.923 6.044 1.00 0.00 C ATOM 992 CG TYR A 75 15.599 13.806 5.703 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.309 14.805 4.997 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.273 12.633 6.095 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.675 14.630 4.692 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.632 12.441 5.780 1.00 0.00 C ATOM 997 CZ TYR A 75 18.335 13.438 5.071 1.00 0.00 C ATOM 998 OH TYR A 75 19.646 13.250 4.762 1.00 0.00 O ATOM 0 H TYR A 75 13.865 16.110 7.438 1.00 0.00 H new ATOM 0 HA TYR A 75 13.622 15.352 4.571 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.015 13.821 7.124 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.604 13.073 5.594 1.00 0.00 H new ATOM 0 HD1 TYR A 75 15.802 15.708 4.689 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.740 11.871 6.644 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.216 15.405 4.170 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.135 11.533 6.080 1.00 0.00 H new ATOM 0 HH TYR A 75 19.940 12.378 5.099 1.00 0.00 H new ATOM 1008 N ALA A 76 11.083 14.863 4.757 1.00 0.00 N ATOM 1009 CA ALA A 76 9.622 14.803 4.832 1.00 0.00 C ATOM 1010 C ALA A 76 9.052 13.823 3.823 1.00 0.00 C ATOM 1011 O ALA A 76 9.732 13.539 2.844 1.00 0.00 O ATOM 1012 CB ALA A 76 9.071 16.207 4.582 1.00 0.00 C ATOM 0 H ALA A 76 11.450 14.740 3.813 1.00 0.00 H new ATOM 0 HA ALA A 76 9.328 14.451 5.821 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.982 16.185 4.633 1.00 0.00 H new ATOM 0 HB2 ALA A 76 9.456 16.889 5.340 1.00 0.00 H new ATOM 0 HB3 ALA A 76 9.381 16.549 3.594 1.00 0.00 H new ATOM 1018 N LEU A 77 7.832 13.332 4.053 1.00 0.00 N ATOM 1019 CA LEU A 77 7.121 12.441 3.136 1.00 0.00 C ATOM 1020 C LEU A 77 6.959 13.045 1.725 1.00 0.00 C ATOM 1021 O LEU A 77 6.885 14.263 1.596 1.00 0.00 O ATOM 1022 CB LEU A 77 5.739 12.123 3.736 1.00 0.00 C ATOM 1023 CG LEU A 77 5.367 10.655 3.559 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.152 9.735 4.495 1.00 0.00 C ATOM 1025 CD2 LEU A 77 3.896 10.575 3.919 1.00 0.00 C ATOM 0 H LEU A 77 7.302 13.547 4.897 1.00 0.00 H new ATOM 0 HA LEU A 77 7.712 11.533 3.019 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.738 12.373 4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.984 12.749 3.260 1.00 0.00 H new ATOM 0 HG LEU A 77 5.591 10.330 2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.849 8.701 4.328 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.219 9.837 4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.949 10.010 5.530 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.552 9.546 3.816 1.00 0.00 H new ATOM 0 HD22 LEU A 77 3.755 10.904 4.949 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.323 11.218 3.251 1.00 0.00 H new ATOM 1037 N ALA A 78 6.814 12.191 0.705 1.00 0.00 N ATOM 1038 CA ALA A 78 6.728 12.526 -0.732 1.00 0.00 C ATOM 1039 C ALA A 78 5.584 13.460 -1.188 1.00 0.00 C ATOM 1040 O ALA A 78 5.538 13.821 -2.358 1.00 0.00 O ATOM 1041 CB ALA A 78 6.559 11.196 -1.479 1.00 0.00 C ATOM 0 H ALA A 78 6.749 11.186 0.864 1.00 0.00 H new ATOM 0 HA ALA A 78 7.637 13.087 -0.951 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.490 11.386 -2.550 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.417 10.555 -1.279 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.649 10.701 -1.139 1.00 0.00 H new ATOM 1047 N ASP A 79 4.622 13.716 -0.296 1.00 0.00 N ATOM 1048 CA ASP A 79 3.383 14.504 -0.406 1.00 0.00 C ATOM 1049 C ASP A 79 2.334 13.952 0.572 1.00 0.00 C ATOM 1050 O ASP A 79 2.344 12.795 1.011 1.00 0.00 O ATOM 1051 CB ASP A 79 2.783 14.607 -1.849 1.00 0.00 C ATOM 1052 CG ASP A 79 1.391 15.285 -1.937 1.00 0.00 C ATOM 1053 OD1 ASP A 79 1.228 16.402 -1.393 1.00 0.00 O ATOM 1054 OD2 ASP A 79 0.402 14.614 -2.320 1.00 0.00 O ATOM 0 H ASP A 79 4.702 13.326 0.643 1.00 0.00 H new ATOM 0 HA ASP A 79 3.660 15.526 -0.147 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.480 15.162 -2.477 1.00 0.00 H new ATOM 0 HB3 ASP A 79 2.708 13.603 -2.267 1.00 0.00 H new ATOM 1059 N SER A 80 1.356 14.813 0.819 1.00 0.00 N ATOM 1060 CA SER A 80 0.046 14.578 1.407 1.00 0.00 C ATOM 1061 C SER A 80 -0.606 13.275 0.877 1.00 0.00 C ATOM 1062 O SER A 80 -1.501 12.720 1.516 1.00 0.00 O ATOM 1063 CB SER A 80 -0.862 15.765 1.014 1.00 0.00 C ATOM 1064 OG SER A 80 -0.165 16.995 0.858 1.00 0.00 O ATOM 0 H SER A 80 1.475 15.799 0.587 1.00 0.00 H new ATOM 0 HA SER A 80 0.162 14.482 2.486 1.00 0.00 H new ATOM 0 HB2 SER A 80 -1.372 15.526 0.081 1.00 0.00 H new ATOM 0 HB3 SER A 80 -1.632 15.889 1.775 1.00 0.00 H new ATOM 0 HG SER A 80 0.280 17.010 -0.015 1.00 0.00 H new ATOM 1070 N HIS A 81 -0.193 12.785 -0.310 1.00 0.00 N ATOM 1071 CA HIS A 81 -0.611 11.529 -0.927 1.00 0.00 C ATOM 1072 C HIS A 81 -0.173 10.331 -0.102 1.00 0.00 C ATOM 1073 O HIS A 81 -1.041 9.643 0.424 1.00 0.00 O ATOM 1074 CB HIS A 81 -0.109 11.408 -2.387 1.00 0.00 C ATOM 1075 CG HIS A 81 -1.191 11.150 -3.403 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -2.512 10.853 -3.133 1.00 0.00 N ATOM 1077 CD2 HIS A 81 -0.978 10.925 -4.733 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -3.086 10.459 -4.274 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -2.174 10.479 -5.264 1.00 0.00 N ATOM 0 H HIS A 81 0.478 13.290 -0.888 1.00 0.00 H new ATOM 0 HA HIS A 81 -1.701 11.537 -0.955 1.00 0.00 H new ATOM 0 HB2 HIS A 81 0.412 12.327 -2.656 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.621 10.601 -2.440 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -2.969 10.922 -2.224 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -0.051 11.068 -5.268 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -4.121 10.170 -4.385 1.00 0.00 H new ATOM 1088 N LEU A 82 1.135 10.081 0.065 1.00 0.00 N ATOM 1089 CA LEU A 82 1.564 9.007 0.968 1.00 0.00 C ATOM 1090 C LEU A 82 0.973 9.264 2.351 1.00 0.00 C ATOM 1091 O LEU A 82 0.379 8.349 2.909 1.00 0.00 O ATOM 1092 CB LEU A 82 3.093 8.844 1.037 1.00 0.00 C ATOM 1093 CG LEU A 82 3.817 8.564 -0.289 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.262 8.144 -0.004 1.00 0.00 C ATOM 1095 CD2 LEU A 82 3.137 7.490 -1.149 1.00 0.00 C ATOM 0 H LEU A 82 1.889 10.589 -0.396 1.00 0.00 H new ATOM 0 HA LEU A 82 1.192 8.063 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.513 9.752 1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.318 8.030 1.726 1.00 0.00 H new ATOM 0 HG LEU A 82 3.783 9.491 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 82 5.775 7.945 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 82 5.776 8.945 0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.265 7.242 0.608 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.705 7.347 -2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.099 6.551 -0.596 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.124 7.808 -1.394 1.00 0.00 H new ATOM 1107 N ALA A 83 1.018 10.518 2.829 1.00 0.00 N ATOM 1108 CA ALA A 83 0.633 10.902 4.189 1.00 0.00 C ATOM 1109 C ALA A 83 -0.784 10.420 4.549 1.00 0.00 C ATOM 1110 O ALA A 83 -0.978 9.856 5.617 1.00 0.00 O ATOM 1111 CB ALA A 83 0.748 12.425 4.337 1.00 0.00 C ATOM 0 H ALA A 83 1.331 11.308 2.265 1.00 0.00 H new ATOM 0 HA ALA A 83 1.313 10.415 4.888 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.462 12.715 5.348 1.00 0.00 H new ATOM 0 HB2 ALA A 83 1.777 12.732 4.148 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.087 12.911 3.620 1.00 0.00 H new ATOM 1117 N ARG A 84 -1.763 10.586 3.646 1.00 0.00 N ATOM 1118 CA ARG A 84 -3.180 10.253 3.887 1.00 0.00 C ATOM 1119 C ARG A 84 -3.548 8.760 3.758 1.00 0.00 C ATOM 1120 O ARG A 84 -4.635 8.383 4.183 1.00 0.00 O ATOM 1121 CB ARG A 84 -4.082 11.142 2.999 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.198 10.655 1.540 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.873 11.641 0.573 1.00 0.00 C ATOM 1124 NE ARG A 84 -3.908 12.577 -0.042 1.00 0.00 N ATOM 1125 CZ ARG A 84 -4.055 13.232 -1.194 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -5.191 13.193 -1.860 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -3.061 13.938 -1.704 1.00 0.00 N ATOM 0 H ARG A 84 -1.592 10.961 2.713 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.358 10.467 4.941 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -5.079 11.184 3.438 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -3.689 12.159 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.198 10.432 1.167 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.758 9.720 1.529 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.385 11.084 -0.212 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.634 12.208 1.109 1.00 0.00 H new ATOM 0 HE ARG A 84 -3.040 12.738 0.468 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.977 12.655 -1.496 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -5.284 13.701 -2.740 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -2.167 13.987 -1.215 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -3.188 14.434 -2.586 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.698 7.917 3.160 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.872 6.456 3.178 1.00 0.00 C ATOM 1143 C ALA A 85 -2.105 5.824 4.356 1.00 0.00 C ATOM 1144 O ALA A 85 -2.675 5.088 5.159 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.430 5.908 1.817 1.00 0.00 C ATOM 0 H ALA A 85 -1.870 8.226 2.650 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.919 6.195 3.336 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.550 4.825 1.805 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.042 6.350 1.031 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.383 6.159 1.646 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.835 6.217 4.499 1.00 0.00 N ATOM 1152 CA LEU A 86 0.043 5.941 5.640 1.00 0.00 C ATOM 1153 C LEU A 86 -0.659 6.289 6.969 1.00 0.00 C ATOM 1154 O LEU A 86 -0.671 5.478 7.892 1.00 0.00 O ATOM 1155 CB LEU A 86 1.296 6.807 5.378 1.00 0.00 C ATOM 1156 CG LEU A 86 2.378 6.892 6.460 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.267 5.681 6.670 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.322 8.041 6.094 1.00 0.00 C ATOM 0 H LEU A 86 -0.366 6.768 3.780 1.00 0.00 H new ATOM 0 HA LEU A 86 0.306 4.887 5.733 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.768 6.436 4.468 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.957 7.822 5.170 1.00 0.00 H new ATOM 0 HG LEU A 86 1.810 7.010 7.383 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.983 5.888 7.466 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.654 4.823 6.948 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.804 5.460 5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.104 8.124 6.849 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.775 7.844 5.123 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.760 8.974 6.050 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.303 7.462 7.027 1.00 0.00 N ATOM 1171 CA GLY A 87 -1.879 8.090 8.221 1.00 0.00 C ATOM 1172 C GLY A 87 -3.156 7.457 8.774 1.00 0.00 C ATOM 1173 O GLY A 87 -3.467 7.692 9.936 1.00 0.00 O ATOM 0 H GLY A 87 -1.444 8.031 6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.125 8.082 9.008 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.088 9.135 7.990 1.00 0.00 H new ATOM 1177 N GLU A 88 -3.884 6.666 7.977 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.009 5.842 8.458 1.00 0.00 C ATOM 1179 C GLU A 88 -4.636 4.355 8.636 1.00 0.00 C ATOM 1180 O GLU A 88 -5.477 3.560 9.048 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.267 6.089 7.600 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.200 5.650 6.132 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.237 4.141 5.972 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -7.291 3.525 6.230 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.256 3.605 5.420 1.00 0.00 O ATOM 0 H GLU A 88 -3.712 6.576 6.976 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.258 6.165 9.469 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.105 5.575 8.070 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.492 7.155 7.626 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.035 6.090 5.587 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.286 6.037 5.682 1.00 0.00 H new ATOM 1192 N LEU A 89 -3.377 4.001 8.323 1.00 0.00 N ATOM 1193 CA LEU A 89 -2.674 2.733 8.585 1.00 0.00 C ATOM 1194 C LEU A 89 -2.753 1.731 7.421 1.00 0.00 C ATOM 1195 O LEU A 89 -2.607 0.520 7.600 1.00 0.00 O ATOM 1196 CB LEU A 89 -3.019 2.122 9.962 1.00 0.00 C ATOM 1197 CG LEU A 89 -1.848 1.278 10.512 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -0.744 2.164 11.115 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -2.350 0.299 11.581 1.00 0.00 C ATOM 0 H LEU A 89 -2.769 4.658 7.834 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.618 2.995 8.646 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.258 2.919 10.666 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -3.909 1.499 9.873 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.427 0.724 9.673 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.062 1.535 11.491 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.354 2.833 10.347 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.157 2.753 11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -1.513 -0.288 11.958 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.801 0.856 12.402 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -3.093 -0.368 11.143 1.00 0.00 H new ATOM 1211 N VAL A 90 -2.977 2.225 6.209 1.00 0.00 N ATOM 1212 CA VAL A 90 -2.871 1.478 4.954 1.00 0.00 C ATOM 1213 C VAL A 90 -4.027 0.480 4.838 1.00 0.00 C ATOM 1214 O VAL A 90 -3.917 -0.617 4.296 1.00 0.00 O ATOM 1215 CB VAL A 90 -1.449 0.926 4.663 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -1.279 0.502 3.190 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -0.426 2.054 4.876 1.00 0.00 C ATOM 0 H VAL A 90 -3.249 3.197 6.064 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.995 2.173 4.123 1.00 0.00 H new ATOM 0 HB VAL A 90 -1.302 0.071 5.323 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.269 0.123 3.035 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.001 -0.279 2.951 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.447 1.362 2.542 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.577 1.678 4.675 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.647 2.879 4.199 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.482 2.406 5.906 1.00 0.00 H new ATOM 1227 N GLN A 91 -5.206 0.914 5.295 1.00 0.00 N ATOM 1228 CA GLN A 91 -6.448 0.823 4.526 1.00 0.00 C ATOM 1229 C GLN A 91 -7.157 -0.532 4.717 1.00 0.00 C ATOM 1230 O GLN A 91 -8.374 -0.615 4.591 1.00 0.00 O ATOM 1231 CB GLN A 91 -6.127 1.181 3.056 1.00 0.00 C ATOM 1232 CG GLN A 91 -7.226 1.905 2.272 1.00 0.00 C ATOM 1233 CD GLN A 91 -7.407 3.423 2.460 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -8.444 3.975 2.099 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -6.468 4.178 2.983 1.00 0.00 N ATOM 0 H GLN A 91 -5.324 1.340 6.214 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.180 1.542 4.896 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.233 1.804 3.044 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -5.881 0.260 2.527 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.046 1.725 1.212 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -8.174 1.428 2.520 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -5.592 3.759 3.295 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -6.615 5.183 3.077 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.422 -1.563 5.128 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.851 -2.915 5.545 1.00 0.00 C ATOM 1246 C VAL A 92 -7.539 -2.918 6.923 1.00 0.00 C ATOM 1247 O VAL A 92 -7.293 -3.773 7.763 1.00 0.00 O ATOM 1248 CB VAL A 92 -5.624 -3.855 5.484 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -4.476 -3.394 6.395 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -5.924 -5.358 5.609 1.00 0.00 C ATOM 0 H VAL A 92 -5.408 -1.473 5.187 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.614 -3.280 4.858 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.277 -3.755 4.456 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.642 -4.091 6.311 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.149 -2.399 6.093 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.821 -3.364 7.428 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.992 -5.921 5.553 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -6.409 -5.554 6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.583 -5.666 4.798 1.00 0.00 H new ATOM 1260 N VAL A 93 -8.352 -1.891 7.172 1.00 0.00 N ATOM 1261 CA VAL A 93 -9.147 -1.614 8.394 1.00 0.00 C ATOM 1262 C VAL A 93 -8.372 -1.627 9.741 1.00 0.00 C ATOM 1263 O VAL A 93 -9.011 -1.592 10.790 1.00 0.00 O ATOM 1264 CB VAL A 93 -10.447 -2.468 8.470 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -11.318 -2.237 7.221 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -10.241 -3.979 8.671 1.00 0.00 C ATOM 0 H VAL A 93 -8.491 -1.163 6.471 1.00 0.00 H new ATOM 0 HA VAL A 93 -9.428 -0.569 8.265 1.00 0.00 H new ATOM 0 HB VAL A 93 -10.946 -2.116 9.373 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -12.222 -2.842 7.291 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -11.590 -1.183 7.157 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.759 -2.522 6.330 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -11.210 -4.476 8.710 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.660 -4.381 7.841 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -9.707 -4.152 9.605 1.00 0.00 H new ATOM 1276 N LEU A 94 -7.027 -1.667 9.682 1.00 0.00 N ATOM 1277 CA LEU A 94 -6.017 -1.889 10.742 1.00 0.00 C ATOM 1278 C LEU A 94 -5.539 -3.353 10.675 1.00 0.00 C ATOM 1279 O LEU A 94 -6.209 -4.254 11.180 1.00 0.00 O ATOM 1280 CB LEU A 94 -6.514 -1.472 12.151 1.00 0.00 C ATOM 1281 CG LEU A 94 -5.450 -1.300 13.257 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -6.138 -0.742 14.513 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -4.709 -2.592 13.637 1.00 0.00 C ATOM 0 H LEU A 94 -6.565 -1.528 8.783 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.164 -1.235 10.558 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.053 -0.530 12.053 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.234 -2.218 12.489 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.696 -0.622 12.856 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.401 -0.614 15.305 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.593 0.221 14.281 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.910 -1.437 14.844 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.982 -2.377 14.420 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.425 -3.329 13.999 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.194 -2.987 12.761 1.00 0.00 H new ATOM 1295 N ALA A 95 -4.357 -3.584 10.087 1.00 0.00 N ATOM 1296 CA ALA A 95 -3.676 -4.886 10.130 1.00 0.00 C ATOM 1297 C ALA A 95 -2.512 -4.870 11.147 1.00 0.00 C ATOM 1298 O ALA A 95 -1.947 -3.806 11.405 1.00 0.00 O ATOM 1299 CB ALA A 95 -3.196 -5.261 8.730 1.00 0.00 C ATOM 0 H ALA A 95 -3.845 -2.872 9.567 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.382 -5.646 10.467 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.692 -6.227 8.765 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.051 -5.322 8.057 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -2.502 -4.502 8.368 1.00 0.00 H new ATOM 1305 N VAL A 96 -2.118 -6.035 11.674 1.00 0.00 N ATOM 1306 CA VAL A 96 -1.137 -6.147 12.791 1.00 0.00 C ATOM 1307 C VAL A 96 0.300 -6.459 12.338 1.00 0.00 C ATOM 1308 O VAL A 96 0.507 -7.140 11.341 1.00 0.00 O ATOM 1309 CB VAL A 96 -1.581 -7.180 13.855 1.00 0.00 C ATOM 1310 CG1 VAL A 96 -2.864 -6.719 14.565 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.791 -8.590 13.277 1.00 0.00 C ATOM 0 H VAL A 96 -2.464 -6.937 11.346 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.123 -5.152 13.237 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.763 -7.240 14.573 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.156 -7.462 15.308 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.684 -5.764 15.058 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.664 -6.604 13.833 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.101 -9.267 14.073 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -2.562 -8.557 12.508 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.858 -8.947 12.840 1.00 0.00 H new ATOM 1321 N ASP A 97 1.317 -6.010 13.080 1.00 0.00 N ATOM 1322 CA ASP A 97 2.744 -6.227 12.766 1.00 0.00 C ATOM 1323 C ASP A 97 3.416 -7.372 13.548 1.00 0.00 C ATOM 1324 O ASP A 97 4.574 -7.698 13.284 1.00 0.00 O ATOM 1325 CB ASP A 97 3.511 -4.914 13.008 1.00 0.00 C ATOM 1326 CG ASP A 97 3.505 -4.390 14.451 1.00 0.00 C ATOM 1327 OD1 ASP A 97 2.924 -5.038 15.350 1.00 0.00 O ATOM 1328 OD2 ASP A 97 4.065 -3.280 14.629 1.00 0.00 O ATOM 0 H ASP A 97 1.174 -5.473 13.936 1.00 0.00 H new ATOM 0 HA ASP A 97 2.782 -6.533 11.720 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.546 -5.058 12.699 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.089 -4.145 12.361 1.00 0.00 H new ATOM 1333 N THR A 98 2.682 -7.990 14.477 1.00 0.00 N ATOM 1334 CA THR A 98 3.147 -8.913 15.524 1.00 0.00 C ATOM 1335 C THR A 98 3.497 -10.333 15.053 1.00 0.00 C ATOM 1336 O THR A 98 3.160 -11.300 15.722 1.00 0.00 O ATOM 1337 CB THR A 98 2.115 -8.918 16.670 1.00 0.00 C ATOM 1338 OG1 THR A 98 1.507 -7.643 16.789 1.00 0.00 O ATOM 1339 CG2 THR A 98 2.749 -9.229 18.029 1.00 0.00 C ATOM 0 H THR A 98 1.673 -7.850 14.523 1.00 0.00 H new ATOM 0 HA THR A 98 4.107 -8.533 15.873 1.00 0.00 H new ATOM 0 HB THR A 98 1.391 -9.692 16.417 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.853 -7.659 17.519 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.979 -9.220 18.800 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.217 -10.213 17.995 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.503 -8.476 18.260 1.00 0.00 H new ATOM 1347 N ASP A 99 4.137 -10.471 13.889 1.00 0.00 N ATOM 1348 CA ASP A 99 4.729 -11.704 13.350 1.00 0.00 C ATOM 1349 C ASP A 99 3.642 -12.748 13.116 1.00 0.00 C ATOM 1350 O ASP A 99 3.493 -13.741 13.829 1.00 0.00 O ATOM 1351 CB ASP A 99 5.899 -12.218 14.205 1.00 0.00 C ATOM 1352 CG ASP A 99 6.629 -13.404 13.557 1.00 0.00 C ATOM 1353 OD1 ASP A 99 6.536 -13.584 12.318 1.00 0.00 O ATOM 1354 OD2 ASP A 99 7.348 -14.105 14.303 1.00 0.00 O ATOM 0 H ASP A 99 4.265 -9.680 13.258 1.00 0.00 H new ATOM 0 HA ASP A 99 5.175 -11.477 12.382 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.608 -11.406 14.370 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.524 -12.518 15.184 1.00 0.00 H new ATOM 1359 N GLN A 100 2.806 -12.467 12.117 1.00 0.00 N ATOM 1360 CA GLN A 100 1.589 -13.220 11.877 1.00 0.00 C ATOM 1361 C GLN A 100 1.325 -13.406 10.362 1.00 0.00 C ATOM 1362 O GLN A 100 1.961 -12.733 9.544 1.00 0.00 O ATOM 1363 CB GLN A 100 0.428 -12.570 12.672 1.00 0.00 C ATOM 1364 CG GLN A 100 -0.219 -13.514 13.711 1.00 0.00 C ATOM 1365 CD GLN A 100 0.106 -13.171 15.166 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -0.740 -12.666 15.892 1.00 0.00 O ATOM 1367 NE2 GLN A 100 1.303 -13.437 15.643 1.00 0.00 N ATOM 0 H GLN A 100 2.960 -11.708 11.453 1.00 0.00 H new ATOM 0 HA GLN A 100 1.690 -14.239 12.250 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.802 -11.683 13.183 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -0.337 -12.236 11.972 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.301 -13.493 13.579 1.00 0.00 H new ATOM 0 HG3 GLN A 100 0.107 -14.534 13.509 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.010 -13.858 15.040 1.00 0.00 H new ATOM 0 HE22 GLN A 100 1.524 -13.222 16.615 1.00 0.00 H new ATOM 1376 N PRO A 101 0.430 -14.331 9.954 1.00 0.00 N ATOM 1377 CA PRO A 101 0.063 -14.562 8.559 1.00 0.00 C ATOM 1378 C PRO A 101 -1.009 -13.580 8.083 1.00 0.00 C ATOM 1379 O PRO A 101 -1.572 -12.826 8.875 1.00 0.00 O ATOM 1380 CB PRO A 101 -0.446 -16.000 8.537 1.00 0.00 C ATOM 1381 CG PRO A 101 -1.159 -16.130 9.876 1.00 0.00 C ATOM 1382 CD PRO A 101 -0.289 -15.279 10.802 1.00 0.00 C ATOM 0 HA PRO A 101 0.904 -14.409 7.883 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.122 -16.176 7.701 1.00 0.00 H new ATOM 0 HB3 PRO A 101 0.370 -16.716 8.443 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -2.183 -15.759 9.828 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -1.211 -17.167 10.208 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -0.903 -14.754 11.534 1.00 0.00 H new ATOM 0 HD3 PRO A 101 0.408 -15.904 11.360 1.00 0.00 H new ATOM 1390 N CYS A 102 -1.308 -13.608 6.779 1.00 0.00 N ATOM 1391 CA CYS A 102 -2.497 -12.971 6.229 1.00 0.00 C ATOM 1392 C CYS A 102 -3.727 -13.662 6.870 1.00 0.00 C ATOM 1393 O CYS A 102 -4.555 -13.061 7.549 1.00 0.00 O ATOM 1394 CB CYS A 102 -2.381 -13.153 4.703 1.00 0.00 C ATOM 1395 SG CYS A 102 -2.409 -14.831 3.970 1.00 0.00 S ATOM 0 H CYS A 102 -0.729 -14.074 6.081 1.00 0.00 H new ATOM 0 HA CYS A 102 -2.601 -11.907 6.440 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -3.194 -12.588 4.248 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.450 -12.680 4.391 1.00 0.00 H new ATOM 0 HG CYS A 102 -2.070 -14.763 2.717 1.00 0.00 H new ATOM 1476 N LEU B 11 0.026 -6.725 8.629 1.00 0.00 N ATOM 1477 CA LEU B 11 0.159 -5.554 7.747 1.00 0.00 C ATOM 1478 C LEU B 11 1.169 -5.753 6.624 1.00 0.00 C ATOM 1479 O LEU B 11 0.898 -5.349 5.497 1.00 0.00 O ATOM 1480 CB LEU B 11 0.340 -4.252 8.561 1.00 0.00 C ATOM 1481 CG LEU B 11 1.715 -3.937 9.196 1.00 0.00 C ATOM 1482 CD1 LEU B 11 2.708 -3.293 8.211 1.00 0.00 C ATOM 1483 CD2 LEU B 11 1.498 -2.942 10.349 1.00 0.00 C ATOM 0 HA LEU B 11 -0.785 -5.439 7.215 1.00 0.00 H new ATOM 0 HB2 LEU B 11 0.084 -3.419 7.906 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.396 -4.264 9.365 1.00 0.00 H new ATOM 0 HG LEU B 11 2.139 -4.885 9.527 1.00 0.00 H new ATOM 0 HD11 LEU B 11 3.652 -3.098 8.721 1.00 0.00 H new ATOM 0 HD12 LEU B 11 2.881 -3.970 7.374 1.00 0.00 H new ATOM 0 HD13 LEU B 11 2.296 -2.355 7.840 1.00 0.00 H new ATOM 0 HD21 LEU B 11 2.457 -2.706 10.811 1.00 0.00 H new ATOM 0 HD22 LEU B 11 1.048 -2.028 9.961 1.00 0.00 H new ATOM 0 HD23 LEU B 11 0.836 -3.386 11.093 1.00 0.00 H new ATOM 1495 N ALA B 12 2.261 -6.485 6.867 1.00 0.00 N ATOM 1496 CA ALA B 12 3.228 -6.801 5.815 1.00 0.00 C ATOM 1497 C ALA B 12 2.604 -7.630 4.667 1.00 0.00 C ATOM 1498 O ALA B 12 3.025 -7.532 3.514 1.00 0.00 O ATOM 1499 CB ALA B 12 4.436 -7.495 6.459 1.00 0.00 C ATOM 0 H ALA B 12 2.496 -6.869 7.782 1.00 0.00 H new ATOM 0 HA ALA B 12 3.559 -5.877 5.341 1.00 0.00 H new ATOM 0 HB1 ALA B 12 5.169 -7.739 5.690 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.889 -6.829 7.194 1.00 0.00 H new ATOM 0 HB3 ALA B 12 4.109 -8.411 6.952 1.00 0.00 H new ATOM 1505 N ARG B 13 1.563 -8.423 4.947 1.00 0.00 N ATOM 1506 CA ARG B 13 0.863 -9.197 3.917 1.00 0.00 C ATOM 1507 C ARG B 13 -0.090 -8.354 3.065 1.00 0.00 C ATOM 1508 O ARG B 13 -0.262 -8.715 1.901 1.00 0.00 O ATOM 1509 CB ARG B 13 0.116 -10.388 4.520 1.00 0.00 C ATOM 1510 CG ARG B 13 1.045 -11.406 5.196 1.00 0.00 C ATOM 1511 CD ARG B 13 2.093 -12.002 4.240 1.00 0.00 C ATOM 1512 NE ARG B 13 2.546 -13.342 4.642 1.00 0.00 N ATOM 1513 CZ ARG B 13 2.920 -13.785 5.833 1.00 0.00 C ATOM 1514 NH1 ARG B 13 3.037 -13.020 6.897 1.00 0.00 N ATOM 1515 NH2 ARG B 13 3.171 -15.064 5.923 1.00 0.00 N ATOM 0 H ARG B 13 1.185 -8.545 5.886 1.00 0.00 H new ATOM 0 HA ARG B 13 1.643 -9.566 3.251 1.00 0.00 H new ATOM 0 HB2 ARG B 13 -0.606 -10.023 5.251 1.00 0.00 H new ATOM 0 HB3 ARG B 13 -0.451 -10.888 3.735 1.00 0.00 H new ATOM 0 HG2 ARG B 13 1.556 -10.924 6.029 1.00 0.00 H new ATOM 0 HG3 ARG B 13 0.444 -12.214 5.615 1.00 0.00 H new ATOM 0 HD2 ARG B 13 1.672 -12.054 3.236 1.00 0.00 H new ATOM 0 HD3 ARG B 13 2.953 -11.334 4.191 1.00 0.00 H new ATOM 0 HE ARG B 13 2.577 -14.033 3.892 1.00 0.00 H new ATOM 0 HH11 ARG B 13 2.835 -12.022 6.833 1.00 0.00 H new ATOM 0 HH12 ARG B 13 3.330 -13.425 7.786 1.00 0.00 H new ATOM 0 HH21 ARG B 13 3.075 -15.662 5.102 1.00 0.00 H new ATOM 0 HH22 ARG B 13 3.463 -15.465 6.814 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.628 -7.232 3.576 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.394 -6.262 2.779 1.00 0.00 C ATOM 1531 C LEU B 14 -0.540 -5.773 1.614 1.00 0.00 C ATOM 1532 O LEU B 14 -0.867 -6.052 0.465 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.891 -5.096 3.669 1.00 0.00 C ATOM 1534 CG LEU B 14 -2.734 -3.983 2.997 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -1.971 -3.047 2.049 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.949 -4.548 2.256 1.00 0.00 C ATOM 0 H LEU B 14 -0.542 -6.973 4.559 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.280 -6.745 2.368 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.483 -5.522 4.479 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.019 -4.627 4.124 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.049 -3.376 3.846 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -2.658 -2.308 1.636 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.179 -2.539 2.599 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -1.533 -3.629 1.238 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -4.510 -3.731 1.801 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.614 -5.235 1.479 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.589 -5.080 2.960 1.00 0.00 H new ATOM 1548 N GLY B 15 0.574 -5.085 1.891 1.00 0.00 N ATOM 1549 CA GLY B 15 1.385 -4.436 0.850 1.00 0.00 C ATOM 1550 C GLY B 15 1.988 -5.435 -0.136 1.00 0.00 C ATOM 1551 O GLY B 15 1.965 -5.209 -1.343 1.00 0.00 O ATOM 0 H GLY B 15 0.938 -4.962 2.836 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.766 -3.723 0.305 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.187 -3.868 1.321 1.00 0.00 H new ATOM 1555 N ARG B 16 2.413 -6.605 0.359 1.00 0.00 N ATOM 1556 CA ARG B 16 2.892 -7.714 -0.472 1.00 0.00 C ATOM 1557 C ARG B 16 1.806 -8.192 -1.442 1.00 0.00 C ATOM 1558 O ARG B 16 2.088 -8.372 -2.620 1.00 0.00 O ATOM 1559 CB ARG B 16 3.371 -8.847 0.453 1.00 0.00 C ATOM 1560 CG ARG B 16 4.167 -9.982 -0.214 1.00 0.00 C ATOM 1561 CD ARG B 16 3.375 -10.870 -1.192 1.00 0.00 C ATOM 1562 NE ARG B 16 3.758 -12.288 -1.055 1.00 0.00 N ATOM 1563 CZ ARG B 16 3.118 -13.194 -0.323 1.00 0.00 C ATOM 1564 NH1 ARG B 16 1.939 -12.972 0.216 1.00 0.00 N ATOM 1565 NH2 ARG B 16 3.636 -14.382 -0.111 1.00 0.00 N ATOM 0 H ARG B 16 2.434 -6.809 1.358 1.00 0.00 H new ATOM 0 HA ARG B 16 3.726 -7.378 -1.088 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.990 -8.410 1.237 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.499 -9.282 0.941 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.009 -9.544 -0.751 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.583 -10.617 0.568 1.00 0.00 H new ATOM 0 HD2 ARG B 16 2.307 -10.759 -1.004 1.00 0.00 H new ATOM 0 HD3 ARG B 16 3.555 -10.539 -2.215 1.00 0.00 H new ATOM 0 HE ARG B 16 4.584 -12.600 -1.565 1.00 0.00 H new ATOM 0 HH11 ARG B 16 1.477 -12.073 0.080 1.00 0.00 H new ATOM 0 HH12 ARG B 16 1.487 -13.699 0.770 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.543 -14.621 -0.511 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.131 -15.065 0.453 1.00 0.00 H new ATOM 1579 N ALA B 17 0.571 -8.391 -0.970 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.544 -8.853 -1.796 1.00 0.00 C ATOM 1581 C ALA B 17 -1.060 -7.775 -2.760 1.00 0.00 C ATOM 1582 O ALA B 17 -1.760 -8.128 -3.706 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.657 -9.369 -0.877 1.00 0.00 C ATOM 0 H ALA B 17 0.317 -8.234 0.005 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.188 -9.662 -2.433 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.495 -9.717 -1.481 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.278 -10.194 -0.274 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -1.991 -8.564 -0.222 1.00 0.00 H new ATOM 1589 N LEU B 18 -0.695 -6.498 -2.569 1.00 0.00 N ATOM 1590 CA LEU B 18 -0.968 -5.429 -3.542 1.00 0.00 C ATOM 1591 C LEU B 18 0.204 -5.203 -4.519 1.00 0.00 C ATOM 1592 O LEU B 18 -0.034 -4.754 -5.632 1.00 0.00 O ATOM 1593 CB LEU B 18 -1.410 -4.150 -2.796 1.00 0.00 C ATOM 1594 CG LEU B 18 -2.940 -4.081 -2.557 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.489 -5.220 -1.685 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -3.335 -2.743 -1.915 1.00 0.00 C ATOM 0 H LEU B 18 -0.202 -6.177 -1.736 1.00 0.00 H new ATOM 0 HA LEU B 18 -1.794 -5.739 -4.182 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -0.896 -4.101 -1.836 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.098 -3.277 -3.369 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.384 -4.182 -3.547 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.566 -5.100 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.282 -6.177 -2.164 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.010 -5.192 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.413 -2.719 -1.758 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -2.826 -2.635 -0.957 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -3.046 -1.924 -2.574 1.00 0.00 H new ATOM 1608 N ALA B 19 1.437 -5.559 -4.149 1.00 0.00 N ATOM 1609 CA ALA B 19 2.616 -5.617 -5.024 1.00 0.00 C ATOM 1610 C ALA B 19 2.664 -6.872 -5.921 1.00 0.00 C ATOM 1611 O ALA B 19 3.436 -6.918 -6.879 1.00 0.00 O ATOM 1612 CB ALA B 19 3.859 -5.567 -4.122 1.00 0.00 C ATOM 0 H ALA B 19 1.653 -5.827 -3.189 1.00 0.00 H new ATOM 0 HA ALA B 19 2.573 -4.771 -5.710 1.00 0.00 H new ATOM 0 HB1 ALA B 19 4.757 -5.608 -4.738 1.00 0.00 H new ATOM 0 HB2 ALA B 19 3.855 -4.641 -3.548 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.848 -6.417 -3.440 1.00 0.00 H new ATOM 1618 N ASP B 20 1.876 -7.897 -5.592 1.00 0.00 N ATOM 1619 CA ASP B 20 1.718 -9.133 -6.332 1.00 0.00 C ATOM 1620 C ASP B 20 1.210 -8.821 -7.752 1.00 0.00 C ATOM 1621 O ASP B 20 0.224 -8.088 -7.904 1.00 0.00 O ATOM 1622 CB ASP B 20 0.765 -10.037 -5.541 1.00 0.00 C ATOM 1623 CG ASP B 20 0.468 -11.396 -6.188 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.087 -11.437 -7.314 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.710 -12.413 -5.499 1.00 0.00 O ATOM 0 H ASP B 20 1.300 -7.877 -4.750 1.00 0.00 H new ATOM 0 HA ASP B 20 2.666 -9.657 -6.450 1.00 0.00 H new ATOM 0 HB2 ASP B 20 1.189 -10.208 -4.552 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.177 -9.507 -5.397 1.00 0.00 H new ATOM 1630 N PRO B 21 1.869 -9.395 -8.777 1.00 0.00 N ATOM 1631 CA PRO B 21 1.713 -9.060 -10.188 1.00 0.00 C ATOM 1632 C PRO B 21 0.246 -9.016 -10.604 1.00 0.00 C ATOM 1633 O PRO B 21 -0.304 -7.940 -10.833 1.00 0.00 O ATOM 1634 CB PRO B 21 2.524 -10.127 -10.950 1.00 0.00 C ATOM 1635 CG PRO B 21 2.566 -11.290 -9.954 1.00 0.00 C ATOM 1636 CD PRO B 21 2.753 -10.542 -8.654 1.00 0.00 C ATOM 0 HA PRO B 21 2.081 -8.059 -10.413 1.00 0.00 H new ATOM 0 HB2 PRO B 21 2.042 -10.411 -11.885 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.524 -9.773 -11.202 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.648 -11.877 -9.965 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.387 -11.978 -10.157 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.488 -11.160 -7.796 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.789 -10.234 -8.516 1.00 0.00 H new ATOM 1644 N THR B 22 -0.393 -10.184 -10.698 1.00 0.00 N ATOM 1645 CA THR B 22 -1.753 -10.311 -11.210 1.00 0.00 C ATOM 1646 C THR B 22 -2.795 -10.226 -10.098 1.00 0.00 C ATOM 1647 O THR B 22 -3.948 -9.926 -10.410 1.00 0.00 O ATOM 1648 CB THR B 22 -1.844 -11.549 -12.099 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.984 -11.331 -13.193 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.221 -11.788 -12.711 1.00 0.00 C ATOM 0 H THR B 22 0.024 -11.072 -10.418 1.00 0.00 H new ATOM 0 HA THR B 22 -1.995 -9.459 -11.845 1.00 0.00 H new ATOM 0 HB THR B 22 -1.598 -12.404 -11.469 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.012 -12.107 -13.791 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.194 -12.687 -13.327 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.956 -11.914 -11.916 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.498 -10.934 -13.328 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.452 -10.361 -8.803 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.426 -10.012 -7.750 1.00 0.00 C ATOM 1660 C ARG B 23 -3.721 -8.514 -7.760 1.00 0.00 C ATOM 1661 O ARG B 23 -4.888 -8.170 -7.616 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.039 -10.496 -6.354 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.365 -11.988 -6.233 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.686 -12.611 -5.009 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.890 -14.069 -4.964 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.938 -14.999 -4.929 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -0.658 -14.711 -4.995 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -2.251 -16.273 -4.859 1.00 0.00 N ATOM 0 H ARG B 23 -1.548 -10.695 -8.469 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.339 -10.554 -7.996 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.976 -10.328 -6.179 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -3.581 -9.930 -5.596 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.444 -12.121 -6.159 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.040 -12.507 -7.135 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -1.618 -12.392 -5.033 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -3.084 -12.158 -4.101 1.00 0.00 H new ATOM 0 HE ARG B 23 -3.855 -14.398 -4.959 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -0.357 -13.740 -5.077 1.00 0.00 H new ATOM 0 HH12 ARG B 23 0.035 -15.459 -4.964 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -3.230 -16.557 -4.831 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -1.515 -16.978 -4.833 1.00 0.00 H new ATOM 1682 N CYS B 24 -2.755 -7.642 -8.084 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.029 -6.226 -8.378 1.00 0.00 C ATOM 1684 C CYS B 24 -4.050 -6.083 -9.529 1.00 0.00 C ATOM 1685 O CYS B 24 -5.026 -5.339 -9.395 1.00 0.00 O ATOM 1686 CB CYS B 24 -1.701 -5.513 -8.696 1.00 0.00 C ATOM 1687 SG CYS B 24 -1.995 -3.735 -8.944 1.00 0.00 S ATOM 0 H CYS B 24 -1.769 -7.895 -8.150 1.00 0.00 H new ATOM 0 HA CYS B 24 -3.479 -5.754 -7.505 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -0.994 -5.663 -7.880 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -1.252 -5.944 -9.591 1.00 0.00 H new ATOM 0 HG CYS B 24 -0.869 -3.142 -9.210 1.00 0.00 H new ATOM 1693 N ARG B 25 -3.877 -6.840 -10.633 1.00 0.00 N ATOM 1694 CA ARG B 25 -4.822 -6.853 -11.773 1.00 0.00 C ATOM 1695 C ARG B 25 -6.226 -7.324 -11.349 1.00 0.00 C ATOM 1696 O ARG B 25 -7.215 -6.674 -11.661 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.322 -7.729 -12.939 1.00 0.00 C ATOM 1698 CG ARG B 25 -3.351 -7.074 -13.941 1.00 0.00 C ATOM 1699 CD ARG B 25 -1.975 -6.721 -13.362 1.00 0.00 C ATOM 1700 NE ARG B 25 -0.893 -6.930 -14.348 1.00 0.00 N ATOM 1701 CZ ARG B 25 0.102 -6.097 -14.656 1.00 0.00 C ATOM 1702 NH1 ARG B 25 0.251 -4.907 -14.124 1.00 0.00 N ATOM 1703 NH2 ARG B 25 1.015 -6.430 -15.542 1.00 0.00 N ATOM 0 H ARG B 25 -3.078 -7.461 -10.760 1.00 0.00 H new ATOM 0 HA ARG B 25 -4.883 -5.821 -12.118 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.832 -8.607 -12.517 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.191 -8.084 -13.493 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -3.212 -7.749 -14.786 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -3.810 -6.165 -14.330 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -1.974 -5.681 -13.037 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -1.785 -7.331 -12.479 1.00 0.00 H new ATOM 0 HE ARG B 25 -0.910 -7.816 -14.852 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -0.418 -4.571 -13.431 1.00 0.00 H new ATOM 0 HH12 ARG B 25 1.035 -4.318 -14.404 1.00 0.00 H new ATOM 0 HH21 ARG B 25 0.969 -7.337 -16.005 1.00 0.00 H new ATOM 0 HH22 ARG B 25 1.769 -5.781 -15.766 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.320 -8.416 -10.591 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.578 -8.938 -10.006 1.00 0.00 C ATOM 1719 C ILE B 26 -8.267 -7.907 -9.114 1.00 0.00 C ATOM 1720 O ILE B 26 -9.458 -7.655 -9.277 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.248 -10.217 -9.209 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.801 -11.329 -10.175 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.358 -10.683 -8.249 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.901 -12.258 -10.687 1.00 0.00 C ATOM 0 H ILE B 26 -5.507 -8.985 -10.354 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.276 -9.164 -10.812 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.423 -9.966 -8.542 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.318 -10.863 -11.034 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.046 -11.935 -9.674 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.037 -11.588 -7.733 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -8.559 -9.900 -7.518 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.265 -10.891 -8.816 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.468 -13.000 -11.358 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.372 -12.763 -9.844 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.649 -11.675 -11.225 1.00 0.00 H new ATOM 1736 N LEU B 27 -7.519 -7.308 -8.186 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.027 -6.320 -7.237 1.00 0.00 C ATOM 1738 C LEU B 27 -8.561 -5.069 -7.957 1.00 0.00 C ATOM 1739 O LEU B 27 -9.671 -4.635 -7.648 1.00 0.00 O ATOM 1740 CB LEU B 27 -6.925 -5.988 -6.201 1.00 0.00 C ATOM 1741 CG LEU B 27 -6.573 -7.094 -5.173 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -5.358 -6.664 -4.340 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -7.730 -7.361 -4.205 1.00 0.00 C ATOM 0 H LEU B 27 -6.524 -7.501 -8.072 1.00 0.00 H new ATOM 0 HA LEU B 27 -8.878 -6.740 -6.701 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.016 -5.728 -6.744 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -7.233 -5.099 -5.651 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.362 -8.001 -5.739 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.116 -7.445 -3.620 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -4.505 -6.500 -4.998 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -5.589 -5.740 -3.809 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -7.443 -8.142 -3.501 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -7.965 -6.448 -3.658 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -8.607 -7.683 -4.766 1.00 0.00 H new ATOM 1755 N VAL B 28 -7.832 -4.530 -8.945 1.00 0.00 N ATOM 1756 CA VAL B 28 -8.261 -3.321 -9.686 1.00 0.00 C ATOM 1757 C VAL B 28 -9.390 -3.601 -10.687 1.00 0.00 C ATOM 1758 O VAL B 28 -10.260 -2.761 -10.881 1.00 0.00 O ATOM 1759 CB VAL B 28 -7.084 -2.586 -10.369 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -6.553 -3.271 -11.638 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -7.440 -1.129 -10.696 1.00 0.00 C ATOM 0 H VAL B 28 -6.938 -4.910 -9.255 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.664 -2.651 -8.926 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.283 -2.621 -9.630 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.730 -2.687 -12.049 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.199 -4.272 -11.390 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -7.353 -3.341 -12.376 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -6.589 -0.645 -11.175 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -8.297 -1.106 -11.370 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -7.688 -0.600 -9.776 1.00 0.00 H new ATOM 1771 N ALA B 29 -9.427 -4.795 -11.285 1.00 0.00 N ATOM 1772 CA ALA B 29 -10.531 -5.197 -12.147 1.00 0.00 C ATOM 1773 C ALA B 29 -11.816 -5.458 -11.347 1.00 0.00 C ATOM 1774 O ALA B 29 -12.902 -5.210 -11.865 1.00 0.00 O ATOM 1775 CB ALA B 29 -10.057 -6.401 -12.965 1.00 0.00 C ATOM 0 H ALA B 29 -8.698 -5.501 -11.184 1.00 0.00 H new ATOM 0 HA ALA B 29 -10.804 -4.393 -12.830 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -10.859 -6.731 -13.625 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.190 -6.117 -13.562 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -9.783 -7.213 -12.292 1.00 0.00 H new ATOM 1781 N LEU B 30 -11.740 -5.876 -10.074 1.00 0.00 N ATOM 1782 CA LEU B 30 -12.947 -6.034 -9.273 1.00 0.00 C ATOM 1783 C LEU B 30 -13.674 -4.721 -9.003 1.00 0.00 C ATOM 1784 O LEU B 30 -14.903 -4.716 -8.994 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.556 -6.693 -7.967 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.733 -7.449 -7.348 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.425 -8.470 -8.264 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.075 -8.168 -6.195 1.00 0.00 C ATOM 0 H LEU B 30 -10.871 -6.105 -9.592 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.649 -6.649 -9.837 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.729 -7.382 -8.139 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.200 -5.936 -7.268 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.538 -6.759 -7.095 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -15.243 -8.947 -7.725 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.818 -7.961 -9.144 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -13.705 -9.227 -8.574 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.821 -8.756 -5.660 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.296 -8.829 -6.575 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.632 -7.439 -5.516 1.00 0.00 H new ATOM 1800 N LEU B 31 -12.896 -3.652 -8.813 1.00 0.00 N ATOM 1801 CA LEU B 31 -13.302 -2.248 -8.708 1.00 0.00 C ATOM 1802 C LEU B 31 -14.251 -1.808 -9.838 1.00 0.00 C ATOM 1803 O LEU B 31 -15.222 -1.112 -9.566 1.00 0.00 O ATOM 1804 CB LEU B 31 -11.985 -1.437 -8.720 1.00 0.00 C ATOM 1805 CG LEU B 31 -11.829 -0.355 -7.646 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -10.385 0.150 -7.734 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -12.826 0.797 -7.815 1.00 0.00 C ATOM 0 H LEU B 31 -11.885 -3.754 -8.721 1.00 0.00 H new ATOM 0 HA LEU B 31 -13.876 -2.082 -7.796 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -11.155 -2.136 -8.621 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -11.887 -0.963 -9.697 1.00 0.00 H new ATOM 0 HG LEU B 31 -12.044 -0.779 -6.665 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -10.225 0.926 -6.985 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -9.699 -0.677 -7.553 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -10.203 0.561 -8.727 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -12.669 1.533 -7.027 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -12.676 1.268 -8.786 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -13.843 0.410 -7.752 1.00 0.00 H new ATOM 1819 N ASP B 32 -13.980 -2.259 -11.068 1.00 0.00 N ATOM 1820 CA ASP B 32 -14.742 -1.987 -12.302 1.00 0.00 C ATOM 1821 C ASP B 32 -15.716 -3.139 -12.658 1.00 0.00 C ATOM 1822 O ASP B 32 -16.255 -3.204 -13.762 1.00 0.00 O ATOM 1823 CB ASP B 32 -13.710 -1.743 -13.427 1.00 0.00 C ATOM 1824 CG ASP B 32 -14.289 -1.054 -14.672 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -14.859 0.048 -14.502 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -14.091 -1.594 -15.787 1.00 0.00 O ATOM 0 H ASP B 32 -13.175 -2.860 -11.244 1.00 0.00 H new ATOM 0 HA ASP B 32 -15.375 -1.110 -12.164 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -12.897 -1.134 -13.033 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -13.278 -2.699 -13.722 1.00 0.00 H new ATOM 1831 N GLY B 33 -15.884 -4.105 -11.744 1.00 0.00 N ATOM 1832 CA GLY B 33 -16.586 -5.366 -11.983 1.00 0.00 C ATOM 1833 C GLY B 33 -17.711 -5.679 -10.999 1.00 0.00 C ATOM 1834 O GLY B 33 -18.880 -5.527 -11.334 1.00 0.00 O ATOM 0 H GLY B 33 -15.524 -4.025 -10.793 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.001 -5.347 -12.991 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -15.861 -6.179 -11.952 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.349 -6.233 -9.836 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.228 -6.850 -8.804 1.00 0.00 C ATOM 1840 C VAL B 34 -19.442 -7.648 -9.316 1.00 0.00 C ATOM 1841 O VAL B 34 -20.485 -7.706 -8.661 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.616 -5.864 -7.688 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.364 -5.385 -6.962 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.435 -4.671 -8.197 1.00 0.00 C ATOM 0 H VAL B 34 -16.368 -6.271 -9.560 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.584 -7.618 -8.375 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.261 -6.403 -6.994 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -17.645 -4.687 -6.173 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.848 -6.239 -6.524 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -16.702 -4.885 -7.669 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -19.677 -4.013 -7.362 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -18.854 -4.120 -8.937 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.357 -5.031 -8.654 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.300 -8.283 -10.483 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.350 -9.084 -11.100 1.00 0.00 C ATOM 1856 C CYS B 35 -20.429 -10.473 -10.460 1.00 0.00 C ATOM 1857 O CYS B 35 -21.157 -10.658 -9.490 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.195 -9.077 -12.629 1.00 0.00 C ATOM 1859 SG CYS B 35 -20.661 -7.447 -13.279 1.00 0.00 S ATOM 0 H CYS B 35 -18.439 -8.252 -11.029 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.325 -8.637 -10.905 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.165 -9.308 -12.902 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.823 -9.850 -13.072 1.00 0.00 H new ATOM 0 HG CYS B 35 -20.039 -6.520 -12.613 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.700 -11.463 -10.987 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.880 -12.869 -10.598 1.00 0.00 C ATOM 1867 C TYR B 36 -18.543 -13.613 -10.389 1.00 0.00 C ATOM 1868 O TYR B 36 -17.536 -13.227 -10.994 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.732 -13.578 -11.680 1.00 0.00 C ATOM 1870 CG TYR B 36 -21.834 -12.746 -12.320 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -22.931 -12.302 -11.559 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -21.716 -12.353 -13.671 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -23.888 -11.440 -12.130 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -22.665 -11.491 -14.248 1.00 0.00 C ATOM 1875 CZ TYR B 36 -23.750 -11.020 -13.472 1.00 0.00 C ATOM 1876 OH TYR B 36 -24.650 -10.156 -14.017 1.00 0.00 O ATOM 0 H TYR B 36 -18.975 -11.316 -11.689 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.390 -12.889 -9.635 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -20.064 -13.926 -12.468 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -21.186 -14.462 -11.233 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -23.040 -12.623 -10.534 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -20.891 -12.717 -14.265 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -24.727 -11.100 -11.542 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -22.566 -11.189 -15.280 1.00 0.00 H new ATOM 0 HH TYR B 36 -24.404 -9.972 -14.948 1.00 0.00 H new ATOM 1886 N PRO B 37 -18.490 -14.686 -9.572 1.00 0.00 N ATOM 1887 CA PRO B 37 -17.278 -15.485 -9.410 1.00 0.00 C ATOM 1888 C PRO B 37 -16.806 -15.990 -10.777 1.00 0.00 C ATOM 1889 O PRO B 37 -17.583 -16.554 -11.542 1.00 0.00 O ATOM 1890 CB PRO B 37 -17.640 -16.618 -8.443 1.00 0.00 C ATOM 1891 CG PRO B 37 -19.158 -16.728 -8.566 1.00 0.00 C ATOM 1892 CD PRO B 37 -19.577 -15.280 -8.808 1.00 0.00 C ATOM 0 HA PRO B 37 -16.446 -14.912 -9.001 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -17.147 -17.551 -8.717 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -17.337 -16.385 -7.422 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -19.452 -17.378 -9.390 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -19.610 -17.135 -7.661 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -20.517 -15.230 -9.358 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -19.730 -14.752 -7.866 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.542 -15.708 -11.108 1.00 0.00 N ATOM 1901 CA GLY B 38 -14.964 -16.010 -12.421 1.00 0.00 C ATOM 1902 C GLY B 38 -15.103 -14.901 -13.470 1.00 0.00 C ATOM 1903 O GLY B 38 -14.454 -15.015 -14.510 1.00 0.00 O ATOM 0 H GLY B 38 -14.886 -15.260 -10.467 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.905 -16.233 -12.291 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.435 -16.914 -12.808 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.844 -13.805 -13.217 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.993 -12.700 -14.179 1.00 0.00 C ATOM 1909 C GLN B 39 -14.642 -12.087 -14.569 1.00 0.00 C ATOM 1910 O GLN B 39 -14.503 -11.554 -15.664 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.949 -11.601 -13.660 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.429 -10.747 -12.470 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.532 -9.233 -12.602 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.721 -8.552 -11.615 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.444 -8.639 -13.765 1.00 0.00 N ATOM 0 H GLN B 39 -16.353 -13.663 -12.345 1.00 0.00 H new ATOM 0 HA GLN B 39 -16.436 -13.138 -15.073 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.182 -10.931 -14.487 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.884 -12.074 -13.360 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -16.975 -11.046 -11.576 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.382 -11.001 -12.304 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -16.285 -9.190 -14.608 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.534 -7.625 -13.828 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.647 -12.177 -13.677 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.324 -11.604 -13.876 1.00 0.00 C ATOM 1926 C LEU B 40 -11.504 -12.345 -14.924 1.00 0.00 C ATOM 1927 O LEU B 40 -10.576 -11.753 -15.445 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.557 -11.523 -12.549 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.320 -10.701 -11.490 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -12.896 -11.624 -10.405 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.393 -9.648 -10.880 1.00 0.00 C ATOM 0 H LEU B 40 -13.748 -12.660 -12.784 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.481 -10.595 -14.258 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.382 -12.530 -12.169 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.579 -11.073 -12.722 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.154 -10.189 -11.971 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.431 -11.027 -9.666 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.582 -12.338 -10.861 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.084 -12.163 -9.917 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.939 -9.072 -10.133 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.543 -10.141 -10.408 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.036 -8.980 -11.664 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.839 -13.587 -15.273 1.00 0.00 N ATOM 1944 CA ALA B 41 -11.187 -14.277 -16.384 1.00 0.00 C ATOM 1945 C ALA B 41 -11.468 -13.568 -17.722 1.00 0.00 C ATOM 1946 O ALA B 41 -10.553 -13.355 -18.507 1.00 0.00 O ATOM 1947 CB ALA B 41 -11.653 -15.740 -16.375 1.00 0.00 C ATOM 0 H ALA B 41 -12.558 -14.135 -14.802 1.00 0.00 H new ATOM 0 HA ALA B 41 -10.104 -14.253 -16.265 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -11.180 -16.278 -17.196 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -11.375 -16.205 -15.429 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -12.736 -15.778 -16.493 1.00 0.00 H new ATOM 1953 N ALA B 42 -12.704 -13.103 -17.941 1.00 0.00 N ATOM 1954 CA ALA B 42 -13.031 -12.234 -19.075 1.00 0.00 C ATOM 1955 C ALA B 42 -12.440 -10.825 -18.901 1.00 0.00 C ATOM 1956 O ALA B 42 -11.849 -10.287 -19.831 1.00 0.00 O ATOM 1957 CB ALA B 42 -14.556 -12.199 -19.234 1.00 0.00 C ATOM 0 H ALA B 42 -13.500 -13.318 -17.341 1.00 0.00 H new ATOM 0 HA ALA B 42 -12.582 -12.636 -19.984 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.820 -11.556 -20.074 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.926 -13.208 -19.419 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -15.008 -11.808 -18.322 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.554 -10.244 -17.703 1.00 0.00 N ATOM 1964 CA HIS B 43 -12.075 -8.881 -17.420 1.00 0.00 C ATOM 1965 C HIS B 43 -10.539 -8.719 -17.579 1.00 0.00 C ATOM 1966 O HIS B 43 -10.048 -7.642 -17.907 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.555 -8.524 -15.997 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.043 -7.118 -15.783 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -13.418 -6.199 -16.762 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -13.299 -6.592 -14.553 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -13.847 -5.113 -16.091 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -13.795 -5.322 -14.765 1.00 0.00 N ATOM 0 H HIS B 43 -12.981 -10.703 -16.899 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.488 -8.190 -18.155 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -13.359 -9.208 -15.727 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.734 -8.709 -15.304 1.00 0.00 H new ATOM 0 HD1 HIS B 43 -13.376 -6.323 -17.774 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.144 -7.074 -13.599 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -14.186 -4.199 -16.555 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.778 -9.798 -17.347 1.00 0.00 N ATOM 1981 CA LEU B 44 -8.315 -9.846 -17.462 1.00 0.00 C ATOM 1982 C LEU B 44 -7.814 -10.553 -18.735 1.00 0.00 C ATOM 1983 O LEU B 44 -6.622 -10.487 -19.014 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.742 -10.543 -16.207 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.087 -9.873 -14.865 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.341 -10.509 -13.705 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.791 -8.367 -14.857 1.00 0.00 C ATOM 0 H LEU B 44 -10.179 -10.692 -17.064 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.963 -8.817 -17.537 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.105 -11.570 -16.185 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.657 -10.591 -16.302 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.160 -10.023 -14.743 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.614 -10.006 -12.777 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.606 -11.564 -13.637 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.267 -10.414 -13.867 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.054 -7.950 -13.885 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.730 -8.204 -15.047 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.378 -7.877 -15.634 1.00 0.00 H new ATOM 1999 N GLY B 45 -8.674 -11.289 -19.450 1.00 0.00 N ATOM 2000 CA GLY B 45 -8.271 -12.188 -20.541 1.00 0.00 C ATOM 2001 C GLY B 45 -7.576 -13.471 -20.062 1.00 0.00 C ATOM 2002 O GLY B 45 -7.176 -14.287 -20.894 1.00 0.00 O ATOM 0 H GLY B 45 -9.681 -11.278 -19.286 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -9.153 -12.459 -21.121 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -7.600 -11.652 -21.212 1.00 0.00 H new ATOM 2006 N LEU B 46 -7.393 -13.652 -18.750 1.00 0.00 N ATOM 2007 CA LEU B 46 -6.588 -14.737 -18.175 1.00 0.00 C ATOM 2008 C LEU B 46 -7.442 -15.964 -17.854 1.00 0.00 C ATOM 2009 O LEU B 46 -8.652 -15.843 -17.668 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.847 -14.231 -16.927 1.00 0.00 C ATOM 2011 CG LEU B 46 -4.969 -12.988 -17.169 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -4.165 -12.693 -15.900 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -4.047 -13.143 -18.380 1.00 0.00 C ATOM 0 H LEU B 46 -7.806 -13.040 -18.046 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.853 -15.050 -18.917 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -6.579 -13.999 -16.154 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.220 -15.034 -16.541 1.00 0.00 H new ATOM 0 HG LEU B 46 -5.625 -12.148 -17.397 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -3.540 -11.815 -16.061 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.848 -12.505 -15.072 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.533 -13.549 -15.662 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -3.452 -12.238 -18.503 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.384 -13.995 -18.226 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -4.647 -13.307 -19.275 1.00 0.00 H new ATOM 2025 N THR B 47 -6.824 -17.151 -17.759 1.00 0.00 N ATOM 2026 CA THR B 47 -7.578 -18.402 -17.570 1.00 0.00 C ATOM 2027 C THR B 47 -8.345 -18.381 -16.254 1.00 0.00 C ATOM 2028 O THR B 47 -7.871 -17.841 -15.245 1.00 0.00 O ATOM 2029 CB THR B 47 -6.733 -19.679 -17.720 1.00 0.00 C ATOM 2030 OG1 THR B 47 -5.934 -19.907 -16.590 1.00 0.00 O ATOM 2031 CG2 THR B 47 -5.789 -19.654 -18.922 1.00 0.00 C ATOM 0 H THR B 47 -5.812 -17.272 -17.809 1.00 0.00 H new ATOM 0 HA THR B 47 -8.295 -18.445 -18.390 1.00 0.00 H new ATOM 0 HB THR B 47 -7.471 -20.470 -17.855 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.412 -20.726 -16.718 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.227 -20.587 -18.963 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.369 -19.540 -19.838 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.097 -18.817 -18.824 1.00 0.00 H new ATOM 2039 N ARG B 48 -9.512 -19.034 -16.230 1.00 0.00 N ATOM 2040 CA ARG B 48 -10.317 -19.173 -15.005 1.00 0.00 C ATOM 2041 C ARG B 48 -9.532 -19.859 -13.882 1.00 0.00 C ATOM 2042 O ARG B 48 -9.674 -19.489 -12.719 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.658 -19.868 -15.305 1.00 0.00 C ATOM 2044 CG ARG B 48 -11.554 -21.376 -15.624 1.00 0.00 C ATOM 2045 CD ARG B 48 -12.704 -21.870 -16.516 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.566 -21.247 -17.834 1.00 0.00 N ATOM 2047 CZ ARG B 48 -13.389 -21.181 -18.862 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -14.518 -21.854 -18.932 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -13.024 -20.397 -19.848 1.00 0.00 N ATOM 0 H ARG B 48 -9.925 -19.479 -17.050 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.551 -18.173 -14.640 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -12.317 -19.738 -14.447 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -12.130 -19.365 -16.149 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -10.603 -21.575 -16.119 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.552 -21.942 -14.692 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -12.676 -22.956 -16.605 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -13.666 -21.611 -16.073 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.672 -20.780 -17.984 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -14.795 -22.466 -18.165 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -15.116 -21.763 -19.754 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -12.146 -19.881 -19.791 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -13.618 -20.303 -20.672 1.00 0.00 H new ATOM 2063 N SER B 49 -8.647 -20.794 -14.220 1.00 0.00 N ATOM 2064 CA SER B 49 -7.702 -21.398 -13.275 1.00 0.00 C ATOM 2065 C SER B 49 -6.686 -20.370 -12.760 1.00 0.00 C ATOM 2066 O SER B 49 -6.532 -20.229 -11.550 1.00 0.00 O ATOM 2067 CB SER B 49 -6.973 -22.572 -13.941 1.00 0.00 C ATOM 2068 OG SER B 49 -7.904 -23.472 -14.515 1.00 0.00 O ATOM 0 H SER B 49 -8.562 -21.160 -15.168 1.00 0.00 H new ATOM 0 HA SER B 49 -8.270 -21.763 -12.419 1.00 0.00 H new ATOM 0 HB2 SER B 49 -6.297 -22.199 -14.710 1.00 0.00 H new ATOM 0 HB3 SER B 49 -6.361 -23.093 -13.205 1.00 0.00 H new ATOM 0 HG SER B 49 -7.424 -24.214 -14.937 1.00 0.00 H new ATOM 2074 N ASN B 50 -6.043 -19.597 -13.644 1.00 0.00 N ATOM 2075 CA ASN B 50 -5.042 -18.621 -13.211 1.00 0.00 C ATOM 2076 C ASN B 50 -5.684 -17.495 -12.377 1.00 0.00 C ATOM 2077 O ASN B 50 -5.222 -17.168 -11.288 1.00 0.00 O ATOM 2078 CB ASN B 50 -4.211 -18.110 -14.412 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.845 -17.575 -13.978 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -2.442 -17.745 -12.833 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -2.086 -16.950 -14.857 1.00 0.00 N ATOM 0 H ASN B 50 -6.197 -19.629 -14.652 1.00 0.00 H new ATOM 0 HA ASN B 50 -4.335 -19.115 -12.545 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -4.072 -18.920 -15.128 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -4.762 -17.322 -14.925 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.164 -16.609 -14.584 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -2.420 -16.808 -15.810 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.840 -16.968 -12.780 1.00 0.00 N ATOM 2089 CA VAL B 51 -7.616 -16.041 -11.933 1.00 0.00 C ATOM 2090 C VAL B 51 -8.037 -16.677 -10.591 1.00 0.00 C ATOM 2091 O VAL B 51 -8.042 -15.977 -9.579 1.00 0.00 O ATOM 2092 CB VAL B 51 -8.835 -15.486 -12.731 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -10.004 -14.963 -11.884 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -8.372 -14.428 -13.755 1.00 0.00 C ATOM 0 H VAL B 51 -7.266 -17.163 -13.686 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.969 -15.204 -11.669 1.00 0.00 H new ATOM 0 HB VAL B 51 -9.249 -16.352 -13.248 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -10.796 -14.602 -12.540 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -10.390 -15.769 -11.259 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -9.657 -14.147 -11.250 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -9.235 -14.051 -14.304 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.886 -13.604 -13.232 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.668 -14.881 -14.453 1.00 0.00 H new ATOM 2104 N SER B 52 -8.292 -17.989 -10.525 1.00 0.00 N ATOM 2105 CA SER B 52 -8.540 -18.689 -9.249 1.00 0.00 C ATOM 2106 C SER B 52 -7.296 -18.757 -8.342 1.00 0.00 C ATOM 2107 O SER B 52 -7.423 -18.504 -7.140 1.00 0.00 O ATOM 2108 CB SER B 52 -9.098 -20.103 -9.470 1.00 0.00 C ATOM 2109 OG SER B 52 -10.331 -20.076 -10.171 1.00 0.00 O ATOM 0 H SER B 52 -8.333 -18.595 -11.344 1.00 0.00 H new ATOM 0 HA SER B 52 -9.290 -18.088 -8.735 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.374 -20.697 -10.029 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.237 -20.594 -8.507 1.00 0.00 H new ATOM 0 HG SER B 52 -10.192 -19.696 -11.064 1.00 0.00 H new ATOM 2115 N ASN B 53 -6.094 -18.992 -8.899 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.814 -18.896 -8.170 1.00 0.00 C ATOM 2117 C ASN B 53 -4.718 -17.565 -7.416 1.00 0.00 C ATOM 2118 O ASN B 53 -4.386 -17.509 -6.229 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.607 -18.961 -9.133 1.00 0.00 C ATOM 2120 CG ASN B 53 -3.372 -20.299 -9.816 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -3.732 -21.352 -9.311 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -2.724 -20.299 -10.968 1.00 0.00 N ATOM 0 H ASN B 53 -5.982 -19.257 -9.878 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.788 -19.738 -7.479 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.740 -18.201 -9.903 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.708 -18.697 -8.576 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -2.522 -21.181 -11.440 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.426 -19.417 -11.385 1.00 0.00 H new ATOM 2129 N HIS B 54 -5.052 -16.477 -8.109 1.00 0.00 N ATOM 2130 CA HIS B 54 -5.002 -15.140 -7.548 1.00 0.00 C ATOM 2131 C HIS B 54 -6.047 -14.937 -6.439 1.00 0.00 C ATOM 2132 O HIS B 54 -5.684 -14.438 -5.373 1.00 0.00 O ATOM 2133 CB HIS B 54 -5.136 -14.121 -8.682 1.00 0.00 C ATOM 2134 CG HIS B 54 -4.089 -14.279 -9.759 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -4.309 -14.580 -11.084 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.735 -14.302 -9.575 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -3.123 -14.842 -11.656 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -2.133 -14.663 -10.776 1.00 0.00 N ATOM 0 H HIS B 54 -5.365 -16.505 -9.079 1.00 0.00 H new ATOM 0 HA HIS B 54 -4.039 -14.991 -7.060 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -6.125 -14.216 -9.131 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -5.070 -13.116 -8.266 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -2.219 -14.078 -8.653 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -2.988 -15.153 -12.681 1.00 0.00 H new ATOM 0 HE2 HIS B 54 -1.134 -14.770 -10.951 1.00 0.00 H new ATOM 2146 N LEU B 55 -7.300 -15.367 -6.643 1.00 0.00 N ATOM 2147 CA LEU B 55 -8.394 -15.188 -5.677 1.00 0.00 C ATOM 2148 C LEU B 55 -8.297 -16.102 -4.450 1.00 0.00 C ATOM 2149 O LEU B 55 -8.910 -15.780 -3.438 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.753 -15.409 -6.370 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.095 -14.346 -7.434 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.158 -14.897 -8.390 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.609 -13.057 -6.774 1.00 0.00 C ATOM 0 H LEU B 55 -7.586 -15.854 -7.492 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.306 -14.164 -5.313 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.754 -16.392 -6.840 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -10.538 -15.417 -5.614 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.188 -14.110 -7.991 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.398 -14.144 -9.141 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.776 -15.791 -8.882 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -12.058 -15.148 -7.828 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -10.844 -12.322 -7.544 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.507 -13.277 -6.197 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.841 -12.656 -6.112 1.00 0.00 H new ATOM 2165 N SER B 56 -7.594 -17.234 -4.512 1.00 0.00 N ATOM 2166 CA SER B 56 -7.524 -18.183 -3.388 1.00 0.00 C ATOM 2167 C SER B 56 -7.013 -17.554 -2.078 1.00 0.00 C ATOM 2168 O SER B 56 -7.723 -17.591 -1.072 1.00 0.00 O ATOM 2169 CB SER B 56 -6.701 -19.416 -3.784 1.00 0.00 C ATOM 2170 OG SER B 56 -7.192 -20.547 -3.089 1.00 0.00 O ATOM 0 H SER B 56 -7.060 -17.522 -5.332 1.00 0.00 H new ATOM 0 HA SER B 56 -8.547 -18.494 -3.175 1.00 0.00 H new ATOM 0 HB2 SER B 56 -6.764 -19.580 -4.860 1.00 0.00 H new ATOM 0 HB3 SER B 56 -5.649 -19.257 -3.547 1.00 0.00 H new ATOM 0 HG SER B 56 -6.670 -21.337 -3.340 1.00 0.00 H new ATOM 2176 N CYS B 57 -5.849 -16.886 -2.096 1.00 0.00 N ATOM 2177 CA CYS B 57 -5.327 -16.217 -0.905 1.00 0.00 C ATOM 2178 C CYS B 57 -6.174 -14.972 -0.562 1.00 0.00 C ATOM 2179 O CYS B 57 -6.487 -14.730 0.599 1.00 0.00 O ATOM 2180 CB CYS B 57 -3.854 -15.867 -1.188 1.00 0.00 C ATOM 2181 SG CYS B 57 -2.878 -15.810 0.341 1.00 0.00 S ATOM 0 H CYS B 57 -5.257 -16.798 -2.922 1.00 0.00 H new ATOM 0 HA CYS B 57 -5.384 -16.866 -0.031 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -3.427 -16.606 -1.866 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -3.799 -14.902 -1.692 1.00 0.00 H new ATOM 0 HG CYS B 57 -3.202 -14.752 1.023 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.576 -14.233 -1.605 1.00 0.00 N ATOM 2187 CA LEU B 58 -7.269 -12.937 -1.577 1.00 0.00 C ATOM 2188 C LEU B 58 -8.585 -12.928 -0.782 1.00 0.00 C ATOM 2189 O LEU B 58 -8.900 -11.927 -0.130 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.536 -12.558 -3.050 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.158 -11.123 -3.448 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.648 -10.890 -3.363 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.617 -10.916 -4.896 1.00 0.00 C ATOM 0 H LEU B 58 -6.413 -14.549 -2.561 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.634 -12.219 -1.058 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.987 -13.249 -3.689 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.596 -12.706 -3.258 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.637 -10.422 -2.765 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.421 -9.864 -3.652 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.310 -11.062 -2.341 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.135 -11.578 -4.035 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.365 -9.905 -5.216 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.117 -11.637 -5.543 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.696 -11.059 -4.960 1.00 0.00 H new ATOM 2205 N ARG B 59 -9.361 -14.018 -0.879 1.00 0.00 N ATOM 2206 CA ARG B 59 -10.624 -14.204 -0.147 1.00 0.00 C ATOM 2207 C ARG B 59 -10.407 -14.620 1.318 1.00 0.00 C ATOM 2208 O ARG B 59 -11.331 -14.507 2.120 1.00 0.00 O ATOM 2209 CB ARG B 59 -11.520 -15.210 -0.886 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.917 -14.764 -2.313 1.00 0.00 C ATOM 2211 CD ARG B 59 -12.781 -15.812 -3.023 1.00 0.00 C ATOM 2212 NE ARG B 59 -12.053 -17.083 -3.215 1.00 0.00 N ATOM 2213 CZ ARG B 59 -12.341 -18.271 -2.687 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -13.339 -18.456 -1.844 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -11.609 -19.315 -3.006 1.00 0.00 N ATOM 0 H ARG B 59 -9.125 -14.809 -1.478 1.00 0.00 H new ATOM 0 HA ARG B 59 -11.127 -13.238 -0.116 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -11.002 -16.167 -0.946 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -12.426 -15.373 -0.302 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -12.461 -13.821 -2.260 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -11.016 -14.579 -2.899 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -13.684 -15.994 -2.440 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -13.099 -15.425 -3.991 1.00 0.00 H new ATOM 0 HE ARG B 59 -11.235 -17.046 -3.823 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -13.928 -17.670 -1.571 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -13.521 -19.385 -1.465 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -10.828 -19.211 -3.653 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -11.822 -20.229 -2.606 1.00 0.00 H new ATOM 2229 N GLY B 60 -9.193 -15.077 1.659 1.00 0.00 N ATOM 2230 CA GLY B 60 -8.720 -15.321 3.027 1.00 0.00 C ATOM 2231 C GLY B 60 -8.162 -14.043 3.650 1.00 0.00 C ATOM 2232 O GLY B 60 -8.718 -13.590 4.645 1.00 0.00 O ATOM 0 H GLY B 60 -8.485 -15.295 0.958 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -9.540 -15.699 3.637 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -7.949 -16.091 3.017 1.00 0.00 H new ATOM 2236 N CYS B 61 -7.194 -13.386 2.980 1.00 0.00 N ATOM 2237 CA CYS B 61 -6.583 -12.103 3.327 1.00 0.00 C ATOM 2238 C CYS B 61 -7.624 -10.981 3.605 1.00 0.00 C ATOM 2239 O CYS B 61 -7.294 -9.893 4.072 1.00 0.00 O ATOM 2240 CB CYS B 61 -5.693 -11.721 2.115 1.00 0.00 C ATOM 2241 SG CYS B 61 -4.243 -12.733 1.698 1.00 0.00 S ATOM 0 H CYS B 61 -6.796 -13.771 2.124 1.00 0.00 H new ATOM 0 HA CYS B 61 -6.017 -12.203 4.253 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -6.336 -11.698 1.235 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -5.341 -10.703 2.279 1.00 0.00 H new ATOM 0 HG CYS B 61 -3.961 -13.519 2.694 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.867 -11.223 3.172 1.00 0.00 N ATOM 2247 CA GLY B 62 -10.004 -10.318 3.283 1.00 0.00 C ATOM 2248 C GLY B 62 -9.995 -9.206 2.253 1.00 0.00 C ATOM 2249 O GLY B 62 -10.968 -8.469 2.180 1.00 0.00 O ATOM 0 H GLY B 62 -9.113 -12.100 2.713 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.926 -10.891 3.179 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -10.012 -9.878 4.280 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.944 -9.105 1.425 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.829 -8.092 0.370 1.00 0.00 C ATOM 2255 C LEU B 63 -10.016 -8.126 -0.601 1.00 0.00 C ATOM 2256 O LEU B 63 -10.406 -7.097 -1.153 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.502 -8.281 -0.347 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.317 -8.241 0.633 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.072 -8.402 -0.206 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.203 -6.975 1.488 1.00 0.00 C ATOM 0 H LEU B 63 -8.142 -9.733 1.472 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.854 -7.102 0.826 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.506 -9.235 -0.875 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.380 -7.501 -1.098 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.465 -9.038 1.362 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.193 -8.381 0.439 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.111 -9.354 -0.736 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.012 -7.587 -0.928 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.334 -7.054 2.141 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.091 -6.106 0.839 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.103 -6.862 2.093 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.598 -9.319 -0.745 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.861 -9.582 -1.432 1.00 0.00 C ATOM 2274 C VAL B 64 -12.778 -10.466 -0.594 1.00 0.00 C ATOM 2275 O VAL B 64 -12.321 -11.230 0.251 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.659 -10.250 -2.804 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.115 -9.230 -3.800 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.733 -11.438 -2.736 1.00 0.00 C ATOM 0 H VAL B 64 -10.179 -10.168 -0.366 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.322 -8.606 -1.582 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.632 -10.615 -3.133 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.974 -9.708 -4.769 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.822 -8.407 -3.901 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.160 -8.846 -3.442 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.625 -11.872 -3.730 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.757 -11.118 -2.371 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.147 -12.184 -2.057 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.074 -10.351 -0.865 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.173 -10.931 -0.074 1.00 0.00 C ATOM 2290 C VAL B 65 -16.361 -11.318 -0.964 1.00 0.00 C ATOM 2291 O VAL B 65 -16.559 -10.730 -2.026 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.644 -9.946 1.028 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -14.717 -10.025 2.255 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -15.699 -8.495 0.514 1.00 0.00 C ATOM 0 H VAL B 65 -14.410 -9.830 -1.675 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.787 -11.834 0.399 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.653 -10.243 1.315 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -15.063 -9.327 3.018 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -14.731 -11.038 2.657 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -13.700 -9.766 1.960 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -16.033 -7.837 1.316 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.707 -8.188 0.183 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -16.396 -8.431 -0.322 1.00 0.00 H new ATOM 2304 N ALA B 66 -17.131 -12.328 -0.542 1.00 0.00 N ATOM 2305 CA ALA B 66 -18.333 -12.823 -1.222 1.00 0.00 C ATOM 2306 C ALA B 66 -19.605 -12.166 -0.668 1.00 0.00 C ATOM 2307 O ALA B 66 -19.743 -11.949 0.535 1.00 0.00 O ATOM 2308 CB ALA B 66 -18.375 -14.351 -1.096 1.00 0.00 C ATOM 0 H ALA B 66 -16.926 -12.842 0.315 1.00 0.00 H new ATOM 0 HA ALA B 66 -18.290 -12.554 -2.277 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -19.264 -14.733 -1.597 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -17.486 -14.779 -1.558 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -18.405 -14.629 -0.042 1.00 0.00 H new ATOM 2314 N THR B 67 -20.546 -11.840 -1.556 1.00 0.00 N ATOM 2315 CA THR B 67 -21.787 -11.100 -1.258 1.00 0.00 C ATOM 2316 C THR B 67 -22.760 -11.302 -2.421 1.00 0.00 C ATOM 2317 O THR B 67 -22.351 -11.844 -3.433 1.00 0.00 O ATOM 2318 CB THR B 67 -21.465 -9.606 -1.063 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.482 -9.370 -0.086 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.681 -8.792 -0.644 1.00 0.00 C ATOM 0 H THR B 67 -20.468 -12.091 -2.542 1.00 0.00 H new ATOM 0 HA THR B 67 -22.242 -11.469 -0.339 1.00 0.00 H new ATOM 0 HB THR B 67 -21.106 -9.295 -2.044 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.321 -8.406 -0.010 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.395 -7.747 -0.521 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.452 -8.869 -1.410 1.00 0.00 H new ATOM 0 HG23 THR B 67 -23.068 -9.175 0.300 1.00 0.00 H new ATOM 2328 N TYR B 68 -24.019 -10.875 -2.345 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.894 -10.817 -3.529 1.00 0.00 C ATOM 2330 C TYR B 68 -24.763 -9.474 -4.275 1.00 0.00 C ATOM 2331 O TYR B 68 -24.547 -8.421 -3.659 1.00 0.00 O ATOM 2332 CB TYR B 68 -26.343 -11.146 -3.143 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.651 -12.631 -3.257 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -25.968 -13.564 -2.447 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.577 -13.086 -4.214 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -26.190 -14.944 -2.608 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.805 -14.466 -4.380 1.00 0.00 C ATOM 2338 CZ TYR B 68 -27.103 -15.397 -3.589 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.305 -16.728 -3.775 1.00 0.00 O ATOM 0 H TYR B 68 -24.462 -10.563 -1.481 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.566 -11.580 -4.235 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -26.527 -10.817 -2.120 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -27.023 -10.586 -3.785 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.271 -13.216 -1.699 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -28.115 -12.375 -4.823 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.666 -15.654 -1.986 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.518 -14.811 -5.114 1.00 0.00 H new ATOM 0 HH TYR B 68 -27.965 -16.862 -4.487 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.867 -9.494 -5.608 1.00 0.00 N ATOM 2350 CA GLU B 69 -24.963 -8.265 -6.411 1.00 0.00 C ATOM 2351 C GLU B 69 -26.416 -7.755 -6.484 1.00 0.00 C ATOM 2352 O GLU B 69 -26.665 -6.585 -6.189 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.224 -8.409 -7.759 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.543 -9.578 -8.694 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.959 -9.537 -9.238 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.342 -8.588 -9.951 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -26.719 -10.472 -8.922 1.00 0.00 O ATOM 0 H GLU B 69 -24.887 -10.352 -6.159 1.00 0.00 H new ATOM 0 HA GLU B 69 -24.427 -7.461 -5.907 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -24.395 -7.491 -8.321 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.157 -8.454 -7.539 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.840 -9.571 -9.527 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -24.393 -10.515 -8.158 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.376 -8.656 -6.721 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.821 -8.403 -6.650 1.00 0.00 C ATOM 2366 C GLY B 70 -29.690 -9.644 -6.883 1.00 0.00 C ATOM 2367 O GLY B 70 -30.813 -9.709 -6.391 1.00 0.00 O ATOM 0 H GLY B 70 -27.160 -9.619 -6.978 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.058 -7.987 -5.671 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.083 -7.646 -7.390 1.00 0.00 H new ATOM 2371 N ARG B 71 -29.164 -10.638 -7.610 1.00 0.00 N ATOM 2372 CA ARG B 71 -29.802 -11.933 -7.896 1.00 0.00 C ATOM 2373 C ARG B 71 -28.818 -13.115 -7.805 1.00 0.00 C ATOM 2374 O ARG B 71 -29.223 -14.239 -7.511 1.00 0.00 O ATOM 2375 CB ARG B 71 -30.495 -11.947 -9.283 1.00 0.00 C ATOM 2376 CG ARG B 71 -30.682 -10.629 -10.068 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.411 -10.014 -10.686 1.00 0.00 C ATOM 2378 NE ARG B 71 -28.678 -10.963 -11.544 1.00 0.00 N ATOM 2379 CZ ARG B 71 -27.649 -10.669 -12.327 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -27.082 -9.488 -12.353 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -27.136 -11.609 -13.083 1.00 0.00 N ATOM 0 H ARG B 71 -28.240 -10.560 -8.035 1.00 0.00 H new ATOM 0 HA ARG B 71 -30.558 -12.058 -7.121 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.930 -12.626 -9.921 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -31.483 -12.386 -9.147 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -31.400 -10.807 -10.869 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -31.127 -9.893 -9.399 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -29.685 -9.137 -11.273 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -28.754 -9.670 -9.887 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.991 -11.934 -11.534 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -27.430 -8.742 -11.751 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -26.292 -9.315 -12.975 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -27.529 -12.550 -13.063 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -26.344 -11.399 -13.691 1.00 0.00 H new ATOM 2395 N GLN B 72 -27.539 -12.891 -8.092 1.00 0.00 N ATOM 2396 CA GLN B 72 -26.439 -13.838 -8.013 1.00 0.00 C ATOM 2397 C GLN B 72 -25.406 -13.368 -6.978 1.00 0.00 C ATOM 2398 O GLN B 72 -25.397 -12.217 -6.539 1.00 0.00 O ATOM 2399 CB GLN B 72 -25.769 -13.987 -9.401 1.00 0.00 C ATOM 2400 CG GLN B 72 -26.443 -15.027 -10.315 1.00 0.00 C ATOM 2401 CD GLN B 72 -27.849 -14.660 -10.798 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -28.038 -13.857 -11.698 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -28.896 -15.227 -10.238 1.00 0.00 N ATOM 0 H GLN B 72 -27.225 -11.974 -8.409 1.00 0.00 H new ATOM 0 HA GLN B 72 -26.831 -14.806 -7.702 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -25.777 -13.019 -9.902 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -24.724 -14.265 -9.261 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -25.808 -15.187 -11.186 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -26.496 -15.976 -9.781 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -28.768 -15.902 -9.484 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -29.835 -14.992 -10.558 1.00 0.00 H new ATOM 2412 N VAL B 73 -24.506 -14.284 -6.620 1.00 0.00 N ATOM 2413 CA VAL B 73 -23.344 -14.001 -5.778 1.00 0.00 C ATOM 2414 C VAL B 73 -22.224 -13.354 -6.602 1.00 0.00 C ATOM 2415 O VAL B 73 -22.057 -13.649 -7.787 1.00 0.00 O ATOM 2416 CB VAL B 73 -22.895 -15.284 -5.034 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.260 -16.319 -5.981 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -21.945 -15.022 -3.854 1.00 0.00 C ATOM 0 H VAL B 73 -24.565 -15.260 -6.912 1.00 0.00 H new ATOM 0 HA VAL B 73 -23.617 -13.275 -5.012 1.00 0.00 H new ATOM 0 HB VAL B 73 -23.820 -15.691 -4.625 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -21.962 -17.199 -5.411 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.984 -16.608 -6.743 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -21.383 -15.884 -6.460 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -21.677 -15.969 -3.386 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -21.043 -14.528 -4.216 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -22.440 -14.383 -3.123 1.00 0.00 H new ATOM 2428 N ARG B 74 -21.460 -12.486 -5.940 1.00 0.00 N ATOM 2429 CA ARG B 74 -20.367 -11.682 -6.457 1.00 0.00 C ATOM 2430 C ARG B 74 -19.155 -11.828 -5.555 1.00 0.00 C ATOM 2431 O ARG B 74 -19.251 -12.213 -4.388 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.754 -10.183 -6.507 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.918 -9.429 -5.165 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.017 -7.913 -5.360 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.867 -7.299 -4.326 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.516 -6.707 -3.194 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -20.278 -6.595 -2.761 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -22.470 -6.220 -2.442 1.00 0.00 N ATOM 0 H ARG B 74 -21.607 -12.317 -4.945 1.00 0.00 H new ATOM 0 HA ARG B 74 -20.143 -12.031 -7.465 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.996 -9.662 -7.092 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.693 -10.099 -7.054 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.813 -9.787 -4.656 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -20.071 -9.656 -4.517 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.020 -7.473 -5.324 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.426 -7.696 -6.347 1.00 0.00 H new ATOM 0 HE ARG B 74 -22.870 -7.335 -4.507 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -19.509 -6.979 -3.310 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -20.088 -6.124 -1.877 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -23.443 -6.304 -2.735 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -22.240 -5.757 -1.563 1.00 0.00 H new ATOM 2452 N TYR B 75 -18.003 -11.479 -6.111 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.806 -11.179 -5.332 1.00 0.00 C ATOM 2454 C TYR B 75 -16.667 -9.645 -5.364 1.00 0.00 C ATOM 2455 O TYR B 75 -17.057 -9.015 -6.346 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.575 -11.911 -5.893 1.00 0.00 C ATOM 2457 CG TYR B 75 -15.542 -13.435 -5.767 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -16.310 -14.131 -4.802 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.683 -14.165 -6.612 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -16.221 -15.532 -4.688 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.590 -15.569 -6.504 1.00 0.00 C ATOM 2462 CZ TYR B 75 -15.351 -16.256 -5.537 1.00 0.00 C ATOM 2463 OH TYR B 75 -15.244 -17.608 -5.427 1.00 0.00 O ATOM 0 H TYR B 75 -17.870 -11.395 -7.119 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.885 -11.531 -4.303 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.486 -11.659 -6.950 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.691 -11.513 -5.395 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -16.970 -13.582 -4.147 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.090 -13.645 -7.350 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -16.816 -16.053 -3.953 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.934 -16.118 -7.164 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.602 -17.940 -6.089 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.164 -9.021 -4.305 1.00 0.00 N ATOM 2474 CA ALA B 76 -15.957 -7.573 -4.219 1.00 0.00 C ATOM 2475 C ALA B 76 -14.755 -7.262 -3.333 1.00 0.00 C ATOM 2476 O ALA B 76 -14.390 -8.114 -2.527 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.232 -6.919 -3.685 1.00 0.00 C ATOM 0 H ALA B 76 -15.881 -9.517 -3.460 1.00 0.00 H new ATOM 0 HA ALA B 76 -15.745 -7.168 -5.208 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.087 -5.841 -3.618 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.061 -7.132 -4.360 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.458 -7.317 -2.696 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.140 -6.084 -3.479 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.087 -5.620 -2.574 1.00 0.00 C ATOM 2485 C LEU B 77 -13.612 -5.449 -1.137 1.00 0.00 C ATOM 2486 O LEU B 77 -14.797 -5.190 -0.948 1.00 0.00 O ATOM 2487 CB LEU B 77 -12.533 -4.295 -3.129 1.00 0.00 C ATOM 2488 CG LEU B 77 -11.616 -4.443 -4.350 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.380 -3.035 -4.896 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -10.281 -5.108 -4.006 1.00 0.00 C ATOM 0 H LEU B 77 -14.359 -5.427 -4.228 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.292 -6.363 -2.523 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.371 -3.651 -3.397 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -11.982 -3.788 -2.337 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.092 -5.090 -5.086 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.730 -3.088 -5.770 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -12.334 -2.590 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -10.907 -2.422 -4.129 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.672 -5.188 -4.906 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -9.756 -4.507 -3.264 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -10.464 -6.104 -3.602 1.00 0.00 H new ATOM 2502 N ALA B 78 -12.699 -5.536 -0.159 1.00 0.00 N ATOM 2503 CA ALA B 78 -12.919 -5.492 1.303 1.00 0.00 C ATOM 2504 C ALA B 78 -13.767 -4.326 1.857 1.00 0.00 C ATOM 2505 O ALA B 78 -14.238 -4.393 2.986 1.00 0.00 O ATOM 2506 CB ALA B 78 -11.529 -5.410 1.953 1.00 0.00 C ATOM 0 H ALA B 78 -11.710 -5.648 -0.381 1.00 0.00 H new ATOM 0 HA ALA B 78 -13.497 -6.385 1.540 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -11.636 -5.375 3.037 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -10.945 -6.287 1.674 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.019 -4.510 1.609 1.00 0.00 H new ATOM 2512 N ASP B 79 -13.853 -3.246 1.079 1.00 0.00 N ATOM 2513 CA ASP B 79 -14.604 -1.996 1.256 1.00 0.00 C ATOM 2514 C ASP B 79 -14.096 -0.977 0.221 1.00 0.00 C ATOM 2515 O ASP B 79 -13.023 -1.102 -0.387 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.520 -1.423 2.711 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.041 0.026 2.886 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.196 0.304 2.484 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.230 0.944 3.167 1.00 0.00 O ATOM 0 H ASP B 79 -13.335 -3.222 0.201 1.00 0.00 H new ATOM 0 HA ASP B 79 -15.662 -2.205 1.095 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.086 -2.077 3.374 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.481 -1.459 3.038 1.00 0.00 H new ATOM 2524 N SER B 80 -14.866 0.100 0.121 1.00 0.00 N ATOM 2525 CA SER B 80 -14.524 1.391 -0.462 1.00 0.00 C ATOM 2526 C SER B 80 -13.098 1.841 -0.064 1.00 0.00 C ATOM 2527 O SER B 80 -12.530 2.715 -0.706 1.00 0.00 O ATOM 2528 CB SER B 80 -15.493 2.466 0.081 1.00 0.00 C ATOM 2529 OG SER B 80 -16.765 1.978 0.467 1.00 0.00 O ATOM 0 H SER B 80 -15.823 0.092 0.474 1.00 0.00 H new ATOM 0 HA SER B 80 -14.588 1.283 -1.545 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.030 2.952 0.940 1.00 0.00 H new ATOM 0 HB3 SER B 80 -15.630 3.231 -0.683 1.00 0.00 H new ATOM 0 HG SER B 80 -16.691 1.516 1.328 1.00 0.00 H new ATOM 2535 N HIS B 81 -12.520 1.294 1.021 1.00 0.00 N ATOM 2536 CA HIS B 81 -11.164 1.505 1.516 1.00 0.00 C ATOM 2537 C HIS B 81 -10.115 1.031 0.512 1.00 0.00 C ATOM 2538 O HIS B 81 -9.361 1.858 0.008 1.00 0.00 O ATOM 2539 CB HIS B 81 -10.995 0.831 2.906 1.00 0.00 C ATOM 2540 CG HIS B 81 -10.676 1.776 4.039 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -10.293 3.094 3.904 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.455 1.414 5.340 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -9.824 3.516 5.082 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -9.902 2.515 5.976 1.00 0.00 N ATOM 0 H HIS B 81 -13.036 0.644 1.614 1.00 0.00 H new ATOM 0 HA HIS B 81 -11.003 2.576 1.639 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -11.913 0.295 3.147 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.201 0.088 2.838 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -10.357 3.651 3.052 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -10.670 0.454 5.786 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -9.442 4.506 5.284 1.00 0.00 H new ATOM 2553 N LEU B 82 -10.058 -0.264 0.185 1.00 0.00 N ATOM 2554 CA LEU B 82 -9.109 -0.713 -0.839 1.00 0.00 C ATOM 2555 C LEU B 82 -9.485 -0.109 -2.188 1.00 0.00 C ATOM 2556 O LEU B 82 -8.592 0.330 -2.899 1.00 0.00 O ATOM 2557 CB LEU B 82 -8.977 -2.241 -0.920 1.00 0.00 C ATOM 2558 CG LEU B 82 -8.738 -2.942 0.428 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.546 -4.437 0.179 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -7.524 -2.390 1.195 1.00 0.00 C ATOM 0 H LEU B 82 -10.635 -0.997 0.597 1.00 0.00 H new ATOM 0 HA LEU B 82 -8.122 -0.355 -0.547 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -9.884 -2.646 -1.368 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.153 -2.485 -1.591 1.00 0.00 H new ATOM 0 HG LEU B 82 -9.612 -2.753 1.051 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.376 -4.945 1.128 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.439 -4.844 -0.295 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -7.686 -4.590 -0.474 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -7.413 -2.928 2.136 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -6.624 -2.520 0.594 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -7.674 -1.330 1.399 1.00 0.00 H new ATOM 2572 N ALA B 83 -10.781 0.046 -2.484 1.00 0.00 N ATOM 2573 CA ALA B 83 -11.228 0.671 -3.730 1.00 0.00 C ATOM 2574 C ALA B 83 -10.680 2.108 -3.916 1.00 0.00 C ATOM 2575 O ALA B 83 -10.232 2.441 -5.005 1.00 0.00 O ATOM 2576 CB ALA B 83 -12.758 0.626 -3.786 1.00 0.00 C ATOM 0 H ALA B 83 -11.540 -0.255 -1.873 1.00 0.00 H new ATOM 0 HA ALA B 83 -10.819 0.104 -4.566 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -13.102 1.089 -4.711 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.093 -0.411 -3.753 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -13.169 1.167 -2.934 1.00 0.00 H new ATOM 2582 N ARG B 84 -10.645 2.954 -2.873 1.00 0.00 N ATOM 2583 CA ARG B 84 -10.203 4.362 -2.988 1.00 0.00 C ATOM 2584 C ARG B 84 -8.678 4.582 -2.966 1.00 0.00 C ATOM 2585 O ARG B 84 -8.222 5.627 -3.418 1.00 0.00 O ATOM 2586 CB ARG B 84 -10.925 5.241 -1.939 1.00 0.00 C ATOM 2587 CG ARG B 84 -10.325 5.162 -0.520 1.00 0.00 C ATOM 2588 CD ARG B 84 -11.177 5.811 0.584 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.136 4.859 1.189 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.695 4.951 2.397 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -12.535 6.034 3.136 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -13.418 3.964 2.903 1.00 0.00 N ATOM 0 H ARG B 84 -10.920 2.687 -1.928 1.00 0.00 H new ATOM 0 HA ARG B 84 -10.495 4.675 -3.990 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -10.901 6.278 -2.273 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.973 4.945 -1.894 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -10.167 4.114 -0.267 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -9.345 5.639 -0.529 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -10.522 6.205 1.361 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -11.723 6.657 0.168 1.00 0.00 H new ATOM 0 HE ARG B 84 -12.396 4.050 0.625 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -11.978 6.813 2.785 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -12.968 6.091 4.058 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -13.558 3.108 2.367 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -13.835 4.060 3.829 1.00 0.00 H new ATOM 2606 N ALA B 85 -7.894 3.641 -2.427 1.00 0.00 N ATOM 2607 CA ALA B 85 -6.429 3.678 -2.531 1.00 0.00 C ATOM 2608 C ALA B 85 -5.938 3.030 -3.838 1.00 0.00 C ATOM 2609 O ALA B 85 -5.115 3.611 -4.537 1.00 0.00 O ATOM 2610 CB ALA B 85 -5.819 3.021 -1.288 1.00 0.00 C ATOM 0 H ALA B 85 -8.253 2.838 -1.910 1.00 0.00 H new ATOM 0 HA ALA B 85 -6.097 4.715 -2.570 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -4.732 3.046 -1.360 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -6.136 3.563 -0.397 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.155 1.986 -1.222 1.00 0.00 H new ATOM 2616 N LEU B 86 -6.494 1.871 -4.208 1.00 0.00 N ATOM 2617 CA LEU B 86 -6.178 1.210 -5.474 1.00 0.00 C ATOM 2618 C LEU B 86 -6.680 2.038 -6.670 1.00 0.00 C ATOM 2619 O LEU B 86 -5.960 2.194 -7.647 1.00 0.00 O ATOM 2620 CB LEU B 86 -6.775 -0.214 -5.459 1.00 0.00 C ATOM 2621 CG LEU B 86 -5.932 -1.285 -6.175 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -6.821 -2.520 -6.334 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -5.355 -0.880 -7.537 1.00 0.00 C ATOM 0 H LEU B 86 -7.174 1.368 -3.638 1.00 0.00 H new ATOM 0 HA LEU B 86 -5.097 1.131 -5.588 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -6.918 -0.520 -4.423 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -7.762 -0.182 -5.921 1.00 0.00 H new ATOM 0 HG LEU B 86 -5.051 -1.464 -5.558 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -6.262 -3.308 -6.839 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -7.136 -2.871 -5.351 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -7.700 -2.262 -6.926 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -4.780 -1.709 -7.950 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -6.169 -0.629 -8.217 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -4.705 -0.014 -7.414 1.00 0.00 H new ATOM 2635 N GLY B 87 -7.872 2.638 -6.567 1.00 0.00 N ATOM 2636 CA GLY B 87 -8.539 3.408 -7.627 1.00 0.00 C ATOM 2637 C GLY B 87 -7.797 4.658 -8.104 1.00 0.00 C ATOM 2638 O GLY B 87 -8.081 5.134 -9.199 1.00 0.00 O ATOM 0 H GLY B 87 -8.422 2.599 -5.709 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -8.696 2.752 -8.483 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -9.524 3.707 -7.269 1.00 0.00 H new ATOM 2642 N GLU B 88 -6.849 5.174 -7.310 1.00 0.00 N ATOM 2643 CA GLU B 88 -5.919 6.234 -7.736 1.00 0.00 C ATOM 2644 C GLU B 88 -4.480 5.747 -8.037 1.00 0.00 C ATOM 2645 O GLU B 88 -3.651 6.566 -8.425 1.00 0.00 O ATOM 2646 CB GLU B 88 -5.988 7.419 -6.757 1.00 0.00 C ATOM 2647 CG GLU B 88 -5.458 7.159 -5.342 1.00 0.00 C ATOM 2648 CD GLU B 88 -3.948 7.009 -5.308 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -3.237 8.005 -5.533 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -3.472 5.934 -4.901 1.00 0.00 O ATOM 0 H GLU B 88 -6.703 4.867 -6.348 1.00 0.00 H new ATOM 0 HA GLU B 88 -6.256 6.586 -8.711 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -5.428 8.250 -7.185 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -7.027 7.740 -6.680 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -5.753 7.981 -4.690 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -5.919 6.255 -4.945 1.00 0.00 H new ATOM 2657 N LEU B 89 -4.204 4.442 -7.842 1.00 0.00 N ATOM 2658 CA LEU B 89 -3.035 3.631 -8.257 1.00 0.00 C ATOM 2659 C LEU B 89 -2.069 3.271 -7.112 1.00 0.00 C ATOM 2660 O LEU B 89 -1.049 2.626 -7.335 1.00 0.00 O ATOM 2661 CB LEU B 89 -2.332 4.216 -9.507 1.00 0.00 C ATOM 2662 CG LEU B 89 -1.317 3.293 -10.216 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -1.889 1.923 -10.612 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -0.797 4.006 -11.468 1.00 0.00 C ATOM 0 H LEU B 89 -4.870 3.862 -7.331 1.00 0.00 H new ATOM 0 HA LEU B 89 -3.443 2.666 -8.559 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -3.098 4.500 -10.229 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -1.816 5.130 -9.213 1.00 0.00 H new ATOM 0 HG LEU B 89 -0.517 3.094 -9.502 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -1.115 1.334 -11.104 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -2.231 1.399 -9.719 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -2.728 2.062 -11.294 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -0.079 3.365 -11.979 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -1.631 4.222 -12.136 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -0.311 4.938 -11.180 1.00 0.00 H new ATOM 2676 N VAL B 90 -2.362 3.656 -5.874 1.00 0.00 N ATOM 2677 CA VAL B 90 -1.531 3.434 -4.682 1.00 0.00 C ATOM 2678 C VAL B 90 -0.416 4.480 -4.617 1.00 0.00 C ATOM 2679 O VAL B 90 0.713 4.228 -4.202 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.083 1.971 -4.423 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -0.633 1.768 -2.960 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -2.269 1.013 -4.628 1.00 0.00 C ATOM 0 H VAL B 90 -3.225 4.155 -5.658 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.179 3.589 -3.819 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.264 1.770 -5.113 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -0.326 0.732 -2.814 1.00 0.00 H new ATOM 0 HG12 VAL B 90 0.206 2.429 -2.742 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -1.461 1.999 -2.289 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.945 -0.011 -4.444 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -3.069 1.271 -3.934 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -2.634 1.100 -5.651 1.00 0.00 H new ATOM 2692 N GLN B 91 -0.776 5.723 -4.955 1.00 0.00 N ATOM 2693 CA GLN B 91 -0.535 6.896 -4.106 1.00 0.00 C ATOM 2694 C GLN B 91 0.852 7.525 -4.327 1.00 0.00 C ATOM 2695 O GLN B 91 1.024 8.730 -4.183 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.809 6.495 -2.638 1.00 0.00 C ATOM 2697 CG GLN B 91 -1.382 7.600 -1.748 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.891 7.893 -1.804 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -3.356 8.932 -1.342 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.733 7.046 -2.340 1.00 0.00 N ATOM 0 H GLN B 91 -1.247 5.945 -5.832 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.223 7.694 -4.385 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -1.501 5.653 -2.633 1.00 0.00 H new ATOM 0 HB3 GLN B 91 0.123 6.144 -2.196 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -1.132 7.354 -0.716 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -0.858 8.524 -1.991 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -3.392 6.170 -2.736 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.730 7.262 -2.361 1.00 0.00 H new ATOM 2709 N VAL B 92 1.807 6.712 -4.772 1.00 0.00 N ATOM 2710 CA VAL B 92 3.208 6.963 -5.168 1.00 0.00 C ATOM 2711 C VAL B 92 3.345 7.790 -6.464 1.00 0.00 C ATOM 2712 O VAL B 92 4.257 7.595 -7.257 1.00 0.00 O ATOM 2713 CB VAL B 92 3.915 5.586 -5.263 1.00 0.00 C ATOM 2714 CG1 VAL B 92 3.315 4.727 -6.388 1.00 0.00 C ATOM 2715 CG2 VAL B 92 5.453 5.634 -5.305 1.00 0.00 C ATOM 0 H VAL B 92 1.594 5.721 -4.881 1.00 0.00 H new ATOM 0 HA VAL B 92 3.689 7.585 -4.414 1.00 0.00 H new ATOM 0 HB VAL B 92 3.707 5.095 -4.312 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.832 3.768 -6.429 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.256 4.560 -6.193 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.431 5.243 -7.341 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.847 4.620 -5.371 1.00 0.00 H new ATOM 0 HG22 VAL B 92 5.776 6.206 -6.175 1.00 0.00 H new ATOM 0 HG23 VAL B 92 5.827 6.110 -4.399 1.00 0.00 H new ATOM 2725 N VAL B 93 2.383 8.680 -6.713 1.00 0.00 N ATOM 2726 CA VAL B 93 2.249 9.549 -7.907 1.00 0.00 C ATOM 2727 C VAL B 93 2.435 8.846 -9.281 1.00 0.00 C ATOM 2728 O VAL B 93 2.787 9.506 -10.256 1.00 0.00 O ATOM 2729 CB VAL B 93 3.081 10.859 -7.784 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.630 11.663 -6.551 1.00 0.00 C ATOM 2731 CG2 VAL B 93 4.608 10.663 -7.727 1.00 0.00 C ATOM 0 H VAL B 93 1.623 8.831 -6.050 1.00 0.00 H new ATOM 0 HA VAL B 93 1.195 9.828 -7.908 1.00 0.00 H new ATOM 0 HB VAL B 93 2.882 11.402 -8.708 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.220 12.577 -6.477 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.575 11.919 -6.650 1.00 0.00 H new ATOM 0 HG13 VAL B 93 2.775 11.063 -5.652 1.00 0.00 H new ATOM 0 HG21 VAL B 93 5.096 11.634 -7.642 1.00 0.00 H new ATOM 0 HG22 VAL B 93 4.864 10.051 -6.862 1.00 0.00 H new ATOM 0 HG23 VAL B 93 4.945 10.166 -8.636 1.00 0.00 H new ATOM 2741 N LEU B 94 2.170 7.524 -9.332 1.00 0.00 N ATOM 2742 CA LEU B 94 2.257 6.566 -10.463 1.00 0.00 C ATOM 2743 C LEU B 94 3.588 5.788 -10.411 1.00 0.00 C ATOM 2744 O LEU B 94 4.605 6.271 -10.902 1.00 0.00 O ATOM 2745 CB LEU B 94 2.028 7.246 -11.842 1.00 0.00 C ATOM 2746 CG LEU B 94 1.641 6.355 -13.046 1.00 0.00 C ATOM 2747 CD1 LEU B 94 1.611 7.223 -14.315 1.00 0.00 C ATOM 2748 CD2 LEU B 94 2.557 5.146 -13.290 1.00 0.00 C ATOM 0 H LEU B 94 1.854 7.045 -8.489 1.00 0.00 H new ATOM 0 HA LEU B 94 1.443 5.850 -10.349 1.00 0.00 H new ATOM 0 HB2 LEU B 94 1.245 7.994 -11.717 1.00 0.00 H new ATOM 0 HB3 LEU B 94 2.941 7.781 -12.104 1.00 0.00 H new ATOM 0 HG LEU B 94 0.664 5.937 -12.803 1.00 0.00 H new ATOM 0 HD11 LEU B 94 1.339 6.606 -15.171 1.00 0.00 H new ATOM 0 HD12 LEU B 94 0.877 8.019 -14.194 1.00 0.00 H new ATOM 0 HD13 LEU B 94 2.596 7.660 -14.480 1.00 0.00 H new ATOM 0 HD21 LEU B 94 2.200 4.588 -14.155 1.00 0.00 H new ATOM 0 HD22 LEU B 94 3.574 5.492 -13.476 1.00 0.00 H new ATOM 0 HD23 LEU B 94 2.548 4.500 -12.412 1.00 0.00 H new ATOM 2760 N ALA B 95 3.574 4.557 -9.880 1.00 0.00 N ATOM 2761 CA ALA B 95 4.722 3.647 -9.982 1.00 0.00 C ATOM 2762 C ALA B 95 4.478 2.582 -11.070 1.00 0.00 C ATOM 2763 O ALA B 95 3.350 2.114 -11.218 1.00 0.00 O ATOM 2764 CB ALA B 95 5.026 3.015 -8.623 1.00 0.00 C ATOM 0 H ALA B 95 2.778 4.169 -9.374 1.00 0.00 H new ATOM 0 HA ALA B 95 5.600 4.220 -10.281 1.00 0.00 H new ATOM 0 HB1 ALA B 95 5.879 2.343 -8.717 1.00 0.00 H new ATOM 0 HB2 ALA B 95 5.258 3.798 -7.901 1.00 0.00 H new ATOM 0 HB3 ALA B 95 4.157 2.452 -8.281 1.00 0.00 H new