USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=36 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= -1.65 K(o=-2.4,f=-4.4!) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.708 K(o=-2.4,f=-6.9!) USER MOD Set 2.1: A 102 CYS SG : rot 180:sc= 0.22 USER MOD Set 2.2: B 57 CYS SG : rot 170:sc= 0.981 USER MOD Set 2.3: B 61 CYS SG : rot -139:sc= 0.322 USER MOD Set 3.1: B 39 GLN : amide:sc= -0.586 K(o=-2.7,f=-5.7!) USER MOD Set 3.2: B 43 HIS :FLIP no HD1:sc= -2.1 F(o=-6.2,f=-2.7) USER MOD Set 4.1: B 22 THR OG1 : rot 76:sc= 1.43 USER MOD Set 4.2: B 54 HIS : no HE2:sc= 0.712 K(o=2.1,f=-3.3) USER MOD Set 5.1: A 91 GLN : amide:sc= 0.567 K(o=-1.2,f=-7.5!) USER MOD Set 5.2: B 81 HIS : no HE2:sc= -1.79 K(o=-1.2,f=-3.5!) USER MOD Set 6.1: A 57 CYS SG : rot 170:sc= 0.962 USER MOD Set 6.2: A 61 CYS SG : rot 180:sc= 0.694 USER MOD Set 7.1: A 22 THR OG1 : rot 78:sc= 1.33 USER MOD Set 7.2: A 54 HIS : no HE2:sc= 0.571 K(o=1.9,f=-4.2) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot -95:sc= 1.22 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -1.74 K(o=-1.7,f=-5.4!) USER MOD Single : A 43 HIS :FLIP no HD1:sc= -0.748 F(o=-1.5,f=-0.75) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0109 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.0892 K(o=-0.089,f=-1.7!) USER MOD Single : A 52 SER OG : rot -90:sc= 1.22 USER MOD Single : A 53 ASN : amide:sc=-0.000296 X(o=-0.0003,f=-0.38) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 150:sc= 0.216 USER MOD Single : A 68 TYR OH : rot -18:sc= 0.236 USER MOD Single : A 72 GLN : amide:sc= 0.366 K(o=0.37,f=-5.9!) USER MOD Single : A 75 TYR OH : rot 30:sc= 0 USER MOD Single : A 80 SER OG : rot -78:sc= 1.2 USER MOD Single : A 98 THR OG1 : rot 74:sc= 0.229 USER MOD Single : A 100 GLN : amide:sc= 0.611 K(o=0.61,f=0) USER MOD Single : B 24 CYS SG : rot 97:sc= 0.407 USER MOD Single : B 35 CYS SG : rot 180:sc= -0.0756 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= -0.108 K(o=-0.11,f=-1.8!) USER MOD Single : B 52 SER OG : rot -73:sc= 1.22 USER MOD Single : B 53 ASN : amide:sc= -0.0137 K(o=-0.014,f=-0.64) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 95:sc= 0.675 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= -0.426 X(o=-0.43,f=-0.66) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot -70:sc= 0.965 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 8.143 -1.553 -8.734 1.00 0.00 N ATOM 12 CA LEU A 11 7.003 -1.077 -7.946 1.00 0.00 C ATOM 13 C LEU A 11 6.537 -2.088 -6.886 1.00 0.00 C ATOM 14 O LEU A 11 6.030 -1.670 -5.845 1.00 0.00 O ATOM 15 CB LEU A 11 5.884 -0.551 -8.851 1.00 0.00 C ATOM 16 CG LEU A 11 6.190 0.750 -9.634 1.00 0.00 C ATOM 17 CD1 LEU A 11 6.674 1.892 -8.726 1.00 0.00 C ATOM 18 CD2 LEU A 11 7.191 0.564 -10.785 1.00 0.00 C ATOM 0 HA LEU A 11 7.344 -0.223 -7.360 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.629 -1.331 -9.569 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.999 -0.381 -8.238 1.00 0.00 H new ATOM 0 HG LEU A 11 5.228 1.023 -10.068 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.873 2.778 -9.330 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.905 2.121 -7.988 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.588 1.588 -8.215 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.353 1.519 -11.284 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.137 0.197 -10.388 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.793 -0.156 -11.500 1.00 0.00 H new ATOM 30 N ALA A 12 6.851 -3.379 -7.044 1.00 0.00 N ATOM 31 CA ALA A 12 6.697 -4.365 -5.975 1.00 0.00 C ATOM 32 C ALA A 12 7.519 -3.983 -4.720 1.00 0.00 C ATOM 33 O ALA A 12 7.022 -4.112 -3.597 1.00 0.00 O ATOM 34 CB ALA A 12 7.099 -5.734 -6.540 1.00 0.00 C ATOM 0 H ALA A 12 7.217 -3.766 -7.914 1.00 0.00 H new ATOM 0 HA ALA A 12 5.660 -4.398 -5.642 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.995 -6.493 -5.764 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.453 -5.984 -7.382 1.00 0.00 H new ATOM 0 HB3 ALA A 12 8.135 -5.699 -6.876 1.00 0.00 H new ATOM 40 N ARG A 13 8.753 -3.458 -4.879 1.00 0.00 N ATOM 41 CA ARG A 13 9.575 -2.956 -3.755 1.00 0.00 C ATOM 42 C ARG A 13 8.890 -1.815 -2.998 1.00 0.00 C ATOM 43 O ARG A 13 9.067 -1.704 -1.786 1.00 0.00 O ATOM 44 CB ARG A 13 10.972 -2.486 -4.194 1.00 0.00 C ATOM 45 CG ARG A 13 11.959 -3.641 -4.410 1.00 0.00 C ATOM 46 CD ARG A 13 13.288 -3.208 -5.051 1.00 0.00 C ATOM 47 NE ARG A 13 13.737 -1.854 -4.656 1.00 0.00 N ATOM 48 CZ ARG A 13 14.558 -1.080 -5.366 1.00 0.00 C ATOM 49 NH1 ARG A 13 15.074 -1.497 -6.493 1.00 0.00 N ATOM 50 NH2 ARG A 13 14.938 0.113 -4.965 1.00 0.00 N ATOM 0 H ARG A 13 9.207 -3.370 -5.788 1.00 0.00 H new ATOM 0 HA ARG A 13 9.689 -3.814 -3.092 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.882 -1.916 -5.119 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.374 -1.809 -3.440 1.00 0.00 H new ATOM 0 HG2 ARG A 13 12.166 -4.114 -3.450 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.490 -4.395 -5.042 1.00 0.00 H new ATOM 0 HD2 ARG A 13 14.061 -3.928 -4.782 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.184 -3.243 -6.135 1.00 0.00 H new ATOM 0 HE ARG A 13 13.391 -1.484 -3.771 1.00 0.00 H new ATOM 0 HH11 ARG A 13 14.850 -2.429 -6.843 1.00 0.00 H new ATOM 0 HH12 ARG A 13 15.700 -0.890 -7.022 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.603 0.483 -4.075 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.568 0.669 -5.543 1.00 0.00 H new ATOM 64 N LEU A 14 8.096 -0.988 -3.679 1.00 0.00 N ATOM 65 CA LEU A 14 7.340 0.111 -3.077 1.00 0.00 C ATOM 66 C LEU A 14 6.310 -0.404 -2.052 1.00 0.00 C ATOM 67 O LEU A 14 6.262 0.107 -0.935 1.00 0.00 O ATOM 68 CB LEU A 14 6.720 0.948 -4.225 1.00 0.00 C ATOM 69 CG LEU A 14 6.892 2.477 -4.131 1.00 0.00 C ATOM 70 CD1 LEU A 14 6.161 3.059 -2.915 1.00 0.00 C ATOM 71 CD2 LEU A 14 8.367 2.898 -4.169 1.00 0.00 C ATOM 0 H LEU A 14 7.957 -1.065 -4.687 1.00 0.00 H new ATOM 0 HA LEU A 14 7.996 0.760 -2.497 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.156 0.613 -5.166 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.654 0.727 -4.271 1.00 0.00 H new ATOM 0 HG LEU A 14 6.424 2.901 -5.019 1.00 0.00 H new ATOM 0 HD11 LEU A 14 6.307 4.139 -2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 14 5.096 2.839 -2.991 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.559 2.614 -2.003 1.00 0.00 H new ATOM 0 HD21 LEU A 14 8.437 3.984 -4.100 1.00 0.00 H new ATOM 0 HD22 LEU A 14 8.896 2.446 -3.330 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.817 2.564 -5.104 1.00 0.00 H new ATOM 83 N GLY A 15 5.574 -1.479 -2.367 1.00 0.00 N ATOM 84 CA GLY A 15 4.612 -2.107 -1.444 1.00 0.00 C ATOM 85 C GLY A 15 5.294 -2.913 -0.341 1.00 0.00 C ATOM 86 O GLY A 15 4.845 -2.896 0.804 1.00 0.00 O ATOM 0 H GLY A 15 5.628 -1.942 -3.274 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.991 -1.334 -0.992 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.947 -2.761 -2.008 1.00 0.00 H new ATOM 90 N ARG A 16 6.436 -3.540 -0.660 1.00 0.00 N ATOM 91 CA ARG A 16 7.331 -4.182 0.317 1.00 0.00 C ATOM 92 C ARG A 16 7.732 -3.170 1.393 1.00 0.00 C ATOM 93 O ARG A 16 7.583 -3.451 2.571 1.00 0.00 O ATOM 94 CB ARG A 16 8.584 -4.767 -0.382 1.00 0.00 C ATOM 95 CG ARG A 16 8.280 -6.096 -1.087 1.00 0.00 C ATOM 96 CD ARG A 16 9.012 -6.443 -2.388 1.00 0.00 C ATOM 97 NE ARG A 16 10.477 -6.624 -2.305 1.00 0.00 N ATOM 98 CZ ARG A 16 11.112 -7.359 -3.221 1.00 0.00 C ATOM 99 NH1 ARG A 16 10.526 -8.387 -3.799 1.00 0.00 N ATOM 100 NH2 ARG A 16 12.325 -7.054 -3.627 1.00 0.00 N ATOM 0 H ARG A 16 6.770 -3.617 -1.621 1.00 0.00 H new ATOM 0 HA ARG A 16 6.800 -5.008 0.790 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.962 -4.049 -1.109 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.373 -4.919 0.355 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.481 -6.897 -0.375 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.211 -6.117 -1.298 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.579 -7.361 -2.786 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.808 -5.654 -3.112 1.00 0.00 H new ATOM 0 HE ARG A 16 11.003 -6.187 -1.548 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.569 -8.635 -3.549 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.029 -8.935 -4.496 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.802 -6.240 -3.241 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.789 -7.632 -4.328 1.00 0.00 H new ATOM 114 N ALA A 17 8.184 -1.985 0.972 1.00 0.00 N ATOM 115 CA ALA A 17 8.630 -0.924 1.867 1.00 0.00 C ATOM 116 C ALA A 17 7.493 -0.234 2.640 1.00 0.00 C ATOM 117 O ALA A 17 7.734 0.284 3.727 1.00 0.00 O ATOM 118 CB ALA A 17 9.433 0.079 1.034 1.00 0.00 C ATOM 0 H ALA A 17 8.250 -1.737 -0.015 1.00 0.00 H new ATOM 0 HA ALA A 17 9.248 -1.371 2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.782 0.888 1.676 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.290 -0.424 0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.799 0.488 0.247 1.00 0.00 H new ATOM 124 N LEU A 18 6.272 -0.184 2.099 1.00 0.00 N ATOM 125 CA LEU A 18 5.154 0.501 2.767 1.00 0.00 C ATOM 126 C LEU A 18 4.412 -0.388 3.777 1.00 0.00 C ATOM 127 O LEU A 18 3.802 0.154 4.698 1.00 0.00 O ATOM 128 CB LEU A 18 4.246 1.155 1.704 1.00 0.00 C ATOM 129 CG LEU A 18 4.594 2.641 1.443 1.00 0.00 C ATOM 130 CD1 LEU A 18 6.085 2.932 1.186 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.788 3.172 0.250 1.00 0.00 C ATOM 0 H LEU A 18 6.030 -0.607 1.203 1.00 0.00 H new ATOM 0 HA LEU A 18 5.555 1.299 3.392 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.330 0.599 0.770 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.207 1.082 2.027 1.00 0.00 H new ATOM 0 HG LEU A 18 4.333 3.149 2.371 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.223 4.000 1.015 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.670 2.625 2.053 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.418 2.378 0.309 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.041 4.218 0.076 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.027 2.588 -0.639 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.723 3.088 0.464 1.00 0.00 H new ATOM 143 N ALA A 19 4.529 -1.717 3.676 1.00 0.00 N ATOM 144 CA ALA A 19 4.012 -2.666 4.668 1.00 0.00 C ATOM 145 C ALA A 19 5.075 -3.144 5.688 1.00 0.00 C ATOM 146 O ALA A 19 4.884 -4.165 6.345 1.00 0.00 O ATOM 147 CB ALA A 19 3.304 -3.794 3.909 1.00 0.00 C ATOM 0 H ALA A 19 4.993 -2.171 2.889 1.00 0.00 H new ATOM 0 HA ALA A 19 3.288 -2.167 5.312 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.907 -4.518 4.621 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.486 -3.379 3.320 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.014 -4.288 3.246 1.00 0.00 H new ATOM 153 N ASP A 20 6.197 -2.423 5.793 1.00 0.00 N ATOM 154 CA ASP A 20 7.206 -2.557 6.838 1.00 0.00 C ATOM 155 C ASP A 20 6.633 -2.241 8.245 1.00 0.00 C ATOM 156 O ASP A 20 5.621 -1.545 8.359 1.00 0.00 O ATOM 157 CB ASP A 20 8.313 -1.527 6.556 1.00 0.00 C ATOM 158 CG ASP A 20 9.600 -2.025 5.896 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.611 -2.381 4.701 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.668 -1.787 6.499 1.00 0.00 O ATOM 0 H ASP A 20 6.433 -1.697 5.117 1.00 0.00 H new ATOM 0 HA ASP A 20 7.569 -3.585 6.830 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.891 -0.748 5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.582 -1.057 7.502 1.00 0.00 H new ATOM 165 N PRO A 21 7.371 -2.623 9.307 1.00 0.00 N ATOM 166 CA PRO A 21 7.111 -2.287 10.713 1.00 0.00 C ATOM 167 C PRO A 21 7.355 -0.778 10.993 1.00 0.00 C ATOM 168 O PRO A 21 6.709 0.108 10.427 1.00 0.00 O ATOM 169 CB PRO A 21 8.082 -3.226 11.468 1.00 0.00 C ATOM 170 CG PRO A 21 9.302 -3.198 10.543 1.00 0.00 C ATOM 171 CD PRO A 21 8.606 -3.401 9.215 1.00 0.00 C ATOM 0 HA PRO A 21 6.077 -2.433 11.024 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.315 -2.859 12.468 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.676 -4.231 11.584 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.845 -2.254 10.593 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.017 -3.989 10.767 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.227 -3.057 8.388 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.395 -4.456 9.038 1.00 0.00 H new ATOM 179 N THR A 22 8.351 -0.479 11.838 1.00 0.00 N ATOM 180 CA THR A 22 8.940 0.832 12.132 1.00 0.00 C ATOM 181 C THR A 22 9.068 1.765 10.943 1.00 0.00 C ATOM 182 O THR A 22 8.867 2.966 11.119 1.00 0.00 O ATOM 183 CB THR A 22 10.322 0.647 12.791 1.00 0.00 C ATOM 184 OG1 THR A 22 10.905 -0.606 12.485 1.00 0.00 O ATOM 185 CG2 THR A 22 10.171 0.675 14.308 1.00 0.00 C ATOM 0 H THR A 22 8.804 -1.214 12.380 1.00 0.00 H new ATOM 0 HA THR A 22 8.236 1.316 12.809 1.00 0.00 H new ATOM 0 HB THR A 22 10.951 1.452 12.412 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.280 -0.580 11.580 1.00 0.00 H new ATOM 0 HG21 THR A 22 11.148 0.544 14.773 1.00 0.00 H new ATOM 0 HG22 THR A 22 9.749 1.632 14.614 1.00 0.00 H new ATOM 0 HG23 THR A 22 9.508 -0.131 14.623 1.00 0.00 H new ATOM 193 N ARG A 23 9.360 1.272 9.734 1.00 0.00 N ATOM 194 CA ARG A 23 9.468 2.146 8.561 1.00 0.00 C ATOM 195 C ARG A 23 8.144 2.831 8.201 1.00 0.00 C ATOM 196 O ARG A 23 8.157 4.009 7.850 1.00 0.00 O ATOM 197 CB ARG A 23 9.932 1.385 7.330 1.00 0.00 C ATOM 198 CG ARG A 23 10.561 2.323 6.288 1.00 0.00 C ATOM 199 CD ARG A 23 10.042 1.943 4.894 1.00 0.00 C ATOM 200 NE ARG A 23 10.487 0.596 4.517 1.00 0.00 N ATOM 201 CZ ARG A 23 11.679 0.247 4.070 1.00 0.00 C ATOM 202 NH1 ARG A 23 12.584 1.134 3.724 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.971 -1.027 3.959 1.00 0.00 N ATOM 0 H ARG A 23 9.524 0.284 9.543 1.00 0.00 H new ATOM 0 HA ARG A 23 10.201 2.901 8.845 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.658 0.627 7.623 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.086 0.861 6.885 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.309 3.359 6.514 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.648 2.245 6.319 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.953 1.987 4.883 1.00 0.00 H new ATOM 0 HD3 ARG A 23 10.397 2.666 4.160 1.00 0.00 H new ATOM 0 HE ARG A 23 9.800 -0.152 4.611 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.376 2.130 3.797 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.495 0.827 3.383 1.00 0.00 H new ATOM 0 HH21 ARG A 23 11.281 -1.733 4.217 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.888 -1.312 3.615 1.00 0.00 H new ATOM 217 N CYS A 24 6.999 2.152 8.317 1.00 0.00 N ATOM 218 CA CYS A 24 5.695 2.794 8.110 1.00 0.00 C ATOM 219 C CYS A 24 5.529 3.973 9.093 1.00 0.00 C ATOM 220 O CYS A 24 5.190 5.097 8.698 1.00 0.00 O ATOM 221 CB CYS A 24 4.614 1.707 8.237 1.00 0.00 C ATOM 222 SG CYS A 24 3.064 2.278 7.482 1.00 0.00 S ATOM 0 H CYS A 24 6.947 1.161 8.552 1.00 0.00 H new ATOM 0 HA CYS A 24 5.605 3.233 7.116 1.00 0.00 H new ATOM 0 HB2 CYS A 24 4.949 0.791 7.750 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.449 1.468 9.288 1.00 0.00 H new ATOM 0 HG CYS A 24 2.160 1.351 7.593 1.00 0.00 H new ATOM 228 N ARG A 25 5.912 3.755 10.361 1.00 0.00 N ATOM 229 CA ARG A 25 5.947 4.813 11.378 1.00 0.00 C ATOM 230 C ARG A 25 6.976 5.920 11.069 1.00 0.00 C ATOM 231 O ARG A 25 6.660 7.083 11.269 1.00 0.00 O ATOM 232 CB ARG A 25 6.092 4.220 12.796 1.00 0.00 C ATOM 233 CG ARG A 25 4.861 4.553 13.667 1.00 0.00 C ATOM 234 CD ARG A 25 4.761 6.038 14.058 1.00 0.00 C ATOM 235 NE ARG A 25 3.366 6.483 14.235 1.00 0.00 N ATOM 236 CZ ARG A 25 2.975 7.753 14.363 1.00 0.00 C ATOM 237 NH1 ARG A 25 3.839 8.745 14.458 1.00 0.00 N ATOM 238 NH2 ARG A 25 1.691 8.049 14.385 1.00 0.00 N ATOM 0 H ARG A 25 6.205 2.842 10.708 1.00 0.00 H new ATOM 0 HA ARG A 25 4.983 5.320 11.345 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.213 3.139 12.731 1.00 0.00 H new ATOM 0 HB3 ARG A 25 6.992 4.614 13.268 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.958 4.267 13.128 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.895 3.949 14.574 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.312 6.205 14.983 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.238 6.646 13.289 1.00 0.00 H new ATOM 0 HE ARG A 25 2.643 5.764 14.262 1.00 0.00 H new ATOM 0 HH11 ARG A 25 4.841 8.553 14.435 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.506 9.704 14.555 1.00 0.00 H new ATOM 0 HH21 ARG A 25 0.995 7.308 14.304 1.00 0.00 H new ATOM 0 HH22 ARG A 25 1.393 9.020 14.483 1.00 0.00 H new ATOM 252 N ILE A 26 8.159 5.613 10.530 1.00 0.00 N ATOM 253 CA ILE A 26 9.154 6.594 10.016 1.00 0.00 C ATOM 254 C ILE A 26 8.552 7.475 8.920 1.00 0.00 C ATOM 255 O ILE A 26 8.665 8.693 8.966 1.00 0.00 O ATOM 256 CB ILE A 26 10.409 5.849 9.489 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.218 5.251 10.649 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.298 6.665 8.541 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.157 6.214 11.371 1.00 0.00 C ATOM 0 H ILE A 26 8.473 4.648 10.430 1.00 0.00 H new ATOM 0 HA ILE A 26 9.447 7.246 10.839 1.00 0.00 H new ATOM 0 HB ILE A 26 10.023 5.040 8.869 1.00 0.00 H new ATOM 0 HG12 ILE A 26 10.521 4.838 11.378 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.807 4.419 10.265 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.148 6.059 8.227 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.721 6.961 7.665 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.658 7.556 9.056 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.676 5.685 12.170 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.886 6.610 10.664 1.00 0.00 H new ATOM 0 HD13 ILE A 26 11.580 7.036 11.795 1.00 0.00 H new ATOM 271 N LEU A 27 7.877 6.877 7.946 1.00 0.00 N ATOM 272 CA LEU A 27 7.275 7.621 6.839 1.00 0.00 C ATOM 273 C LEU A 27 6.144 8.547 7.313 1.00 0.00 C ATOM 274 O LEU A 27 6.132 9.709 6.920 1.00 0.00 O ATOM 275 CB LEU A 27 6.823 6.634 5.753 1.00 0.00 C ATOM 276 CG LEU A 27 7.963 6.035 4.913 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.431 4.828 4.128 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.522 7.065 3.915 1.00 0.00 C ATOM 0 H LEU A 27 7.730 5.869 7.898 1.00 0.00 H new ATOM 0 HA LEU A 27 8.024 8.285 6.406 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.273 5.821 6.227 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.127 7.143 5.086 1.00 0.00 H new ATOM 0 HG LEU A 27 8.763 5.734 5.590 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.236 4.399 3.530 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.057 4.078 4.824 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.623 5.149 3.471 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.326 6.611 3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.728 7.388 3.242 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.908 7.927 4.459 1.00 0.00 H new ATOM 290 N VAL A 28 5.255 8.086 8.201 1.00 0.00 N ATOM 291 CA VAL A 28 4.195 8.940 8.791 1.00 0.00 C ATOM 292 C VAL A 28 4.759 9.957 9.794 1.00 0.00 C ATOM 293 O VAL A 28 4.158 11.002 10.018 1.00 0.00 O ATOM 294 CB VAL A 28 3.037 8.124 9.415 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.270 7.668 10.863 1.00 0.00 C ATOM 296 CG2 VAL A 28 1.705 8.888 9.374 1.00 0.00 C ATOM 0 H VAL A 28 5.242 7.122 8.534 1.00 0.00 H new ATOM 0 HA VAL A 28 3.772 9.499 7.956 1.00 0.00 H new ATOM 0 HB VAL A 28 2.997 7.234 8.787 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.404 7.105 11.211 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.156 7.035 10.907 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.415 8.540 11.500 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.921 8.277 9.822 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.803 9.820 9.931 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.445 9.110 8.339 1.00 0.00 H new ATOM 306 N ALA A 29 5.925 9.673 10.386 1.00 0.00 N ATOM 307 CA ALA A 29 6.658 10.621 11.205 1.00 0.00 C ATOM 308 C ALA A 29 7.227 11.762 10.357 1.00 0.00 C ATOM 309 O ALA A 29 7.198 12.904 10.800 1.00 0.00 O ATOM 310 CB ALA A 29 7.748 9.865 11.986 1.00 0.00 C ATOM 0 H ALA A 29 6.384 8.766 10.303 1.00 0.00 H new ATOM 0 HA ALA A 29 5.984 11.089 11.922 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.306 10.568 12.605 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.284 9.111 12.621 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.428 9.380 11.285 1.00 0.00 H new ATOM 316 N LEU A 30 7.707 11.492 9.139 1.00 0.00 N ATOM 317 CA LEU A 30 8.293 12.540 8.295 1.00 0.00 C ATOM 318 C LEU A 30 7.271 13.510 7.729 1.00 0.00 C ATOM 319 O LEU A 30 7.556 14.699 7.627 1.00 0.00 O ATOM 320 CB LEU A 30 9.139 11.893 7.188 1.00 0.00 C ATOM 321 CG LEU A 30 10.487 11.398 7.739 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.346 10.838 6.608 1.00 0.00 C ATOM 323 CD2 LEU A 30 11.209 12.529 8.482 1.00 0.00 C ATOM 0 H LEU A 30 7.702 10.563 8.717 1.00 0.00 H new ATOM 0 HA LEU A 30 8.934 13.150 8.932 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.593 11.058 6.750 1.00 0.00 H new ATOM 0 HB3 LEU A 30 9.312 12.615 6.389 1.00 0.00 H new ATOM 0 HG LEU A 30 10.305 10.594 8.452 1.00 0.00 H new ATOM 0 HD11 LEU A 30 12.297 10.491 7.011 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.827 10.004 6.135 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.528 11.618 5.869 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.161 12.163 8.866 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.389 13.358 7.797 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.591 12.872 9.312 1.00 0.00 H new ATOM 335 N LEU A 31 6.087 12.981 7.452 1.00 0.00 N ATOM 336 CA LEU A 31 4.860 13.693 7.081 1.00 0.00 C ATOM 337 C LEU A 31 4.658 14.996 7.877 1.00 0.00 C ATOM 338 O LEU A 31 4.522 16.049 7.261 1.00 0.00 O ATOM 339 CB LEU A 31 3.693 12.694 7.245 1.00 0.00 C ATOM 340 CG LEU A 31 2.758 12.590 6.028 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.904 11.330 6.186 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.878 13.834 5.853 1.00 0.00 C ATOM 0 H LEU A 31 5.943 11.972 7.481 1.00 0.00 H new ATOM 0 HA LEU A 31 4.919 14.031 6.046 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.105 11.707 7.455 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.104 12.985 8.115 1.00 0.00 H new ATOM 0 HG LEU A 31 3.365 12.526 5.125 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.232 11.236 5.333 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.552 10.455 6.236 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.318 11.400 7.103 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.238 13.707 4.980 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.259 13.969 6.740 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.511 14.711 5.715 1.00 0.00 H new ATOM 354 N ASP A 32 4.747 14.938 9.211 1.00 0.00 N ATOM 355 CA ASP A 32 4.714 16.113 10.105 1.00 0.00 C ATOM 356 C ASP A 32 6.126 16.590 10.536 1.00 0.00 C ATOM 357 O ASP A 32 6.310 17.730 10.964 1.00 0.00 O ATOM 358 CB ASP A 32 3.945 15.769 11.402 1.00 0.00 C ATOM 359 CG ASP A 32 2.628 14.991 11.254 1.00 0.00 C ATOM 360 OD1 ASP A 32 1.651 15.546 10.704 1.00 0.00 O ATOM 361 OD2 ASP A 32 2.617 13.848 11.774 1.00 0.00 O ATOM 0 H ASP A 32 4.846 14.057 9.715 1.00 0.00 H new ATOM 0 HA ASP A 32 4.229 16.905 9.535 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.609 15.190 12.044 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.729 16.701 11.924 1.00 0.00 H new ATOM 366 N GLY A 33 7.130 15.710 10.434 1.00 0.00 N ATOM 367 CA GLY A 33 8.462 15.824 11.044 1.00 0.00 C ATOM 368 C GLY A 33 9.599 16.238 10.122 1.00 0.00 C ATOM 369 O GLY A 33 10.758 16.104 10.499 1.00 0.00 O ATOM 0 H GLY A 33 7.030 14.851 9.893 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.403 16.546 11.858 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.717 14.862 11.489 1.00 0.00 H new ATOM 373 N VAL A 34 9.296 16.773 8.946 1.00 0.00 N ATOM 374 CA VAL A 34 10.228 17.395 7.977 1.00 0.00 C ATOM 375 C VAL A 34 11.185 18.469 8.562 1.00 0.00 C ATOM 376 O VAL A 34 11.038 19.662 8.285 1.00 0.00 O ATOM 377 CB VAL A 34 9.452 17.990 6.773 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.088 16.940 5.733 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.194 18.782 7.172 1.00 0.00 C ATOM 0 H VAL A 34 8.333 16.792 8.609 1.00 0.00 H new ATOM 0 HA VAL A 34 10.871 16.574 7.658 1.00 0.00 H new ATOM 0 HB VAL A 34 10.154 18.695 6.328 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.547 17.412 4.913 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.997 16.478 5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.459 16.177 6.191 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.706 19.166 6.276 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.506 18.127 7.707 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.477 19.614 7.816 1.00 0.00 H new ATOM 389 N CYS A 35 12.213 18.046 9.314 1.00 0.00 N ATOM 390 CA CYS A 35 13.128 18.953 10.030 1.00 0.00 C ATOM 391 C CYS A 35 14.600 18.492 10.100 1.00 0.00 C ATOM 392 O CYS A 35 15.459 19.234 9.639 1.00 0.00 O ATOM 393 CB CYS A 35 12.506 19.222 11.404 1.00 0.00 C ATOM 394 SG CYS A 35 13.275 20.684 12.168 1.00 0.00 S ATOM 0 H CYS A 35 12.435 17.059 9.444 1.00 0.00 H new ATOM 0 HA CYS A 35 13.220 19.877 9.459 1.00 0.00 H new ATOM 0 HB2 CYS A 35 11.432 19.379 11.301 1.00 0.00 H new ATOM 0 HB3 CYS A 35 12.640 18.353 12.048 1.00 0.00 H new ATOM 0 HG CYS A 35 14.229 20.305 12.966 1.00 0.00 H new ATOM 400 N TYR A 36 14.925 17.279 10.583 1.00 0.00 N ATOM 401 CA TYR A 36 16.331 16.814 10.600 1.00 0.00 C ATOM 402 C TYR A 36 16.558 15.295 10.670 1.00 0.00 C ATOM 403 O TYR A 36 15.685 14.567 11.150 1.00 0.00 O ATOM 404 CB TYR A 36 17.181 17.546 11.668 1.00 0.00 C ATOM 405 CG TYR A 36 16.620 17.755 13.054 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.868 16.832 14.089 1.00 0.00 C ATOM 407 CD2 TYR A 36 15.958 18.961 13.331 1.00 0.00 C ATOM 408 CE1 TYR A 36 16.407 17.101 15.394 1.00 0.00 C ATOM 409 CE2 TYR A 36 15.493 19.239 14.626 1.00 0.00 C ATOM 410 CZ TYR A 36 15.716 18.308 15.662 1.00 0.00 C ATOM 411 OH TYR A 36 15.287 18.589 16.921 1.00 0.00 O ATOM 0 H TYR A 36 14.251 16.612 10.960 1.00 0.00 H new ATOM 0 HA TYR A 36 16.679 17.091 9.605 1.00 0.00 H new ATOM 0 HB2 TYR A 36 18.116 16.995 11.774 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.433 18.528 11.267 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.410 15.921 13.883 1.00 0.00 H new ATOM 0 HD2 TYR A 36 15.805 19.681 12.541 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.580 16.389 16.187 1.00 0.00 H new ATOM 0 HE2 TYR A 36 14.967 20.161 14.828 1.00 0.00 H new ATOM 0 HH TYR A 36 14.833 19.458 16.926 1.00 0.00 H new ATOM 421 N PRO A 37 17.737 14.795 10.225 1.00 0.00 N ATOM 422 CA PRO A 37 18.154 13.417 10.461 1.00 0.00 C ATOM 423 C PRO A 37 18.085 13.134 11.957 1.00 0.00 C ATOM 424 O PRO A 37 18.601 13.906 12.760 1.00 0.00 O ATOM 425 CB PRO A 37 19.596 13.299 9.941 1.00 0.00 C ATOM 426 CG PRO A 37 20.092 14.739 9.895 1.00 0.00 C ATOM 427 CD PRO A 37 18.820 15.506 9.554 1.00 0.00 C ATOM 0 HA PRO A 37 17.513 12.697 9.952 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.209 12.687 10.602 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.628 12.834 8.955 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.515 15.055 10.849 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.867 14.879 9.141 1.00 0.00 H new ATOM 0 HD2 PRO A 37 18.882 16.539 9.897 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.659 15.537 8.476 1.00 0.00 H new ATOM 435 N GLY A 38 17.400 12.054 12.335 1.00 0.00 N ATOM 436 CA GLY A 38 17.240 11.690 13.742 1.00 0.00 C ATOM 437 C GLY A 38 16.191 12.502 14.505 1.00 0.00 C ATOM 438 O GLY A 38 15.920 12.146 15.644 1.00 0.00 O ATOM 0 H GLY A 38 16.946 11.414 11.683 1.00 0.00 H new ATOM 0 HA2 GLY A 38 16.974 10.635 13.801 1.00 0.00 H new ATOM 0 HA3 GLY A 38 18.201 11.805 14.243 1.00 0.00 H new ATOM 442 N GLN A 39 15.535 13.511 13.903 1.00 0.00 N ATOM 443 CA GLN A 39 14.368 14.176 14.521 1.00 0.00 C ATOM 444 C GLN A 39 13.285 13.152 14.888 1.00 0.00 C ATOM 445 O GLN A 39 12.629 13.270 15.918 1.00 0.00 O ATOM 446 CB GLN A 39 13.791 15.278 13.612 1.00 0.00 C ATOM 447 CG GLN A 39 12.861 14.831 12.463 1.00 0.00 C ATOM 448 CD GLN A 39 11.415 14.512 12.865 1.00 0.00 C ATOM 449 OE1 GLN A 39 10.853 13.490 12.510 1.00 0.00 O ATOM 450 NE2 GLN A 39 10.763 15.345 13.644 1.00 0.00 N ATOM 0 H GLN A 39 15.792 13.885 12.989 1.00 0.00 H new ATOM 0 HA GLN A 39 14.714 14.654 15.437 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.240 15.979 14.239 1.00 0.00 H new ATOM 0 HB3 GLN A 39 14.625 15.828 13.177 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.844 15.616 11.707 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.292 13.947 11.994 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.210 16.207 13.956 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.810 15.129 13.937 1.00 0.00 H new ATOM 459 N LEU A 40 13.172 12.113 14.054 1.00 0.00 N ATOM 460 CA LEU A 40 12.217 11.017 14.139 1.00 0.00 C ATOM 461 C LEU A 40 12.388 10.200 15.419 1.00 0.00 C ATOM 462 O LEU A 40 11.487 9.464 15.792 1.00 0.00 O ATOM 463 CB LEU A 40 12.341 10.082 12.917 1.00 0.00 C ATOM 464 CG LEU A 40 12.612 10.723 11.538 1.00 0.00 C ATOM 465 CD1 LEU A 40 14.084 11.070 11.221 1.00 0.00 C ATOM 466 CD2 LEU A 40 12.167 9.729 10.466 1.00 0.00 C ATOM 0 H LEU A 40 13.790 12.014 13.249 1.00 0.00 H new ATOM 0 HA LEU A 40 11.226 11.470 14.153 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.144 9.373 13.119 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.419 9.506 12.842 1.00 0.00 H new ATOM 0 HG LEU A 40 12.067 11.667 11.554 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.147 11.513 10.227 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.458 11.779 11.959 1.00 0.00 H new ATOM 0 HD13 LEU A 40 14.687 10.162 11.253 1.00 0.00 H new ATOM 0 HD21 LEU A 40 12.346 10.154 9.479 1.00 0.00 H new ATOM 0 HD22 LEU A 40 12.733 8.803 10.571 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.104 9.519 10.583 1.00 0.00 H new ATOM 478 N ALA A 41 13.537 10.320 16.082 1.00 0.00 N ATOM 479 CA ALA A 41 13.817 9.606 17.330 1.00 0.00 C ATOM 480 C ALA A 41 12.849 10.037 18.439 1.00 0.00 C ATOM 481 O ALA A 41 12.259 9.194 19.110 1.00 0.00 O ATOM 482 CB ALA A 41 15.289 9.815 17.716 1.00 0.00 C ATOM 0 H ALA A 41 14.303 10.916 15.769 1.00 0.00 H new ATOM 0 HA ALA A 41 13.656 8.538 17.186 1.00 0.00 H new ATOM 0 HB1 ALA A 41 15.500 9.285 18.645 1.00 0.00 H new ATOM 0 HB2 ALA A 41 15.931 9.430 16.924 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.481 10.879 17.854 1.00 0.00 H new ATOM 488 N ALA A 42 12.598 11.344 18.570 1.00 0.00 N ATOM 489 CA ALA A 42 11.596 11.872 19.500 1.00 0.00 C ATOM 490 C ALA A 42 10.163 11.543 19.049 1.00 0.00 C ATOM 491 O ALA A 42 9.320 11.204 19.872 1.00 0.00 O ATOM 492 CB ALA A 42 11.815 13.384 19.640 1.00 0.00 C ATOM 0 H ALA A 42 13.083 12.064 18.035 1.00 0.00 H new ATOM 0 HA ALA A 42 11.718 11.394 20.472 1.00 0.00 H new ATOM 0 HB1 ALA A 42 11.078 13.796 20.329 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.817 13.572 20.025 1.00 0.00 H new ATOM 0 HB3 ALA A 42 11.706 13.859 18.665 1.00 0.00 H new ATOM 498 N HIS A 43 9.887 11.601 17.744 1.00 0.00 N ATOM 499 CA HIS A 43 8.545 11.360 17.192 1.00 0.00 C ATOM 500 C HIS A 43 8.108 9.874 17.204 1.00 0.00 C ATOM 501 O HIS A 43 6.927 9.565 17.012 1.00 0.00 O ATOM 502 CB HIS A 43 8.543 11.944 15.776 1.00 0.00 C ATOM 503 CG HIS A 43 7.191 12.278 15.205 1.00 0.00 C ATOM 504 ND1 HIS A 43 6.985 12.494 13.883 1.00 0.00 N flip ATOM 505 CD2 HIS A 43 6.025 12.603 15.900 1.00 0.00 C flip ATOM 506 CE1 HIS A 43 5.695 12.959 13.736 1.00 0.00 C flip ATOM 507 NE2 HIS A 43 5.148 13.011 14.963 1.00 0.00 N flip ATOM 0 H HIS A 43 10.588 11.817 17.035 1.00 0.00 H new ATOM 0 HA HIS A 43 7.806 11.847 17.828 1.00 0.00 H new ATOM 0 HB2 HIS A 43 9.150 12.850 15.776 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.032 11.233 15.110 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.861 12.540 16.966 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.214 13.231 12.808 1.00 0.00 H new ATOM 0 HE2 HIS A 43 4.195 13.319 15.158 1.00 0.00 H new ATOM 515 N LEU A 44 9.066 8.955 17.394 1.00 0.00 N ATOM 516 CA LEU A 44 8.843 7.511 17.545 1.00 0.00 C ATOM 517 C LEU A 44 9.123 6.984 18.961 1.00 0.00 C ATOM 518 O LEU A 44 8.581 5.937 19.301 1.00 0.00 O ATOM 519 CB LEU A 44 9.707 6.749 16.511 1.00 0.00 C ATOM 520 CG LEU A 44 9.394 7.068 15.034 1.00 0.00 C ATOM 521 CD1 LEU A 44 10.069 6.116 14.063 1.00 0.00 C ATOM 522 CD2 LEU A 44 7.896 7.037 14.714 1.00 0.00 C ATOM 0 H LEU A 44 10.053 9.207 17.449 1.00 0.00 H new ATOM 0 HA LEU A 44 7.782 7.335 17.366 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.756 6.975 16.701 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.577 5.679 16.671 1.00 0.00 H new ATOM 0 HG LEU A 44 9.784 8.078 14.906 1.00 0.00 H new ATOM 0 HD11 LEU A 44 9.809 6.394 13.041 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.150 6.172 14.191 1.00 0.00 H new ATOM 0 HD13 LEU A 44 9.733 5.098 14.259 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.744 7.270 13.660 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.499 6.045 14.927 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.378 7.775 15.327 1.00 0.00 H new ATOM 534 N GLY A 45 9.969 7.648 19.757 1.00 0.00 N ATOM 535 CA GLY A 45 10.494 7.130 21.028 1.00 0.00 C ATOM 536 C GLY A 45 11.649 6.142 20.827 1.00 0.00 C ATOM 537 O GLY A 45 12.077 5.500 21.784 1.00 0.00 O ATOM 0 H GLY A 45 10.316 8.580 19.532 1.00 0.00 H new ATOM 0 HA2 GLY A 45 10.835 7.963 21.643 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.690 6.638 21.576 1.00 0.00 H new ATOM 541 N LEU A 46 12.127 5.980 19.584 1.00 0.00 N ATOM 542 CA LEU A 46 13.088 4.941 19.195 1.00 0.00 C ATOM 543 C LEU A 46 14.456 5.537 18.845 1.00 0.00 C ATOM 544 O LEU A 46 14.553 6.644 18.322 1.00 0.00 O ATOM 545 CB LEU A 46 12.512 4.129 18.020 1.00 0.00 C ATOM 546 CG LEU A 46 11.182 3.407 18.334 1.00 0.00 C ATOM 547 CD1 LEU A 46 10.703 2.685 17.070 1.00 0.00 C ATOM 548 CD2 LEU A 46 11.312 2.398 19.486 1.00 0.00 C ATOM 0 H LEU A 46 11.850 6.580 18.807 1.00 0.00 H new ATOM 0 HA LEU A 46 13.247 4.276 20.044 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.357 4.798 17.173 1.00 0.00 H new ATOM 0 HB3 LEU A 46 13.249 3.388 17.710 1.00 0.00 H new ATOM 0 HG LEU A 46 10.461 4.160 18.651 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.765 2.171 17.278 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.550 3.412 16.272 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.454 1.958 16.760 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.348 1.921 19.663 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.049 1.639 19.224 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.631 2.917 20.390 1.00 0.00 H new ATOM 560 N THR A 47 15.521 4.766 19.101 1.00 0.00 N ATOM 561 CA THR A 47 16.913 5.230 18.990 1.00 0.00 C ATOM 562 C THR A 47 17.258 5.737 17.595 1.00 0.00 C ATOM 563 O THR A 47 16.778 5.214 16.584 1.00 0.00 O ATOM 564 CB THR A 47 17.911 4.181 19.518 1.00 0.00 C ATOM 565 OG1 THR A 47 19.231 4.599 19.250 1.00 0.00 O ATOM 566 CG2 THR A 47 17.738 2.795 18.901 1.00 0.00 C ATOM 0 H THR A 47 15.441 3.792 19.394 1.00 0.00 H new ATOM 0 HA THR A 47 17.007 6.099 19.642 1.00 0.00 H new ATOM 0 HB THR A 47 17.711 4.102 20.587 1.00 0.00 H new ATOM 0 HG1 THR A 47 19.861 3.930 19.589 1.00 0.00 H new ATOM 0 HG21 THR A 47 18.477 2.114 19.324 1.00 0.00 H new ATOM 0 HG22 THR A 47 16.736 2.423 19.117 1.00 0.00 H new ATOM 0 HG23 THR A 47 17.877 2.857 17.822 1.00 0.00 H new ATOM 574 N ARG A 48 18.187 6.701 17.556 1.00 0.00 N ATOM 575 CA ARG A 48 18.809 7.251 16.345 1.00 0.00 C ATOM 576 C ARG A 48 19.297 6.140 15.405 1.00 0.00 C ATOM 577 O ARG A 48 19.174 6.262 14.186 1.00 0.00 O ATOM 578 CB ARG A 48 20.017 8.119 16.741 1.00 0.00 C ATOM 579 CG ARG A 48 19.691 9.268 17.715 1.00 0.00 C ATOM 580 CD ARG A 48 20.897 10.098 18.203 1.00 0.00 C ATOM 581 NE ARG A 48 22.207 9.412 18.102 1.00 0.00 N ATOM 582 CZ ARG A 48 22.734 8.535 18.956 1.00 0.00 C ATOM 583 NH1 ARG A 48 22.133 8.152 20.055 1.00 0.00 N ATOM 584 NH2 ARG A 48 23.917 8.011 18.710 1.00 0.00 N ATOM 0 H ARG A 48 18.541 7.138 18.407 1.00 0.00 H new ATOM 0 HA ARG A 48 18.056 7.843 15.825 1.00 0.00 H new ATOM 0 HB2 ARG A 48 20.774 7.479 17.195 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.457 8.541 15.837 1.00 0.00 H new ATOM 0 HG2 ARG A 48 18.984 9.941 17.230 1.00 0.00 H new ATOM 0 HG3 ARG A 48 19.186 8.849 18.586 1.00 0.00 H new ATOM 0 HD2 ARG A 48 20.941 11.022 17.626 1.00 0.00 H new ATOM 0 HD3 ARG A 48 20.729 10.379 19.243 1.00 0.00 H new ATOM 0 HE ARG A 48 22.771 9.638 17.283 1.00 0.00 H new ATOM 0 HH11 ARG A 48 21.215 8.529 20.292 1.00 0.00 H new ATOM 0 HH12 ARG A 48 22.583 7.477 20.674 1.00 0.00 H new ATOM 0 HH21 ARG A 48 24.427 8.277 17.868 1.00 0.00 H new ATOM 0 HH22 ARG A 48 24.323 7.340 19.362 1.00 0.00 H new ATOM 598 N SER A 49 19.818 5.043 15.955 1.00 0.00 N ATOM 599 CA SER A 49 20.246 3.860 15.196 1.00 0.00 C ATOM 600 C SER A 49 19.074 3.235 14.426 1.00 0.00 C ATOM 601 O SER A 49 19.084 3.200 13.200 1.00 0.00 O ATOM 602 CB SER A 49 20.863 2.836 16.161 1.00 0.00 C ATOM 603 OG SER A 49 21.875 3.447 16.947 1.00 0.00 O ATOM 0 H SER A 49 19.959 4.947 16.961 1.00 0.00 H new ATOM 0 HA SER A 49 20.991 4.166 14.462 1.00 0.00 H new ATOM 0 HB2 SER A 49 20.089 2.424 16.809 1.00 0.00 H new ATOM 0 HB3 SER A 49 21.284 2.003 15.598 1.00 0.00 H new ATOM 0 HG SER A 49 22.259 2.784 17.559 1.00 0.00 H new ATOM 609 N ASN A 50 18.027 2.805 15.128 1.00 0.00 N ATOM 610 CA ASN A 50 16.887 2.114 14.522 1.00 0.00 C ATOM 611 C ASN A 50 16.081 3.066 13.618 1.00 0.00 C ATOM 612 O ASN A 50 15.602 2.641 12.567 1.00 0.00 O ATOM 613 CB ASN A 50 16.015 1.491 15.627 1.00 0.00 C ATOM 614 CG ASN A 50 16.737 0.448 16.488 1.00 0.00 C ATOM 615 OD1 ASN A 50 17.953 0.302 16.465 1.00 0.00 O ATOM 616 ND2 ASN A 50 16.007 -0.272 17.316 1.00 0.00 N ATOM 0 H ASN A 50 17.944 2.926 16.137 1.00 0.00 H new ATOM 0 HA ASN A 50 17.252 1.310 13.883 1.00 0.00 H new ATOM 0 HB2 ASN A 50 15.646 2.287 16.274 1.00 0.00 H new ATOM 0 HB3 ASN A 50 15.144 1.025 15.167 1.00 0.00 H new ATOM 0 HD21 ASN A 50 16.455 -0.948 17.935 1.00 0.00 H new ATOM 0 HD22 ASN A 50 14.994 -0.153 17.338 1.00 0.00 H new ATOM 623 N VAL A 51 15.982 4.356 13.973 1.00 0.00 N ATOM 624 CA VAL A 51 15.439 5.398 13.093 1.00 0.00 C ATOM 625 C VAL A 51 16.214 5.467 11.772 1.00 0.00 C ATOM 626 O VAL A 51 15.610 5.372 10.707 1.00 0.00 O ATOM 627 CB VAL A 51 15.421 6.767 13.818 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.463 7.989 12.885 1.00 0.00 C ATOM 629 CG2 VAL A 51 14.179 6.866 14.716 1.00 0.00 C ATOM 0 H VAL A 51 16.278 4.706 14.884 1.00 0.00 H new ATOM 0 HA VAL A 51 14.409 5.137 12.848 1.00 0.00 H new ATOM 0 HB VAL A 51 16.340 6.796 14.403 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.447 8.902 13.480 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.375 7.961 12.289 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.597 7.972 12.224 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.172 7.831 15.223 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.281 6.770 14.106 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.201 6.067 15.457 1.00 0.00 H new ATOM 639 N SER A 52 17.545 5.591 11.809 1.00 0.00 N ATOM 640 CA SER A 52 18.343 5.717 10.579 1.00 0.00 C ATOM 641 C SER A 52 18.476 4.438 9.756 1.00 0.00 C ATOM 642 O SER A 52 18.573 4.546 8.533 1.00 0.00 O ATOM 643 CB SER A 52 19.729 6.316 10.825 1.00 0.00 C ATOM 644 OG SER A 52 20.423 5.717 11.903 1.00 0.00 O ATOM 0 H SER A 52 18.092 5.607 12.670 1.00 0.00 H new ATOM 0 HA SER A 52 17.754 6.412 9.981 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.326 6.214 9.918 1.00 0.00 H new ATOM 0 HB3 SER A 52 19.625 7.383 11.019 1.00 0.00 H new ATOM 0 HG SER A 52 20.210 6.192 12.733 1.00 0.00 H new ATOM 650 N ASN A 53 18.385 3.255 10.372 1.00 0.00 N ATOM 651 CA ASN A 53 18.380 1.961 9.682 1.00 0.00 C ATOM 652 C ASN A 53 17.363 1.944 8.524 1.00 0.00 C ATOM 653 O ASN A 53 17.688 1.680 7.364 1.00 0.00 O ATOM 654 CB ASN A 53 18.101 0.874 10.730 1.00 0.00 C ATOM 655 CG ASN A 53 18.359 -0.524 10.190 1.00 0.00 C ATOM 656 OD1 ASN A 53 17.638 -1.026 9.346 1.00 0.00 O ATOM 657 ND2 ASN A 53 19.392 -1.192 10.665 1.00 0.00 N ATOM 0 H ASN A 53 18.311 3.168 11.386 1.00 0.00 H new ATOM 0 HA ASN A 53 19.348 1.772 9.218 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.728 1.045 11.605 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.065 0.948 11.061 1.00 0.00 H new ATOM 0 HD21 ASN A 53 19.590 -2.133 10.326 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.993 -0.767 11.372 1.00 0.00 H new ATOM 664 N HIS A 54 16.144 2.392 8.815 1.00 0.00 N ATOM 665 CA HIS A 54 15.076 2.505 7.831 1.00 0.00 C ATOM 666 C HIS A 54 15.170 3.740 6.913 1.00 0.00 C ATOM 667 O HIS A 54 14.559 3.702 5.846 1.00 0.00 O ATOM 668 CB HIS A 54 13.739 2.449 8.577 1.00 0.00 C ATOM 669 CG HIS A 54 13.340 1.058 9.018 1.00 0.00 C ATOM 670 ND1 HIS A 54 12.980 -0.006 8.214 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.187 0.635 10.312 1.00 0.00 C ATOM 672 CE1 HIS A 54 12.561 -1.006 9.007 1.00 0.00 C ATOM 673 NE2 HIS A 54 12.647 -0.649 10.299 1.00 0.00 N ATOM 0 H HIS A 54 15.869 2.689 9.751 1.00 0.00 H new ATOM 0 HA HIS A 54 15.172 1.668 7.140 1.00 0.00 H new ATOM 0 HB2 HIS A 54 13.796 3.095 9.453 1.00 0.00 H new ATOM 0 HB3 HIS A 54 12.958 2.853 7.933 1.00 0.00 H new ATOM 0 HD1 HIS A 54 13.025 -0.028 7.195 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.442 1.202 11.195 1.00 0.00 H new ATOM 0 HE1 HIS A 54 12.205 -1.963 8.655 1.00 0.00 H new ATOM 681 N LEU A 55 15.933 4.799 7.250 1.00 0.00 N ATOM 682 CA LEU A 55 16.164 5.924 6.320 1.00 0.00 C ATOM 683 C LEU A 55 17.068 5.526 5.150 1.00 0.00 C ATOM 684 O LEU A 55 17.050 6.197 4.124 1.00 0.00 O ATOM 685 CB LEU A 55 16.758 7.184 6.982 1.00 0.00 C ATOM 686 CG LEU A 55 15.939 7.766 8.148 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.749 8.858 8.854 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.610 8.357 7.668 1.00 0.00 C ATOM 0 H LEU A 55 16.397 4.899 8.153 1.00 0.00 H new ATOM 0 HA LEU A 55 15.165 6.173 5.961 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.757 6.946 7.346 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.872 7.955 6.220 1.00 0.00 H new ATOM 0 HG LEU A 55 15.721 6.951 8.838 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.166 9.268 9.679 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.675 8.432 9.241 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.983 9.653 8.146 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.061 8.758 8.520 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.804 9.157 6.953 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.017 7.578 7.188 1.00 0.00 H new ATOM 700 N SER A 56 17.872 4.472 5.271 1.00 0.00 N ATOM 701 CA SER A 56 18.696 3.996 4.152 1.00 0.00 C ATOM 702 C SER A 56 17.814 3.520 2.984 1.00 0.00 C ATOM 703 O SER A 56 17.881 4.065 1.880 1.00 0.00 O ATOM 704 CB SER A 56 19.631 2.883 4.645 1.00 0.00 C ATOM 705 OG SER A 56 20.673 2.691 3.711 1.00 0.00 O ATOM 0 H SER A 56 17.973 3.929 6.129 1.00 0.00 H new ATOM 0 HA SER A 56 19.304 4.819 3.777 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.045 3.147 5.618 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.072 1.957 4.777 1.00 0.00 H new ATOM 0 HG SER A 56 21.270 1.981 4.028 1.00 0.00 H new ATOM 711 N CYS A 57 16.872 2.613 3.267 1.00 0.00 N ATOM 712 CA CYS A 57 15.925 2.035 2.303 1.00 0.00 C ATOM 713 C CYS A 57 14.733 2.991 1.986 1.00 0.00 C ATOM 714 O CYS A 57 13.709 2.600 1.421 1.00 0.00 O ATOM 715 CB CYS A 57 15.586 0.653 2.892 1.00 0.00 C ATOM 716 SG CYS A 57 14.548 -0.517 1.944 1.00 0.00 S ATOM 0 H CYS A 57 16.742 2.246 4.210 1.00 0.00 H new ATOM 0 HA CYS A 57 16.333 1.905 1.301 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.530 0.151 3.103 1.00 0.00 H new ATOM 0 HB3 CYS A 57 15.093 0.821 3.849 1.00 0.00 H new ATOM 0 HG CYS A 57 14.567 -1.681 2.522 1.00 0.00 H new ATOM 721 N LEU A 58 14.866 4.255 2.398 1.00 0.00 N ATOM 722 CA LEU A 58 13.940 5.360 2.150 1.00 0.00 C ATOM 723 C LEU A 58 14.509 6.339 1.120 1.00 0.00 C ATOM 724 O LEU A 58 13.843 6.666 0.138 1.00 0.00 O ATOM 725 CB LEU A 58 13.685 6.055 3.503 1.00 0.00 C ATOM 726 CG LEU A 58 12.207 6.187 3.887 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.634 4.809 4.203 1.00 0.00 C ATOM 728 CD2 LEU A 58 12.062 7.068 5.129 1.00 0.00 C ATOM 0 H LEU A 58 15.673 4.550 2.947 1.00 0.00 H new ATOM 0 HA LEU A 58 13.004 4.987 1.733 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.201 5.498 4.285 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.129 7.050 3.474 1.00 0.00 H new ATOM 0 HG LEU A 58 11.670 6.636 3.052 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.583 4.906 4.476 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.724 4.168 3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 58 12.185 4.367 5.033 1.00 0.00 H new ATOM 0 HD21 LEU A 58 11.008 7.155 5.393 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.608 6.619 5.959 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.467 8.059 4.922 1.00 0.00 H new ATOM 740 N ARG A 59 15.738 6.801 1.360 1.00 0.00 N ATOM 741 CA ARG A 59 16.364 7.882 0.594 1.00 0.00 C ATOM 742 C ARG A 59 16.977 7.387 -0.724 1.00 0.00 C ATOM 743 O ARG A 59 17.089 8.159 -1.671 1.00 0.00 O ATOM 744 CB ARG A 59 17.397 8.584 1.476 1.00 0.00 C ATOM 745 CG ARG A 59 16.758 9.143 2.765 1.00 0.00 C ATOM 746 CD ARG A 59 17.766 9.845 3.646 1.00 0.00 C ATOM 747 NE ARG A 59 18.846 8.951 4.106 1.00 0.00 N ATOM 748 CZ ARG A 59 20.137 9.054 3.799 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.587 9.951 2.941 1.00 0.00 N ATOM 750 NH2 ARG A 59 21.006 8.248 4.366 1.00 0.00 N ATOM 0 H ARG A 59 16.334 6.431 2.100 1.00 0.00 H new ATOM 0 HA ARG A 59 15.593 8.597 0.307 1.00 0.00 H new ATOM 0 HB2 ARG A 59 18.190 7.883 1.737 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.861 9.397 0.917 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.962 9.839 2.501 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.297 8.328 3.322 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.201 10.680 3.097 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.254 10.264 4.512 1.00 0.00 H new ATOM 0 HE ARG A 59 18.578 8.180 4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.938 10.595 2.489 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.584 10.000 2.730 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.690 7.548 5.037 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.997 8.322 4.135 1.00 0.00 H new ATOM 764 N GLY A 60 17.356 6.103 -0.794 1.00 0.00 N ATOM 765 CA GLY A 60 17.921 5.474 -2.002 1.00 0.00 C ATOM 766 C GLY A 60 16.873 4.797 -2.892 1.00 0.00 C ATOM 767 O GLY A 60 17.024 4.748 -4.113 1.00 0.00 O ATOM 0 H GLY A 60 17.279 5.462 -0.005 1.00 0.00 H new ATOM 0 HA2 GLY A 60 18.444 6.232 -2.585 1.00 0.00 H new ATOM 0 HA3 GLY A 60 18.663 4.734 -1.702 1.00 0.00 H new ATOM 771 N CYS A 61 15.809 4.286 -2.266 1.00 0.00 N ATOM 772 CA CYS A 61 14.626 3.727 -2.904 1.00 0.00 C ATOM 773 C CYS A 61 13.579 4.808 -3.341 1.00 0.00 C ATOM 774 O CYS A 61 12.572 4.468 -3.960 1.00 0.00 O ATOM 775 CB CYS A 61 14.088 2.673 -1.915 1.00 0.00 C ATOM 776 SG CYS A 61 14.972 1.077 -1.854 1.00 0.00 S ATOM 0 H CYS A 61 15.752 4.252 -1.248 1.00 0.00 H new ATOM 0 HA CYS A 61 14.870 3.261 -3.859 1.00 0.00 H new ATOM 0 HB2 CYS A 61 14.101 3.107 -0.915 1.00 0.00 H new ATOM 0 HB3 CYS A 61 13.045 2.475 -2.163 1.00 0.00 H new ATOM 0 HG CYS A 61 14.406 0.301 -0.978 1.00 0.00 H new ATOM 781 N GLY A 62 13.803 6.087 -2.988 1.00 0.00 N ATOM 782 CA GLY A 62 13.065 7.278 -3.458 1.00 0.00 C ATOM 783 C GLY A 62 11.835 7.701 -2.640 1.00 0.00 C ATOM 784 O GLY A 62 11.267 8.758 -2.886 1.00 0.00 O ATOM 0 H GLY A 62 14.544 6.333 -2.331 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.759 8.118 -3.486 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.744 7.095 -4.484 1.00 0.00 H new ATOM 788 N LEU A 63 11.454 6.945 -1.609 1.00 0.00 N ATOM 789 CA LEU A 63 10.325 7.226 -0.695 1.00 0.00 C ATOM 790 C LEU A 63 10.408 8.591 0.008 1.00 0.00 C ATOM 791 O LEU A 63 9.389 9.126 0.449 1.00 0.00 O ATOM 792 CB LEU A 63 10.286 6.105 0.331 1.00 0.00 C ATOM 793 CG LEU A 63 10.083 4.726 -0.319 1.00 0.00 C ATOM 794 CD1 LEU A 63 10.095 3.737 0.823 1.00 0.00 C ATOM 795 CD2 LEU A 63 8.760 4.588 -1.077 1.00 0.00 C ATOM 0 H LEU A 63 11.940 6.080 -1.370 1.00 0.00 H new ATOM 0 HA LEU A 63 9.412 7.272 -1.288 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.216 6.103 0.899 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.480 6.292 1.040 1.00 0.00 H new ATOM 0 HG LEU A 63 10.867 4.562 -1.059 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.955 2.729 0.433 1.00 0.00 H new ATOM 0 HD12 LEU A 63 11.050 3.795 1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.288 3.973 1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.690 3.589 -1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.929 4.747 -0.390 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.718 5.330 -1.874 1.00 0.00 H new ATOM 807 N VAL A 64 11.615 9.141 0.102 1.00 0.00 N ATOM 808 CA VAL A 64 11.940 10.445 0.687 1.00 0.00 C ATOM 809 C VAL A 64 13.066 11.141 -0.069 1.00 0.00 C ATOM 810 O VAL A 64 13.975 10.495 -0.584 1.00 0.00 O ATOM 811 CB VAL A 64 12.386 10.330 2.156 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.200 10.150 3.100 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.342 9.175 2.357 1.00 0.00 C ATOM 0 H VAL A 64 12.445 8.662 -0.248 1.00 0.00 H new ATOM 0 HA VAL A 64 11.019 11.025 0.619 1.00 0.00 H new ATOM 0 HB VAL A 64 12.891 11.267 2.392 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.560 10.073 4.126 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.532 11.007 3.013 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.660 9.241 2.836 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.636 9.124 3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.853 8.244 2.072 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.227 9.324 1.739 1.00 0.00 H new ATOM 823 N VAL A 65 13.010 12.468 -0.056 1.00 0.00 N ATOM 824 CA VAL A 65 13.999 13.391 -0.636 1.00 0.00 C ATOM 825 C VAL A 65 14.643 14.210 0.484 1.00 0.00 C ATOM 826 O VAL A 65 13.977 14.573 1.456 1.00 0.00 O ATOM 827 CB VAL A 65 13.331 14.316 -1.681 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.316 15.329 -2.289 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.714 13.467 -2.807 1.00 0.00 C ATOM 0 H VAL A 65 12.233 12.963 0.382 1.00 0.00 H new ATOM 0 HA VAL A 65 14.772 12.817 -1.147 1.00 0.00 H new ATOM 0 HB VAL A 65 12.558 14.881 -1.161 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.795 15.952 -3.015 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.725 15.958 -1.498 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.127 14.795 -2.785 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.245 14.122 -3.541 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.495 12.881 -3.291 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.964 12.796 -2.388 1.00 0.00 H new ATOM 839 N ALA A 66 15.945 14.493 0.361 1.00 0.00 N ATOM 840 CA ALA A 66 16.701 15.297 1.321 1.00 0.00 C ATOM 841 C ALA A 66 16.865 16.754 0.849 1.00 0.00 C ATOM 842 O ALA A 66 17.433 16.989 -0.221 1.00 0.00 O ATOM 843 CB ALA A 66 18.047 14.603 1.570 1.00 0.00 C ATOM 0 H ALA A 66 16.510 14.163 -0.422 1.00 0.00 H new ATOM 0 HA ALA A 66 16.153 15.363 2.261 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.630 15.185 2.284 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.873 13.605 1.972 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.596 14.526 0.631 1.00 0.00 H new ATOM 849 N THR A 67 16.417 17.722 1.669 1.00 0.00 N ATOM 850 CA THR A 67 16.457 19.168 1.363 1.00 0.00 C ATOM 851 C THR A 67 17.194 19.891 2.462 1.00 0.00 C ATOM 852 O THR A 67 17.289 19.373 3.565 1.00 0.00 O ATOM 853 CB THR A 67 15.057 19.819 1.200 1.00 0.00 C ATOM 854 OG1 THR A 67 14.520 20.358 2.396 1.00 0.00 O ATOM 855 CG2 THR A 67 13.995 18.868 0.658 1.00 0.00 C ATOM 0 H THR A 67 16.009 17.519 2.581 1.00 0.00 H new ATOM 0 HA THR A 67 16.965 19.259 0.403 1.00 0.00 H new ATOM 0 HB THR A 67 15.266 20.616 0.486 1.00 0.00 H new ATOM 0 HG1 THR A 67 13.942 21.120 2.181 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.045 19.395 0.572 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.299 18.505 -0.324 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.882 18.024 1.338 1.00 0.00 H new ATOM 863 N TYR A 68 17.635 21.114 2.196 1.00 0.00 N ATOM 864 CA TYR A 68 18.060 22.027 3.257 1.00 0.00 C ATOM 865 C TYR A 68 16.825 22.859 3.654 1.00 0.00 C ATOM 866 O TYR A 68 16.157 23.387 2.763 1.00 0.00 O ATOM 867 CB TYR A 68 19.220 22.885 2.736 1.00 0.00 C ATOM 868 CG TYR A 68 19.851 23.766 3.792 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.548 23.177 4.864 1.00 0.00 C ATOM 870 CD2 TYR A 68 19.742 25.167 3.713 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.113 23.979 5.871 1.00 0.00 C ATOM 872 CE2 TYR A 68 20.321 25.975 4.708 1.00 0.00 C ATOM 873 CZ TYR A 68 20.998 25.385 5.798 1.00 0.00 C ATOM 874 OH TYR A 68 21.526 26.162 6.784 1.00 0.00 O ATOM 0 H TYR A 68 17.709 21.500 1.255 1.00 0.00 H new ATOM 0 HA TYR A 68 18.428 21.507 4.141 1.00 0.00 H new ATOM 0 HB2 TYR A 68 19.985 22.230 2.318 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.858 23.513 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 68 20.649 22.103 4.913 1.00 0.00 H new ATOM 0 HD2 TYR A 68 19.214 25.622 2.888 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.634 23.521 6.699 1.00 0.00 H new ATOM 0 HE2 TYR A 68 20.248 27.050 4.638 1.00 0.00 H new ATOM 0 HH TYR A 68 21.684 25.616 7.582 1.00 0.00 H new ATOM 884 N GLU A 69 16.446 22.916 4.934 1.00 0.00 N ATOM 885 CA GLU A 69 15.272 23.681 5.391 1.00 0.00 C ATOM 886 C GLU A 69 15.558 25.138 5.802 1.00 0.00 C ATOM 887 O GLU A 69 14.639 25.860 6.182 1.00 0.00 O ATOM 888 CB GLU A 69 14.444 22.862 6.395 1.00 0.00 C ATOM 889 CG GLU A 69 15.104 22.189 7.609 1.00 0.00 C ATOM 890 CD GLU A 69 15.580 23.168 8.674 1.00 0.00 C ATOM 891 OE1 GLU A 69 16.503 23.947 8.354 1.00 0.00 O ATOM 892 OE2 GLU A 69 15.067 23.113 9.810 1.00 0.00 O ATOM 0 H GLU A 69 16.941 22.435 5.685 1.00 0.00 H new ATOM 0 HA GLU A 69 14.637 23.833 4.518 1.00 0.00 H new ATOM 0 HB2 GLU A 69 13.667 23.522 6.780 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.943 22.077 5.829 1.00 0.00 H new ATOM 0 HG2 GLU A 69 14.393 21.495 8.059 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.954 21.598 7.267 1.00 0.00 H new ATOM 899 N GLY A 70 16.803 25.602 5.634 1.00 0.00 N ATOM 900 CA GLY A 70 17.231 26.986 5.885 1.00 0.00 C ATOM 901 C GLY A 70 18.126 27.129 7.117 1.00 0.00 C ATOM 902 O GLY A 70 18.796 28.154 7.261 1.00 0.00 O ATOM 0 H GLY A 70 17.565 25.006 5.309 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.766 27.358 5.011 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.349 27.615 6.010 1.00 0.00 H new ATOM 906 N ARG A 71 18.148 26.106 7.979 1.00 0.00 N ATOM 907 CA ARG A 71 19.024 25.917 9.140 1.00 0.00 C ATOM 908 C ARG A 71 19.816 24.605 9.043 1.00 0.00 C ATOM 909 O ARG A 71 21.021 24.601 9.299 1.00 0.00 O ATOM 910 CB ARG A 71 18.141 25.890 10.411 1.00 0.00 C ATOM 911 CG ARG A 71 18.902 26.091 11.736 1.00 0.00 C ATOM 912 CD ARG A 71 19.043 27.558 12.176 1.00 0.00 C ATOM 913 NE ARG A 71 19.911 28.341 11.277 1.00 0.00 N ATOM 914 CZ ARG A 71 19.527 29.018 10.199 1.00 0.00 C ATOM 915 NH1 ARG A 71 18.260 29.195 9.891 1.00 0.00 N ATOM 916 NH2 ARG A 71 20.430 29.483 9.365 1.00 0.00 N ATOM 0 H ARG A 71 17.500 25.325 7.873 1.00 0.00 H new ATOM 0 HA ARG A 71 19.743 26.736 9.177 1.00 0.00 H new ATOM 0 HB2 ARG A 71 17.381 26.667 10.324 1.00 0.00 H new ATOM 0 HB3 ARG A 71 17.617 24.935 10.451 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.389 25.537 12.522 1.00 0.00 H new ATOM 0 HG3 ARG A 71 19.897 25.657 11.638 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.056 28.018 12.213 1.00 0.00 H new ATOM 0 HD3 ARG A 71 19.449 27.592 13.187 1.00 0.00 H new ATOM 0 HE ARG A 71 20.905 28.366 11.505 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.531 28.806 10.489 1.00 0.00 H new ATOM 0 HH12 ARG A 71 18.007 29.721 9.054 1.00 0.00 H new ATOM 0 HH21 ARG A 71 21.421 29.324 9.546 1.00 0.00 H new ATOM 0 HH22 ARG A 71 20.140 30.003 8.537 1.00 0.00 H new ATOM 930 N GLN A 72 19.162 23.509 8.674 1.00 0.00 N ATOM 931 CA GLN A 72 19.640 22.138 8.728 1.00 0.00 C ATOM 932 C GLN A 72 19.209 21.355 7.472 1.00 0.00 C ATOM 933 O GLN A 72 18.406 21.838 6.675 1.00 0.00 O ATOM 934 CB GLN A 72 19.045 21.535 10.026 1.00 0.00 C ATOM 935 CG GLN A 72 19.615 20.177 10.463 1.00 0.00 C ATOM 936 CD GLN A 72 21.125 20.161 10.315 1.00 0.00 C ATOM 937 OE1 GLN A 72 21.660 19.738 9.300 1.00 0.00 O ATOM 938 NE2 GLN A 72 21.849 20.779 11.213 1.00 0.00 N ATOM 0 H GLN A 72 18.214 23.563 8.302 1.00 0.00 H new ATOM 0 HA GLN A 72 20.729 22.087 8.744 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.197 22.248 10.837 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.968 21.428 9.893 1.00 0.00 H new ATOM 0 HG2 GLN A 72 19.343 19.979 11.500 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.176 19.381 9.861 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.412 21.136 12.063 1.00 0.00 H new ATOM 0 HE22 GLN A 72 22.850 20.904 11.063 1.00 0.00 H new ATOM 947 N VAL A 73 19.755 20.151 7.266 1.00 0.00 N ATOM 948 CA VAL A 73 19.241 19.197 6.261 1.00 0.00 C ATOM 949 C VAL A 73 18.065 18.407 6.846 1.00 0.00 C ATOM 950 O VAL A 73 18.105 18.070 8.025 1.00 0.00 O ATOM 951 CB VAL A 73 20.346 18.241 5.754 1.00 0.00 C ATOM 952 CG1 VAL A 73 20.844 17.212 6.783 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.922 17.479 4.485 1.00 0.00 C ATOM 0 H VAL A 73 20.562 19.806 7.786 1.00 0.00 H new ATOM 0 HA VAL A 73 18.895 19.769 5.400 1.00 0.00 H new ATOM 0 HB VAL A 73 21.173 18.918 5.540 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.617 16.590 6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.257 17.732 7.647 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.012 16.583 7.101 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.731 16.821 4.168 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.033 16.885 4.697 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.701 18.191 3.690 1.00 0.00 H new ATOM 963 N ARG A 74 17.055 18.059 6.038 1.00 0.00 N ATOM 964 CA ARG A 74 15.876 17.297 6.464 1.00 0.00 C ATOM 965 C ARG A 74 15.536 16.184 5.482 1.00 0.00 C ATOM 966 O ARG A 74 16.068 16.145 4.376 1.00 0.00 O ATOM 967 CB ARG A 74 14.679 18.244 6.620 1.00 0.00 C ATOM 968 CG ARG A 74 14.028 18.696 5.302 1.00 0.00 C ATOM 969 CD ARG A 74 12.858 19.594 5.653 1.00 0.00 C ATOM 970 NE ARG A 74 12.309 20.298 4.487 1.00 0.00 N ATOM 971 CZ ARG A 74 11.274 21.130 4.524 1.00 0.00 C ATOM 972 NH1 ARG A 74 10.570 21.310 5.627 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.940 21.794 3.437 1.00 0.00 N ATOM 0 H ARG A 74 17.035 18.305 5.048 1.00 0.00 H new ATOM 0 HA ARG A 74 16.106 16.831 7.422 1.00 0.00 H new ATOM 0 HB2 ARG A 74 13.922 17.751 7.230 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.004 19.128 7.168 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.748 19.230 4.683 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.690 17.834 4.727 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.072 18.995 6.113 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.177 20.325 6.396 1.00 0.00 H new ATOM 0 HE ARG A 74 12.754 20.137 3.584 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.817 20.804 6.478 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.780 21.955 5.628 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.474 21.667 2.577 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.147 22.435 3.455 1.00 0.00 H new ATOM 987 N TYR A 75 14.572 15.336 5.841 1.00 0.00 N ATOM 988 CA TYR A 75 14.014 14.296 4.970 1.00 0.00 C ATOM 989 C TYR A 75 12.497 14.470 4.823 1.00 0.00 C ATOM 990 O TYR A 75 11.794 14.548 5.824 1.00 0.00 O ATOM 991 CB TYR A 75 14.357 12.929 5.574 1.00 0.00 C ATOM 992 CG TYR A 75 15.846 12.687 5.757 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.758 13.008 4.730 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.327 12.172 6.976 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.142 12.851 4.928 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.708 11.986 7.167 1.00 0.00 C ATOM 997 CZ TYR A 75 18.621 12.335 6.149 1.00 0.00 C ATOM 998 OH TYR A 75 19.959 12.164 6.332 1.00 0.00 O ATOM 0 H TYR A 75 14.146 15.352 6.768 1.00 0.00 H new ATOM 0 HA TYR A 75 14.445 14.373 3.972 1.00 0.00 H new ATOM 0 HB2 TYR A 75 13.863 12.837 6.541 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.949 12.148 4.933 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.391 13.377 3.784 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.635 11.919 7.765 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.835 13.125 4.147 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.071 11.574 8.097 1.00 0.00 H new ATOM 0 HH TYR A 75 20.449 12.831 5.807 1.00 0.00 H new ATOM 1008 N ALA A 76 12.004 14.575 3.591 1.00 0.00 N ATOM 1009 CA ALA A 76 10.595 14.805 3.264 1.00 0.00 C ATOM 1010 C ALA A 76 10.065 13.704 2.346 1.00 0.00 C ATOM 1011 O ALA A 76 10.809 13.247 1.479 1.00 0.00 O ATOM 1012 CB ALA A 76 10.478 16.182 2.595 1.00 0.00 C ATOM 0 H ALA A 76 12.594 14.500 2.762 1.00 0.00 H new ATOM 0 HA ALA A 76 9.993 14.783 4.172 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.436 16.376 2.342 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.834 16.951 3.280 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.081 16.198 1.687 1.00 0.00 H new ATOM 1018 N LEU A 77 8.804 13.302 2.538 1.00 0.00 N ATOM 1019 CA LEU A 77 8.117 12.294 1.721 1.00 0.00 C ATOM 1020 C LEU A 77 8.211 12.624 0.223 1.00 0.00 C ATOM 1021 O LEU A 77 8.136 13.798 -0.124 1.00 0.00 O ATOM 1022 CB LEU A 77 6.639 12.210 2.167 1.00 0.00 C ATOM 1023 CG LEU A 77 6.186 10.777 2.463 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.813 10.218 3.731 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.678 10.777 2.681 1.00 0.00 C ATOM 0 H LEU A 77 8.218 13.677 3.284 1.00 0.00 H new ATOM 0 HA LEU A 77 8.603 11.330 1.869 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.498 12.821 3.058 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.005 12.632 1.387 1.00 0.00 H new ATOM 0 HG LEU A 77 6.491 10.163 1.616 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.458 9.200 3.894 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.898 10.212 3.628 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.532 10.841 4.581 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.341 9.762 2.893 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.432 11.424 3.523 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.181 11.144 1.783 1.00 0.00 H new ATOM 1037 N ALA A 78 8.340 11.607 -0.638 1.00 0.00 N ATOM 1038 CA ALA A 78 8.587 11.737 -2.083 1.00 0.00 C ATOM 1039 C ALA A 78 7.722 12.775 -2.823 1.00 0.00 C ATOM 1040 O ALA A 78 8.215 13.465 -3.707 1.00 0.00 O ATOM 1041 CB ALA A 78 8.361 10.353 -2.705 1.00 0.00 C ATOM 0 H ALA A 78 8.273 10.634 -0.338 1.00 0.00 H new ATOM 0 HA ALA A 78 9.607 12.105 -2.195 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.534 10.404 -3.780 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.052 9.637 -2.260 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.336 10.033 -2.518 1.00 0.00 H new ATOM 1047 N ASP A 79 6.442 12.871 -2.454 1.00 0.00 N ATOM 1048 CA ASP A 79 5.418 13.716 -3.072 1.00 0.00 C ATOM 1049 C ASP A 79 4.098 13.596 -2.286 1.00 0.00 C ATOM 1050 O ASP A 79 3.895 12.694 -1.461 1.00 0.00 O ATOM 1051 CB ASP A 79 5.248 13.349 -4.579 1.00 0.00 C ATOM 1052 CG ASP A 79 4.004 13.942 -5.267 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.766 15.168 -5.169 1.00 0.00 O ATOM 1054 OD2 ASP A 79 3.146 13.150 -5.706 1.00 0.00 O ATOM 0 H ASP A 79 6.072 12.331 -1.672 1.00 0.00 H new ATOM 0 HA ASP A 79 5.730 14.760 -3.032 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.134 13.682 -5.119 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.209 12.263 -4.669 1.00 0.00 H new ATOM 1059 N SER A 80 3.179 14.501 -2.612 1.00 0.00 N ATOM 1060 CA SER A 80 1.755 14.463 -2.282 1.00 0.00 C ATOM 1061 C SER A 80 1.155 13.055 -2.457 1.00 0.00 C ATOM 1062 O SER A 80 0.300 12.657 -1.666 1.00 0.00 O ATOM 1063 CB SER A 80 1.034 15.483 -3.181 1.00 0.00 C ATOM 1064 OG SER A 80 1.142 15.177 -4.566 1.00 0.00 O ATOM 0 H SER A 80 3.423 15.334 -3.148 1.00 0.00 H new ATOM 0 HA SER A 80 1.623 14.719 -1.231 1.00 0.00 H new ATOM 0 HB2 SER A 80 -0.020 15.522 -2.904 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.448 16.475 -3.000 1.00 0.00 H new ATOM 0 HG SER A 80 2.028 15.441 -4.891 1.00 0.00 H new ATOM 1070 N HIS A 81 1.677 12.268 -3.414 1.00 0.00 N ATOM 1071 CA HIS A 81 1.430 10.844 -3.619 1.00 0.00 C ATOM 1072 C HIS A 81 1.521 10.018 -2.338 1.00 0.00 C ATOM 1073 O HIS A 81 0.499 9.474 -1.915 1.00 0.00 O ATOM 1074 CB HIS A 81 2.396 10.308 -4.702 1.00 0.00 C ATOM 1075 CG HIS A 81 1.927 10.549 -6.115 1.00 0.00 C ATOM 1076 ND1 HIS A 81 0.869 11.347 -6.492 1.00 0.00 N ATOM 1077 CD2 HIS A 81 2.289 9.809 -7.202 1.00 0.00 C ATOM 1078 CE1 HIS A 81 0.494 10.984 -7.728 1.00 0.00 C ATOM 1079 NE2 HIS A 81 1.398 10.110 -8.217 1.00 0.00 N ATOM 0 H HIS A 81 2.325 12.642 -4.107 1.00 0.00 H new ATOM 0 HA HIS A 81 0.399 10.738 -3.957 1.00 0.00 H new ATOM 0 HB2 HIS A 81 3.371 10.777 -4.569 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.534 9.237 -4.553 1.00 0.00 H new ATOM 0 HD1 HIS A 81 0.445 12.085 -5.930 1.00 0.00 H new ATOM 0 HD2 HIS A 81 3.116 9.117 -7.260 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -0.387 11.334 -8.246 1.00 0.00 H new ATOM 1088 N LEU A 82 2.704 9.881 -1.723 1.00 0.00 N ATOM 1089 CA LEU A 82 2.790 9.106 -0.476 1.00 0.00 C ATOM 1090 C LEU A 82 2.053 9.845 0.647 1.00 0.00 C ATOM 1091 O LEU A 82 1.396 9.202 1.458 1.00 0.00 O ATOM 1092 CB LEU A 82 4.236 8.727 -0.070 1.00 0.00 C ATOM 1093 CG LEU A 82 5.133 8.046 -1.111 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.356 7.439 -0.414 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.433 6.966 -1.948 1.00 0.00 C ATOM 0 H LEU A 82 3.584 10.279 -2.052 1.00 0.00 H new ATOM 0 HA LEU A 82 2.297 8.151 -0.659 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.738 9.638 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.175 8.069 0.797 1.00 0.00 H new ATOM 0 HG LEU A 82 5.423 8.828 -1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.993 6.955 -1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.917 8.227 0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.028 6.703 0.320 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.142 6.539 -2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.060 6.181 -1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.599 7.410 -2.492 1.00 0.00 H new ATOM 1107 N ALA A 83 2.080 11.182 0.665 1.00 0.00 N ATOM 1108 CA ALA A 83 1.539 11.974 1.773 1.00 0.00 C ATOM 1109 C ALA A 83 0.013 11.821 1.912 1.00 0.00 C ATOM 1110 O ALA A 83 -0.489 11.806 3.031 1.00 0.00 O ATOM 1111 CB ALA A 83 1.971 13.431 1.590 1.00 0.00 C ATOM 0 H ALA A 83 2.477 11.744 -0.088 1.00 0.00 H new ATOM 0 HA ALA A 83 1.945 11.601 2.713 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.575 14.033 2.408 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.059 13.490 1.589 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.586 13.808 0.643 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.706 11.622 0.796 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.128 11.258 0.792 1.00 0.00 C ATOM 1119 C ARG A 84 -2.357 9.807 1.217 1.00 0.00 C ATOM 1120 O ARG A 84 -3.033 9.587 2.214 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.751 11.499 -0.600 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.459 12.862 -0.725 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.945 12.642 -1.032 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.721 13.895 -1.019 1.00 0.00 N ATOM 1125 CZ ARG A 84 -7.043 13.962 -1.168 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.781 12.896 -1.390 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -7.653 15.127 -1.097 1.00 0.00 N ATOM 0 H ARG A 84 -0.309 11.711 -0.139 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.618 11.900 1.524 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.969 11.433 -1.356 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -3.467 10.705 -0.812 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.348 13.427 0.200 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -2.997 13.452 -1.516 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.044 12.169 -2.009 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.365 11.952 -0.300 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.212 14.769 -0.887 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.343 11.977 -1.453 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.791 12.989 -1.499 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.113 15.976 -0.928 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.665 15.180 -1.211 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.789 8.811 0.527 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.090 7.403 0.835 1.00 0.00 C ATOM 1143 C ALA A 85 -1.643 6.971 2.245 1.00 0.00 C ATOM 1144 O ALA A 85 -2.249 6.083 2.843 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.456 6.514 -0.233 1.00 0.00 C ATOM 0 H ALA A 85 -1.128 8.947 -0.238 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.174 7.291 0.827 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.674 5.469 -0.013 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.864 6.772 -1.210 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.377 6.666 -0.239 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.595 7.609 2.780 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.143 7.422 4.157 1.00 0.00 C ATOM 1153 C LEU A 86 -0.887 8.329 5.152 1.00 0.00 C ATOM 1154 O LEU A 86 -1.164 7.881 6.258 1.00 0.00 O ATOM 1155 CB LEU A 86 1.383 7.614 4.229 1.00 0.00 C ATOM 1156 CG LEU A 86 2.100 6.613 5.155 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.540 7.085 5.317 1.00 0.00 C ATOM 1158 CD2 LEU A 86 1.491 6.431 6.550 1.00 0.00 C ATOM 0 H LEU A 86 -0.031 8.279 2.257 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.383 6.402 4.458 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.797 7.525 3.225 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.595 8.626 4.572 1.00 0.00 H new ATOM 0 HG LEU A 86 2.005 5.639 4.674 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.077 6.396 5.969 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.025 7.114 4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.549 8.082 5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.078 5.704 7.111 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.495 7.386 7.076 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.466 6.074 6.456 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.285 9.544 4.752 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.094 10.476 5.555 1.00 0.00 C ATOM 1172 C GLY A 87 -3.535 9.985 5.783 1.00 0.00 C ATOM 1173 O GLY A 87 -4.097 10.207 6.850 1.00 0.00 O ATOM 0 H GLY A 87 -1.047 9.918 3.834 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.611 10.627 6.521 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.122 11.445 5.057 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.083 9.252 4.812 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.317 8.454 4.908 1.00 0.00 C ATOM 1179 C GLU A 88 -5.175 7.324 5.953 1.00 0.00 C ATOM 1180 O GLU A 88 -6.166 6.813 6.475 1.00 0.00 O ATOM 1181 CB GLU A 88 -5.552 7.877 3.497 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.619 6.785 3.358 1.00 0.00 C ATOM 1183 CD GLU A 88 -8.000 7.221 3.830 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -8.371 8.398 3.654 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -8.778 6.344 4.266 1.00 0.00 O ATOM 0 H GLU A 88 -3.659 9.193 3.886 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.159 9.064 5.237 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.822 8.700 2.836 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.606 7.474 3.134 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.681 6.479 2.314 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.308 5.910 3.929 1.00 0.00 H new ATOM 1192 N LEU A 89 -3.921 6.934 6.220 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.428 5.844 7.062 1.00 0.00 C ATOM 1194 C LEU A 89 -3.512 4.568 6.235 1.00 0.00 C ATOM 1195 O LEU A 89 -4.578 4.222 5.743 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.154 5.734 8.423 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.574 4.671 9.378 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -2.109 4.942 9.757 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -4.428 4.601 10.651 1.00 0.00 C ATOM 0 H LEU A 89 -3.139 7.437 5.800 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.395 6.041 7.348 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.119 6.705 8.917 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.204 5.506 8.242 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.598 3.719 8.848 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.757 4.161 10.430 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.495 4.948 8.856 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.035 5.909 10.254 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -4.016 3.849 11.324 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.424 5.572 11.146 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.451 4.332 10.388 1.00 0.00 H new ATOM 1211 N VAL A 90 -2.411 3.819 6.152 1.00 0.00 N ATOM 1212 CA VAL A 90 -2.216 2.675 5.226 1.00 0.00 C ATOM 1213 C VAL A 90 -3.145 1.477 5.486 1.00 0.00 C ATOM 1214 O VAL A 90 -3.086 0.469 4.786 1.00 0.00 O ATOM 1215 CB VAL A 90 -0.708 2.311 5.133 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -0.319 1.059 4.325 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -0.003 3.499 4.465 1.00 0.00 C ATOM 0 H VAL A 90 -1.597 3.988 6.742 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.533 3.003 4.236 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.414 2.088 6.159 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.763 0.932 4.349 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.797 0.182 4.761 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.648 1.176 3.292 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.063 3.288 4.378 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.423 3.660 3.472 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.147 4.394 5.070 1.00 0.00 H new ATOM 1227 N GLN A 91 -4.106 1.597 6.413 1.00 0.00 N ATOM 1228 CA GLN A 91 -5.487 1.181 6.157 1.00 0.00 C ATOM 1229 C GLN A 91 -5.693 -0.301 6.501 1.00 0.00 C ATOM 1230 O GLN A 91 -6.761 -0.672 6.952 1.00 0.00 O ATOM 1231 CB GLN A 91 -5.869 1.570 4.714 1.00 0.00 C ATOM 1232 CG GLN A 91 -7.334 1.919 4.462 1.00 0.00 C ATOM 1233 CD GLN A 91 -8.025 3.077 5.190 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -9.243 3.121 5.176 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -7.372 4.013 5.837 1.00 0.00 N ATOM 0 H GLN A 91 -3.950 1.979 7.346 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.176 1.708 6.816 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.260 2.425 4.420 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -5.598 0.744 4.056 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.432 2.114 3.394 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -7.913 1.021 4.677 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.352 3.998 5.863 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -7.884 4.755 6.314 1.00 0.00 H new ATOM 1244 N VAL A 92 -4.643 -1.121 6.435 1.00 0.00 N ATOM 1245 CA VAL A 92 -4.474 -2.505 6.937 1.00 0.00 C ATOM 1246 C VAL A 92 -4.564 -2.595 8.477 1.00 0.00 C ATOM 1247 O VAL A 92 -3.860 -3.349 9.134 1.00 0.00 O ATOM 1248 CB VAL A 92 -3.149 -3.075 6.350 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -1.932 -2.242 6.782 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -2.869 -4.561 6.627 1.00 0.00 C ATOM 0 H VAL A 92 -3.788 -0.804 5.978 1.00 0.00 H new ATOM 0 HA VAL A 92 -5.301 -3.126 6.594 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.307 -3.000 5.274 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.027 -2.671 6.353 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.050 -1.217 6.431 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.855 -2.247 7.869 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.921 -4.844 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.817 -4.727 7.703 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.670 -5.167 6.205 1.00 0.00 H new ATOM 1260 N VAL A 93 -5.425 -1.764 9.065 1.00 0.00 N ATOM 1261 CA VAL A 93 -5.768 -1.675 10.498 1.00 0.00 C ATOM 1262 C VAL A 93 -4.558 -1.367 11.420 1.00 0.00 C ATOM 1263 O VAL A 93 -4.691 -1.401 12.638 1.00 0.00 O ATOM 1264 CB VAL A 93 -6.546 -2.933 10.997 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -7.621 -2.492 12.000 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -7.299 -3.715 9.898 1.00 0.00 C ATOM 0 H VAL A 93 -5.945 -1.080 8.515 1.00 0.00 H new ATOM 0 HA VAL A 93 -6.431 -0.813 10.572 1.00 0.00 H new ATOM 0 HB VAL A 93 -5.780 -3.585 11.417 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.169 -3.365 12.353 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.147 -1.994 12.846 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -8.311 -1.803 11.514 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.807 -4.570 10.343 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.033 -3.062 9.425 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.589 -4.065 9.149 1.00 0.00 H new ATOM 1276 N LEU A 94 -3.405 -1.050 10.805 1.00 0.00 N ATOM 1277 CA LEU A 94 -2.028 -0.957 11.317 1.00 0.00 C ATOM 1278 C LEU A 94 -1.341 -2.298 10.993 1.00 0.00 C ATOM 1279 O LEU A 94 -1.690 -3.351 11.531 1.00 0.00 O ATOM 1280 CB LEU A 94 -1.925 -0.574 12.815 1.00 0.00 C ATOM 1281 CG LEU A 94 -0.586 0.034 13.294 1.00 0.00 C ATOM 1282 CD1 LEU A 94 0.632 -0.879 13.095 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -0.317 1.402 12.646 1.00 0.00 C ATOM 0 H LEU A 94 -3.421 -0.825 9.810 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.518 -0.130 10.824 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.719 0.138 13.038 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.122 -1.467 13.407 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.714 0.156 14.369 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.528 -0.375 13.458 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.487 -1.805 13.651 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.747 -1.106 12.035 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.633 1.796 13.008 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.274 1.289 11.563 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.119 2.092 12.907 1.00 0.00 H new ATOM 1295 N ALA A 95 -0.376 -2.262 10.074 1.00 0.00 N ATOM 1296 CA ALA A 95 0.420 -3.433 9.736 1.00 0.00 C ATOM 1297 C ALA A 95 1.263 -3.887 10.936 1.00 0.00 C ATOM 1298 O ALA A 95 2.341 -3.354 11.161 1.00 0.00 O ATOM 1299 CB ALA A 95 1.299 -3.127 8.511 1.00 0.00 C ATOM 0 H ALA A 95 -0.128 -1.424 9.548 1.00 0.00 H new ATOM 0 HA ALA A 95 -0.248 -4.257 9.483 1.00 0.00 H new ATOM 0 HB1 ALA A 95 1.893 -4.006 8.261 1.00 0.00 H new ATOM 0 HB2 ALA A 95 0.665 -2.865 7.664 1.00 0.00 H new ATOM 0 HB3 ALA A 95 1.963 -2.293 8.739 1.00 0.00 H new ATOM 1305 N VAL A 96 0.771 -4.867 11.691 1.00 0.00 N ATOM 1306 CA VAL A 96 1.572 -5.576 12.703 1.00 0.00 C ATOM 1307 C VAL A 96 2.863 -6.105 12.058 1.00 0.00 C ATOM 1308 O VAL A 96 2.855 -6.516 10.894 1.00 0.00 O ATOM 1309 CB VAL A 96 0.838 -6.769 13.366 1.00 0.00 C ATOM 1310 CG1 VAL A 96 1.416 -7.065 14.755 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -0.678 -6.573 13.505 1.00 0.00 C ATOM 0 H VAL A 96 -0.192 -5.196 11.623 1.00 0.00 H new ATOM 0 HA VAL A 96 1.777 -4.846 13.486 1.00 0.00 H new ATOM 0 HB VAL A 96 1.001 -7.608 12.689 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.884 -7.906 15.199 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.474 -7.312 14.664 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.302 -6.187 15.391 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.117 -7.452 13.978 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -0.877 -5.694 14.118 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.119 -6.434 12.518 1.00 0.00 H new ATOM 1321 N ASP A 97 3.938 -6.149 12.845 1.00 0.00 N ATOM 1322 CA ASP A 97 5.328 -6.506 12.514 1.00 0.00 C ATOM 1323 C ASP A 97 5.522 -8.010 12.176 1.00 0.00 C ATOM 1324 O ASP A 97 6.534 -8.631 12.511 1.00 0.00 O ATOM 1325 CB ASP A 97 6.233 -6.053 13.686 1.00 0.00 C ATOM 1326 CG ASP A 97 5.773 -4.752 14.367 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.856 -4.881 15.216 1.00 0.00 O ATOM 1328 OD2 ASP A 97 6.310 -3.673 14.034 1.00 0.00 O ATOM 0 H ASP A 97 3.854 -5.912 13.833 1.00 0.00 H new ATOM 0 HA ASP A 97 5.609 -5.987 11.598 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.269 -6.848 14.431 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.249 -5.917 13.315 1.00 0.00 H new ATOM 1333 N THR A 98 4.515 -8.620 11.538 1.00 0.00 N ATOM 1334 CA THR A 98 4.447 -10.040 11.191 1.00 0.00 C ATOM 1335 C THR A 98 4.803 -10.272 9.736 1.00 0.00 C ATOM 1336 O THR A 98 4.196 -9.694 8.830 1.00 0.00 O ATOM 1337 CB THR A 98 3.077 -10.668 11.483 1.00 0.00 C ATOM 1338 OG1 THR A 98 2.021 -9.814 11.097 1.00 0.00 O ATOM 1339 CG2 THR A 98 2.916 -10.901 12.980 1.00 0.00 C ATOM 0 H THR A 98 3.686 -8.109 11.236 1.00 0.00 H new ATOM 0 HA THR A 98 5.181 -10.530 11.831 1.00 0.00 H new ATOM 0 HB THR A 98 3.035 -11.601 10.921 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.948 -9.805 10.120 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.941 -11.347 13.176 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.699 -11.573 13.330 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.993 -9.950 13.507 1.00 0.00 H new ATOM 1347 N ASP A 99 5.729 -11.207 9.535 1.00 0.00 N ATOM 1348 CA ASP A 99 6.020 -11.800 8.232 1.00 0.00 C ATOM 1349 C ASP A 99 5.962 -13.335 8.317 1.00 0.00 C ATOM 1350 O ASP A 99 6.127 -13.933 9.382 1.00 0.00 O ATOM 1351 CB ASP A 99 7.343 -11.295 7.632 1.00 0.00 C ATOM 1352 CG ASP A 99 7.384 -11.520 6.114 1.00 0.00 C ATOM 1353 OD1 ASP A 99 6.333 -11.898 5.537 1.00 0.00 O ATOM 1354 OD2 ASP A 99 8.407 -11.231 5.469 1.00 0.00 O ATOM 0 H ASP A 99 6.308 -11.580 10.287 1.00 0.00 H new ATOM 0 HA ASP A 99 5.245 -11.472 7.539 1.00 0.00 H new ATOM 0 HB2 ASP A 99 7.462 -10.233 7.849 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.180 -11.812 8.102 1.00 0.00 H new ATOM 1359 N GLN A 100 5.670 -13.977 7.188 1.00 0.00 N ATOM 1360 CA GLN A 100 5.299 -15.382 7.058 1.00 0.00 C ATOM 1361 C GLN A 100 5.279 -15.759 5.555 1.00 0.00 C ATOM 1362 O GLN A 100 5.202 -14.841 4.731 1.00 0.00 O ATOM 1363 CB GLN A 100 3.910 -15.515 7.726 1.00 0.00 C ATOM 1364 CG GLN A 100 3.745 -16.737 8.637 1.00 0.00 C ATOM 1365 CD GLN A 100 3.371 -16.295 10.040 1.00 0.00 C ATOM 1366 OE1 GLN A 100 2.276 -16.565 10.516 1.00 0.00 O ATOM 1367 NE2 GLN A 100 4.259 -15.599 10.717 1.00 0.00 N ATOM 0 H GLN A 100 5.687 -13.501 6.286 1.00 0.00 H new ATOM 0 HA GLN A 100 6.003 -16.061 7.539 1.00 0.00 H new ATOM 0 HB2 GLN A 100 3.717 -14.616 8.311 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.150 -15.557 6.945 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.975 -17.397 8.238 1.00 0.00 H new ATOM 0 HG3 GLN A 100 4.672 -17.309 8.663 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.165 -15.386 10.300 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.041 -15.273 11.659 1.00 0.00 H new ATOM 1376 N PRO A 101 5.303 -17.050 5.153 1.00 0.00 N ATOM 1377 CA PRO A 101 5.057 -17.439 3.762 1.00 0.00 C ATOM 1378 C PRO A 101 3.617 -17.092 3.363 1.00 0.00 C ATOM 1379 O PRO A 101 2.753 -16.960 4.230 1.00 0.00 O ATOM 1380 CB PRO A 101 5.333 -18.942 3.682 1.00 0.00 C ATOM 1381 CG PRO A 101 5.047 -19.419 5.104 1.00 0.00 C ATOM 1382 CD PRO A 101 5.496 -18.242 5.967 1.00 0.00 C ATOM 0 HA PRO A 101 5.702 -16.903 3.066 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.687 -19.433 2.954 1.00 0.00 H new ATOM 0 HB3 PRO A 101 6.362 -19.148 3.386 1.00 0.00 H new ATOM 0 HG2 PRO A 101 3.990 -19.643 5.248 1.00 0.00 H new ATOM 0 HG3 PRO A 101 5.601 -20.327 5.343 1.00 0.00 H new ATOM 0 HD2 PRO A 101 4.911 -18.186 6.885 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.540 -18.349 6.260 1.00 0.00 H new ATOM 1390 N CYS A 102 3.377 -16.897 2.061 1.00 0.00 N ATOM 1391 CA CYS A 102 2.112 -16.409 1.534 1.00 0.00 C ATOM 1392 C CYS A 102 1.141 -17.536 1.129 1.00 0.00 C ATOM 1393 O CYS A 102 1.101 -18.609 1.723 1.00 0.00 O ATOM 1394 CB CYS A 102 2.447 -15.378 0.431 1.00 0.00 C ATOM 1395 SG CYS A 102 1.297 -13.962 0.264 1.00 0.00 S ATOM 0 H CYS A 102 4.073 -17.079 1.338 1.00 0.00 H new ATOM 0 HA CYS A 102 1.535 -15.904 2.309 1.00 0.00 H new ATOM 0 HB2 CYS A 102 3.446 -14.986 0.622 1.00 0.00 H new ATOM 0 HB3 CYS A 102 2.487 -15.901 -0.525 1.00 0.00 H new ATOM 0 HG CYS A 102 1.704 -13.183 -0.694 1.00 0.00 H new ATOM 1476 N LEU B 11 0.970 -9.104 8.170 1.00 0.00 N ATOM 1477 CA LEU B 11 0.520 -7.884 7.500 1.00 0.00 C ATOM 1478 C LEU B 11 1.559 -7.277 6.548 1.00 0.00 C ATOM 1479 O LEU B 11 1.155 -6.640 5.578 1.00 0.00 O ATOM 1480 CB LEU B 11 -0.046 -6.878 8.517 1.00 0.00 C ATOM 1481 CG LEU B 11 -1.358 -7.283 9.234 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -2.442 -7.805 8.275 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -1.156 -8.336 10.334 1.00 0.00 C ATOM 0 HA LEU B 11 -0.298 -8.170 6.839 1.00 0.00 H new ATOM 0 HB2 LEU B 11 0.715 -6.695 9.276 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.216 -5.932 8.003 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.693 -6.350 9.687 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -3.333 -8.070 8.843 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -2.691 -7.030 7.551 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -2.071 -8.685 7.751 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.116 -8.572 10.793 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -0.730 -9.240 9.899 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -0.478 -7.945 11.092 1.00 0.00 H new ATOM 1495 N ALA B 12 2.856 -7.573 6.688 1.00 0.00 N ATOM 1496 CA ALA B 12 3.840 -7.217 5.658 1.00 0.00 C ATOM 1497 C ALA B 12 3.561 -7.914 4.307 1.00 0.00 C ATOM 1498 O ALA B 12 3.813 -7.337 3.243 1.00 0.00 O ATOM 1499 CB ALA B 12 5.237 -7.524 6.211 1.00 0.00 C ATOM 0 H ALA B 12 3.247 -8.054 7.498 1.00 0.00 H new ATOM 0 HA ALA B 12 3.768 -6.153 5.434 1.00 0.00 H new ATOM 0 HB1 ALA B 12 5.988 -7.268 5.464 1.00 0.00 H new ATOM 0 HB2 ALA B 12 5.408 -6.937 7.114 1.00 0.00 H new ATOM 0 HB3 ALA B 12 5.309 -8.585 6.449 1.00 0.00 H new ATOM 1505 N ARG B 13 2.996 -9.135 4.325 1.00 0.00 N ATOM 1506 CA ARG B 13 2.564 -9.816 3.097 1.00 0.00 C ATOM 1507 C ARG B 13 1.480 -9.026 2.359 1.00 0.00 C ATOM 1508 O ARG B 13 1.454 -9.072 1.134 1.00 0.00 O ATOM 1509 CB ARG B 13 2.002 -11.224 3.329 1.00 0.00 C ATOM 1510 CG ARG B 13 2.935 -12.225 4.023 1.00 0.00 C ATOM 1511 CD ARG B 13 2.422 -13.681 3.981 1.00 0.00 C ATOM 1512 NE ARG B 13 0.972 -13.801 3.697 1.00 0.00 N ATOM 1513 CZ ARG B 13 0.121 -14.698 4.186 1.00 0.00 C ATOM 1514 NH1 ARG B 13 0.505 -15.619 5.037 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -1.136 -14.716 3.798 1.00 0.00 N ATOM 0 H ARG B 13 2.829 -9.668 5.178 1.00 0.00 H new ATOM 0 HA ARG B 13 3.477 -9.888 2.506 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.093 -11.135 3.924 1.00 0.00 H new ATOM 0 HB3 ARG B 13 1.712 -11.640 2.364 1.00 0.00 H new ATOM 0 HG2 ARG B 13 3.917 -12.181 3.551 1.00 0.00 H new ATOM 0 HG3 ARG B 13 3.067 -11.925 5.063 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.977 -14.229 3.220 1.00 0.00 H new ATOM 0 HD3 ARG B 13 2.635 -14.158 4.937 1.00 0.00 H new ATOM 0 HE ARG B 13 0.581 -13.115 3.051 1.00 0.00 H new ATOM 0 HH11 ARG B 13 1.478 -15.660 5.340 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -0.170 -16.295 5.396 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -1.468 -14.036 3.114 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -1.778 -15.410 4.181 1.00 0.00 H new ATOM 1529 N LEU B 14 0.603 -8.300 3.076 1.00 0.00 N ATOM 1530 CA LEU B 14 -0.486 -7.492 2.504 1.00 0.00 C ATOM 1531 C LEU B 14 0.075 -6.580 1.409 1.00 0.00 C ATOM 1532 O LEU B 14 -0.306 -6.718 0.251 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.192 -6.699 3.634 1.00 0.00 C ATOM 1534 CG LEU B 14 -2.588 -6.099 3.344 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.686 -5.318 2.033 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.694 -7.153 3.433 1.00 0.00 C ATOM 0 H LEU B 14 0.634 -8.259 4.095 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.235 -8.134 2.041 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -1.286 -7.360 4.496 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.533 -5.882 3.929 1.00 0.00 H new ATOM 0 HG LEU B 14 -2.738 -5.366 4.137 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.699 -4.934 1.913 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.983 -4.486 2.052 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.446 -5.977 1.198 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -4.657 -6.688 3.222 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.505 -7.942 2.705 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.709 -7.581 4.435 1.00 0.00 H new ATOM 1548 N GLY B 15 1.052 -5.724 1.733 1.00 0.00 N ATOM 1549 CA GLY B 15 1.650 -4.812 0.751 1.00 0.00 C ATOM 1550 C GLY B 15 2.369 -5.548 -0.382 1.00 0.00 C ATOM 1551 O GLY B 15 2.288 -5.128 -1.533 1.00 0.00 O ATOM 0 H GLY B 15 1.446 -5.644 2.670 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.870 -4.178 0.329 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.357 -4.154 1.257 1.00 0.00 H new ATOM 1555 N ARG B 16 2.982 -6.698 -0.080 1.00 0.00 N ATOM 1556 CA ARG B 16 3.599 -7.609 -1.058 1.00 0.00 C ATOM 1557 C ARG B 16 2.590 -8.339 -1.963 1.00 0.00 C ATOM 1558 O ARG B 16 3.000 -8.936 -2.952 1.00 0.00 O ATOM 1559 CB ARG B 16 4.484 -8.604 -0.293 1.00 0.00 C ATOM 1560 CG ARG B 16 5.841 -7.960 0.015 1.00 0.00 C ATOM 1561 CD ARG B 16 6.458 -8.329 1.362 1.00 0.00 C ATOM 1562 NE ARG B 16 6.573 -9.782 1.554 1.00 0.00 N ATOM 1563 CZ ARG B 16 6.442 -10.406 2.718 1.00 0.00 C ATOM 1564 NH1 ARG B 16 6.195 -9.753 3.826 1.00 0.00 N ATOM 1565 NH2 ARG B 16 6.558 -11.710 2.808 1.00 0.00 N ATOM 0 H ARG B 16 3.066 -7.033 0.880 1.00 0.00 H new ATOM 0 HA ARG B 16 4.195 -7.008 -1.745 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.994 -8.903 0.634 1.00 0.00 H new ATOM 0 HB3 ARG B 16 4.626 -9.508 -0.885 1.00 0.00 H new ATOM 0 HG2 ARG B 16 6.541 -8.237 -0.773 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.726 -6.877 -0.027 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.447 -7.877 1.440 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.851 -7.908 2.163 1.00 0.00 H new ATOM 0 HE ARG B 16 6.768 -10.353 0.732 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.098 -8.738 3.809 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.099 -10.260 4.706 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.752 -12.264 1.974 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.454 -12.170 3.712 1.00 0.00 H new ATOM 1579 N ALA B 17 1.296 -8.277 -1.643 1.00 0.00 N ATOM 1580 CA ALA B 17 0.186 -8.741 -2.476 1.00 0.00 C ATOM 1581 C ALA B 17 -0.689 -7.599 -3.040 1.00 0.00 C ATOM 1582 O ALA B 17 -1.567 -7.861 -3.855 1.00 0.00 O ATOM 1583 CB ALA B 17 -0.637 -9.729 -1.641 1.00 0.00 C ATOM 0 H ALA B 17 0.980 -7.884 -0.756 1.00 0.00 H new ATOM 0 HA ALA B 17 0.594 -9.228 -3.362 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -1.475 -10.096 -2.233 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -0.007 -10.568 -1.345 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -1.014 -9.227 -0.750 1.00 0.00 H new ATOM 1589 N LEU B 18 -0.497 -6.341 -2.621 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.217 -5.189 -3.186 1.00 0.00 C ATOM 1591 C LEU B 18 -0.423 -4.453 -4.265 1.00 0.00 C ATOM 1592 O LEU B 18 -1.028 -3.938 -5.200 1.00 0.00 O ATOM 1593 CB LEU B 18 -1.675 -4.242 -2.055 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.209 -4.086 -2.032 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.906 -5.410 -1.692 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -3.618 -3.029 -0.999 1.00 0.00 C ATOM 0 H LEU B 18 0.161 -6.092 -1.882 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.100 -5.575 -3.695 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.334 -4.629 -1.095 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.211 -3.265 -2.188 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.519 -3.775 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.986 -5.261 -1.685 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.648 -6.160 -2.440 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.580 -5.751 -0.709 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.703 -2.928 -0.992 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -3.276 -3.335 -0.010 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -3.166 -2.072 -1.259 1.00 0.00 H new ATOM 1608 N ALA B 19 0.911 -4.459 -4.181 1.00 0.00 N ATOM 1609 CA ALA B 19 1.813 -3.908 -5.206 1.00 0.00 C ATOM 1610 C ALA B 19 2.183 -4.944 -6.290 1.00 0.00 C ATOM 1611 O ALA B 19 3.321 -5.007 -6.753 1.00 0.00 O ATOM 1612 CB ALA B 19 3.029 -3.292 -4.507 1.00 0.00 C ATOM 0 H ALA B 19 1.408 -4.855 -3.383 1.00 0.00 H new ATOM 0 HA ALA B 19 1.298 -3.121 -5.757 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.707 -2.879 -5.254 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.700 -2.498 -3.837 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.546 -4.060 -3.932 1.00 0.00 H new ATOM 1618 N ASP B 20 1.207 -5.783 -6.627 1.00 0.00 N ATOM 1619 CA ASP B 20 1.195 -6.765 -7.700 1.00 0.00 C ATOM 1620 C ASP B 20 0.927 -6.125 -9.085 1.00 0.00 C ATOM 1621 O ASP B 20 0.382 -5.019 -9.145 1.00 0.00 O ATOM 1622 CB ASP B 20 0.022 -7.716 -7.409 1.00 0.00 C ATOM 1623 CG ASP B 20 0.401 -9.110 -6.924 1.00 0.00 C ATOM 1624 OD1 ASP B 20 0.754 -9.262 -5.735 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.096 -10.072 -7.656 1.00 0.00 O ATOM 0 H ASP B 20 0.329 -5.791 -6.109 1.00 0.00 H new ATOM 0 HA ASP B 20 2.167 -7.257 -7.734 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.619 -7.253 -6.659 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.572 -7.817 -8.317 1.00 0.00 H new ATOM 1630 N PRO B 21 1.159 -6.892 -10.174 1.00 0.00 N ATOM 1631 CA PRO B 21 0.777 -6.587 -11.561 1.00 0.00 C ATOM 1632 C PRO B 21 -0.760 -6.648 -11.761 1.00 0.00 C ATOM 1633 O PRO B 21 -1.508 -5.882 -11.154 1.00 0.00 O ATOM 1634 CB PRO B 21 1.540 -7.653 -12.372 1.00 0.00 C ATOM 1635 CG PRO B 21 1.437 -8.865 -11.449 1.00 0.00 C ATOM 1636 CD PRO B 21 1.806 -8.202 -10.137 1.00 0.00 C ATOM 0 HA PRO B 21 1.032 -5.574 -11.872 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.081 -7.836 -13.343 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.575 -7.365 -12.558 1.00 0.00 H new ATOM 0 HG2 PRO B 21 0.437 -9.298 -11.434 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.126 -9.663 -11.725 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.458 -8.789 -9.287 1.00 0.00 H new ATOM 0 HD3 PRO B 21 2.887 -8.105 -10.035 1.00 0.00 H new ATOM 1644 N THR B 22 -1.261 -7.585 -12.584 1.00 0.00 N ATOM 1645 CA THR B 22 -2.676 -7.878 -12.883 1.00 0.00 C ATOM 1646 C THR B 22 -3.593 -7.858 -11.668 1.00 0.00 C ATOM 1647 O THR B 22 -4.749 -7.439 -11.782 1.00 0.00 O ATOM 1648 CB THR B 22 -2.820 -9.256 -13.568 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.611 -9.979 -13.601 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.278 -9.088 -15.013 1.00 0.00 C ATOM 0 H THR B 22 -0.638 -8.207 -13.099 1.00 0.00 H new ATOM 0 HA THR B 22 -2.989 -7.071 -13.545 1.00 0.00 H new ATOM 0 HB THR B 22 -3.551 -9.805 -12.975 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.431 -10.356 -12.714 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.374 -10.068 -15.480 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.242 -8.580 -15.032 1.00 0.00 H new ATOM 0 HG23 THR B 22 -2.545 -8.495 -15.560 1.00 0.00 H new ATOM 1658 N ARG B 23 -3.092 -8.268 -10.497 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.860 -8.260 -9.254 1.00 0.00 C ATOM 1660 C ARG B 23 -4.347 -6.855 -8.860 1.00 0.00 C ATOM 1661 O ARG B 23 -5.451 -6.756 -8.324 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.059 -8.846 -8.098 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.937 -9.611 -7.097 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.357 -9.417 -5.691 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.050 -10.055 -5.531 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.781 -11.282 -5.131 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -2.720 -12.175 -4.912 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.530 -11.620 -4.934 1.00 0.00 N ATOM 0 H ARG B 23 -2.139 -8.615 -10.388 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.734 -8.882 -9.449 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.296 -9.517 -8.493 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.538 -8.042 -7.578 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.963 -9.245 -7.137 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.966 -10.670 -7.352 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.265 -8.351 -5.483 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -4.050 -9.826 -4.956 1.00 0.00 H new ATOM 0 HE ARG B 23 -1.242 -9.475 -5.758 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -3.700 -11.929 -5.051 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -2.469 -13.114 -4.603 1.00 0.00 H new ATOM 0 HH21 ARG B 23 0.213 -10.939 -5.090 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -0.299 -12.564 -4.624 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.598 -5.784 -9.176 1.00 0.00 N ATOM 1683 CA CYS B 24 -4.072 -4.401 -9.040 1.00 0.00 C ATOM 1684 C CYS B 24 -5.401 -4.236 -9.779 1.00 0.00 C ATOM 1685 O CYS B 24 -6.412 -3.909 -9.154 1.00 0.00 O ATOM 1686 CB CYS B 24 -3.031 -3.402 -9.591 1.00 0.00 C ATOM 1687 SG CYS B 24 -1.904 -2.861 -8.283 1.00 0.00 S ATOM 0 H CYS B 24 -2.645 -5.856 -9.533 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.217 -4.188 -7.981 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -2.463 -3.869 -10.396 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -3.540 -2.538 -10.019 1.00 0.00 H new ATOM 0 HG CYS B 24 -0.811 -3.562 -8.335 1.00 0.00 H new ATOM 1693 N ARG B 25 -5.432 -4.548 -11.084 1.00 0.00 N ATOM 1694 CA ARG B 25 -6.655 -4.437 -11.886 1.00 0.00 C ATOM 1695 C ARG B 25 -7.737 -5.439 -11.439 1.00 0.00 C ATOM 1696 O ARG B 25 -8.888 -5.044 -11.381 1.00 0.00 O ATOM 1697 CB ARG B 25 -6.359 -4.439 -13.399 1.00 0.00 C ATOM 1698 CG ARG B 25 -6.959 -3.199 -14.112 1.00 0.00 C ATOM 1699 CD ARG B 25 -8.501 -3.119 -14.175 1.00 0.00 C ATOM 1700 NE ARG B 25 -9.012 -1.759 -13.930 1.00 0.00 N ATOM 1701 CZ ARG B 25 -10.247 -1.457 -13.529 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -11.235 -2.323 -13.516 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -10.527 -0.261 -13.070 1.00 0.00 N ATOM 0 H ARG B 25 -4.620 -4.880 -11.605 1.00 0.00 H new ATOM 0 HA ARG B 25 -7.091 -3.457 -11.691 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -5.281 -4.461 -13.557 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -6.765 -5.346 -13.846 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -6.591 -2.305 -13.609 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -6.574 -3.172 -15.131 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -8.838 -3.458 -15.154 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -8.926 -3.800 -13.438 1.00 0.00 H new ATOM 0 HE ARG B 25 -8.367 -0.983 -14.080 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -11.076 -3.283 -13.823 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -12.161 -2.036 -13.198 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -9.796 0.449 -13.017 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -11.475 -0.041 -12.766 1.00 0.00 H new ATOM 1717 N ILE B 26 -7.403 -6.659 -11.008 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.355 -7.613 -10.367 1.00 0.00 C ATOM 1719 C ILE B 26 -9.085 -6.991 -9.175 1.00 0.00 C ATOM 1720 O ILE B 26 -10.307 -7.043 -9.100 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.597 -8.886 -9.917 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.145 -9.711 -11.130 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.314 -9.759 -8.876 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -8.186 -10.657 -11.720 1.00 0.00 C ATOM 0 H ILE B 26 -6.456 -7.030 -11.089 1.00 0.00 H new ATOM 0 HA ILE B 26 -9.109 -7.872 -11.110 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.723 -8.511 -9.384 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.823 -9.024 -11.912 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.273 -10.297 -10.841 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -7.693 -10.622 -8.635 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -8.492 -9.176 -7.972 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.267 -10.100 -9.281 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.756 -11.186 -12.570 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.494 -11.377 -10.962 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -9.053 -10.084 -12.050 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.352 -6.391 -8.240 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.959 -5.883 -7.007 1.00 0.00 C ATOM 1738 C LEU B 27 -9.860 -4.671 -7.266 1.00 0.00 C ATOM 1739 O LEU B 27 -10.948 -4.616 -6.698 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.871 -5.586 -5.964 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.297 -6.817 -5.245 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.054 -6.397 -4.450 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.308 -7.412 -4.251 1.00 0.00 C ATOM 0 H LEU B 27 -7.345 -6.244 -8.309 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.609 -6.659 -6.603 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.053 -5.059 -6.456 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.283 -4.908 -5.216 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.057 -7.564 -6.002 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.640 -7.265 -3.936 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.308 -5.988 -5.131 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.330 -5.639 -3.717 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -7.868 -8.281 -3.761 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.565 -6.664 -3.501 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.209 -7.714 -4.785 1.00 0.00 H new ATOM 1755 N VAL B 28 -9.459 -3.740 -8.137 1.00 0.00 N ATOM 1756 CA VAL B 28 -10.315 -2.593 -8.510 1.00 0.00 C ATOM 1757 C VAL B 28 -11.460 -3.002 -9.451 1.00 0.00 C ATOM 1758 O VAL B 28 -12.517 -2.385 -9.434 1.00 0.00 O ATOM 1759 CB VAL B 28 -9.512 -1.392 -9.055 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -8.819 -1.691 -10.383 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -10.347 -0.110 -9.173 1.00 0.00 C ATOM 0 H VAL B 28 -8.550 -3.752 -8.600 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.775 -2.250 -7.583 1.00 0.00 H new ATOM 0 HB VAL B 28 -8.740 -1.217 -8.305 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -8.271 -0.809 -10.714 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -8.125 -2.521 -10.252 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -9.566 -1.957 -11.131 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -9.724 0.696 -9.562 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -11.183 -0.281 -9.851 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -10.728 0.168 -8.190 1.00 0.00 H new ATOM 1771 N ALA B 29 -11.306 -4.088 -10.217 1.00 0.00 N ATOM 1772 CA ALA B 29 -12.393 -4.673 -10.994 1.00 0.00 C ATOM 1773 C ALA B 29 -13.505 -5.236 -10.095 1.00 0.00 C ATOM 1774 O ALA B 29 -14.673 -5.230 -10.479 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.781 -5.719 -11.939 1.00 0.00 C ATOM 0 H ALA B 29 -10.420 -4.584 -10.312 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.891 -3.908 -11.590 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -12.570 -6.176 -12.536 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -11.061 -5.236 -12.599 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -11.277 -6.488 -11.353 1.00 0.00 H new ATOM 1781 N LEU B 30 -13.183 -5.662 -8.870 1.00 0.00 N ATOM 1782 CA LEU B 30 -14.205 -5.978 -7.882 1.00 0.00 C ATOM 1783 C LEU B 30 -14.952 -4.731 -7.430 1.00 0.00 C ATOM 1784 O LEU B 30 -16.175 -4.750 -7.513 1.00 0.00 O ATOM 1785 CB LEU B 30 -13.582 -6.723 -6.712 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.881 -8.218 -6.820 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -13.360 -8.883 -8.099 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.198 -8.821 -5.614 1.00 0.00 C ATOM 0 H LEU B 30 -12.225 -5.794 -8.545 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.946 -6.630 -8.345 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.504 -6.560 -6.700 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.974 -6.333 -5.773 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.959 -8.377 -6.857 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -13.618 -9.942 -8.089 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -13.815 -8.407 -8.968 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.277 -8.774 -8.151 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.359 -9.899 -5.606 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.129 -8.614 -5.660 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -13.613 -8.386 -4.705 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.243 -3.670 -7.021 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.807 -2.329 -6.761 1.00 0.00 C ATOM 1802 C LEU B 31 -15.790 -1.888 -7.871 1.00 0.00 C ATOM 1803 O LEU B 31 -16.892 -1.450 -7.558 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.645 -1.319 -6.630 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.253 -0.830 -5.218 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.025 0.066 -5.371 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.388 -0.047 -4.540 1.00 0.00 C ATOM 0 H LEU B 31 -13.237 -3.717 -6.857 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.378 -2.365 -5.833 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.761 -1.769 -7.083 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.898 -0.443 -7.227 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.044 -1.692 -4.584 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -11.717 0.432 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.211 -0.505 -5.817 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -12.269 0.912 -6.014 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.066 0.276 -3.550 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.639 0.826 -5.143 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.265 -0.687 -4.445 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.407 -2.069 -9.140 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.177 -1.740 -10.353 1.00 0.00 C ATOM 1821 C ASP B 32 -17.242 -2.810 -10.737 1.00 0.00 C ATOM 1822 O ASP B 32 -17.838 -2.723 -11.813 1.00 0.00 O ATOM 1823 CB ASP B 32 -15.189 -1.601 -11.540 1.00 0.00 C ATOM 1824 CG ASP B 32 -14.121 -0.498 -11.492 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -14.411 0.622 -11.028 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -13.018 -0.771 -12.032 1.00 0.00 O ATOM 0 H ASP B 32 -14.498 -2.473 -9.365 1.00 0.00 H new ATOM 0 HA ASP B 32 -16.713 -0.815 -10.140 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -14.673 -2.555 -11.653 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -15.779 -1.449 -12.444 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.439 -3.877 -9.943 1.00 0.00 N ATOM 1832 CA GLY B 33 -18.225 -5.059 -10.354 1.00 0.00 C ATOM 1833 C GLY B 33 -18.904 -5.886 -9.262 1.00 0.00 C ATOM 1834 O GLY B 33 -20.117 -6.059 -9.302 1.00 0.00 O ATOM 0 H GLY B 33 -17.059 -3.947 -8.999 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.997 -4.722 -11.046 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -17.564 -5.722 -10.912 1.00 0.00 H new ATOM 1838 N VAL B 34 -18.124 -6.498 -8.366 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.521 -7.513 -7.350 1.00 0.00 C ATOM 1840 C VAL B 34 -19.657 -8.472 -7.763 1.00 0.00 C ATOM 1841 O VAL B 34 -20.535 -8.774 -6.955 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.793 -6.906 -5.946 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.522 -6.401 -5.260 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.844 -5.781 -5.958 1.00 0.00 C ATOM 0 H VAL B 34 -17.126 -6.292 -8.317 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.629 -8.136 -7.287 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.195 -7.739 -5.370 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -17.775 -5.988 -4.283 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.823 -7.228 -5.134 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.061 -5.626 -5.873 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -19.984 -5.403 -4.945 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.503 -4.971 -6.603 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.790 -6.171 -6.334 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.671 -8.949 -9.017 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.819 -9.684 -9.564 1.00 0.00 C ATOM 1856 C CYS B 35 -20.666 -11.210 -9.486 1.00 0.00 C ATOM 1857 O CYS B 35 -21.445 -11.850 -8.795 1.00 0.00 O ATOM 1858 CB CYS B 35 -21.126 -9.161 -10.974 1.00 0.00 C ATOM 1859 SG CYS B 35 -22.881 -9.466 -11.326 1.00 0.00 S ATOM 0 H CYS B 35 -18.897 -8.838 -9.672 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.686 -9.490 -8.933 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -20.905 -8.096 -11.040 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.498 -9.663 -11.710 1.00 0.00 H new ATOM 0 HG CYS B 35 -23.167 -9.029 -12.516 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.647 -11.794 -10.132 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.517 -13.266 -10.197 1.00 0.00 C ATOM 1867 C TYR B 36 -18.105 -13.801 -10.504 1.00 0.00 C ATOM 1868 O TYR B 36 -17.298 -13.065 -11.076 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.571 -13.838 -11.178 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.506 -13.351 -12.608 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -19.671 -13.982 -13.545 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -21.322 -12.280 -13.005 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -19.598 -13.501 -14.866 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -21.252 -11.780 -14.319 1.00 0.00 C ATOM 1875 CZ TYR B 36 -20.375 -12.384 -15.248 1.00 0.00 C ATOM 1876 OH TYR B 36 -20.269 -11.895 -16.512 1.00 0.00 O ATOM 0 H TYR B 36 -18.907 -11.282 -10.613 1.00 0.00 H new ATOM 0 HA TYR B 36 -19.707 -13.624 -9.185 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -20.475 -14.924 -11.184 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -21.561 -13.607 -10.785 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -19.083 -14.839 -13.251 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -22.008 -11.837 -12.298 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -18.951 -13.983 -15.584 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -21.864 -10.941 -14.615 1.00 0.00 H new ATOM 0 HH TYR B 36 -20.869 -11.127 -16.617 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.766 -15.074 -10.184 1.00 0.00 N ATOM 1887 CA PRO B 37 -16.477 -15.670 -10.535 1.00 0.00 C ATOM 1888 C PRO B 37 -16.288 -15.673 -12.049 1.00 0.00 C ATOM 1889 O PRO B 37 -17.130 -16.174 -12.787 1.00 0.00 O ATOM 1890 CB PRO B 37 -16.488 -17.097 -9.967 1.00 0.00 C ATOM 1891 CG PRO B 37 -17.971 -17.422 -9.848 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.562 -16.066 -9.477 1.00 0.00 C ATOM 0 HA PRO B 37 -15.646 -15.101 -10.119 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.976 -17.796 -10.628 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -15.987 -17.148 -9.000 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -18.381 -17.804 -10.783 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -18.164 -18.175 -9.083 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.611 -16.005 -9.768 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.521 -15.904 -8.400 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.186 -15.082 -12.513 1.00 0.00 N ATOM 1901 CA GLY B 38 -14.920 -14.923 -13.942 1.00 0.00 C ATOM 1902 C GLY B 38 -15.555 -13.682 -14.566 1.00 0.00 C ATOM 1903 O GLY B 38 -15.233 -13.400 -15.715 1.00 0.00 O ATOM 0 H GLY B 38 -14.456 -14.702 -11.911 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.842 -14.882 -14.096 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.284 -15.806 -14.468 1.00 0.00 H new ATOM 1907 N GLN B 39 -16.364 -12.895 -13.828 1.00 0.00 N ATOM 1908 CA GLN B 39 -16.822 -11.570 -14.292 1.00 0.00 C ATOM 1909 C GLN B 39 -15.615 -10.696 -14.634 1.00 0.00 C ATOM 1910 O GLN B 39 -15.654 -9.951 -15.603 1.00 0.00 O ATOM 1911 CB GLN B 39 -17.729 -10.843 -13.279 1.00 0.00 C ATOM 1912 CG GLN B 39 -17.049 -10.161 -12.071 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.428 -8.774 -12.290 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -15.391 -8.472 -11.736 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -17.012 -7.878 -13.055 1.00 0.00 N ATOM 0 H GLN B 39 -16.714 -13.155 -12.906 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.430 -11.743 -15.180 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -18.295 -10.084 -13.819 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.450 -11.565 -12.895 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -17.788 -10.075 -11.275 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -16.265 -10.826 -11.708 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -17.884 -8.106 -13.532 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.593 -6.955 -13.171 1.00 0.00 H new ATOM 1924 N LEU B 40 -14.533 -10.845 -13.854 1.00 0.00 N ATOM 1925 CA LEU B 40 -13.274 -10.126 -13.993 1.00 0.00 C ATOM 1926 C LEU B 40 -12.601 -10.379 -15.337 1.00 0.00 C ATOM 1927 O LEU B 40 -11.723 -9.623 -15.714 1.00 0.00 O ATOM 1928 CB LEU B 40 -12.260 -10.482 -12.889 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.783 -10.722 -11.463 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -13.368 -12.122 -11.188 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.609 -10.521 -10.502 1.00 0.00 C ATOM 0 H LEU B 40 -14.520 -11.503 -13.075 1.00 0.00 H new ATOM 0 HA LEU B 40 -13.552 -9.075 -13.911 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.730 -11.381 -13.203 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.525 -9.678 -12.842 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.606 -10.020 -11.326 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.705 -12.178 -10.153 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -14.211 -12.301 -11.855 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.601 -12.877 -11.361 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.945 -10.684 -9.478 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.817 -11.231 -10.741 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.227 -9.505 -10.601 1.00 0.00 H new ATOM 1943 N ALA B 41 -12.969 -11.447 -16.037 1.00 0.00 N ATOM 1944 CA ALA B 41 -12.373 -11.746 -17.338 1.00 0.00 C ATOM 1945 C ALA B 41 -12.756 -10.668 -18.356 1.00 0.00 C ATOM 1946 O ALA B 41 -11.888 -9.959 -18.863 1.00 0.00 O ATOM 1947 CB ALA B 41 -12.744 -13.169 -17.777 1.00 0.00 C ATOM 0 H ALA B 41 -13.673 -12.118 -15.729 1.00 0.00 H new ATOM 0 HA ALA B 41 -11.286 -11.723 -17.264 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -12.294 -13.379 -18.747 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -12.374 -13.884 -17.043 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -13.828 -13.255 -17.853 1.00 0.00 H new ATOM 1953 N ALA B 42 -14.061 -10.479 -18.570 1.00 0.00 N ATOM 1954 CA ALA B 42 -14.573 -9.428 -19.450 1.00 0.00 C ATOM 1955 C ALA B 42 -14.212 -8.030 -18.919 1.00 0.00 C ATOM 1956 O ALA B 42 -13.936 -7.120 -19.693 1.00 0.00 O ATOM 1957 CB ALA B 42 -16.090 -9.611 -19.582 1.00 0.00 C ATOM 0 H ALA B 42 -14.789 -11.049 -18.139 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.111 -9.509 -20.434 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.494 -8.837 -20.235 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.303 -10.592 -20.007 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -16.553 -9.534 -18.598 1.00 0.00 H new ATOM 1963 N HIS B 43 -14.157 -7.877 -17.595 1.00 0.00 N ATOM 1964 CA HIS B 43 -13.825 -6.620 -16.922 1.00 0.00 C ATOM 1965 C HIS B 43 -12.341 -6.198 -17.023 1.00 0.00 C ATOM 1966 O HIS B 43 -11.994 -5.069 -16.662 1.00 0.00 O ATOM 1967 CB HIS B 43 -14.224 -6.812 -15.458 1.00 0.00 C ATOM 1968 CG HIS B 43 -14.807 -5.617 -14.783 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.946 -5.549 -13.438 1.00 0.00 N flip ATOM 1970 CD2 HIS B 43 -15.483 -4.550 -15.374 1.00 0.00 C flip ATOM 1971 CE1 HIS B 43 -15.697 -4.427 -13.178 1.00 0.00 C flip ATOM 1972 NE2 HIS B 43 -15.996 -3.845 -14.352 1.00 0.00 N flip ATOM 0 H HIS B 43 -14.346 -8.641 -16.946 1.00 0.00 H new ATOM 0 HA HIS B 43 -14.363 -5.810 -17.414 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -14.946 -7.626 -15.402 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -13.343 -7.128 -14.899 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -15.575 -4.336 -16.429 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -15.995 -4.075 -12.201 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -16.538 -2.987 -14.453 1.00 0.00 H new ATOM 1980 N LEU B 44 -11.464 -7.116 -17.456 1.00 0.00 N ATOM 1981 CA LEU B 44 -10.025 -6.902 -17.671 1.00 0.00 C ATOM 1982 C LEU B 44 -9.581 -7.099 -19.132 1.00 0.00 C ATOM 1983 O LEU B 44 -8.532 -6.575 -19.497 1.00 0.00 O ATOM 1984 CB LEU B 44 -9.219 -7.865 -16.765 1.00 0.00 C ATOM 1985 CG LEU B 44 -9.368 -7.628 -15.247 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -8.389 -8.439 -14.419 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -9.208 -6.161 -14.860 1.00 0.00 C ATOM 0 H LEU B 44 -11.751 -8.070 -17.676 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.828 -5.860 -17.418 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.525 -8.887 -16.987 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -8.164 -7.784 -17.026 1.00 0.00 H new ATOM 0 HG LEU B 44 -10.384 -7.956 -15.026 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.545 -8.228 -13.361 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.548 -9.501 -14.604 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.369 -8.172 -14.696 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.323 -6.055 -13.781 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -8.218 -5.812 -15.156 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -9.968 -5.566 -15.366 1.00 0.00 H new ATOM 1999 N GLY B 45 -10.330 -7.869 -19.929 1.00 0.00 N ATOM 2000 CA GLY B 45 -9.909 -8.366 -21.245 1.00 0.00 C ATOM 2001 C GLY B 45 -8.986 -9.587 -21.125 1.00 0.00 C ATOM 2002 O GLY B 45 -8.331 -9.948 -22.096 1.00 0.00 O ATOM 0 H GLY B 45 -11.269 -8.172 -19.671 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -10.788 -8.632 -21.832 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -9.393 -7.572 -21.785 1.00 0.00 H new ATOM 2006 N LEU B 46 -8.874 -10.194 -19.931 1.00 0.00 N ATOM 2007 CA LEU B 46 -7.867 -11.224 -19.632 1.00 0.00 C ATOM 2008 C LEU B 46 -8.500 -12.519 -19.110 1.00 0.00 C ATOM 2009 O LEU B 46 -9.326 -12.489 -18.202 1.00 0.00 O ATOM 2010 CB LEU B 46 -6.851 -10.663 -18.618 1.00 0.00 C ATOM 2011 CG LEU B 46 -6.044 -9.443 -19.117 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -5.183 -8.912 -17.963 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -5.141 -9.784 -20.312 1.00 0.00 C ATOM 0 H LEU B 46 -9.484 -9.982 -19.142 1.00 0.00 H new ATOM 0 HA LEU B 46 -7.356 -11.480 -20.560 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -7.383 -10.382 -17.709 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -6.154 -11.456 -18.347 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.755 -8.688 -19.454 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -4.609 -8.050 -18.304 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -5.827 -8.614 -17.136 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.501 -9.693 -17.629 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -4.597 -8.892 -20.623 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -4.432 -10.559 -20.023 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -5.753 -10.143 -21.140 1.00 0.00 H new ATOM 2025 N THR B 47 -8.073 -13.660 -19.672 1.00 0.00 N ATOM 2026 CA THR B 47 -8.674 -14.994 -19.495 1.00 0.00 C ATOM 2027 C THR B 47 -8.949 -15.401 -18.056 1.00 0.00 C ATOM 2028 O THR B 47 -8.175 -15.142 -17.132 1.00 0.00 O ATOM 2029 CB THR B 47 -7.868 -16.055 -20.260 1.00 0.00 C ATOM 2030 OG1 THR B 47 -8.456 -17.325 -20.076 1.00 0.00 O ATOM 2031 CG2 THR B 47 -6.410 -16.164 -19.815 1.00 0.00 C ATOM 0 H THR B 47 -7.262 -13.681 -20.291 1.00 0.00 H new ATOM 0 HA THR B 47 -9.671 -14.924 -19.931 1.00 0.00 H new ATOM 0 HB THR B 47 -7.883 -15.737 -21.302 1.00 0.00 H new ATOM 0 HG1 THR B 47 -7.940 -17.998 -20.567 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.907 -16.933 -20.401 1.00 0.00 H new ATOM 0 HG22 THR B 47 -5.910 -15.207 -19.968 1.00 0.00 H new ATOM 0 HG23 THR B 47 -6.371 -16.429 -18.758 1.00 0.00 H new ATOM 2039 N ARG B 48 -10.042 -16.156 -17.908 1.00 0.00 N ATOM 2040 CA ARG B 48 -10.537 -16.747 -16.661 1.00 0.00 C ATOM 2041 C ARG B 48 -9.441 -17.502 -15.892 1.00 0.00 C ATOM 2042 O ARG B 48 -9.423 -17.470 -14.662 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.713 -17.700 -16.960 1.00 0.00 C ATOM 2044 CG ARG B 48 -12.718 -17.172 -18.005 1.00 0.00 C ATOM 2045 CD ARG B 48 -14.013 -17.994 -18.099 1.00 0.00 C ATOM 2046 NE ARG B 48 -13.781 -19.453 -18.160 1.00 0.00 N ATOM 2047 CZ ARG B 48 -13.350 -20.175 -19.191 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -13.038 -19.646 -20.358 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -13.227 -21.478 -19.052 1.00 0.00 N ATOM 0 H ARG B 48 -10.640 -16.384 -18.702 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.873 -15.926 -16.028 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -11.312 -18.652 -17.309 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -12.247 -17.900 -16.031 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -12.972 -16.140 -17.761 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -12.236 -17.159 -18.983 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -14.640 -17.769 -17.236 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -14.567 -17.685 -18.985 1.00 0.00 H new ATOM 0 HE ARG B 48 -13.976 -19.971 -17.303 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -13.123 -18.640 -20.501 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -12.712 -20.243 -21.118 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -13.461 -21.920 -18.163 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -12.898 -22.045 -19.833 1.00 0.00 H new ATOM 2063 N SER B 49 -8.509 -18.155 -16.590 1.00 0.00 N ATOM 2064 CA SER B 49 -7.345 -18.809 -15.978 1.00 0.00 C ATOM 2065 C SER B 49 -6.459 -17.787 -15.251 1.00 0.00 C ATOM 2066 O SER B 49 -6.296 -17.859 -14.039 1.00 0.00 O ATOM 2067 CB SER B 49 -6.544 -19.563 -17.052 1.00 0.00 C ATOM 2068 OG SER B 49 -7.405 -20.325 -17.885 1.00 0.00 O ATOM 0 H SER B 49 -8.539 -18.247 -17.605 1.00 0.00 H new ATOM 0 HA SER B 49 -7.698 -19.526 -15.236 1.00 0.00 H new ATOM 0 HB2 SER B 49 -5.981 -18.852 -17.657 1.00 0.00 H new ATOM 0 HB3 SER B 49 -5.818 -20.221 -16.575 1.00 0.00 H new ATOM 0 HG SER B 49 -6.874 -20.795 -18.562 1.00 0.00 H new ATOM 2074 N ASN B 50 -5.947 -16.785 -15.970 1.00 0.00 N ATOM 2075 CA ASN B 50 -5.066 -15.750 -15.423 1.00 0.00 C ATOM 2076 C ASN B 50 -5.793 -14.884 -14.375 1.00 0.00 C ATOM 2077 O ASN B 50 -5.205 -14.519 -13.358 1.00 0.00 O ATOM 2078 CB ASN B 50 -4.533 -14.875 -16.575 1.00 0.00 C ATOM 2079 CG ASN B 50 -3.728 -15.624 -17.641 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -3.741 -16.844 -17.745 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -3.038 -14.901 -18.501 1.00 0.00 N ATOM 0 H ASN B 50 -6.136 -16.668 -16.965 1.00 0.00 H new ATOM 0 HA ASN B 50 -4.231 -16.235 -14.917 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -5.378 -14.384 -17.058 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.906 -14.089 -16.154 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -2.518 -15.358 -19.250 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -3.025 -13.884 -18.418 1.00 0.00 H new ATOM 2088 N VAL B 51 -7.082 -14.587 -14.589 1.00 0.00 N ATOM 2089 CA VAL B 51 -7.950 -13.959 -13.583 1.00 0.00 C ATOM 2090 C VAL B 51 -7.976 -14.777 -12.285 1.00 0.00 C ATOM 2091 O VAL B 51 -7.734 -14.226 -11.212 1.00 0.00 O ATOM 2092 CB VAL B 51 -9.370 -13.726 -14.156 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -10.521 -13.809 -13.136 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -9.429 -12.370 -14.877 1.00 0.00 C ATOM 0 H VAL B 51 -7.556 -14.777 -15.472 1.00 0.00 H new ATOM 0 HA VAL B 51 -7.536 -12.982 -13.332 1.00 0.00 H new ATOM 0 HB VAL B 51 -9.530 -14.555 -14.845 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -11.470 -13.631 -13.642 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -10.533 -14.799 -12.681 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -10.376 -13.056 -12.362 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -10.431 -12.214 -15.277 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -9.191 -11.573 -14.173 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -8.707 -12.360 -15.693 1.00 0.00 H new ATOM 2104 N SER B 52 -8.213 -16.091 -12.362 1.00 0.00 N ATOM 2105 CA SER B 52 -8.324 -16.926 -11.153 1.00 0.00 C ATOM 2106 C SER B 52 -6.991 -17.264 -10.481 1.00 0.00 C ATOM 2107 O SER B 52 -6.970 -17.409 -9.258 1.00 0.00 O ATOM 2108 CB SER B 52 -9.155 -18.192 -11.383 1.00 0.00 C ATOM 2109 OG SER B 52 -8.780 -18.920 -12.538 1.00 0.00 O ATOM 0 H SER B 52 -8.331 -16.599 -13.239 1.00 0.00 H new ATOM 0 HA SER B 52 -8.859 -16.289 -10.449 1.00 0.00 H new ATOM 0 HB2 SER B 52 -9.062 -18.839 -10.511 1.00 0.00 H new ATOM 0 HB3 SER B 52 -10.206 -17.915 -11.465 1.00 0.00 H new ATOM 0 HG SER B 52 -9.081 -18.441 -13.338 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.881 -17.267 -11.225 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.523 -17.374 -10.687 1.00 0.00 C ATOM 2117 C ASN B 53 -4.289 -16.338 -9.570 1.00 0.00 C ATOM 2118 O ASN B 53 -3.950 -16.676 -8.433 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.550 -17.222 -11.868 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.113 -17.540 -11.487 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.490 -16.832 -10.715 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -1.543 -18.599 -12.029 1.00 0.00 N ATOM 0 H ASN B 53 -5.903 -17.193 -12.242 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.359 -18.343 -10.216 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.862 -17.882 -12.678 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -3.604 -16.202 -12.249 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -0.575 -18.829 -11.803 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.070 -19.188 -12.674 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.637 -15.080 -9.838 1.00 0.00 N ATOM 2130 CA HIS B 54 -4.597 -14.009 -8.842 1.00 0.00 C ATOM 2131 C HIS B 54 -5.744 -14.032 -7.811 1.00 0.00 C ATOM 2132 O HIS B 54 -5.535 -13.484 -6.726 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.536 -12.665 -9.579 1.00 0.00 C ATOM 2134 CG HIS B 54 -3.157 -12.304 -10.081 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -2.065 -11.911 -9.330 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.769 -12.247 -11.390 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -1.073 -11.583 -10.174 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -1.470 -11.749 -11.444 1.00 0.00 N ATOM 0 H HIS B 54 -4.956 -14.773 -10.757 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.703 -14.167 -8.239 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -5.224 -12.694 -10.424 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.886 -11.879 -8.910 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -2.020 -11.876 -8.312 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -3.369 -12.539 -12.239 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -0.096 -11.235 -9.873 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.907 -14.658 -8.080 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.948 -14.853 -7.047 1.00 0.00 C ATOM 2148 C LEU B 55 -7.502 -15.829 -5.951 1.00 0.00 C ATOM 2149 O LEU B 55 -8.060 -15.797 -4.859 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.297 -15.356 -7.603 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.050 -14.415 -8.560 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.242 -15.173 -9.160 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.563 -13.170 -7.828 1.00 0.00 C ATOM 0 H LEU B 55 -7.150 -15.035 -8.996 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.093 -13.855 -6.634 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.120 -16.298 -8.123 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.951 -15.576 -6.759 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.363 -14.091 -9.342 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.785 -14.517 -9.841 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.881 -16.045 -9.706 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.908 -15.496 -8.360 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -11.090 -12.526 -8.532 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.243 -13.471 -7.031 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.721 -12.627 -7.400 1.00 0.00 H new ATOM 2165 N SER B 56 -6.547 -16.719 -6.209 1.00 0.00 N ATOM 2166 CA SER B 56 -6.052 -17.655 -5.188 1.00 0.00 C ATOM 2167 C SER B 56 -5.404 -16.907 -4.010 1.00 0.00 C ATOM 2168 O SER B 56 -5.856 -17.015 -2.868 1.00 0.00 O ATOM 2169 CB SER B 56 -5.064 -18.640 -5.829 1.00 0.00 C ATOM 2170 OG SER B 56 -4.823 -19.719 -4.946 1.00 0.00 O ATOM 0 H SER B 56 -6.095 -16.816 -7.118 1.00 0.00 H new ATOM 0 HA SER B 56 -6.897 -18.213 -4.786 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.467 -19.012 -6.771 1.00 0.00 H new ATOM 0 HB3 SER B 56 -4.128 -18.132 -6.061 1.00 0.00 H new ATOM 0 HG SER B 56 -4.193 -20.346 -5.360 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.439 -16.029 -4.300 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.705 -15.250 -3.303 1.00 0.00 C ATOM 2178 C CYS B 57 -4.493 -13.975 -2.873 1.00 0.00 C ATOM 2179 O CYS B 57 -3.954 -13.028 -2.299 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.304 -15.107 -3.925 1.00 0.00 C ATOM 2181 SG CYS B 57 -0.994 -14.156 -3.086 1.00 0.00 S ATOM 0 H CYS B 57 -4.141 -15.837 -5.256 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.587 -15.708 -2.321 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.918 -16.115 -4.077 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.437 -14.664 -4.912 1.00 0.00 H new ATOM 0 HG CYS B 57 0.141 -14.356 -3.688 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.790 -13.956 -3.203 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.798 -12.968 -2.812 1.00 0.00 C ATOM 2188 C LEU B 58 -7.743 -13.517 -1.738 1.00 0.00 C ATOM 2189 O LEU B 58 -7.964 -12.871 -0.713 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.587 -12.593 -4.086 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.685 -11.094 -4.377 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.301 -10.557 -4.713 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.611 -10.859 -5.572 1.00 0.00 C ATOM 0 H LEU B 58 -6.190 -14.685 -3.794 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.312 -12.094 -2.379 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -7.119 -13.082 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.596 -12.996 -4.001 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.083 -10.583 -3.500 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.366 -9.489 -4.921 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.632 -10.722 -3.869 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.913 -11.075 -5.590 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.678 -9.790 -5.776 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -8.212 -11.371 -6.448 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.604 -11.248 -5.345 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.308 -14.702 -1.995 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.383 -15.304 -1.196 1.00 0.00 C ATOM 2207 C ARG B 59 -8.850 -16.178 -0.049 1.00 0.00 C ATOM 2208 O ARG B 59 -9.638 -16.622 0.782 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.307 -16.122 -2.119 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.889 -15.354 -3.333 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.657 -16.244 -4.308 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.911 -17.451 -4.720 1.00 0.00 N ATOM 2213 CZ ARG B 59 -11.277 -18.707 -4.472 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -12.322 -18.999 -3.715 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -10.593 -19.707 -4.988 1.00 0.00 N ATOM 0 H ARG B 59 -8.024 -15.284 -2.783 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.945 -14.495 -0.730 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -9.751 -16.984 -2.489 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.135 -16.508 -1.525 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.552 -14.568 -2.971 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.075 -14.863 -3.866 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.597 -16.548 -3.847 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.910 -15.663 -5.195 1.00 0.00 H new ATOM 0 HE ARG B 59 -10.043 -17.310 -5.238 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.876 -18.250 -3.300 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -12.573 -19.973 -3.546 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -9.782 -19.520 -5.578 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.874 -20.669 -4.798 1.00 0.00 H new ATOM 2229 N GLY B 60 -7.534 -16.434 -0.003 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.836 -17.107 1.103 1.00 0.00 C ATOM 2231 C GLY B 60 -5.994 -16.154 1.957 1.00 0.00 C ATOM 2232 O GLY B 60 -5.842 -16.373 3.158 1.00 0.00 O ATOM 0 H GLY B 60 -6.905 -16.169 -0.761 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -7.570 -17.602 1.739 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.191 -17.885 0.696 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.485 -15.082 1.341 1.00 0.00 N ATOM 2237 CA CYS B 61 -4.801 -13.967 1.984 1.00 0.00 C ATOM 2238 C CYS B 61 -5.773 -12.844 2.472 1.00 0.00 C ATOM 2239 O CYS B 61 -5.333 -11.750 2.826 1.00 0.00 O ATOM 2240 CB CYS B 61 -3.738 -13.492 0.978 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.328 -14.612 0.672 1.00 0.00 S ATOM 0 H CYS B 61 -5.545 -14.968 0.329 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.326 -14.278 2.914 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.233 -13.303 0.026 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -3.343 -12.538 1.327 1.00 0.00 H new ATOM 0 HG CYS B 61 -1.231 -13.919 0.600 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.092 -13.093 2.426 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.169 -12.267 3.006 1.00 0.00 C ATOM 2248 C GLY B 62 -8.580 -11.010 2.227 1.00 0.00 C ATOM 2249 O GLY B 62 -9.660 -10.490 2.478 1.00 0.00 O ATOM 0 H GLY B 62 -7.458 -13.922 1.957 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.052 -12.896 3.124 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -7.860 -11.960 4.005 1.00 0.00 H new ATOM 2253 N LEU B 63 -7.792 -10.560 1.239 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.039 -9.376 0.387 1.00 0.00 C ATOM 2255 C LEU B 63 -9.447 -9.300 -0.221 1.00 0.00 C ATOM 2256 O LEU B 63 -9.943 -8.207 -0.497 1.00 0.00 O ATOM 2257 CB LEU B 63 -6.993 -9.373 -0.719 1.00 0.00 C ATOM 2258 CG LEU B 63 -5.574 -9.155 -0.168 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -4.653 -9.229 -1.368 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -5.400 -7.788 0.506 1.00 0.00 C ATOM 0 H LEU B 63 -6.921 -11.032 0.997 1.00 0.00 H new ATOM 0 HA LEU B 63 -7.965 -8.498 1.028 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.032 -10.320 -1.257 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.228 -8.588 -1.438 1.00 0.00 H new ATOM 0 HG LEU B 63 -5.359 -9.905 0.593 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -3.622 -9.081 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -4.749 -10.207 -1.840 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -4.924 -8.452 -2.083 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -4.379 -7.692 0.875 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.600 -6.998 -0.217 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.097 -7.702 1.340 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.081 -10.452 -0.393 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.467 -10.618 -0.828 1.00 0.00 C ATOM 2274 C VAL B 64 -12.187 -11.686 -0.017 1.00 0.00 C ATOM 2275 O VAL B 64 -11.594 -12.674 0.413 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.547 -11.009 -2.315 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.286 -9.793 -3.200 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.564 -12.102 -2.659 1.00 0.00 C ATOM 0 H VAL B 64 -9.620 -11.346 -0.224 1.00 0.00 H new ATOM 0 HA VAL B 64 -11.951 -9.654 -0.673 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.554 -11.385 -2.497 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.346 -10.086 -4.248 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.033 -9.026 -2.994 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.292 -9.397 -2.990 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.651 -12.350 -3.717 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.551 -11.759 -2.449 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.779 -12.987 -2.060 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.497 -11.492 0.104 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.477 -12.438 0.657 1.00 0.00 C ATOM 2290 C VAL B 65 -15.496 -12.784 -0.436 1.00 0.00 C ATOM 2291 O VAL B 65 -15.784 -11.974 -1.317 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.174 -11.852 1.912 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.244 -12.801 2.483 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.148 -11.546 3.017 1.00 0.00 C ATOM 0 H VAL B 65 -13.934 -10.621 -0.197 1.00 0.00 H new ATOM 0 HA VAL B 65 -13.966 -13.347 0.976 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.661 -10.932 1.589 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -16.703 -12.346 3.361 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.008 -12.984 1.728 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -15.779 -13.746 2.766 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.661 -11.136 3.887 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.633 -12.464 3.299 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.422 -10.821 2.649 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.032 -14.005 -0.406 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.024 -14.504 -1.357 1.00 0.00 C ATOM 2306 C ALA B 66 -18.405 -14.702 -0.713 1.00 0.00 C ATOM 2307 O ALA B 66 -18.498 -15.390 0.302 1.00 0.00 O ATOM 2308 CB ALA B 66 -16.469 -15.829 -1.901 1.00 0.00 C ATOM 0 H ALA B 66 -15.780 -14.694 0.302 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.181 -13.779 -2.155 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.172 -16.250 -2.620 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -15.512 -15.649 -2.391 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -16.328 -16.530 -1.078 1.00 0.00 H new ATOM 2314 N THR B 67 -19.484 -14.263 -1.382 1.00 0.00 N ATOM 2315 CA THR B 67 -20.888 -14.447 -0.939 1.00 0.00 C ATOM 2316 C THR B 67 -21.685 -15.230 -1.975 1.00 0.00 C ATOM 2317 O THR B 67 -21.127 -15.646 -2.988 1.00 0.00 O ATOM 2318 CB THR B 67 -21.612 -13.097 -0.680 1.00 0.00 C ATOM 2319 OG1 THR B 67 -22.218 -12.555 -1.839 1.00 0.00 O ATOM 2320 CG2 THR B 67 -20.708 -11.989 -0.165 1.00 0.00 C ATOM 0 H THR B 67 -19.410 -13.759 -2.266 1.00 0.00 H new ATOM 0 HA THR B 67 -20.839 -15.000 -0.001 1.00 0.00 H new ATOM 0 HB THR B 67 -22.348 -13.380 0.072 1.00 0.00 H new ATOM 0 HG1 THR B 67 -23.162 -12.816 -1.867 1.00 0.00 H new ATOM 0 HG21 THR B 67 -21.294 -11.083 -0.011 1.00 0.00 H new ATOM 0 HG22 THR B 67 -20.259 -12.295 0.780 1.00 0.00 H new ATOM 0 HG23 THR B 67 -19.921 -11.793 -0.894 1.00 0.00 H new ATOM 2328 N TYR B 68 -22.971 -15.429 -1.697 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.008 -15.783 -2.671 1.00 0.00 C ATOM 2330 C TYR B 68 -24.699 -14.439 -3.023 1.00 0.00 C ATOM 2331 O TYR B 68 -24.889 -13.627 -2.114 1.00 0.00 O ATOM 2332 CB TYR B 68 -24.977 -16.812 -2.059 1.00 0.00 C ATOM 2333 CG TYR B 68 -25.801 -17.572 -3.086 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -25.266 -18.730 -3.686 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.084 -17.129 -3.459 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.965 -19.395 -4.711 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.803 -17.809 -4.463 1.00 0.00 C ATOM 2338 CZ TYR B 68 -27.232 -18.922 -5.118 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.900 -19.547 -6.128 1.00 0.00 O ATOM 0 H TYR B 68 -23.337 -15.345 -0.749 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.613 -16.256 -3.570 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -24.406 -17.526 -1.466 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -25.652 -16.298 -1.375 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -24.311 -19.111 -3.356 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -27.518 -16.267 -2.975 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.534 -20.264 -5.185 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.795 -17.477 -4.732 1.00 0.00 H new ATOM 0 HH TYR B 68 -28.756 -19.096 -6.282 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.969 -14.130 -4.293 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.678 -12.894 -4.706 1.00 0.00 C ATOM 2351 C GLU B 69 -27.193 -13.062 -4.969 1.00 0.00 C ATOM 2352 O GLU B 69 -27.913 -12.065 -5.005 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.939 -12.129 -5.832 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.226 -12.894 -6.960 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.159 -13.512 -7.994 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.346 -13.706 -7.680 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -24.690 -13.933 -9.069 1.00 0.00 O ATOM 0 H GLU B 69 -24.705 -14.727 -5.077 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.643 -12.255 -3.824 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.667 -11.468 -6.302 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.194 -11.494 -5.353 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.542 -12.213 -7.467 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -23.619 -13.685 -6.518 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.701 -14.300 -5.050 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.130 -14.614 -5.226 1.00 0.00 C ATOM 2366 C GLY B 70 -29.419 -15.357 -6.531 1.00 0.00 C ATOM 2367 O GLY B 70 -30.280 -16.235 -6.565 1.00 0.00 O ATOM 0 H GLY B 70 -27.116 -15.134 -4.994 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.470 -15.220 -4.386 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.706 -13.689 -5.205 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.671 -15.048 -7.590 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.627 -15.786 -8.853 1.00 0.00 C ATOM 2373 C ARG B 71 -27.441 -16.770 -8.890 1.00 0.00 C ATOM 2374 O ARG B 71 -27.579 -17.863 -9.453 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.562 -14.773 -10.015 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.587 -15.363 -11.441 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.842 -16.185 -11.788 1.00 0.00 C ATOM 2378 NE ARG B 71 -29.808 -17.502 -11.132 1.00 0.00 N ATOM 2379 CZ ARG B 71 -30.757 -18.058 -10.391 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -32.018 -17.684 -10.456 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -30.409 -18.989 -9.531 1.00 0.00 N ATOM 0 H ARG B 71 -28.050 -14.239 -7.591 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.529 -16.389 -8.952 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.401 -14.084 -9.915 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -27.651 -14.184 -9.905 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.498 -14.546 -12.157 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -27.710 -15.997 -11.570 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -30.734 -15.642 -11.476 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -29.909 -16.314 -12.868 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.957 -18.050 -11.262 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -32.297 -16.939 -11.095 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -32.716 -18.139 -9.868 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -29.431 -19.266 -9.447 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -31.117 -19.435 -8.947 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.312 -16.401 -8.295 1.00 0.00 N ATOM 2396 CA GLN B 72 -25.046 -17.125 -8.240 1.00 0.00 C ATOM 2397 C GLN B 72 -24.233 -16.695 -6.996 1.00 0.00 C ATOM 2398 O GLN B 72 -24.786 -16.490 -5.919 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.301 -16.959 -9.591 1.00 0.00 C ATOM 2400 CG GLN B 72 -23.457 -18.188 -9.955 1.00 0.00 C ATOM 2401 CD GLN B 72 -24.340 -19.415 -10.140 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -24.460 -20.260 -9.271 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -25.054 -19.511 -11.236 1.00 0.00 N ATOM 0 H GLN B 72 -26.254 -15.513 -7.797 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.214 -18.195 -8.113 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -25.028 -16.775 -10.382 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.656 -16.082 -9.540 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -22.900 -17.994 -10.872 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -22.724 -18.377 -9.171 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -24.960 -18.808 -11.969 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -25.703 -20.289 -11.355 1.00 0.00 H new ATOM 2412 N VAL B 73 -22.913 -16.578 -7.119 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.941 -16.298 -6.048 1.00 0.00 C ATOM 2414 C VAL B 73 -20.987 -15.216 -6.530 1.00 0.00 C ATOM 2415 O VAL B 73 -20.780 -15.118 -7.737 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.140 -17.558 -5.635 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.020 -18.564 -4.883 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.440 -18.274 -6.803 1.00 0.00 C ATOM 0 H VAL B 73 -22.457 -16.682 -8.026 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.490 -15.967 -5.167 1.00 0.00 H new ATOM 0 HB VAL B 73 -20.358 -17.179 -4.977 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -21.424 -19.435 -4.609 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.417 -18.098 -3.981 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -22.845 -18.876 -5.523 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -19.903 -19.144 -6.427 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -21.184 -18.594 -7.532 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -19.736 -17.591 -7.279 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.398 -14.419 -5.629 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.573 -13.262 -6.013 1.00 0.00 C ATOM 2430 C ARG B 74 -18.284 -13.198 -5.210 1.00 0.00 C ATOM 2431 O ARG B 74 -18.114 -13.926 -4.232 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.387 -11.965 -5.868 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.332 -11.327 -4.470 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.542 -10.419 -4.268 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.495 -9.700 -2.985 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.474 -8.380 -2.812 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.457 -7.550 -3.837 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -21.475 -7.877 -1.594 1.00 0.00 N ATOM 0 H ARG B 74 -20.478 -14.555 -4.621 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.287 -13.380 -7.058 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -20.025 -11.241 -6.598 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.427 -12.175 -6.116 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -20.317 -12.104 -3.706 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.412 -10.753 -4.358 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -21.592 -9.698 -5.084 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.453 -11.016 -4.314 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.477 -10.272 -2.141 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.460 -7.915 -4.789 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.441 -6.543 -3.677 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -21.492 -8.499 -0.786 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -21.459 -6.866 -1.460 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.421 -12.258 -5.580 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.245 -11.860 -4.805 1.00 0.00 C ATOM 2454 C TYR B 75 -16.337 -10.365 -4.489 1.00 0.00 C ATOM 2455 O TYR B 75 -16.832 -9.598 -5.309 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.961 -12.200 -5.576 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.807 -13.671 -5.906 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.951 -14.627 -4.885 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.536 -14.092 -7.222 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.857 -16.000 -5.171 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.417 -15.465 -7.513 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.581 -16.423 -6.488 1.00 0.00 C ATOM 2463 OH TYR B 75 -14.464 -17.752 -6.746 1.00 0.00 O ATOM 0 H TYR B 75 -17.520 -11.736 -6.451 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.214 -12.411 -3.865 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.945 -11.627 -6.503 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.101 -11.879 -4.988 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -15.136 -14.303 -3.871 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.419 -13.362 -8.009 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.996 -16.728 -4.386 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -14.200 -15.786 -8.521 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.274 -17.885 -7.698 1.00 0.00 H new ATOM 2473 N ALA B 76 -15.921 -9.963 -3.296 1.00 0.00 N ATOM 2474 CA ALA B 76 -15.970 -8.588 -2.817 1.00 0.00 C ATOM 2475 C ALA B 76 -14.719 -8.305 -1.990 1.00 0.00 C ATOM 2476 O ALA B 76 -14.244 -9.209 -1.305 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.250 -8.400 -1.988 1.00 0.00 C ATOM 0 H ALA B 76 -15.526 -10.608 -2.611 1.00 0.00 H new ATOM 0 HA ALA B 76 -15.992 -7.885 -3.649 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.300 -7.374 -1.623 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.120 -8.606 -2.611 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.239 -9.086 -1.141 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.206 -7.075 -2.065 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.072 -6.603 -1.272 1.00 0.00 C ATOM 2485 C LEU B 77 -13.295 -6.873 0.227 1.00 0.00 C ATOM 2486 O LEU B 77 -14.437 -6.799 0.676 1.00 0.00 O ATOM 2487 CB LEU B 77 -12.902 -5.095 -1.547 1.00 0.00 C ATOM 2488 CG LEU B 77 -11.453 -4.673 -1.755 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -10.823 -5.189 -3.037 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.459 -3.156 -1.872 1.00 0.00 C ATOM 0 H LEU B 77 -14.578 -6.364 -2.694 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.166 -7.139 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.480 -4.828 -2.432 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.319 -4.532 -0.712 1.00 0.00 H new ATOM 0 HG LEU B 77 -10.879 -5.077 -0.921 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -9.792 -4.840 -3.102 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -10.838 -6.279 -3.037 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.386 -4.819 -3.894 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.440 -2.799 -2.023 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -12.077 -2.859 -2.719 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -11.864 -2.722 -0.958 1.00 0.00 H new ATOM 2502 N ALA B 78 -12.224 -7.143 0.981 1.00 0.00 N ATOM 2503 CA ALA B 78 -12.278 -7.513 2.405 1.00 0.00 C ATOM 2504 C ALA B 78 -13.136 -6.585 3.287 1.00 0.00 C ATOM 2505 O ALA B 78 -13.892 -7.052 4.132 1.00 0.00 O ATOM 2506 CB ALA B 78 -10.838 -7.519 2.935 1.00 0.00 C ATOM 0 H ALA B 78 -11.273 -7.110 0.613 1.00 0.00 H new ATOM 0 HA ALA B 78 -12.759 -8.489 2.462 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -10.840 -7.790 3.991 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -10.247 -8.244 2.375 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -10.402 -6.527 2.816 1.00 0.00 H new ATOM 2512 N ASP B 79 -13.003 -5.272 3.071 1.00 0.00 N ATOM 2513 CA ASP B 79 -13.632 -4.206 3.850 1.00 0.00 C ATOM 2514 C ASP B 79 -13.482 -2.852 3.135 1.00 0.00 C ATOM 2515 O ASP B 79 -12.626 -2.649 2.265 1.00 0.00 O ATOM 2516 CB ASP B 79 -13.042 -4.169 5.287 1.00 0.00 C ATOM 2517 CG ASP B 79 -13.442 -2.930 6.107 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -14.648 -2.594 6.176 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -12.526 -2.170 6.486 1.00 0.00 O ATOM 0 H ASP B 79 -12.426 -4.909 2.312 1.00 0.00 H new ATOM 0 HA ASP B 79 -14.699 -4.412 3.935 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -13.364 -5.063 5.822 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -11.955 -4.211 5.221 1.00 0.00 H new ATOM 2524 N SER B 80 -14.304 -1.905 3.580 1.00 0.00 N ATOM 2525 CA SER B 80 -14.247 -0.471 3.302 1.00 0.00 C ATOM 2526 C SER B 80 -12.817 0.100 3.316 1.00 0.00 C ATOM 2527 O SER B 80 -12.496 0.966 2.500 1.00 0.00 O ATOM 2528 CB SER B 80 -15.094 0.250 4.364 1.00 0.00 C ATOM 2529 OG SER B 80 -14.533 0.138 5.665 1.00 0.00 O ATOM 0 H SER B 80 -15.087 -2.137 4.191 1.00 0.00 H new ATOM 0 HA SER B 80 -14.631 -0.311 2.294 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.186 1.303 4.099 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.101 -0.167 4.367 1.00 0.00 H new ATOM 0 HG SER B 80 -14.617 -0.786 5.979 1.00 0.00 H new ATOM 2535 N HIS B 81 -11.932 -0.427 4.172 1.00 0.00 N ATOM 2536 CA HIS B 81 -10.524 -0.056 4.231 1.00 0.00 C ATOM 2537 C HIS B 81 -9.771 -0.287 2.925 1.00 0.00 C ATOM 2538 O HIS B 81 -9.161 0.653 2.409 1.00 0.00 O ATOM 2539 CB HIS B 81 -9.871 -0.807 5.404 1.00 0.00 C ATOM 2540 CG HIS B 81 -9.972 -0.070 6.711 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -10.224 1.278 6.861 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -9.399 -0.511 7.866 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -9.699 1.672 8.027 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -9.264 0.587 8.701 1.00 0.00 N ATOM 0 H HIS B 81 -12.187 -1.139 4.856 1.00 0.00 H new ATOM 0 HA HIS B 81 -10.466 1.020 4.393 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -10.342 -1.784 5.508 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -8.820 -0.983 5.174 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -10.724 1.871 6.198 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -9.105 -1.526 8.089 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -9.634 2.693 8.373 1.00 0.00 H new ATOM 2553 N LEU B 82 -9.786 -1.502 2.362 1.00 0.00 N ATOM 2554 CA LEU B 82 -9.118 -1.724 1.069 1.00 0.00 C ATOM 2555 C LEU B 82 -9.841 -0.943 -0.026 1.00 0.00 C ATOM 2556 O LEU B 82 -9.190 -0.454 -0.939 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.000 -3.209 0.680 1.00 0.00 C ATOM 2558 CG LEU B 82 -8.520 -4.183 1.767 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.391 -5.585 1.162 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -7.178 -3.768 2.387 1.00 0.00 C ATOM 0 H LEU B 82 -10.237 -2.324 2.764 1.00 0.00 H new ATOM 0 HA LEU B 82 -8.096 -1.361 1.179 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -9.976 -3.546 0.332 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.317 -3.283 -0.166 1.00 0.00 H new ATOM 0 HG LEU B 82 -9.260 -4.171 2.567 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.051 -6.282 1.928 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.360 -5.908 0.782 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -7.670 -5.564 0.345 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -6.889 -4.493 3.148 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -6.414 -3.733 1.611 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -7.277 -2.783 2.843 1.00 0.00 H new ATOM 2572 N ALA B 83 -11.159 -0.753 0.090 1.00 0.00 N ATOM 2573 CA ALA B 83 -11.943 0.004 -0.887 1.00 0.00 C ATOM 2574 C ALA B 83 -11.477 1.476 -0.893 1.00 0.00 C ATOM 2575 O ALA B 83 -11.443 2.087 -1.952 1.00 0.00 O ATOM 2576 CB ALA B 83 -13.432 -0.172 -0.578 1.00 0.00 C ATOM 0 H ALA B 83 -11.711 -1.120 0.865 1.00 0.00 H new ATOM 0 HA ALA B 83 -11.785 -0.371 -1.898 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.023 0.389 -1.302 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.694 -1.228 -0.637 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -13.641 0.198 0.426 1.00 0.00 H new ATOM 2582 N ARG B 84 -11.032 2.017 0.253 1.00 0.00 N ATOM 2583 CA ARG B 84 -10.332 3.307 0.354 1.00 0.00 C ATOM 2584 C ARG B 84 -8.913 3.212 -0.219 1.00 0.00 C ATOM 2585 O ARG B 84 -8.618 3.925 -1.169 1.00 0.00 O ATOM 2586 CB ARG B 84 -10.293 3.791 1.826 1.00 0.00 C ATOM 2587 CG ARG B 84 -11.227 4.973 2.112 1.00 0.00 C ATOM 2588 CD ARG B 84 -10.687 6.298 1.549 1.00 0.00 C ATOM 2589 NE ARG B 84 -11.630 7.405 1.782 1.00 0.00 N ATOM 2590 CZ ARG B 84 -11.834 8.062 2.922 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -11.115 7.877 4.007 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -12.813 8.941 2.988 1.00 0.00 N ATOM 0 H ARG B 84 -11.152 1.558 1.156 1.00 0.00 H new ATOM 0 HA ARG B 84 -10.885 4.037 -0.237 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -10.562 2.961 2.479 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -9.272 4.077 2.078 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.207 4.771 1.680 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -11.367 5.069 3.189 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -9.729 6.530 2.015 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -10.504 6.193 0.480 1.00 0.00 H new ATOM 0 HE ARG B 84 -12.189 7.701 0.982 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -10.353 7.199 4.004 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -11.320 8.411 4.852 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -13.402 9.110 2.173 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.982 9.452 3.854 1.00 0.00 H new ATOM 2606 N ALA B 85 -8.053 2.311 0.272 1.00 0.00 N ATOM 2607 CA ALA B 85 -6.656 2.200 -0.185 1.00 0.00 C ATOM 2608 C ALA B 85 -6.507 1.998 -1.707 1.00 0.00 C ATOM 2609 O ALA B 85 -5.548 2.483 -2.314 1.00 0.00 O ATOM 2610 CB ALA B 85 -5.965 1.065 0.592 1.00 0.00 C ATOM 0 H ALA B 85 -8.302 1.638 0.996 1.00 0.00 H new ATOM 0 HA ALA B 85 -6.172 3.154 0.022 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -4.930 0.975 0.261 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -5.987 1.289 1.659 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.488 0.127 0.407 1.00 0.00 H new ATOM 2616 N LEU B 86 -7.467 1.309 -2.327 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.550 1.158 -3.772 1.00 0.00 C ATOM 2618 C LEU B 86 -8.333 2.292 -4.459 1.00 0.00 C ATOM 2619 O LEU B 86 -7.935 2.725 -5.535 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.144 -0.229 -4.087 1.00 0.00 C ATOM 2621 CG LEU B 86 -7.328 -0.976 -5.156 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -8.083 -2.259 -5.483 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -7.078 -0.179 -6.446 1.00 0.00 C ATOM 0 H LEU B 86 -8.218 0.834 -1.827 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.543 1.230 -4.184 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.178 -0.825 -3.175 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.172 -0.114 -4.431 1.00 0.00 H new ATOM 0 HG LEU B 86 -6.336 -1.163 -4.744 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.536 -2.820 -6.240 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -8.179 -2.864 -4.582 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -9.075 -2.011 -5.861 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -6.496 -0.784 -7.141 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -8.032 0.081 -6.904 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -6.528 0.732 -6.210 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.409 2.790 -3.841 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.356 3.745 -4.442 1.00 0.00 C ATOM 2637 C GLY B 87 -9.882 5.208 -4.397 1.00 0.00 C ATOM 2638 O GLY B 87 -10.003 5.916 -5.391 1.00 0.00 O ATOM 0 H GLY B 87 -9.655 2.536 -2.884 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.532 3.462 -5.480 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.312 3.667 -3.924 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.321 5.646 -3.266 1.00 0.00 N ATOM 2643 CA GLU B 88 -8.557 6.908 -3.135 1.00 0.00 C ATOM 2644 C GLU B 88 -7.209 6.738 -3.873 1.00 0.00 C ATOM 2645 O GLU B 88 -6.711 7.657 -4.523 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.376 7.190 -1.626 1.00 0.00 C ATOM 2647 CG GLU B 88 -7.340 8.235 -1.199 1.00 0.00 C ATOM 2648 CD GLU B 88 -7.679 9.674 -1.569 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -8.867 10.069 -1.547 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -6.711 10.435 -1.794 1.00 0.00 O ATOM 0 H GLU B 88 -9.382 5.126 -2.390 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.073 7.758 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -9.343 7.499 -1.228 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -8.117 6.249 -1.141 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -7.212 8.175 -0.118 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -6.381 7.977 -1.649 1.00 0.00 H new ATOM 2657 N LEU B 89 -6.677 5.509 -3.784 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.568 4.895 -4.511 1.00 0.00 C ATOM 2659 C LEU B 89 -4.251 5.045 -3.751 1.00 0.00 C ATOM 2660 O LEU B 89 -3.908 6.103 -3.234 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.482 5.390 -5.978 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.571 4.579 -6.923 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -5.031 3.127 -7.108 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -4.491 5.272 -8.289 1.00 0.00 C ATOM 0 H LEU B 89 -7.067 4.845 -3.116 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.770 3.826 -4.573 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.489 5.396 -6.396 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.133 6.423 -5.970 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.587 4.543 -6.455 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -4.348 2.612 -7.784 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -5.036 2.621 -6.142 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -6.036 3.115 -7.530 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.847 4.695 -8.952 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -5.489 5.340 -8.722 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -4.080 6.274 -8.165 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.413 4.015 -3.851 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.018 3.979 -3.375 1.00 0.00 C ATOM 2678 C VAL B 90 -1.155 5.134 -3.894 1.00 0.00 C ATOM 2679 O VAL B 90 -0.030 5.315 -3.434 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.312 2.681 -3.824 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.642 1.513 -2.887 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -1.649 2.308 -5.281 1.00 0.00 C ATOM 0 H VAL B 90 -3.695 3.137 -4.286 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.103 4.050 -2.291 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.241 2.877 -3.772 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -1.129 0.615 -3.231 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -1.313 1.754 -1.876 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.718 1.339 -2.887 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.129 1.389 -5.551 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -2.724 2.159 -5.379 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -1.332 3.112 -5.945 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.627 5.847 -4.923 1.00 0.00 N ATOM 2693 CA GLN B 91 -0.972 6.970 -5.589 1.00 0.00 C ATOM 2694 C GLN B 91 0.324 6.590 -6.330 1.00 0.00 C ATOM 2695 O GLN B 91 0.766 7.365 -7.165 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.741 8.100 -4.577 1.00 0.00 C ATOM 2697 CG GLN B 91 -1.972 9.004 -4.376 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.194 10.059 -5.454 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -1.599 11.123 -5.445 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.042 9.816 -6.431 1.00 0.00 N ATOM 0 H GLN B 91 -2.536 5.638 -5.337 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.645 7.315 -6.374 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.458 7.666 -3.618 1.00 0.00 H new ATOM 0 HB3 GLN B 91 0.098 8.711 -4.911 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.859 8.373 -4.321 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.879 9.507 -3.414 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -3.550 8.932 -6.457 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -3.191 10.512 -7.162 1.00 0.00 H new ATOM 2709 N VAL B 92 0.886 5.395 -6.102 1.00 0.00 N ATOM 2710 CA VAL B 92 2.117 4.783 -6.662 1.00 0.00 C ATOM 2711 C VAL B 92 2.199 4.628 -8.190 1.00 0.00 C ATOM 2712 O VAL B 92 2.932 3.797 -8.713 1.00 0.00 O ATOM 2713 CB VAL B 92 2.402 3.460 -5.901 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.658 2.237 -6.468 1.00 0.00 C ATOM 2715 CG2 VAL B 92 3.896 3.178 -5.761 1.00 0.00 C ATOM 0 H VAL B 92 0.443 4.753 -5.445 1.00 0.00 H new ATOM 0 HA VAL B 92 2.912 5.509 -6.493 1.00 0.00 H new ATOM 0 HB VAL B 92 1.996 3.625 -4.903 1.00 0.00 H new ATOM 0 HG11 VAL B 92 1.910 1.354 -5.882 1.00 0.00 H new ATOM 0 HG12 VAL B 92 0.583 2.410 -6.419 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.953 2.080 -7.505 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.041 2.242 -5.222 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.346 3.100 -6.751 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.370 3.991 -5.210 1.00 0.00 H new ATOM 2725 N VAL B 93 1.448 5.460 -8.907 1.00 0.00 N ATOM 2726 CA VAL B 93 1.468 5.633 -10.364 1.00 0.00 C ATOM 2727 C VAL B 93 0.987 4.356 -11.089 1.00 0.00 C ATOM 2728 O VAL B 93 1.175 4.236 -12.294 1.00 0.00 O ATOM 2729 CB VAL B 93 2.861 6.127 -10.867 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.699 6.964 -12.145 1.00 0.00 C ATOM 2731 CG2 VAL B 93 3.582 7.068 -9.872 1.00 0.00 C ATOM 0 H VAL B 93 0.765 6.072 -8.461 1.00 0.00 H new ATOM 0 HA VAL B 93 0.757 6.420 -10.617 1.00 0.00 H new ATOM 0 HB VAL B 93 3.441 5.215 -11.012 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.678 7.302 -12.485 1.00 0.00 H new ATOM 0 HG12 VAL B 93 2.235 6.356 -12.922 1.00 0.00 H new ATOM 0 HG13 VAL B 93 2.069 7.829 -11.936 1.00 0.00 H new ATOM 0 HG21 VAL B 93 4.543 7.371 -10.288 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.968 7.951 -9.697 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.744 6.546 -8.929 1.00 0.00 H new ATOM 2741 N LEU B 94 0.365 3.425 -10.337 1.00 0.00 N ATOM 2742 CA LEU B 94 0.043 2.042 -10.709 1.00 0.00 C ATOM 2743 C LEU B 94 1.326 1.198 -10.574 1.00 0.00 C ATOM 2744 O LEU B 94 2.319 1.404 -11.270 1.00 0.00 O ATOM 2745 CB LEU B 94 -0.604 1.935 -12.115 1.00 0.00 C ATOM 2746 CG LEU B 94 -1.521 0.721 -12.389 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -0.841 -0.639 -12.185 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -2.813 0.784 -11.557 1.00 0.00 C ATOM 0 H LEU B 94 0.055 3.640 -9.389 1.00 0.00 H new ATOM 0 HA LEU B 94 -0.717 1.652 -10.032 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -1.185 2.841 -12.288 1.00 0.00 H new ATOM 0 HB3 LEU B 94 0.197 1.925 -12.854 1.00 0.00 H new ATOM 0 HG LEU B 94 -1.765 0.796 -13.449 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -1.552 -1.437 -12.398 1.00 0.00 H new ATOM 0 HD12 LEU B 94 0.012 -0.724 -12.859 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -0.499 -0.723 -11.154 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -3.431 -0.086 -11.778 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.563 0.792 -10.496 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -3.363 1.692 -11.807 1.00 0.00 H new ATOM 2760 N ALA B 95 1.309 0.229 -9.659 1.00 0.00 N ATOM 2761 CA ALA B 95 2.352 -0.793 -9.554 1.00 0.00 C ATOM 2762 C ALA B 95 2.555 -1.623 -10.850 1.00 0.00 C ATOM 2763 O ALA B 95 1.964 -2.679 -11.029 1.00 0.00 O ATOM 2764 CB ALA B 95 2.063 -1.670 -8.326 1.00 0.00 C ATOM 0 H ALA B 95 0.567 0.130 -8.966 1.00 0.00 H new ATOM 0 HA ALA B 95 3.308 -0.287 -9.421 1.00 0.00 H new ATOM 0 HB1 ALA B 95 2.833 -2.436 -8.236 1.00 0.00 H new ATOM 0 HB2 ALA B 95 2.061 -1.051 -7.429 1.00 0.00 H new ATOM 0 HB3 ALA B 95 1.089 -2.146 -8.440 1.00 0.00 H new