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= -2.41 K(o=-3.1,f=-5.1!) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.677 K(o=-3.1,f=-7.3!) USER MOD Set 2.1: A 102 CYS SG : rot 86:sc= 0.811 USER MOD Set 2.2: B 57 CYS SG : rot 94:sc= 2.98 USER MOD Set 2.3: B 61 CYS SG : rot 109:sc= 1.01 USER MOD Set 3.1: B 39 GLN : amide:sc= -2.86 K(o=-4.9,f=-5.7!) USER MOD Set 3.2: B 43 HIS : no HE2:sc= -2.05 X(o=-4.9,f=-5) USER MOD Set 4.1: B 22 THR OG1 : rot 100:sc= 1.42 USER MOD Set 4.2: B 54 HIS : no HE2:sc= 0.752 K(o=2.2,f=-1.7) USER MOD Set 5.1: A 91 GLN : amide:sc= -0.758 K(o=-2.9,f=-7.2!) USER MOD Set 5.2: B 81 HIS : no HE2:sc= -2.18 K(o=-2.9,f=-4.4!) USER MOD Set 6.1: A 57 CYS SG : rot 150:sc= 1.62 USER MOD Set 6.2: A 61 CYS SG : rot 109:sc= 0.683 USER MOD Set 7.1: A 39 GLN : amide:sc= -2.42 K(o=-4.1,f=-6.5!) USER MOD Set 7.2: A 43 HIS : no HE2:sc= -1.64 K(o=-4.1,f=-4.7) USER MOD Set 8.1: A 22 THR OG1 : rot 110:sc= 1.29 USER MOD Set 8.2: A 54 HIS : no HE2:sc= 0.53 K(o=1.8,f=-0.95) USER MOD Single : A 24 CYS SG : rot -120:sc= -0.074 USER MOD Single : A 35 CYS SG : rot 12:sc= 0.0603 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0.011 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 52 SER OG : rot 84:sc= 1.2 USER MOD Single : A 53 ASN : amide:sc= -0.0396 K(o=-0.04,f=-1.2) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0.152 USER MOD Single : A 72 GLN : amide:sc= 0.245 X(o=0.25,f=0) USER MOD Single : A 75 TYR OH : rot 30:sc= 0 USER MOD Single : A 80 SER OG : rot 94:sc= 1.36 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 CYS SG : rot 120:sc= -0.0121 USER MOD Single : B 35 CYS SG : rot 180:sc= 0 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= 0.0042 USER MOD Single : B 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 52 SER OG : rot 79:sc= 1.25 USER MOD Single : B 53 ASN : amide:sc= -0.0569 K(o=-0.057,f=-1.3) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 TYR OH : rot 180:sc= 0.156 USER MOD Single : B 72 GLN : amide:sc= 0.391 X(o=0.39,f=0) USER MOD Single : B 75 TYR OH : rot 30:sc= 0 USER MOD Single : B 80 SER OG : rot 90:sc= 1.37 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 4.329 0.118 -8.057 1.00 0.00 N ATOM 12 CA LEU A 11 3.672 -0.368 -6.839 1.00 0.00 C ATOM 13 C LEU A 11 4.541 -1.300 -5.993 1.00 0.00 C ATOM 14 O LEU A 11 4.619 -1.080 -4.786 1.00 0.00 O ATOM 15 CB LEU A 11 2.297 -1.007 -7.136 1.00 0.00 C ATOM 16 CG LEU A 11 1.131 -0.335 -6.376 1.00 0.00 C ATOM 17 CD1 LEU A 11 -0.197 -1.076 -6.583 1.00 0.00 C ATOM 18 CD2 LEU A 11 1.343 -0.142 -4.863 1.00 0.00 C ATOM 0 HA LEU A 11 3.509 0.524 -6.234 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.103 -0.952 -8.207 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.331 -2.064 -6.873 1.00 0.00 H new ATOM 0 HG LEU A 11 1.097 0.659 -6.822 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.987 -0.568 -6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.446 -1.087 -7.644 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -0.102 -2.100 -6.222 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.465 0.337 -4.431 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.496 -1.112 -4.390 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.218 0.486 -4.695 1.00 0.00 H new ATOM 30 N ALA A 12 5.207 -2.290 -6.598 1.00 0.00 N ATOM 31 CA ALA A 12 6.018 -3.271 -5.873 1.00 0.00 C ATOM 32 C ALA A 12 7.065 -2.610 -4.967 1.00 0.00 C ATOM 33 O ALA A 12 6.978 -2.786 -3.750 1.00 0.00 O ATOM 34 CB ALA A 12 6.635 -4.259 -6.868 1.00 0.00 C ATOM 0 H ALA A 12 5.198 -2.433 -7.608 1.00 0.00 H new ATOM 0 HA ALA A 12 5.369 -3.827 -5.197 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.239 -4.989 -6.329 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.841 -4.773 -7.410 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.265 -3.718 -7.574 1.00 0.00 H new ATOM 40 N ARG A 13 8.006 -1.811 -5.508 1.00 0.00 N ATOM 41 CA ARG A 13 9.032 -1.147 -4.682 1.00 0.00 C ATOM 42 C ARG A 13 8.427 -0.181 -3.646 1.00 0.00 C ATOM 43 O ARG A 13 8.920 -0.109 -2.524 1.00 0.00 O ATOM 44 CB ARG A 13 10.143 -0.500 -5.533 1.00 0.00 C ATOM 45 CG ARG A 13 9.888 0.952 -5.975 1.00 0.00 C ATOM 46 CD ARG A 13 11.030 1.504 -6.841 1.00 0.00 C ATOM 47 NE ARG A 13 10.979 0.949 -8.206 1.00 0.00 N ATOM 48 CZ ARG A 13 10.688 1.610 -9.320 1.00 0.00 C ATOM 49 NH1 ARG A 13 10.613 2.926 -9.379 1.00 0.00 N ATOM 50 NH2 ARG A 13 10.430 0.918 -10.403 1.00 0.00 N ATOM 0 H ARG A 13 8.076 -1.611 -6.506 1.00 0.00 H new ATOM 0 HA ARG A 13 9.517 -1.933 -4.103 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.073 -0.529 -4.965 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.294 -1.110 -6.424 1.00 0.00 H new ATOM 0 HG2 ARG A 13 8.954 1.001 -6.534 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.765 1.582 -5.094 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.964 2.591 -6.885 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.988 1.261 -6.382 1.00 0.00 H new ATOM 0 HE ARG A 13 11.189 -0.044 -8.305 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.782 3.484 -8.542 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.386 3.385 -10.261 1.00 0.00 H new ATOM 0 HH21 ARG A 13 10.456 -0.101 -10.375 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.203 1.399 -11.274 1.00 0.00 H new ATOM 64 N LEU A 14 7.328 0.510 -3.990 1.00 0.00 N ATOM 65 CA LEU A 14 6.588 1.378 -3.068 1.00 0.00 C ATOM 66 C LEU A 14 6.077 0.581 -1.862 1.00 0.00 C ATOM 67 O LEU A 14 6.492 0.836 -0.733 1.00 0.00 O ATOM 68 CB LEU A 14 5.465 2.097 -3.855 1.00 0.00 C ATOM 69 CG LEU A 14 4.507 3.042 -3.093 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.449 2.336 -2.235 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.258 4.081 -2.269 1.00 0.00 C ATOM 0 H LEU A 14 6.926 0.479 -4.927 1.00 0.00 H new ATOM 0 HA LEU A 14 7.244 2.144 -2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.937 2.676 -4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.858 1.331 -4.337 1.00 0.00 H new ATOM 0 HG LEU A 14 3.956 3.550 -3.885 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.826 3.081 -1.740 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.827 1.706 -2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.942 1.719 -1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.543 4.721 -1.752 1.00 0.00 H new ATOM 0 HD22 LEU A 14 5.890 3.578 -1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.879 4.688 -2.928 1.00 0.00 H new ATOM 83 N GLY A 15 5.196 -0.403 -2.067 1.00 0.00 N ATOM 84 CA GLY A 15 4.494 -1.053 -0.962 1.00 0.00 C ATOM 85 C GLY A 15 5.404 -1.972 -0.157 1.00 0.00 C ATOM 86 O GLY A 15 5.239 -2.034 1.053 1.00 0.00 O ATOM 0 H GLY A 15 4.954 -0.765 -2.989 1.00 0.00 H new ATOM 0 HA2 GLY A 15 4.076 -0.292 -0.303 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.657 -1.629 -1.356 1.00 0.00 H new ATOM 90 N ARG A 16 6.418 -2.606 -0.759 1.00 0.00 N ATOM 91 CA ARG A 16 7.415 -3.386 -0.003 1.00 0.00 C ATOM 92 C ARG A 16 8.331 -2.538 0.898 1.00 0.00 C ATOM 93 O ARG A 16 9.130 -3.112 1.627 1.00 0.00 O ATOM 94 CB ARG A 16 8.204 -4.321 -0.938 1.00 0.00 C ATOM 95 CG ARG A 16 9.282 -3.665 -1.824 1.00 0.00 C ATOM 96 CD ARG A 16 10.639 -3.354 -1.177 1.00 0.00 C ATOM 97 NE ARG A 16 11.202 -4.523 -0.482 1.00 0.00 N ATOM 98 CZ ARG A 16 12.114 -4.474 0.475 1.00 0.00 C ATOM 99 NH1 ARG A 16 12.747 -3.366 0.789 1.00 0.00 N ATOM 100 NH2 ARG A 16 12.427 -5.555 1.146 1.00 0.00 N ATOM 0 H ARG A 16 6.573 -2.596 -1.767 1.00 0.00 H new ATOM 0 HA ARG A 16 6.851 -4.004 0.696 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.684 -5.086 -0.328 1.00 0.00 H new ATOM 0 HB3 ARG A 16 7.493 -4.831 -1.588 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.459 -4.319 -2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.874 -2.733 -2.215 1.00 0.00 H new ATOM 0 HD2 ARG A 16 11.337 -3.018 -1.944 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.523 -2.533 -0.469 1.00 0.00 H new ATOM 0 HE ARG A 16 10.862 -5.444 -0.760 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.541 -2.502 0.288 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.444 -3.370 1.534 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.967 -6.440 0.931 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.131 -5.512 1.883 1.00 0.00 H new ATOM 114 N ALA A 17 8.271 -1.204 0.803 1.00 0.00 N ATOM 115 CA ALA A 17 8.901 -0.264 1.731 1.00 0.00 C ATOM 116 C ALA A 17 7.873 0.523 2.574 1.00 0.00 C ATOM 117 O ALA A 17 8.263 1.269 3.471 1.00 0.00 O ATOM 118 CB ALA A 17 9.807 0.652 0.896 1.00 0.00 C ATOM 0 H ALA A 17 7.765 -0.736 0.051 1.00 0.00 H new ATOM 0 HA ALA A 17 9.492 -0.806 2.470 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.299 1.372 1.550 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.560 0.052 0.386 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.206 1.184 0.158 1.00 0.00 H new ATOM 124 N LEU A 18 6.571 0.370 2.291 1.00 0.00 N ATOM 125 CA LEU A 18 5.465 0.983 3.036 1.00 0.00 C ATOM 126 C LEU A 18 4.908 -0.004 4.077 1.00 0.00 C ATOM 127 O LEU A 18 4.606 0.383 5.203 1.00 0.00 O ATOM 128 CB LEU A 18 4.409 1.522 2.006 1.00 0.00 C ATOM 129 CG LEU A 18 3.774 2.917 2.266 1.00 0.00 C ATOM 130 CD1 LEU A 18 4.847 3.878 2.736 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.172 3.625 1.027 1.00 0.00 C ATOM 0 H LEU A 18 6.250 -0.203 1.511 1.00 0.00 H new ATOM 0 HA LEU A 18 5.801 1.840 3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.885 1.550 1.026 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.600 0.794 1.947 1.00 0.00 H new ATOM 0 HG LEU A 18 2.980 2.705 2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.404 4.857 2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.293 3.503 3.658 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.618 3.966 1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.757 4.588 1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.952 3.780 0.282 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.382 3.006 0.602 1.00 0.00 H new ATOM 143 N ALA A 19 4.845 -1.290 3.725 1.00 0.00 N ATOM 144 CA ALA A 19 4.227 -2.398 4.455 1.00 0.00 C ATOM 145 C ALA A 19 5.077 -2.995 5.604 1.00 0.00 C ATOM 146 O ALA A 19 5.038 -4.201 5.838 1.00 0.00 O ATOM 147 CB ALA A 19 3.830 -3.426 3.389 1.00 0.00 C ATOM 0 H ALA A 19 5.259 -1.609 2.849 1.00 0.00 H new ATOM 0 HA ALA A 19 3.360 -2.034 5.006 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.360 -4.284 3.869 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.128 -2.972 2.689 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.719 -3.753 2.850 1.00 0.00 H new ATOM 153 N ASP A 20 5.837 -2.135 6.279 1.00 0.00 N ATOM 154 CA ASP A 20 6.899 -2.388 7.249 1.00 0.00 C ATOM 155 C ASP A 20 6.453 -2.159 8.718 1.00 0.00 C ATOM 156 O ASP A 20 5.482 -1.432 8.954 1.00 0.00 O ATOM 157 CB ASP A 20 7.998 -1.344 6.945 1.00 0.00 C ATOM 158 CG ASP A 20 9.298 -1.849 6.311 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.408 -1.836 5.069 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.299 -1.956 7.053 1.00 0.00 O ATOM 0 H ASP A 20 5.708 -1.132 6.144 1.00 0.00 H new ATOM 0 HA ASP A 20 7.216 -3.427 7.160 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.572 -0.590 6.283 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.252 -0.842 7.878 1.00 0.00 H new ATOM 165 N PRO A 21 7.246 -2.638 9.702 1.00 0.00 N ATOM 166 CA PRO A 21 7.129 -2.336 11.136 1.00 0.00 C ATOM 167 C PRO A 21 7.521 -0.865 11.423 1.00 0.00 C ATOM 168 O PRO A 21 6.774 0.072 11.127 1.00 0.00 O ATOM 169 CB PRO A 21 8.065 -3.364 11.811 1.00 0.00 C ATOM 170 CG PRO A 21 9.176 -3.504 10.765 1.00 0.00 C ATOM 171 CD PRO A 21 8.362 -3.552 9.487 1.00 0.00 C ATOM 0 HA PRO A 21 6.112 -2.422 11.519 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.446 -3.005 12.767 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.562 -4.312 12.003 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.868 -2.662 10.782 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.769 -4.407 10.911 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.960 -3.246 8.629 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.008 -4.563 9.285 1.00 0.00 H new ATOM 179 N THR A 22 8.722 -0.647 11.980 1.00 0.00 N ATOM 180 CA THR A 22 9.341 0.649 12.283 1.00 0.00 C ATOM 181 C THR A 22 9.249 1.632 11.128 1.00 0.00 C ATOM 182 O THR A 22 9.032 2.815 11.369 1.00 0.00 O ATOM 183 CB THR A 22 10.830 0.485 12.649 1.00 0.00 C ATOM 184 OG1 THR A 22 11.151 -0.847 12.980 1.00 0.00 O ATOM 185 CG2 THR A 22 11.196 1.368 13.843 1.00 0.00 C ATOM 0 H THR A 22 9.325 -1.424 12.248 1.00 0.00 H new ATOM 0 HA THR A 22 8.780 1.046 13.129 1.00 0.00 H new ATOM 0 HB THR A 22 11.396 0.782 11.766 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.709 -1.234 12.273 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.251 1.236 14.083 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.009 2.413 13.594 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.590 1.086 14.704 1.00 0.00 H new ATOM 193 N ARG A 23 9.394 1.173 9.880 1.00 0.00 N ATOM 194 CA ARG A 23 9.395 2.057 8.708 1.00 0.00 C ATOM 195 C ARG A 23 8.042 2.724 8.445 1.00 0.00 C ATOM 196 O ARG A 23 8.041 3.874 8.008 1.00 0.00 O ATOM 197 CB ARG A 23 9.855 1.311 7.454 1.00 0.00 C ATOM 198 CG ARG A 23 11.016 1.994 6.736 1.00 0.00 C ATOM 199 CD ARG A 23 10.962 1.778 5.225 1.00 0.00 C ATOM 200 NE ARG A 23 11.105 0.370 4.813 1.00 0.00 N ATOM 201 CZ ARG A 23 11.810 -0.089 3.793 1.00 0.00 C ATOM 202 NH1 ARG A 23 12.508 0.739 3.050 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.794 -1.374 3.511 1.00 0.00 N ATOM 0 H ARG A 23 9.513 0.185 9.654 1.00 0.00 H new ATOM 0 HA ARG A 23 10.104 2.851 8.942 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.153 0.299 7.730 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.015 1.219 6.766 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.996 3.063 6.950 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.959 1.609 7.124 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.014 2.161 4.848 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.752 2.365 4.756 1.00 0.00 H new ATOM 0 HE ARG A 23 10.608 -0.323 5.373 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.507 1.737 3.260 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.052 0.384 2.263 1.00 0.00 H new ATOM 0 HH21 ARG A 23 11.238 -2.014 4.079 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.337 -1.730 2.725 1.00 0.00 H new ATOM 217 N CYS A 24 6.921 2.061 8.750 1.00 0.00 N ATOM 218 CA CYS A 24 5.602 2.695 8.748 1.00 0.00 C ATOM 219 C CYS A 24 5.574 3.848 9.773 1.00 0.00 C ATOM 220 O CYS A 24 5.323 5.002 9.421 1.00 0.00 O ATOM 221 CB CYS A 24 4.569 1.591 9.016 1.00 0.00 C ATOM 222 SG CYS A 24 2.915 2.308 9.159 1.00 0.00 S ATOM 0 H CYS A 24 6.904 1.073 9.004 1.00 0.00 H new ATOM 0 HA CYS A 24 5.362 3.157 7.790 1.00 0.00 H new ATOM 0 HB2 CYS A 24 4.588 0.860 8.207 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.824 1.059 9.933 1.00 0.00 H new ATOM 0 HG CYS A 24 2.426 2.040 10.333 1.00 0.00 H new ATOM 228 N ARG A 25 5.973 3.548 11.015 1.00 0.00 N ATOM 229 CA ARG A 25 6.109 4.511 12.116 1.00 0.00 C ATOM 230 C ARG A 25 6.977 5.733 11.752 1.00 0.00 C ATOM 231 O ARG A 25 6.576 6.861 12.015 1.00 0.00 O ATOM 232 CB ARG A 25 6.665 3.789 13.353 1.00 0.00 C ATOM 233 CG ARG A 25 5.674 2.770 13.944 1.00 0.00 C ATOM 234 CD ARG A 25 6.270 1.957 15.112 1.00 0.00 C ATOM 235 NE ARG A 25 5.331 0.935 15.618 1.00 0.00 N ATOM 236 CZ ARG A 25 4.165 1.153 16.215 1.00 0.00 C ATOM 237 NH1 ARG A 25 3.738 2.366 16.523 1.00 0.00 N ATOM 238 NH2 ARG A 25 3.396 0.139 16.511 1.00 0.00 N ATOM 0 H ARG A 25 6.218 2.597 11.291 1.00 0.00 H new ATOM 0 HA ARG A 25 5.117 4.908 12.331 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.589 3.277 13.084 1.00 0.00 H new ATOM 0 HB3 ARG A 25 6.919 4.526 14.115 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.785 3.296 14.291 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.353 2.086 13.159 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.189 1.472 14.783 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.539 2.634 15.923 1.00 0.00 H new ATOM 0 HE ARG A 25 5.607 -0.039 15.496 1.00 0.00 H new ATOM 0 HH11 ARG A 25 4.312 3.180 16.302 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.835 2.488 16.982 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.693 -0.810 16.283 1.00 0.00 H new ATOM 0 HH22 ARG A 25 2.499 0.296 16.970 1.00 0.00 H new ATOM 252 N ILE A 26 8.135 5.526 11.114 1.00 0.00 N ATOM 253 CA ILE A 26 8.959 6.610 10.509 1.00 0.00 C ATOM 254 C ILE A 26 8.087 7.578 9.717 1.00 0.00 C ATOM 255 O ILE A 26 7.990 8.755 10.037 1.00 0.00 O ATOM 256 CB ILE A 26 10.080 6.090 9.554 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.072 5.214 10.325 1.00 0.00 C ATOM 258 CG2 ILE A 26 10.755 7.273 8.829 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.467 5.001 9.731 1.00 0.00 C ATOM 0 H ILE A 26 8.541 4.598 10.995 1.00 0.00 H new ATOM 0 HA ILE A 26 9.434 7.107 11.355 1.00 0.00 H new ATOM 0 HB ILE A 26 9.640 5.458 8.782 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.196 5.647 11.318 1.00 0.00 H new ATOM 0 HG13 ILE A 26 10.615 4.234 10.460 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.534 6.897 8.166 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.011 7.813 8.244 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.197 7.946 9.564 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.050 4.360 10.392 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.378 4.528 8.753 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.968 5.963 9.624 1.00 0.00 H new ATOM 271 N LEU A 27 7.479 7.045 8.664 1.00 0.00 N ATOM 272 CA LEU A 27 6.759 7.820 7.660 1.00 0.00 C ATOM 273 C LEU A 27 5.582 8.596 8.254 1.00 0.00 C ATOM 274 O LEU A 27 5.428 9.769 7.909 1.00 0.00 O ATOM 275 CB LEU A 27 6.307 6.893 6.525 1.00 0.00 C ATOM 276 CG LEU A 27 7.427 6.453 5.560 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.816 5.402 4.641 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.923 7.602 4.671 1.00 0.00 C ATOM 0 H LEU A 27 7.472 6.042 8.480 1.00 0.00 H new ATOM 0 HA LEU A 27 7.440 8.570 7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.853 6.003 6.961 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.530 7.398 5.951 1.00 0.00 H new ATOM 0 HG LEU A 27 8.272 6.091 6.145 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.569 5.055 3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.461 4.560 5.236 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.980 5.838 4.095 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.711 7.238 4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.095 7.982 4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.316 8.403 5.297 1.00 0.00 H new ATOM 290 N VAL A 28 4.796 7.994 9.157 1.00 0.00 N ATOM 291 CA VAL A 28 3.678 8.722 9.798 1.00 0.00 C ATOM 292 C VAL A 28 4.160 9.908 10.635 1.00 0.00 C ATOM 293 O VAL A 28 3.415 10.868 10.817 1.00 0.00 O ATOM 294 CB VAL A 28 2.693 7.854 10.625 1.00 0.00 C ATOM 295 CG1 VAL A 28 2.363 6.516 9.952 1.00 0.00 C ATOM 296 CG2 VAL A 28 3.136 7.543 12.066 1.00 0.00 C ATOM 0 H VAL A 28 4.904 7.026 9.459 1.00 0.00 H new ATOM 0 HA VAL A 28 3.104 9.085 8.946 1.00 0.00 H new ATOM 0 HB VAL A 28 1.813 8.495 10.669 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.670 5.955 10.579 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.905 6.701 8.980 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.279 5.940 9.818 1.00 0.00 H new ATOM 0 HG21 VAL A 28 2.378 6.932 12.556 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.082 7.002 12.047 1.00 0.00 H new ATOM 0 HG23 VAL A 28 3.262 8.475 12.617 1.00 0.00 H new ATOM 306 N ALA A 29 5.404 9.846 11.119 1.00 0.00 N ATOM 307 CA ALA A 29 6.035 10.930 11.844 1.00 0.00 C ATOM 308 C ALA A 29 6.783 11.917 10.918 1.00 0.00 C ATOM 309 O ALA A 29 6.896 13.085 11.264 1.00 0.00 O ATOM 310 CB ALA A 29 6.937 10.293 12.907 1.00 0.00 C ATOM 0 H ALA A 29 6.001 9.026 11.012 1.00 0.00 H new ATOM 0 HA ALA A 29 5.281 11.553 12.325 1.00 0.00 H new ATOM 0 HB1 ALA A 29 7.434 11.076 13.479 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.333 9.682 13.578 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.686 9.667 12.421 1.00 0.00 H new ATOM 316 N LEU A 30 7.256 11.488 9.734 1.00 0.00 N ATOM 317 CA LEU A 30 8.065 12.294 8.795 1.00 0.00 C ATOM 318 C LEU A 30 7.308 13.502 8.256 1.00 0.00 C ATOM 319 O LEU A 30 7.885 14.580 8.100 1.00 0.00 O ATOM 320 CB LEU A 30 8.487 11.425 7.585 1.00 0.00 C ATOM 321 CG LEU A 30 9.818 11.739 6.883 1.00 0.00 C ATOM 322 CD1 LEU A 30 9.750 12.940 5.936 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.935 11.947 7.897 1.00 0.00 C ATOM 0 H LEU A 30 7.082 10.543 9.392 1.00 0.00 H new ATOM 0 HA LEU A 30 8.931 12.646 9.356 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.525 10.388 7.919 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.695 11.490 6.838 1.00 0.00 H new ATOM 0 HG LEU A 30 10.034 10.865 6.268 1.00 0.00 H new ATOM 0 HD11 LEU A 30 10.727 13.099 5.479 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.012 12.748 5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.463 13.830 6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.865 12.168 7.373 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.681 12.780 8.552 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.059 11.042 8.492 1.00 0.00 H new ATOM 335 N LEU A 31 6.024 13.276 7.977 1.00 0.00 N ATOM 336 CA LEU A 31 5.000 14.247 7.573 1.00 0.00 C ATOM 337 C LEU A 31 5.109 15.565 8.376 1.00 0.00 C ATOM 338 O LEU A 31 5.111 16.632 7.773 1.00 0.00 O ATOM 339 CB LEU A 31 3.621 13.547 7.715 1.00 0.00 C ATOM 340 CG LEU A 31 2.809 13.273 6.426 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.575 12.465 6.827 1.00 0.00 C ATOM 342 CD2 LEU A 31 2.394 14.568 5.717 1.00 0.00 C ATOM 0 H LEU A 31 5.639 12.333 8.031 1.00 0.00 H new ATOM 0 HA LEU A 31 5.140 14.552 6.536 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.781 12.593 8.218 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.004 14.156 8.375 1.00 0.00 H new ATOM 0 HG LEU A 31 3.428 12.722 5.718 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.976 12.252 5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.888 11.528 7.288 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.980 13.038 7.538 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.827 14.325 4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.776 15.167 6.386 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.284 15.134 5.442 1.00 0.00 H new ATOM 354 N ASP A 32 5.298 15.466 9.700 1.00 0.00 N ATOM 355 CA ASP A 32 5.556 16.574 10.648 1.00 0.00 C ATOM 356 C ASP A 32 6.993 16.516 11.246 1.00 0.00 C ATOM 357 O ASP A 32 7.335 17.163 12.231 1.00 0.00 O ATOM 358 CB ASP A 32 4.467 16.506 11.737 1.00 0.00 C ATOM 359 CG ASP A 32 4.321 17.792 12.563 1.00 0.00 C ATOM 360 OD1 ASP A 32 4.265 18.881 11.943 1.00 0.00 O ATOM 361 OD2 ASP A 32 4.183 17.667 13.803 1.00 0.00 O ATOM 0 H ASP A 32 5.275 14.561 10.171 1.00 0.00 H new ATOM 0 HA ASP A 32 5.508 17.531 10.129 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.511 16.280 11.265 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.693 15.679 12.410 1.00 0.00 H new ATOM 366 N GLY A 33 7.844 15.665 10.666 1.00 0.00 N ATOM 367 CA GLY A 33 9.176 15.264 11.142 1.00 0.00 C ATOM 368 C GLY A 33 10.322 15.690 10.234 1.00 0.00 C ATOM 369 O GLY A 33 11.474 15.464 10.570 1.00 0.00 O ATOM 0 H GLY A 33 7.605 15.204 9.788 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.337 15.688 12.133 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.198 14.180 11.251 1.00 0.00 H new ATOM 373 N VAL A 34 10.030 16.277 9.078 1.00 0.00 N ATOM 374 CA VAL A 34 10.952 17.007 8.166 1.00 0.00 C ATOM 375 C VAL A 34 12.013 17.948 8.821 1.00 0.00 C ATOM 376 O VAL A 34 11.997 19.160 8.604 1.00 0.00 O ATOM 377 CB VAL A 34 10.136 17.823 7.127 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.550 16.920 6.047 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.984 18.639 7.745 1.00 0.00 C ATOM 0 H VAL A 34 9.078 16.263 8.713 1.00 0.00 H new ATOM 0 HA VAL A 34 11.536 16.207 7.711 1.00 0.00 H new ATOM 0 HB VAL A 34 10.855 18.521 6.698 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.985 17.523 5.336 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.357 16.405 5.526 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.888 16.186 6.506 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.460 19.182 6.958 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.289 17.965 8.246 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.387 19.348 8.468 1.00 0.00 H new ATOM 389 N CYS A 35 13.000 17.394 9.541 1.00 0.00 N ATOM 390 CA CYS A 35 14.053 18.147 10.246 1.00 0.00 C ATOM 391 C CYS A 35 15.476 17.603 10.020 1.00 0.00 C ATOM 392 O CYS A 35 16.296 18.320 9.464 1.00 0.00 O ATOM 393 CB CYS A 35 13.687 18.233 11.737 1.00 0.00 C ATOM 394 SG CYS A 35 12.377 19.476 11.940 1.00 0.00 S ATOM 0 H CYS A 35 13.092 16.384 9.653 1.00 0.00 H new ATOM 0 HA CYS A 35 14.088 19.149 9.819 1.00 0.00 H new ATOM 0 HB2 CYS A 35 13.348 17.263 12.100 1.00 0.00 H new ATOM 0 HB3 CYS A 35 14.562 18.506 12.327 1.00 0.00 H new ATOM 0 HG CYS A 35 11.902 19.800 10.774 1.00 0.00 H new ATOM 400 N TYR A 36 15.798 16.358 10.393 1.00 0.00 N ATOM 401 CA TYR A 36 17.167 15.817 10.251 1.00 0.00 C ATOM 402 C TYR A 36 17.273 14.276 10.305 1.00 0.00 C ATOM 403 O TYR A 36 16.345 13.615 10.790 1.00 0.00 O ATOM 404 CB TYR A 36 18.152 16.463 11.266 1.00 0.00 C ATOM 405 CG TYR A 36 17.610 17.118 12.521 1.00 0.00 C ATOM 406 CD1 TYR A 36 17.463 16.372 13.704 1.00 0.00 C ATOM 407 CD2 TYR A 36 17.320 18.498 12.521 1.00 0.00 C ATOM 408 CE1 TYR A 36 16.941 16.979 14.863 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.806 19.114 13.676 1.00 0.00 C ATOM 410 CZ TYR A 36 16.597 18.349 14.845 1.00 0.00 C ATOM 411 OH TYR A 36 16.065 18.924 15.957 1.00 0.00 O ATOM 0 H TYR A 36 15.131 15.700 10.797 1.00 0.00 H new ATOM 0 HA TYR A 36 17.456 16.096 9.238 1.00 0.00 H new ATOM 0 HB2 TYR A 36 18.853 15.689 11.579 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.728 17.216 10.728 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.751 15.331 13.724 1.00 0.00 H new ATOM 0 HD2 TYR A 36 17.493 19.084 11.631 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.804 16.398 15.763 1.00 0.00 H new ATOM 0 HE2 TYR A 36 16.572 20.168 13.669 1.00 0.00 H new ATOM 0 HH TYR A 36 15.885 19.871 15.781 1.00 0.00 H new ATOM 421 N PRO A 37 18.397 13.674 9.847 1.00 0.00 N ATOM 422 CA PRO A 37 18.687 12.266 10.085 1.00 0.00 C ATOM 423 C PRO A 37 18.697 12.031 11.591 1.00 0.00 C ATOM 424 O PRO A 37 19.279 12.810 12.347 1.00 0.00 O ATOM 425 CB PRO A 37 20.059 11.982 9.466 1.00 0.00 C ATOM 426 CG PRO A 37 20.718 13.357 9.404 1.00 0.00 C ATOM 427 CD PRO A 37 19.530 14.285 9.165 1.00 0.00 C ATOM 0 HA PRO A 37 17.944 11.604 9.641 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.637 11.288 10.075 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.967 11.537 8.475 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.241 13.598 10.330 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.450 13.420 8.599 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.729 15.282 9.557 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.330 14.396 8.099 1.00 0.00 H new ATOM 435 N GLY A 38 17.989 10.995 12.036 1.00 0.00 N ATOM 436 CA GLY A 38 17.867 10.709 13.458 1.00 0.00 C ATOM 437 C GLY A 38 16.948 11.656 14.229 1.00 0.00 C ATOM 438 O GLY A 38 16.800 11.436 15.425 1.00 0.00 O ATOM 0 H GLY A 38 17.492 10.342 11.430 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.498 9.690 13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 38 18.860 10.744 13.907 1.00 0.00 H new ATOM 442 N GLN A 39 16.287 12.648 13.603 1.00 0.00 N ATOM 443 CA GLN A 39 15.239 13.440 14.282 1.00 0.00 C ATOM 444 C GLN A 39 14.111 12.534 14.779 1.00 0.00 C ATOM 445 O GLN A 39 13.585 12.733 15.869 1.00 0.00 O ATOM 446 CB GLN A 39 14.683 14.558 13.385 1.00 0.00 C ATOM 447 CG GLN A 39 13.622 14.153 12.346 1.00 0.00 C ATOM 448 CD GLN A 39 12.190 13.977 12.875 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.510 13.026 12.538 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.666 14.850 13.705 1.00 0.00 N ATOM 0 H GLN A 39 16.457 12.920 12.635 1.00 0.00 H new ATOM 0 HA GLN A 39 15.707 13.920 15.142 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.253 15.326 14.027 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.519 15.016 12.856 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.607 14.907 11.559 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.934 13.217 11.884 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.211 15.658 14.006 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.714 14.720 14.048 1.00 0.00 H new ATOM 459 N LEU A 40 13.816 11.497 13.990 1.00 0.00 N ATOM 460 CA LEU A 40 12.788 10.500 14.243 1.00 0.00 C ATOM 461 C LEU A 40 13.021 9.756 15.556 1.00 0.00 C ATOM 462 O LEU A 40 12.094 9.172 16.099 1.00 0.00 O ATOM 463 CB LEU A 40 12.816 9.507 13.073 1.00 0.00 C ATOM 464 CG LEU A 40 12.385 10.098 11.720 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.100 9.352 10.594 1.00 0.00 C ATOM 466 CD2 LEU A 40 10.857 10.038 11.595 1.00 0.00 C ATOM 0 H LEU A 40 14.315 11.327 13.117 1.00 0.00 H new ATOM 0 HA LEU A 40 11.820 10.995 14.327 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.826 9.109 12.975 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.164 8.667 13.311 1.00 0.00 H new ATOM 0 HG LEU A 40 12.670 11.148 11.649 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.798 9.768 9.633 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.178 9.460 10.713 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.835 8.295 10.632 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.554 10.457 10.636 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.527 9.001 11.658 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.403 10.613 12.402 1.00 0.00 H new ATOM 478 N ALA A 41 14.253 9.758 16.071 1.00 0.00 N ATOM 479 CA ALA A 41 14.578 9.083 17.324 1.00 0.00 C ATOM 480 C ALA A 41 13.791 9.666 18.508 1.00 0.00 C ATOM 481 O ALA A 41 13.377 8.917 19.388 1.00 0.00 O ATOM 482 CB ALA A 41 16.083 9.202 17.554 1.00 0.00 C ATOM 0 H ALA A 41 15.047 10.225 15.632 1.00 0.00 H new ATOM 0 HA ALA A 41 14.292 8.034 17.252 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.349 8.704 18.486 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.616 8.733 16.727 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.360 10.255 17.613 1.00 0.00 H new ATOM 488 N ALA A 42 13.545 10.982 18.495 1.00 0.00 N ATOM 489 CA ALA A 42 12.662 11.648 19.448 1.00 0.00 C ATOM 490 C ALA A 42 11.192 11.302 19.177 1.00 0.00 C ATOM 491 O ALA A 42 10.480 10.945 20.109 1.00 0.00 O ATOM 492 CB ALA A 42 12.921 13.159 19.377 1.00 0.00 C ATOM 0 H ALA A 42 13.960 11.617 17.813 1.00 0.00 H new ATOM 0 HA ALA A 42 12.875 11.299 20.458 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.269 13.673 20.083 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.962 13.362 19.630 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.716 13.516 18.368 1.00 0.00 H new ATOM 498 N HIS A 43 10.746 11.343 17.916 1.00 0.00 N ATOM 499 CA HIS A 43 9.362 10.973 17.565 1.00 0.00 C ATOM 500 C HIS A 43 8.974 9.522 17.949 1.00 0.00 C ATOM 501 O HIS A 43 7.828 9.258 18.320 1.00 0.00 O ATOM 502 CB HIS A 43 9.153 11.158 16.053 1.00 0.00 C ATOM 503 CG HIS A 43 8.890 12.559 15.566 1.00 0.00 C ATOM 504 ND1 HIS A 43 8.290 13.589 16.291 1.00 0.00 N ATOM 505 CD2 HIS A 43 8.907 12.902 14.247 1.00 0.00 C ATOM 506 CE1 HIS A 43 7.943 14.519 15.384 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.291 14.132 14.145 1.00 0.00 N ATOM 0 H HIS A 43 11.318 11.627 17.121 1.00 0.00 H new ATOM 0 HA HIS A 43 8.717 11.632 18.146 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.038 10.781 15.540 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.316 10.530 15.747 1.00 0.00 H new ATOM 0 HD1 HIS A 43 8.145 13.628 17.300 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.323 12.322 13.437 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.451 15.451 15.619 1.00 0.00 H new ATOM 515 N LEU A 44 9.905 8.569 17.811 1.00 0.00 N ATOM 516 CA LEU A 44 9.657 7.131 17.995 1.00 0.00 C ATOM 517 C LEU A 44 10.092 6.600 19.373 1.00 0.00 C ATOM 518 O LEU A 44 9.714 5.487 19.728 1.00 0.00 O ATOM 519 CB LEU A 44 10.352 6.338 16.864 1.00 0.00 C ATOM 520 CG LEU A 44 9.986 6.759 15.424 1.00 0.00 C ATOM 521 CD1 LEU A 44 10.484 5.745 14.396 1.00 0.00 C ATOM 522 CD2 LEU A 44 8.488 6.982 15.170 1.00 0.00 C ATOM 0 H LEU A 44 10.872 8.779 17.563 1.00 0.00 H new ATOM 0 HA LEU A 44 8.578 6.987 17.949 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.431 6.435 16.988 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.111 5.282 16.986 1.00 0.00 H new ATOM 0 HG LEU A 44 10.487 7.720 15.310 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.207 6.076 13.395 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.569 5.661 14.464 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.032 4.773 14.595 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.335 7.274 14.131 1.00 0.00 H new ATOM 0 HD22 LEU A 44 7.943 6.060 15.372 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.121 7.771 15.827 1.00 0.00 H new ATOM 534 N GLY A 45 10.923 7.336 20.122 1.00 0.00 N ATOM 535 CA GLY A 45 11.558 6.855 21.359 1.00 0.00 C ATOM 536 C GLY A 45 12.678 5.829 21.123 1.00 0.00 C ATOM 537 O GLY A 45 13.166 5.220 22.073 1.00 0.00 O ATOM 0 H GLY A 45 11.177 8.295 19.884 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.967 7.707 21.901 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.796 6.407 21.997 1.00 0.00 H new ATOM 541 N LEU A 46 13.075 5.601 19.863 1.00 0.00 N ATOM 542 CA LEU A 46 14.031 4.560 19.463 1.00 0.00 C ATOM 543 C LEU A 46 15.352 5.172 18.986 1.00 0.00 C ATOM 544 O LEU A 46 15.361 6.241 18.387 1.00 0.00 O ATOM 545 CB LEU A 46 13.398 3.685 18.363 1.00 0.00 C ATOM 546 CG LEU A 46 12.196 2.833 18.824 1.00 0.00 C ATOM 547 CD1 LEU A 46 11.581 2.133 17.603 1.00 0.00 C ATOM 548 CD2 LEU A 46 12.608 1.783 19.870 1.00 0.00 C ATOM 0 H LEU A 46 12.731 6.149 19.075 1.00 0.00 H new ATOM 0 HA LEU A 46 14.260 3.938 20.329 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.076 4.330 17.546 1.00 0.00 H new ATOM 0 HB3 LEU A 46 14.163 3.021 17.962 1.00 0.00 H new ATOM 0 HG LEU A 46 11.467 3.495 19.291 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.731 1.529 17.920 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.247 2.881 16.885 1.00 0.00 H new ATOM 0 HD13 LEU A 46 12.329 1.491 17.137 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.734 1.204 20.169 1.00 0.00 H new ATOM 0 HD22 LEU A 46 13.356 1.116 19.441 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.027 2.284 20.743 1.00 0.00 H new ATOM 560 N THR A 47 16.478 4.480 19.212 1.00 0.00 N ATOM 561 CA THR A 47 17.815 5.029 18.925 1.00 0.00 C ATOM 562 C THR A 47 17.972 5.421 17.457 1.00 0.00 C ATOM 563 O THR A 47 17.585 4.682 16.545 1.00 0.00 O ATOM 564 CB THR A 47 18.942 4.116 19.423 1.00 0.00 C ATOM 565 OG1 THR A 47 20.167 4.741 19.113 1.00 0.00 O ATOM 566 CG2 THR A 47 18.956 2.720 18.801 1.00 0.00 C ATOM 0 H THR A 47 16.491 3.535 19.594 1.00 0.00 H new ATOM 0 HA THR A 47 17.905 5.952 19.498 1.00 0.00 H new ATOM 0 HB THR A 47 18.781 3.975 20.492 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.908 4.179 19.422 1.00 0.00 H new ATOM 0 HG21 THR A 47 19.786 2.146 19.213 1.00 0.00 H new ATOM 0 HG22 THR A 47 18.018 2.212 19.025 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.074 2.804 17.721 1.00 0.00 H new ATOM 574 N ARG A 48 18.582 6.593 17.236 1.00 0.00 N ATOM 575 CA ARG A 48 18.766 7.196 15.910 1.00 0.00 C ATOM 576 C ARG A 48 19.532 6.292 14.947 1.00 0.00 C ATOM 577 O ARG A 48 19.214 6.270 13.759 1.00 0.00 O ATOM 578 CB ARG A 48 19.420 8.586 16.022 1.00 0.00 C ATOM 579 CG ARG A 48 20.793 8.640 16.712 1.00 0.00 C ATOM 580 CD ARG A 48 21.248 10.102 16.827 1.00 0.00 C ATOM 581 NE ARG A 48 22.584 10.206 17.435 1.00 0.00 N ATOM 582 CZ ARG A 48 23.295 11.323 17.554 1.00 0.00 C ATOM 583 NH1 ARG A 48 22.838 12.494 17.156 1.00 0.00 N ATOM 584 NH2 ARG A 48 24.497 11.276 18.087 1.00 0.00 N ATOM 0 H ARG A 48 18.969 7.160 17.990 1.00 0.00 H new ATOM 0 HA ARG A 48 17.772 7.321 15.481 1.00 0.00 H new ATOM 0 HB2 ARG A 48 19.526 8.996 15.018 1.00 0.00 H new ATOM 0 HB3 ARG A 48 18.739 9.242 16.564 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.733 8.187 17.702 1.00 0.00 H new ATOM 0 HG3 ARG A 48 21.522 8.064 16.142 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.261 10.559 15.837 1.00 0.00 H new ATOM 0 HD3 ARG A 48 20.530 10.661 17.427 1.00 0.00 H new ATOM 0 HE ARG A 48 23.000 9.348 17.796 1.00 0.00 H new ATOM 0 HH11 ARG A 48 21.909 12.564 16.740 1.00 0.00 H new ATOM 0 HH12 ARG A 48 23.413 13.329 17.264 1.00 0.00 H new ATOM 0 HH21 ARG A 48 24.879 10.386 18.406 1.00 0.00 H new ATOM 0 HH22 ARG A 48 25.047 12.130 18.181 1.00 0.00 H new ATOM 598 N SER A 49 20.481 5.506 15.451 1.00 0.00 N ATOM 599 CA SER A 49 21.206 4.506 14.666 1.00 0.00 C ATOM 600 C SER A 49 20.261 3.432 14.113 1.00 0.00 C ATOM 601 O SER A 49 20.337 3.108 12.935 1.00 0.00 O ATOM 602 CB SER A 49 22.295 3.863 15.540 1.00 0.00 C ATOM 603 OG SER A 49 22.960 4.841 16.332 1.00 0.00 O ATOM 0 H SER A 49 20.773 5.545 16.428 1.00 0.00 H new ATOM 0 HA SER A 49 21.668 5.004 13.814 1.00 0.00 H new ATOM 0 HB2 SER A 49 21.848 3.109 16.188 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.019 3.350 14.906 1.00 0.00 H new ATOM 0 HG SER A 49 23.647 4.407 16.880 1.00 0.00 H new ATOM 609 N ASN A 50 19.311 2.939 14.923 1.00 0.00 N ATOM 610 CA ASN A 50 18.358 1.912 14.484 1.00 0.00 C ATOM 611 C ASN A 50 17.190 2.478 13.659 1.00 0.00 C ATOM 612 O ASN A 50 16.817 1.870 12.656 1.00 0.00 O ATOM 613 CB ASN A 50 17.841 1.112 15.687 1.00 0.00 C ATOM 614 CG ASN A 50 17.065 -0.110 15.206 1.00 0.00 C ATOM 615 OD1 ASN A 50 17.616 -0.983 14.556 1.00 0.00 O ATOM 616 ND2 ASN A 50 15.775 -0.193 15.474 1.00 0.00 N ATOM 0 H ASN A 50 19.184 3.238 15.890 1.00 0.00 H new ATOM 0 HA ASN A 50 18.904 1.245 13.817 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.677 0.799 16.313 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.199 1.741 16.304 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.234 -0.990 15.137 1.00 0.00 H new ATOM 0 HD22 ASN A 50 15.319 0.540 16.018 1.00 0.00 H new ATOM 623 N VAL A 51 16.637 3.652 14.012 1.00 0.00 N ATOM 624 CA VAL A 51 15.610 4.283 13.159 1.00 0.00 C ATOM 625 C VAL A 51 16.174 4.584 11.756 1.00 0.00 C ATOM 626 O VAL A 51 15.501 4.338 10.756 1.00 0.00 O ATOM 627 CB VAL A 51 14.990 5.548 13.794 1.00 0.00 C ATOM 628 CG1 VAL A 51 13.917 6.132 12.865 1.00 0.00 C ATOM 629 CG2 VAL A 51 14.311 5.233 15.140 1.00 0.00 C ATOM 0 H VAL A 51 16.874 4.172 14.857 1.00 0.00 H new ATOM 0 HA VAL A 51 14.798 3.562 13.062 1.00 0.00 H new ATOM 0 HB VAL A 51 15.804 6.256 13.951 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.486 7.023 13.322 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.368 6.396 11.909 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.133 5.392 12.704 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.887 6.147 15.556 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.517 4.502 14.985 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.048 4.827 15.833 1.00 0.00 H new ATOM 639 N SER A 52 17.436 5.020 11.655 1.00 0.00 N ATOM 640 CA SER A 52 18.058 5.282 10.347 1.00 0.00 C ATOM 641 C SER A 52 18.350 4.035 9.514 1.00 0.00 C ATOM 642 O SER A 52 18.437 4.143 8.294 1.00 0.00 O ATOM 643 CB SER A 52 19.356 6.073 10.447 1.00 0.00 C ATOM 644 OG SER A 52 19.177 7.237 11.231 1.00 0.00 O ATOM 0 H SER A 52 18.044 5.198 12.455 1.00 0.00 H new ATOM 0 HA SER A 52 17.291 5.869 9.841 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.134 5.449 10.887 1.00 0.00 H new ATOM 0 HB3 SER A 52 19.696 6.350 9.449 1.00 0.00 H new ATOM 0 HG SER A 52 19.269 7.010 12.180 1.00 0.00 H new ATOM 650 N ASN A 53 18.445 2.852 10.122 1.00 0.00 N ATOM 651 CA ASN A 53 18.616 1.583 9.404 1.00 0.00 C ATOM 652 C ASN A 53 17.468 1.367 8.388 1.00 0.00 C ATOM 653 O ASN A 53 17.657 1.147 7.190 1.00 0.00 O ATOM 654 CB ASN A 53 18.704 0.481 10.479 1.00 0.00 C ATOM 655 CG ASN A 53 19.508 -0.740 10.066 1.00 0.00 C ATOM 656 OD1 ASN A 53 20.040 -0.839 8.973 1.00 0.00 O ATOM 657 ND2 ASN A 53 19.651 -1.690 10.972 1.00 0.00 N ATOM 0 H ASN A 53 18.405 2.744 11.135 1.00 0.00 H new ATOM 0 HA ASN A 53 19.525 1.571 8.803 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.148 0.905 11.380 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.694 0.164 10.740 1.00 0.00 H new ATOM 0 HD21 ASN A 53 20.211 -2.516 10.761 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.202 -1.598 11.883 1.00 0.00 H new ATOM 664 N HIS A 54 16.250 1.629 8.860 1.00 0.00 N ATOM 665 CA HIS A 54 15.019 1.690 8.070 1.00 0.00 C ATOM 666 C HIS A 54 14.924 2.915 7.107 1.00 0.00 C ATOM 667 O HIS A 54 14.083 2.912 6.203 1.00 0.00 O ATOM 668 CB HIS A 54 13.853 1.642 9.079 1.00 0.00 C ATOM 669 CG HIS A 54 13.349 0.254 9.433 1.00 0.00 C ATOM 670 ND1 HIS A 54 12.535 -0.578 8.683 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.528 -0.376 10.637 1.00 0.00 C ATOM 672 CE1 HIS A 54 12.226 -1.651 9.428 1.00 0.00 C ATOM 673 NE2 HIS A 54 12.778 -1.551 10.645 1.00 0.00 N ATOM 0 H HIS A 54 16.086 1.813 9.850 1.00 0.00 H new ATOM 0 HA HIS A 54 14.990 0.843 7.384 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.169 2.139 9.996 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.021 2.219 8.674 1.00 0.00 H new ATOM 0 HD1 HIS A 54 12.223 -0.405 7.727 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.148 -0.020 11.447 1.00 0.00 H new ATOM 0 HE1 HIS A 54 11.618 -2.479 9.094 1.00 0.00 H new ATOM 681 N LEU A 55 15.773 3.949 7.251 1.00 0.00 N ATOM 682 CA LEU A 55 15.859 5.063 6.283 1.00 0.00 C ATOM 683 C LEU A 55 16.707 4.710 5.067 1.00 0.00 C ATOM 684 O LEU A 55 16.479 5.294 4.014 1.00 0.00 O ATOM 685 CB LEU A 55 16.427 6.369 6.881 1.00 0.00 C ATOM 686 CG LEU A 55 15.593 7.009 8.002 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.356 8.204 8.591 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.246 7.485 7.457 1.00 0.00 C ATOM 0 H LEU A 55 16.417 4.038 8.037 1.00 0.00 H new ATOM 0 HA LEU A 55 14.822 5.230 5.991 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.425 6.165 7.268 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.539 7.096 6.077 1.00 0.00 H new ATOM 0 HG LEU A 55 15.417 6.265 8.779 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.764 8.658 9.386 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.308 7.863 8.997 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.538 8.941 7.809 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.666 7.936 8.262 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.411 8.223 6.672 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.699 6.636 7.048 1.00 0.00 H new ATOM 700 N SER A 56 17.671 3.797 5.189 1.00 0.00 N ATOM 701 CA SER A 56 18.556 3.403 4.083 1.00 0.00 C ATOM 702 C SER A 56 17.770 3.121 2.790 1.00 0.00 C ATOM 703 O SER A 56 18.009 3.745 1.754 1.00 0.00 O ATOM 704 CB SER A 56 19.381 2.183 4.512 1.00 0.00 C ATOM 705 OG SER A 56 20.528 2.066 3.696 1.00 0.00 O ATOM 0 H SER A 56 17.864 3.305 6.061 1.00 0.00 H new ATOM 0 HA SER A 56 19.227 4.232 3.859 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.676 2.282 5.557 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.776 1.279 4.436 1.00 0.00 H new ATOM 0 HG SER A 56 21.051 1.286 3.977 1.00 0.00 H new ATOM 711 N CYS A 57 16.735 2.285 2.893 1.00 0.00 N ATOM 712 CA CYS A 57 15.863 1.942 1.774 1.00 0.00 C ATOM 713 C CYS A 57 14.696 2.939 1.591 1.00 0.00 C ATOM 714 O CYS A 57 14.216 3.082 0.475 1.00 0.00 O ATOM 715 CB CYS A 57 15.427 0.490 1.995 1.00 0.00 C ATOM 716 SG CYS A 57 14.267 -0.193 0.761 1.00 0.00 S ATOM 0 H CYS A 57 16.478 1.824 3.766 1.00 0.00 H new ATOM 0 HA CYS A 57 16.393 2.023 0.825 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.318 -0.137 2.013 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.965 0.416 2.979 1.00 0.00 H new ATOM 0 HG CYS A 57 14.458 -1.474 0.648 1.00 0.00 H new ATOM 721 N LEU A 58 14.263 3.693 2.614 1.00 0.00 N ATOM 722 CA LEU A 58 13.274 4.780 2.438 1.00 0.00 C ATOM 723 C LEU A 58 13.778 5.834 1.437 1.00 0.00 C ATOM 724 O LEU A 58 13.007 6.353 0.623 1.00 0.00 O ATOM 725 CB LEU A 58 12.976 5.447 3.803 1.00 0.00 C ATOM 726 CG LEU A 58 11.517 5.896 4.007 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.538 4.733 4.111 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.444 6.721 5.299 1.00 0.00 C ATOM 0 H LEU A 58 14.581 3.573 3.576 1.00 0.00 H new ATOM 0 HA LEU A 58 12.358 4.345 2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.239 4.747 4.597 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.626 6.315 3.915 1.00 0.00 H new ATOM 0 HG LEU A 58 11.228 6.478 3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.529 5.119 4.254 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.575 4.143 3.195 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.809 4.104 4.959 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.418 7.050 5.463 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.768 6.109 6.141 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.094 7.591 5.212 1.00 0.00 H new ATOM 740 N ARG A 59 15.083 6.126 1.524 1.00 0.00 N ATOM 741 CA ARG A 59 15.812 7.040 0.640 1.00 0.00 C ATOM 742 C ARG A 59 16.141 6.392 -0.714 1.00 0.00 C ATOM 743 O ARG A 59 16.284 7.103 -1.705 1.00 0.00 O ATOM 744 CB ARG A 59 17.081 7.529 1.340 1.00 0.00 C ATOM 745 CG ARG A 59 16.747 8.305 2.630 1.00 0.00 C ATOM 746 CD ARG A 59 17.953 8.992 3.241 1.00 0.00 C ATOM 747 NE ARG A 59 19.095 8.074 3.434 1.00 0.00 N ATOM 748 CZ ARG A 59 20.351 8.306 3.068 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.713 9.475 2.576 1.00 0.00 N ATOM 750 NH2 ARG A 59 21.273 7.376 3.187 1.00 0.00 N ATOM 0 H ARG A 59 15.681 5.715 2.241 1.00 0.00 H new ATOM 0 HA ARG A 59 15.169 7.894 0.428 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.717 6.677 1.580 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.648 8.170 0.664 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.984 9.052 2.410 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.320 7.618 3.360 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.260 9.817 2.599 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.672 9.423 4.202 1.00 0.00 H new ATOM 0 HE ARG A 59 18.902 7.182 3.889 1.00 0.00 H new ATOM 0 HH11 ARG A 59 20.024 10.220 2.471 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.682 9.634 2.301 1.00 0.00 H new ATOM 0 HH21 ARG A 59 21.028 6.461 3.565 1.00 0.00 H new ATOM 0 HH22 ARG A 59 22.233 7.570 2.901 1.00 0.00 H new ATOM 764 N GLY A 60 16.226 5.057 -0.771 1.00 0.00 N ATOM 765 CA GLY A 60 16.485 4.280 -1.994 1.00 0.00 C ATOM 766 C GLY A 60 15.233 4.056 -2.852 1.00 0.00 C ATOM 767 O GLY A 60 15.220 4.428 -4.019 1.00 0.00 O ATOM 0 H GLY A 60 16.114 4.469 0.055 1.00 0.00 H new ATOM 0 HA2 GLY A 60 17.237 4.796 -2.591 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.905 3.313 -1.719 1.00 0.00 H new ATOM 771 N CYS A 61 14.150 3.545 -2.258 1.00 0.00 N ATOM 772 CA CYS A 61 12.821 3.419 -2.858 1.00 0.00 C ATOM 773 C CYS A 61 12.158 4.795 -3.184 1.00 0.00 C ATOM 774 O CYS A 61 11.047 4.860 -3.709 1.00 0.00 O ATOM 775 CB CYS A 61 12.009 2.487 -1.924 1.00 0.00 C ATOM 776 SG CYS A 61 12.356 0.724 -2.214 1.00 0.00 S ATOM 0 H CYS A 61 14.179 3.192 -1.301 1.00 0.00 H new ATOM 0 HA CYS A 61 12.871 2.968 -3.849 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.237 2.732 -0.886 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.945 2.672 -2.069 1.00 0.00 H new ATOM 0 HG CYS A 61 13.028 0.243 -1.210 1.00 0.00 H new ATOM 781 N GLY A 62 12.833 5.909 -2.852 1.00 0.00 N ATOM 782 CA GLY A 62 12.466 7.272 -3.265 1.00 0.00 C ATOM 783 C GLY A 62 11.319 7.885 -2.466 1.00 0.00 C ATOM 784 O GLY A 62 10.871 8.978 -2.795 1.00 0.00 O ATOM 0 H GLY A 62 13.672 5.884 -2.273 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.341 7.915 -3.173 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.191 7.258 -4.320 1.00 0.00 H new ATOM 788 N LEU A 63 10.856 7.211 -1.406 1.00 0.00 N ATOM 789 CA LEU A 63 9.732 7.652 -0.585 1.00 0.00 C ATOM 790 C LEU A 63 10.058 8.931 0.184 1.00 0.00 C ATOM 791 O LEU A 63 9.212 9.816 0.314 1.00 0.00 O ATOM 792 CB LEU A 63 9.362 6.513 0.356 1.00 0.00 C ATOM 793 CG LEU A 63 9.216 5.160 -0.367 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.635 4.206 0.649 1.00 0.00 C ATOM 795 CD2 LEU A 63 8.329 5.196 -1.617 1.00 0.00 C ATOM 0 H LEU A 63 11.262 6.329 -1.093 1.00 0.00 H new ATOM 0 HA LEU A 63 8.884 7.895 -1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.125 6.425 1.129 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.425 6.754 0.858 1.00 0.00 H new ATOM 0 HG LEU A 63 10.196 4.856 -0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.507 3.224 0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.310 4.126 1.501 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.668 4.578 0.986 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.284 4.201 -2.060 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.324 5.516 -1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.747 5.896 -2.340 1.00 0.00 H new ATOM 807 N VAL A 64 11.312 9.019 0.633 1.00 0.00 N ATOM 808 CA VAL A 64 11.933 10.208 1.210 1.00 0.00 C ATOM 809 C VAL A 64 13.041 10.732 0.307 1.00 0.00 C ATOM 810 O VAL A 64 13.876 9.975 -0.181 1.00 0.00 O ATOM 811 CB VAL A 64 12.488 9.999 2.636 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.373 10.133 3.673 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.237 8.701 2.792 1.00 0.00 C ATOM 0 H VAL A 64 11.950 8.224 0.602 1.00 0.00 H new ATOM 0 HA VAL A 64 11.131 10.942 1.289 1.00 0.00 H new ATOM 0 HB VAL A 64 13.219 10.788 2.811 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.784 9.982 4.671 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.933 11.128 3.608 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.605 9.384 3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.602 8.612 3.815 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.570 7.867 2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.081 8.683 2.103 1.00 0.00 H new ATOM 823 N VAL A 65 13.050 12.049 0.131 1.00 0.00 N ATOM 824 CA VAL A 65 14.060 12.805 -0.624 1.00 0.00 C ATOM 825 C VAL A 65 14.787 13.754 0.337 1.00 0.00 C ATOM 826 O VAL A 65 14.174 14.304 1.252 1.00 0.00 O ATOM 827 CB VAL A 65 13.403 13.565 -1.805 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.446 14.302 -2.663 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.638 12.590 -2.724 1.00 0.00 C ATOM 0 H VAL A 65 12.326 12.650 0.525 1.00 0.00 H new ATOM 0 HA VAL A 65 14.791 12.123 -1.058 1.00 0.00 H new ATOM 0 HB VAL A 65 12.720 14.290 -1.363 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.944 14.821 -3.479 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.979 15.025 -2.046 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.155 13.582 -3.072 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.185 13.144 -3.546 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.330 11.849 -3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.858 12.087 -2.152 1.00 0.00 H new ATOM 839 N ALA A 66 16.101 13.925 0.160 1.00 0.00 N ATOM 840 CA ALA A 66 16.910 14.879 0.928 1.00 0.00 C ATOM 841 C ALA A 66 16.640 16.347 0.543 1.00 0.00 C ATOM 842 O ALA A 66 16.466 16.672 -0.630 1.00 0.00 O ATOM 843 CB ALA A 66 18.390 14.516 0.756 1.00 0.00 C ATOM 0 H ALA A 66 16.640 13.399 -0.528 1.00 0.00 H new ATOM 0 HA ALA A 66 16.627 14.801 1.978 1.00 0.00 H new ATOM 0 HB1 ALA A 66 19.005 15.217 1.321 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.562 13.504 1.124 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.657 14.569 -0.299 1.00 0.00 H new ATOM 849 N THR A 67 16.646 17.244 1.533 1.00 0.00 N ATOM 850 CA THR A 67 16.633 18.704 1.347 1.00 0.00 C ATOM 851 C THR A 67 17.683 19.267 2.285 1.00 0.00 C ATOM 852 O THR A 67 17.819 18.761 3.391 1.00 0.00 O ATOM 853 CB THR A 67 15.286 19.323 1.743 1.00 0.00 C ATOM 854 OG1 THR A 67 14.204 18.552 1.267 1.00 0.00 O ATOM 855 CG2 THR A 67 15.106 20.764 1.283 1.00 0.00 C ATOM 0 H THR A 67 16.660 16.970 2.515 1.00 0.00 H new ATOM 0 HA THR A 67 16.818 18.931 0.297 1.00 0.00 H new ATOM 0 HB THR A 67 15.294 19.328 2.833 1.00 0.00 H new ATOM 0 HG1 THR A 67 13.360 18.971 1.537 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.129 21.128 1.602 1.00 0.00 H new ATOM 0 HG22 THR A 67 15.886 21.386 1.721 1.00 0.00 H new ATOM 0 HG23 THR A 67 15.173 20.810 0.196 1.00 0.00 H new ATOM 863 N TYR A 68 18.380 20.322 1.898 1.00 0.00 N ATOM 864 CA TYR A 68 19.222 21.071 2.830 1.00 0.00 C ATOM 865 C TYR A 68 18.358 22.090 3.601 1.00 0.00 C ATOM 866 O TYR A 68 17.916 23.079 3.014 1.00 0.00 O ATOM 867 CB TYR A 68 20.349 21.723 2.019 1.00 0.00 C ATOM 868 CG TYR A 68 21.263 22.599 2.843 1.00 0.00 C ATOM 869 CD1 TYR A 68 22.271 22.024 3.639 1.00 0.00 C ATOM 870 CD2 TYR A 68 21.070 23.991 2.846 1.00 0.00 C ATOM 871 CE1 TYR A 68 23.085 22.842 4.446 1.00 0.00 C ATOM 872 CE2 TYR A 68 21.869 24.811 3.655 1.00 0.00 C ATOM 873 CZ TYR A 68 22.885 24.242 4.454 1.00 0.00 C ATOM 874 OH TYR A 68 23.652 25.064 5.223 1.00 0.00 O ATOM 0 H TYR A 68 18.383 20.684 0.944 1.00 0.00 H new ATOM 0 HA TYR A 68 19.675 20.424 3.581 1.00 0.00 H new ATOM 0 HB2 TYR A 68 20.941 20.941 1.544 1.00 0.00 H new ATOM 0 HB3 TYR A 68 19.910 22.321 1.220 1.00 0.00 H new ATOM 0 HD1 TYR A 68 22.420 20.954 3.631 1.00 0.00 H new ATOM 0 HD2 TYR A 68 20.304 24.430 2.224 1.00 0.00 H new ATOM 0 HE1 TYR A 68 23.859 22.402 5.057 1.00 0.00 H new ATOM 0 HE2 TYR A 68 21.707 25.879 3.667 1.00 0.00 H new ATOM 0 HH TYR A 68 23.366 25.993 5.095 1.00 0.00 H new ATOM 884 N GLU A 69 18.030 21.813 4.871 1.00 0.00 N ATOM 885 CA GLU A 69 17.423 22.809 5.770 1.00 0.00 C ATOM 886 C GLU A 69 18.429 23.922 6.190 1.00 0.00 C ATOM 887 O GLU A 69 19.423 24.143 5.500 1.00 0.00 O ATOM 888 CB GLU A 69 16.629 22.091 6.884 1.00 0.00 C ATOM 889 CG GLU A 69 17.409 21.362 7.988 1.00 0.00 C ATOM 890 CD GLU A 69 18.017 22.332 8.991 1.00 0.00 C ATOM 891 OE1 GLU A 69 17.258 23.174 9.520 1.00 0.00 O ATOM 892 OE2 GLU A 69 19.258 22.339 9.116 1.00 0.00 O ATOM 0 H GLU A 69 18.176 20.900 5.303 1.00 0.00 H new ATOM 0 HA GLU A 69 16.671 23.398 5.245 1.00 0.00 H new ATOM 0 HB2 GLU A 69 15.989 22.831 7.364 1.00 0.00 H new ATOM 0 HB3 GLU A 69 15.973 21.364 6.407 1.00 0.00 H new ATOM 0 HG2 GLU A 69 16.743 20.673 8.508 1.00 0.00 H new ATOM 0 HG3 GLU A 69 18.200 20.763 7.538 1.00 0.00 H new ATOM 899 N GLY A 70 18.189 24.678 7.269 1.00 0.00 N ATOM 900 CA GLY A 70 18.954 25.888 7.610 1.00 0.00 C ATOM 901 C GLY A 70 20.456 25.683 7.851 1.00 0.00 C ATOM 902 O GLY A 70 21.236 26.610 7.606 1.00 0.00 O ATOM 0 H GLY A 70 17.450 24.465 7.939 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.830 26.612 6.805 1.00 0.00 H new ATOM 0 HA3 GLY A 70 18.518 26.330 8.506 1.00 0.00 H new ATOM 906 N ARG A 71 20.891 24.498 8.306 1.00 0.00 N ATOM 907 CA ARG A 71 22.318 24.159 8.462 1.00 0.00 C ATOM 908 C ARG A 71 22.638 22.653 8.479 1.00 0.00 C ATOM 909 O ARG A 71 23.743 22.251 8.854 1.00 0.00 O ATOM 910 CB ARG A 71 22.920 24.900 9.677 1.00 0.00 C ATOM 911 CG ARG A 71 24.329 25.451 9.396 1.00 0.00 C ATOM 912 CD ARG A 71 24.309 26.630 8.408 1.00 0.00 C ATOM 913 NE ARG A 71 25.664 27.165 8.163 1.00 0.00 N ATOM 914 CZ ARG A 71 26.554 26.715 7.284 1.00 0.00 C ATOM 915 NH1 ARG A 71 26.305 25.705 6.474 1.00 0.00 N ATOM 916 NH2 ARG A 71 27.739 27.290 7.205 1.00 0.00 N ATOM 0 H ARG A 71 20.261 23.743 8.578 1.00 0.00 H new ATOM 0 HA ARG A 71 22.804 24.512 7.553 1.00 0.00 H new ATOM 0 HB2 ARG A 71 22.262 25.722 9.959 1.00 0.00 H new ATOM 0 HB3 ARG A 71 22.963 24.220 10.528 1.00 0.00 H new ATOM 0 HG2 ARG A 71 24.784 25.773 10.333 1.00 0.00 H new ATOM 0 HG3 ARG A 71 24.955 24.654 8.994 1.00 0.00 H new ATOM 0 HD2 ARG A 71 23.870 26.306 7.464 1.00 0.00 H new ATOM 0 HD3 ARG A 71 23.671 27.422 8.800 1.00 0.00 H new ATOM 0 HE ARG A 71 25.947 27.965 8.729 1.00 0.00 H new ATOM 0 HH11 ARG A 71 25.400 25.236 6.507 1.00 0.00 H new ATOM 0 HH12 ARG A 71 27.018 25.392 5.815 1.00 0.00 H new ATOM 0 HH21 ARG A 71 27.967 28.074 7.816 1.00 0.00 H new ATOM 0 HH22 ARG A 71 28.427 26.950 6.533 1.00 0.00 H new ATOM 930 N GLN A 72 21.709 21.799 8.071 1.00 0.00 N ATOM 931 CA GLN A 72 21.834 20.346 8.067 1.00 0.00 C ATOM 932 C GLN A 72 21.112 19.757 6.842 1.00 0.00 C ATOM 933 O GLN A 72 20.434 20.463 6.100 1.00 0.00 O ATOM 934 CB GLN A 72 21.213 19.817 9.382 1.00 0.00 C ATOM 935 CG GLN A 72 21.857 18.532 9.930 1.00 0.00 C ATOM 936 CD GLN A 72 23.114 18.734 10.784 1.00 0.00 C ATOM 937 OE1 GLN A 72 23.469 17.869 11.566 1.00 0.00 O ATOM 938 NE2 GLN A 72 23.849 19.827 10.682 1.00 0.00 N ATOM 0 H GLN A 72 20.806 22.114 7.717 1.00 0.00 H new ATOM 0 HA GLN A 72 22.881 20.048 8.005 1.00 0.00 H new ATOM 0 HB2 GLN A 72 21.287 20.596 10.141 1.00 0.00 H new ATOM 0 HB3 GLN A 72 20.151 19.633 9.217 1.00 0.00 H new ATOM 0 HG2 GLN A 72 21.115 18.001 10.527 1.00 0.00 H new ATOM 0 HG3 GLN A 72 22.111 17.887 9.089 1.00 0.00 H new ATOM 0 HE21 GLN A 72 23.575 20.567 10.036 1.00 0.00 H new ATOM 0 HE22 GLN A 72 24.690 19.931 11.250 1.00 0.00 H new ATOM 947 N VAL A 73 21.242 18.447 6.633 1.00 0.00 N ATOM 948 CA VAL A 73 20.413 17.695 5.684 1.00 0.00 C ATOM 949 C VAL A 73 19.154 17.248 6.425 1.00 0.00 C ATOM 950 O VAL A 73 19.241 16.813 7.572 1.00 0.00 O ATOM 951 CB VAL A 73 21.175 16.501 5.062 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.667 15.455 6.081 1.00 0.00 C ATOM 953 CG2 VAL A 73 20.345 15.792 3.977 1.00 0.00 C ATOM 0 H VAL A 73 21.929 17.872 7.119 1.00 0.00 H new ATOM 0 HA VAL A 73 20.144 18.332 4.842 1.00 0.00 H new ATOM 0 HB VAL A 73 22.059 16.957 4.617 1.00 0.00 H new ATOM 0 HG11 VAL A 73 22.190 14.655 5.557 1.00 0.00 H new ATOM 0 HG12 VAL A 73 22.346 15.929 6.790 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.814 15.041 6.618 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.917 14.960 3.567 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.420 15.416 4.414 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.109 16.498 3.181 1.00 0.00 H new ATOM 963 N ARG A 74 18.004 17.330 5.759 1.00 0.00 N ATOM 964 CA ARG A 74 16.721 16.827 6.229 1.00 0.00 C ATOM 965 C ARG A 74 16.179 15.828 5.216 1.00 0.00 C ATOM 966 O ARG A 74 16.637 15.772 4.075 1.00 0.00 O ATOM 967 CB ARG A 74 15.748 17.991 6.510 1.00 0.00 C ATOM 968 CG ARG A 74 15.035 18.627 5.300 1.00 0.00 C ATOM 969 CD ARG A 74 13.515 18.628 5.437 1.00 0.00 C ATOM 970 NE ARG A 74 12.908 19.875 4.943 1.00 0.00 N ATOM 971 CZ ARG A 74 11.780 20.003 4.254 1.00 0.00 C ATOM 972 NH1 ARG A 74 10.986 18.997 3.970 1.00 0.00 N ATOM 973 NH2 ARG A 74 11.424 21.189 3.816 1.00 0.00 N ATOM 0 H ARG A 74 17.941 17.767 4.840 1.00 0.00 H new ATOM 0 HA ARG A 74 16.845 16.305 7.178 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.985 17.633 7.201 1.00 0.00 H new ATOM 0 HB3 ARG A 74 16.301 18.776 7.026 1.00 0.00 H new ATOM 0 HG2 ARG A 74 15.384 19.652 5.177 1.00 0.00 H new ATOM 0 HG3 ARG A 74 15.313 18.085 4.396 1.00 0.00 H new ATOM 0 HD2 ARG A 74 13.103 17.783 4.886 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.247 18.487 6.484 1.00 0.00 H new ATOM 0 HE ARG A 74 13.410 20.737 5.154 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.224 18.056 4.283 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.131 19.157 3.437 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.012 22.000 4.006 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.560 21.299 3.286 1.00 0.00 H new ATOM 987 N TYR A 75 15.178 15.053 5.612 1.00 0.00 N ATOM 988 CA TYR A 75 14.421 14.196 4.699 1.00 0.00 C ATOM 989 C TYR A 75 12.973 14.686 4.611 1.00 0.00 C ATOM 990 O TYR A 75 12.492 15.334 5.535 1.00 0.00 O ATOM 991 CB TYR A 75 14.541 12.735 5.155 1.00 0.00 C ATOM 992 CG TYR A 75 15.978 12.252 5.310 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.937 12.533 4.313 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.377 11.576 6.479 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.291 12.203 4.506 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.722 11.197 6.656 1.00 0.00 C ATOM 997 CZ TYR A 75 18.686 11.531 5.681 1.00 0.00 C ATOM 998 OH TYR A 75 19.993 11.212 5.876 1.00 0.00 O ATOM 0 H TYR A 75 14.864 14.998 6.581 1.00 0.00 H new ATOM 0 HA TYR A 75 14.830 14.250 3.690 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.024 12.618 6.108 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.029 12.097 4.435 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.628 13.006 3.393 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.649 11.347 7.243 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.025 12.463 3.757 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.016 10.650 7.539 1.00 0.00 H new ATOM 0 HH TYR A 75 20.561 11.873 5.428 1.00 0.00 H new ATOM 1008 N ALA A 76 12.307 14.427 3.490 1.00 0.00 N ATOM 1009 CA ALA A 76 10.942 14.850 3.191 1.00 0.00 C ATOM 1010 C ALA A 76 10.238 13.767 2.383 1.00 0.00 C ATOM 1011 O ALA A 76 10.905 13.165 1.543 1.00 0.00 O ATOM 1012 CB ALA A 76 11.019 16.144 2.368 1.00 0.00 C ATOM 0 H ALA A 76 12.724 13.891 2.729 1.00 0.00 H new ATOM 0 HA ALA A 76 10.383 15.019 4.112 1.00 0.00 H new ATOM 0 HB1 ALA A 76 10.011 16.484 2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.534 16.912 2.945 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.566 15.956 1.444 1.00 0.00 H new ATOM 1018 N LEU A 77 8.934 13.540 2.612 1.00 0.00 N ATOM 1019 CA LEU A 77 8.135 12.707 1.708 1.00 0.00 C ATOM 1020 C LEU A 77 8.302 13.283 0.291 1.00 0.00 C ATOM 1021 O LEU A 77 8.375 14.505 0.160 1.00 0.00 O ATOM 1022 CB LEU A 77 6.637 12.703 2.098 1.00 0.00 C ATOM 1023 CG LEU A 77 6.053 11.333 2.441 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.657 10.719 3.693 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.565 11.529 2.719 1.00 0.00 C ATOM 0 H LEU A 77 8.418 13.918 3.407 1.00 0.00 H new ATOM 0 HA LEU A 77 8.480 11.675 1.766 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.500 13.362 2.955 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.063 13.128 1.274 1.00 0.00 H new ATOM 0 HG LEU A 77 6.262 10.668 1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.198 9.748 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.731 10.593 3.555 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.476 11.375 4.544 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.112 10.569 2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.439 12.218 3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.080 11.940 1.833 1.00 0.00 H new ATOM 1037 N ALA A 78 8.357 12.437 -0.740 1.00 0.00 N ATOM 1038 CA ALA A 78 8.604 12.896 -2.110 1.00 0.00 C ATOM 1039 C ALA A 78 7.602 13.973 -2.559 1.00 0.00 C ATOM 1040 O ALA A 78 7.972 15.116 -2.820 1.00 0.00 O ATOM 1041 CB ALA A 78 8.588 11.673 -3.031 1.00 0.00 C ATOM 0 H ALA A 78 8.234 11.428 -0.652 1.00 0.00 H new ATOM 0 HA ALA A 78 9.580 13.380 -2.158 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.770 11.989 -4.058 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.366 10.975 -2.723 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.616 11.183 -2.969 1.00 0.00 H new ATOM 1047 N ASP A 79 6.322 13.608 -2.576 1.00 0.00 N ATOM 1048 CA ASP A 79 5.232 14.454 -3.058 1.00 0.00 C ATOM 1049 C ASP A 79 3.925 14.211 -2.280 1.00 0.00 C ATOM 1050 O ASP A 79 3.730 13.203 -1.589 1.00 0.00 O ATOM 1051 CB ASP A 79 5.066 14.220 -4.584 1.00 0.00 C ATOM 1052 CG ASP A 79 3.745 14.736 -5.171 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.486 15.961 -5.116 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.896 13.884 -5.517 1.00 0.00 O ATOM 0 H ASP A 79 6.006 12.695 -2.248 1.00 0.00 H new ATOM 0 HA ASP A 79 5.479 15.501 -2.883 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.893 14.704 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.145 13.152 -4.785 1.00 0.00 H new ATOM 1059 N SER A 80 3.009 15.159 -2.479 1.00 0.00 N ATOM 1060 CA SER A 80 1.581 15.188 -2.163 1.00 0.00 C ATOM 1061 C SER A 80 0.916 13.804 -2.244 1.00 0.00 C ATOM 1062 O SER A 80 0.056 13.475 -1.425 1.00 0.00 O ATOM 1063 CB SER A 80 0.885 16.101 -3.200 1.00 0.00 C ATOM 1064 OG SER A 80 1.688 17.191 -3.634 1.00 0.00 O ATOM 0 H SER A 80 3.287 16.035 -2.922 1.00 0.00 H new ATOM 0 HA SER A 80 1.479 15.548 -1.139 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.603 15.502 -4.066 1.00 0.00 H new ATOM 0 HB3 SER A 80 -0.037 16.490 -2.767 1.00 0.00 H new ATOM 0 HG SER A 80 2.157 16.944 -4.458 1.00 0.00 H new ATOM 1070 N HIS A 81 1.352 12.982 -3.207 1.00 0.00 N ATOM 1071 CA HIS A 81 0.998 11.582 -3.397 1.00 0.00 C ATOM 1072 C HIS A 81 1.106 10.742 -2.118 1.00 0.00 C ATOM 1073 O HIS A 81 0.077 10.269 -1.628 1.00 0.00 O ATOM 1074 CB HIS A 81 1.862 11.048 -4.562 1.00 0.00 C ATOM 1075 CG HIS A 81 1.356 11.462 -5.926 1.00 0.00 C ATOM 1076 ND1 HIS A 81 0.242 12.228 -6.181 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.735 10.900 -7.108 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.143 12.005 -7.446 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.801 11.266 -8.065 1.00 0.00 N ATOM 0 H HIS A 81 2.006 13.306 -3.919 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.059 11.500 -3.652 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.885 11.404 -4.439 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.895 9.960 -4.510 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.213 12.858 -5.521 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.605 10.281 -7.270 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.059 12.359 -7.896 1.00 0.00 H new ATOM 1088 N LEU A 82 2.311 10.536 -1.564 1.00 0.00 N ATOM 1089 CA LEU A 82 2.444 9.732 -0.335 1.00 0.00 C ATOM 1090 C LEU A 82 1.859 10.490 0.857 1.00 0.00 C ATOM 1091 O LEU A 82 1.294 9.859 1.739 1.00 0.00 O ATOM 1092 CB LEU A 82 3.892 9.287 -0.021 1.00 0.00 C ATOM 1093 CG LEU A 82 4.778 8.782 -1.170 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.077 8.201 -0.608 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.116 7.754 -2.084 1.00 0.00 C ATOM 0 H LEU A 82 3.188 10.903 -1.934 1.00 0.00 H new ATOM 0 HA LEU A 82 1.881 8.816 -0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.403 10.131 0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.839 8.496 0.727 1.00 0.00 H new ATOM 0 HG LEU A 82 4.972 9.655 -1.793 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.701 7.845 -1.428 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.611 8.973 -0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.846 7.371 0.059 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.816 7.456 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.830 6.879 -1.500 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.228 8.192 -2.541 1.00 0.00 H new ATOM 1107 N ALA A 83 1.929 11.825 0.871 1.00 0.00 N ATOM 1108 CA ALA A 83 1.437 12.643 1.984 1.00 0.00 C ATOM 1109 C ALA A 83 -0.085 12.488 2.156 1.00 0.00 C ATOM 1110 O ALA A 83 -0.555 12.333 3.280 1.00 0.00 O ATOM 1111 CB ALA A 83 1.860 14.093 1.728 1.00 0.00 C ATOM 0 H ALA A 83 2.330 12.370 0.108 1.00 0.00 H new ATOM 0 HA ALA A 83 1.873 12.310 2.926 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.506 14.725 2.543 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.947 14.150 1.671 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.428 14.437 0.788 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.849 12.441 1.052 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.273 12.088 1.045 1.00 0.00 C ATOM 1119 C ARG A 84 -2.488 10.615 1.382 1.00 0.00 C ATOM 1120 O ARG A 84 -3.233 10.349 2.313 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.917 12.447 -0.313 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.309 11.831 -0.595 1.00 0.00 C ATOM 1123 CD ARG A 84 -5.404 12.096 0.456 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.757 13.522 0.542 1.00 0.00 N ATOM 1125 CZ ARG A 84 -6.616 14.151 -0.250 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.300 13.544 -1.197 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -6.798 15.445 -0.096 1.00 0.00 N ATOM 0 H ARG A 84 -0.484 12.652 0.123 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.764 12.673 1.822 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -3.004 13.532 -0.375 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.238 12.136 -1.107 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.660 12.207 -1.556 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.190 10.753 -0.699 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -6.293 11.518 0.206 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.062 11.749 1.431 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.304 14.073 1.271 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.182 12.542 -1.349 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.948 14.075 -1.778 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.282 15.950 0.624 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -7.455 15.943 -0.697 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.880 9.657 0.672 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.210 8.233 0.877 1.00 0.00 C ATOM 1143 C ALA A 85 -1.876 7.726 2.294 1.00 0.00 C ATOM 1144 O ALA A 85 -2.571 6.874 2.848 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.514 7.396 -0.201 1.00 0.00 C ATOM 0 H ALA A 85 -1.169 9.832 -0.038 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.291 8.125 0.784 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.754 6.343 -0.055 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.857 7.713 -1.186 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.435 7.536 -0.130 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.830 8.300 2.889 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.509 8.132 4.295 1.00 0.00 C ATOM 1153 C LEU A 86 -1.531 8.897 5.143 1.00 0.00 C ATOM 1154 O LEU A 86 -2.166 8.293 6.002 1.00 0.00 O ATOM 1155 CB LEU A 86 0.935 8.628 4.511 1.00 0.00 C ATOM 1156 CG LEU A 86 1.594 8.167 5.818 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.013 8.733 5.838 1.00 0.00 C ATOM 1158 CD2 LEU A 86 0.831 8.604 7.076 1.00 0.00 C ATOM 0 H LEU A 86 -0.174 8.904 2.393 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.563 7.087 4.602 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.547 8.290 3.675 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.936 9.718 4.487 1.00 0.00 H new ATOM 0 HG LEU A 86 1.591 7.077 5.840 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.515 8.425 6.756 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.567 8.357 4.978 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.971 9.821 5.795 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.354 8.244 7.962 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.773 9.692 7.107 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.176 8.187 7.054 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.706 10.198 4.886 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.441 11.128 5.749 1.00 0.00 C ATOM 1172 C GLY A 87 -3.960 10.895 5.831 1.00 0.00 C ATOM 1173 O GLY A 87 -4.562 11.240 6.842 1.00 0.00 O ATOM 0 H GLY A 87 -1.330 10.645 4.050 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.027 11.067 6.755 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.265 12.143 5.393 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.560 10.268 4.813 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.943 9.735 4.792 1.00 0.00 C ATOM 1179 C GLU A 88 -6.074 8.438 5.623 1.00 0.00 C ATOM 1180 O GLU A 88 -7.155 8.101 6.097 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.308 9.478 3.310 1.00 0.00 C ATOM 1182 CG GLU A 88 -7.554 8.632 2.989 1.00 0.00 C ATOM 1183 CD GLU A 88 -8.901 9.239 3.389 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -8.979 10.465 3.613 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -9.882 8.455 3.385 1.00 0.00 O ATOM 0 H GLU A 88 -4.075 10.106 3.930 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.626 10.454 5.244 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.434 10.448 2.828 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.452 8.997 2.838 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.570 8.438 1.917 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.451 7.667 3.486 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.958 7.713 5.783 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.772 6.436 6.475 1.00 0.00 C ATOM 1194 C LEU A 89 -5.297 5.280 5.620 1.00 0.00 C ATOM 1195 O LEU A 89 -6.495 5.007 5.581 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.381 6.415 7.896 1.00 0.00 C ATOM 1197 CG LEU A 89 -4.994 5.149 8.692 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -3.526 5.177 9.145 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.910 4.976 9.910 1.00 0.00 C ATOM 0 H LEU A 89 -4.076 8.042 5.390 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.699 6.308 6.614 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -5.049 7.298 8.442 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.467 6.475 7.822 1.00 0.00 H new ATOM 0 HG LEU A 89 -5.120 4.300 8.020 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.299 4.267 9.701 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.877 5.240 8.272 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.359 6.044 9.784 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.621 4.079 10.458 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.817 5.845 10.562 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.944 4.881 9.577 1.00 0.00 H new ATOM 1211 N VAL A 90 -4.364 4.485 5.094 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.528 3.341 4.166 1.00 0.00 C ATOM 1213 C VAL A 90 -5.497 2.226 4.593 1.00 0.00 C ATOM 1214 O VAL A 90 -5.559 1.185 3.939 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.171 2.643 3.921 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.200 3.478 3.076 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.536 2.269 5.267 1.00 0.00 C ATOM 0 H VAL A 90 -3.380 4.630 5.321 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.952 3.820 3.284 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.373 1.743 3.341 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.268 2.928 2.943 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.645 3.678 2.102 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.996 4.421 3.582 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.579 1.777 5.094 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.378 3.171 5.858 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.199 1.593 5.807 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.186 2.347 5.730 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.367 1.572 6.049 1.00 0.00 C ATOM 1229 C GLN A 91 -7.053 0.122 6.430 1.00 0.00 C ATOM 1230 O GLN A 91 -7.937 -0.581 6.886 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.351 1.680 4.884 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.061 3.036 4.709 1.00 0.00 C ATOM 1233 CD GLN A 91 -9.929 3.523 5.865 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.096 3.190 5.979 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.399 4.302 6.784 1.00 0.00 N ATOM 0 H GLN A 91 -5.925 3.004 6.465 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.827 1.988 6.945 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.815 1.454 3.962 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -9.112 0.910 5.007 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.301 3.793 4.515 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.687 2.977 3.818 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.424 4.592 6.707 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.963 4.616 7.574 1.00 0.00 H new ATOM 1244 N VAL A 92 -5.802 -0.321 6.336 1.00 0.00 N ATOM 1245 CA VAL A 92 -5.242 -1.594 6.858 1.00 0.00 C ATOM 1246 C VAL A 92 -5.262 -1.687 8.397 1.00 0.00 C ATOM 1247 O VAL A 92 -4.295 -2.058 9.046 1.00 0.00 O ATOM 1248 CB VAL A 92 -3.838 -1.805 6.256 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -2.830 -0.790 6.824 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -3.293 -3.233 6.373 1.00 0.00 C ATOM 0 H VAL A 92 -5.089 0.231 5.860 1.00 0.00 H new ATOM 0 HA VAL A 92 -5.888 -2.413 6.540 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.966 -1.632 5.187 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.849 -0.964 6.381 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.160 0.222 6.588 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.765 -0.908 7.906 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.302 -3.282 5.922 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -3.228 -3.512 7.425 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.962 -3.921 5.856 1.00 0.00 H new ATOM 1260 N VAL A 93 -6.386 -1.266 8.975 1.00 0.00 N ATOM 1261 CA VAL A 93 -6.760 -1.330 10.394 1.00 0.00 C ATOM 1262 C VAL A 93 -5.788 -0.575 11.333 1.00 0.00 C ATOM 1263 O VAL A 93 -5.918 -0.689 12.545 1.00 0.00 O ATOM 1264 CB VAL A 93 -6.983 -2.804 10.861 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -8.071 -2.863 11.947 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -7.473 -3.748 9.737 1.00 0.00 C ATOM 0 H VAL A 93 -7.124 -0.834 8.418 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.710 -0.801 10.472 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.006 -3.131 11.215 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.215 -3.896 12.262 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.764 -2.262 12.803 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.006 -2.472 11.547 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.605 -4.753 10.138 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.424 -3.385 9.346 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.736 -3.771 8.934 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.857 0.219 10.765 1.00 0.00 N ATOM 1277 CA LEU A 94 -3.665 0.795 11.408 1.00 0.00 C ATOM 1278 C LEU A 94 -2.611 -0.316 11.514 1.00 0.00 C ATOM 1279 O LEU A 94 -2.719 -1.231 12.323 1.00 0.00 O ATOM 1280 CB LEU A 94 -3.919 1.451 12.787 1.00 0.00 C ATOM 1281 CG LEU A 94 -2.677 2.189 13.337 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -2.446 3.530 12.623 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -2.822 2.425 14.845 1.00 0.00 C ATOM 0 H LEU A 94 -4.925 0.490 9.784 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.322 1.620 10.784 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.747 2.155 12.702 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.225 0.684 13.498 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.812 1.553 13.148 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.564 4.017 13.039 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.295 3.354 11.558 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.315 4.172 12.765 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.940 2.945 15.218 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.708 3.031 15.035 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.921 1.467 15.355 1.00 0.00 H new ATOM 1295 N ALA A 95 -1.576 -0.228 10.685 1.00 0.00 N ATOM 1296 CA ALA A 95 -0.408 -1.099 10.749 1.00 0.00 C ATOM 1297 C ALA A 95 0.212 -1.169 12.162 1.00 0.00 C ATOM 1298 O ALA A 95 0.319 -0.152 12.846 1.00 0.00 O ATOM 1299 CB ALA A 95 0.589 -0.553 9.733 1.00 0.00 C ATOM 0 H ALA A 95 -1.525 0.463 9.937 1.00 0.00 H new ATOM 0 HA ALA A 95 -0.695 -2.125 10.518 1.00 0.00 H new ATOM 0 HB1 ALA A 95 1.488 -1.170 9.738 1.00 0.00 H new ATOM 0 HB2 ALA A 95 0.142 -0.571 8.739 1.00 0.00 H new ATOM 0 HB3 ALA A 95 0.851 0.472 9.995 1.00 0.00 H new ATOM 1305 N VAL A 96 0.669 -2.364 12.540 1.00 0.00 N ATOM 1306 CA VAL A 96 1.236 -2.738 13.843 1.00 0.00 C ATOM 1307 C VAL A 96 2.262 -3.862 13.632 1.00 0.00 C ATOM 1308 O VAL A 96 2.271 -4.499 12.578 1.00 0.00 O ATOM 1309 CB VAL A 96 0.144 -3.208 14.841 1.00 0.00 C ATOM 1310 CG1 VAL A 96 -0.664 -2.030 15.407 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -0.810 -4.254 14.235 1.00 0.00 C ATOM 0 H VAL A 96 0.653 -3.156 11.898 1.00 0.00 H new ATOM 0 HA VAL A 96 1.712 -1.857 14.274 1.00 0.00 H new ATOM 0 HB VAL A 96 0.685 -3.685 15.658 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.417 -2.405 16.101 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.005 -1.348 15.932 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -1.155 -1.500 14.591 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.551 -4.545 14.979 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.314 -3.827 13.368 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.241 -5.131 13.928 1.00 0.00 H new ATOM 1321 N ASP A 97 3.091 -4.112 14.645 1.00 0.00 N ATOM 1322 CA ASP A 97 4.256 -5.016 14.655 1.00 0.00 C ATOM 1323 C ASP A 97 3.901 -6.528 14.717 1.00 0.00 C ATOM 1324 O ASP A 97 4.666 -7.352 15.221 1.00 0.00 O ATOM 1325 CB ASP A 97 5.196 -4.560 15.791 1.00 0.00 C ATOM 1326 CG ASP A 97 5.453 -3.044 15.765 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.553 -2.292 16.218 1.00 0.00 O ATOM 1328 OD2 ASP A 97 6.504 -2.589 15.267 1.00 0.00 O ATOM 0 H ASP A 97 2.962 -3.658 15.549 1.00 0.00 H new ATOM 0 HA ASP A 97 4.767 -4.936 13.695 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.761 -4.836 16.752 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.146 -5.088 15.707 1.00 0.00 H new ATOM 1333 N THR A 98 2.715 -6.899 14.212 1.00 0.00 N ATOM 1334 CA THR A 98 2.268 -8.280 13.938 1.00 0.00 C ATOM 1335 C THR A 98 2.079 -8.478 12.439 1.00 0.00 C ATOM 1336 O THR A 98 1.124 -9.099 11.969 1.00 0.00 O ATOM 1337 CB THR A 98 1.011 -8.662 14.724 1.00 0.00 C ATOM 1338 OG1 THR A 98 0.048 -7.640 14.606 1.00 0.00 O ATOM 1339 CG2 THR A 98 1.330 -8.849 16.207 1.00 0.00 C ATOM 0 H THR A 98 2.002 -6.211 13.970 1.00 0.00 H new ATOM 0 HA THR A 98 3.050 -8.956 14.285 1.00 0.00 H new ATOM 0 HB THR A 98 0.631 -9.598 14.314 1.00 0.00 H new ATOM 0 HG1 THR A 98 -0.756 -7.888 15.109 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.421 -9.120 16.743 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.069 -9.641 16.323 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.728 -7.919 16.614 1.00 0.00 H new ATOM 1347 N ASP A 99 3.048 -7.987 11.674 1.00 0.00 N ATOM 1348 CA ASP A 99 3.211 -8.066 10.217 1.00 0.00 C ATOM 1349 C ASP A 99 3.517 -9.492 9.703 1.00 0.00 C ATOM 1350 O ASP A 99 4.270 -9.717 8.757 1.00 0.00 O ATOM 1351 CB ASP A 99 4.242 -7.003 9.798 1.00 0.00 C ATOM 1352 CG ASP A 99 5.548 -7.004 10.605 1.00 0.00 C ATOM 1353 OD1 ASP A 99 5.839 -8.026 11.276 1.00 0.00 O ATOM 1354 OD2 ASP A 99 6.221 -5.957 10.566 1.00 0.00 O ATOM 0 H ASP A 99 3.819 -7.471 12.097 1.00 0.00 H new ATOM 0 HA ASP A 99 2.261 -7.843 9.730 1.00 0.00 H new ATOM 0 HB2 ASP A 99 4.484 -7.150 8.745 1.00 0.00 H new ATOM 0 HB3 ASP A 99 3.781 -6.019 9.885 1.00 0.00 H new ATOM 1359 N GLN A 100 2.857 -10.476 10.315 1.00 0.00 N ATOM 1360 CA GLN A 100 2.851 -11.873 9.914 1.00 0.00 C ATOM 1361 C GLN A 100 2.403 -12.020 8.431 1.00 0.00 C ATOM 1362 O GLN A 100 1.424 -11.374 8.031 1.00 0.00 O ATOM 1363 CB GLN A 100 1.993 -12.672 10.921 1.00 0.00 C ATOM 1364 CG GLN A 100 2.828 -13.558 11.869 1.00 0.00 C ATOM 1365 CD GLN A 100 3.201 -12.907 13.207 1.00 0.00 C ATOM 1366 OE1 GLN A 100 2.891 -13.427 14.265 1.00 0.00 O ATOM 1367 NE2 GLN A 100 3.874 -11.775 13.247 1.00 0.00 N ATOM 0 H GLN A 100 2.286 -10.306 11.143 1.00 0.00 H new ATOM 0 HA GLN A 100 3.857 -12.292 9.945 1.00 0.00 H new ATOM 0 HB2 GLN A 100 1.400 -11.976 11.514 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.292 -13.300 10.372 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.271 -14.473 12.071 1.00 0.00 H new ATOM 0 HG3 GLN A 100 3.745 -13.849 11.356 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.149 -11.314 12.380 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.120 -11.360 14.145 1.00 0.00 H new ATOM 1376 N PRO A 101 3.109 -12.866 7.642 1.00 0.00 N ATOM 1377 CA PRO A 101 3.068 -12.920 6.174 1.00 0.00 C ATOM 1378 C PRO A 101 1.813 -13.582 5.566 1.00 0.00 C ATOM 1379 O PRO A 101 0.743 -13.581 6.172 1.00 0.00 O ATOM 1380 CB PRO A 101 4.388 -13.630 5.808 1.00 0.00 C ATOM 1381 CG PRO A 101 4.524 -14.660 6.922 1.00 0.00 C ATOM 1382 CD PRO A 101 4.090 -13.835 8.129 1.00 0.00 C ATOM 0 HA PRO A 101 2.986 -11.922 5.743 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.338 -14.099 4.825 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.230 -12.938 5.789 1.00 0.00 H new ATOM 0 HG2 PRO A 101 3.884 -15.528 6.763 1.00 0.00 H new ATOM 0 HG3 PRO A 101 5.544 -15.030 7.020 1.00 0.00 H new ATOM 0 HD2 PRO A 101 3.655 -14.473 8.898 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.944 -13.329 8.580 1.00 0.00 H new ATOM 1390 N CYS A 102 1.959 -14.085 4.331 1.00 0.00 N ATOM 1391 CA CYS A 102 0.946 -14.720 3.500 1.00 0.00 C ATOM 1392 C CYS A 102 0.485 -16.117 4.006 1.00 0.00 C ATOM 1393 O CYS A 102 0.672 -16.508 5.156 1.00 0.00 O ATOM 1394 CB CYS A 102 1.559 -14.739 2.081 1.00 0.00 C ATOM 1395 SG CYS A 102 0.465 -15.135 0.680 1.00 0.00 S ATOM 0 H CYS A 102 2.862 -14.052 3.858 1.00 0.00 H new ATOM 0 HA CYS A 102 0.010 -14.162 3.526 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.999 -13.759 1.894 1.00 0.00 H new ATOM 0 HB3 CYS A 102 2.376 -15.460 2.080 1.00 0.00 H new ATOM 0 HG CYS A 102 -0.129 -14.052 0.273 1.00 0.00 H new ATOM 1476 N LEU B 11 0.028 -4.919 7.705 1.00 0.00 N ATOM 1477 CA LEU B 11 0.482 -4.211 6.506 1.00 0.00 C ATOM 1478 C LEU B 11 1.244 -5.100 5.526 1.00 0.00 C ATOM 1479 O LEU B 11 0.923 -5.064 4.341 1.00 0.00 O ATOM 1480 CB LEU B 11 1.283 -2.939 6.860 1.00 0.00 C ATOM 1481 CG LEU B 11 0.706 -1.663 6.208 1.00 0.00 C ATOM 1482 CD1 LEU B 11 1.583 -0.429 6.463 1.00 0.00 C ATOM 1483 CD2 LEU B 11 0.413 -1.748 4.697 1.00 0.00 C ATOM 0 HA LEU B 11 -0.424 -3.901 5.986 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.296 -2.814 7.943 1.00 0.00 H new ATOM 0 HB3 LEU B 11 2.318 -3.067 6.542 1.00 0.00 H new ATOM 0 HG LEU B 11 -0.257 -1.564 6.708 1.00 0.00 H new ATOM 0 HD11 LEU B 11 1.134 0.441 5.984 1.00 0.00 H new ATOM 0 HD12 LEU B 11 1.661 -0.253 7.536 1.00 0.00 H new ATOM 0 HD13 LEU B 11 2.578 -0.598 6.050 1.00 0.00 H new ATOM 0 HD21 LEU B 11 0.012 -0.796 4.350 1.00 0.00 H new ATOM 0 HD22 LEU B 11 1.335 -1.971 4.160 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -0.315 -2.537 4.511 1.00 0.00 H new ATOM 1495 N ALA B 12 2.194 -5.915 5.997 1.00 0.00 N ATOM 1496 CA ALA B 12 3.014 -6.778 5.145 1.00 0.00 C ATOM 1497 C ALA B 12 2.178 -7.681 4.228 1.00 0.00 C ATOM 1498 O ALA B 12 2.269 -7.522 3.010 1.00 0.00 O ATOM 1499 CB ALA B 12 3.987 -7.565 6.027 1.00 0.00 C ATOM 0 H ALA B 12 2.416 -5.994 6.989 1.00 0.00 H new ATOM 0 HA ALA B 12 3.587 -6.152 4.461 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.603 -8.212 5.402 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.627 -6.871 6.572 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.425 -8.174 6.735 1.00 0.00 H new ATOM 1505 N ARG B 13 1.330 -8.576 4.769 1.00 0.00 N ATOM 1506 CA ARG B 13 0.490 -9.466 3.942 1.00 0.00 C ATOM 1507 C ARG B 13 -0.491 -8.696 3.041 1.00 0.00 C ATOM 1508 O ARG B 13 -0.742 -9.123 1.918 1.00 0.00 O ATOM 1509 CB ARG B 13 -0.205 -10.563 4.779 1.00 0.00 C ATOM 1510 CG ARG B 13 -1.572 -10.189 5.385 1.00 0.00 C ATOM 1511 CD ARG B 13 -2.194 -11.336 6.199 1.00 0.00 C ATOM 1512 NE ARG B 13 -1.541 -11.472 7.513 1.00 0.00 N ATOM 1513 CZ ARG B 13 -2.073 -11.244 8.712 1.00 0.00 C ATOM 1514 NH1 ARG B 13 -3.365 -11.055 8.928 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -1.250 -11.166 9.731 1.00 0.00 N ATOM 0 H ARG B 13 1.208 -8.703 5.774 1.00 0.00 H new ATOM 0 HA ARG B 13 1.171 -9.982 3.265 1.00 0.00 H new ATOM 0 HB2 ARG B 13 -0.338 -11.443 4.149 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.463 -10.850 5.591 1.00 0.00 H new ATOM 0 HG2 ARG B 13 -1.454 -9.316 6.027 1.00 0.00 H new ATOM 0 HG3 ARG B 13 -2.255 -9.906 4.584 1.00 0.00 H new ATOM 0 HD2 ARG B 13 -3.259 -11.152 6.337 1.00 0.00 H new ATOM 0 HD3 ARG B 13 -2.101 -12.270 5.645 1.00 0.00 H new ATOM 0 HE ARG B 13 -0.568 -11.776 7.503 1.00 0.00 H new ATOM 0 HH11 ARG B 13 -4.021 -11.079 8.148 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -3.704 -10.885 9.875 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -0.247 -11.279 9.586 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -1.614 -10.993 10.668 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.996 -7.540 3.500 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.847 -6.653 2.702 1.00 0.00 C ATOM 1531 C LEU B 14 -1.077 -6.134 1.486 1.00 0.00 C ATOM 1532 O LEU B 14 -1.407 -6.475 0.353 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.393 -5.529 3.616 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.316 -4.455 2.996 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.593 -3.386 2.167 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.460 -5.072 2.201 1.00 0.00 C ATOM 0 H LEU B 14 -0.822 -7.195 4.444 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.706 -7.193 2.303 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.938 -6.002 4.433 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.538 -5.016 4.057 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.730 -3.930 3.857 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.321 -2.677 1.773 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.878 -2.859 2.798 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.066 -3.862 1.340 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.082 -4.280 1.784 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.055 -5.679 1.392 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.063 -5.699 2.858 1.00 0.00 H new ATOM 1548 N GLY B 15 -0.034 -5.329 1.693 1.00 0.00 N ATOM 1549 CA GLY B 15 0.599 -4.611 0.593 1.00 0.00 C ATOM 1550 C GLY B 15 1.393 -5.535 -0.323 1.00 0.00 C ATOM 1551 O GLY B 15 1.435 -5.247 -1.508 1.00 0.00 O ATOM 0 H GLY B 15 0.386 -5.160 2.607 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.165 -4.096 0.011 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.262 -3.846 0.996 1.00 0.00 H new ATOM 1555 N ARG B 16 1.939 -6.666 0.145 1.00 0.00 N ATOM 1556 CA ARG B 16 2.598 -7.645 -0.743 1.00 0.00 C ATOM 1557 C ARG B 16 1.643 -8.368 -1.710 1.00 0.00 C ATOM 1558 O ARG B 16 2.128 -9.055 -2.597 1.00 0.00 O ATOM 1559 CB ARG B 16 3.459 -8.634 0.065 1.00 0.00 C ATOM 1560 CG ARG B 16 2.701 -9.715 0.864 1.00 0.00 C ATOM 1561 CD ARG B 16 2.208 -10.953 0.103 1.00 0.00 C ATOM 1562 NE ARG B 16 3.284 -11.615 -0.651 1.00 0.00 N ATOM 1563 CZ ARG B 16 3.101 -12.472 -1.646 1.00 0.00 C ATOM 1564 NH1 ARG B 16 1.906 -12.920 -1.965 1.00 0.00 N ATOM 1565 NH2 ARG B 16 4.123 -12.915 -2.337 1.00 0.00 N ATOM 0 H ARG B 16 1.940 -6.929 1.131 1.00 0.00 H new ATOM 0 HA ARG B 16 3.256 -7.063 -1.388 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.141 -9.134 -0.623 1.00 0.00 H new ATOM 0 HB3 ARG B 16 4.072 -8.062 0.762 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.352 -10.054 1.670 1.00 0.00 H new ATOM 0 HG3 ARG B 16 1.837 -9.242 1.330 1.00 0.00 H new ATOM 0 HD2 ARG B 16 1.775 -11.661 0.809 1.00 0.00 H new ATOM 0 HD3 ARG B 16 1.414 -10.661 -0.584 1.00 0.00 H new ATOM 0 HE ARG B 16 4.245 -11.398 -0.388 1.00 0.00 H new ATOM 0 HH11 ARG B 16 1.088 -12.608 -1.441 1.00 0.00 H new ATOM 0 HH12 ARG B 16 1.797 -13.579 -2.736 1.00 0.00 H new ATOM 0 HH21 ARG B 16 5.067 -12.601 -2.111 1.00 0.00 H new ATOM 0 HH22 ARG B 16 3.975 -13.574 -3.101 1.00 0.00 H new ATOM 1579 N ALA B 17 0.328 -8.267 -1.499 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.716 -8.717 -2.420 1.00 0.00 C ATOM 1581 C ALA B 17 -1.462 -7.545 -3.096 1.00 0.00 C ATOM 1582 O ALA B 17 -2.273 -7.781 -3.993 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.666 -9.605 -1.605 1.00 0.00 C ATOM 0 H ALA B 17 -0.052 -7.853 -0.648 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.273 -9.274 -3.246 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.467 -9.968 -2.249 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.114 -10.453 -1.200 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.093 -9.026 -0.787 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.215 -6.299 -2.664 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.779 -5.080 -3.254 1.00 0.00 C ATOM 1591 C LEU B 18 -0.820 -4.499 -4.307 1.00 0.00 C ATOM 1592 O LEU B 18 -1.258 -4.060 -5.366 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.168 -4.093 -2.098 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.481 -3.274 -2.252 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.568 -4.178 -2.795 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.085 -2.725 -0.936 1.00 0.00 C ATOM 0 H LEU B 18 -0.600 -6.109 -1.873 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.697 -5.292 -3.803 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -2.240 -4.670 -1.176 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.347 -3.388 -1.970 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.195 -2.440 -2.892 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.492 -3.610 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.264 -4.570 -3.766 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -4.731 -5.006 -2.105 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.997 -2.170 -1.158 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.318 -3.555 -0.269 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -3.366 -2.063 -0.454 1.00 0.00 H new ATOM 1608 N ALA B 19 0.486 -4.582 -4.052 1.00 0.00 N ATOM 1609 CA ALA B 19 1.599 -4.048 -4.836 1.00 0.00 C ATOM 1610 C ALA B 19 2.028 -4.909 -6.048 1.00 0.00 C ATOM 1611 O ALA B 19 3.217 -5.023 -6.333 1.00 0.00 O ATOM 1612 CB ALA B 19 2.737 -3.797 -3.835 1.00 0.00 C ATOM 0 H ALA B 19 0.821 -5.067 -3.219 1.00 0.00 H new ATOM 0 HA ALA B 19 1.287 -3.127 -5.327 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.603 -3.395 -4.362 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.407 -3.082 -3.081 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.010 -4.735 -3.351 1.00 0.00 H new ATOM 1618 N ASP B 20 1.050 -5.512 -6.722 1.00 0.00 N ATOM 1619 CA ASP B 20 1.141 -6.531 -7.765 1.00 0.00 C ATOM 1620 C ASP B 20 0.866 -5.946 -9.177 1.00 0.00 C ATOM 1621 O ASP B 20 0.229 -4.891 -9.290 1.00 0.00 O ATOM 1622 CB ASP B 20 0.024 -7.557 -7.466 1.00 0.00 C ATOM 1623 CG ASP B 20 0.449 -8.964 -7.025 1.00 0.00 C ATOM 1624 OD1 ASP B 20 0.550 -9.202 -5.805 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.373 -9.891 -7.862 1.00 0.00 O ATOM 0 H ASP B 20 0.077 -5.275 -6.531 1.00 0.00 H new ATOM 0 HA ASP B 20 2.144 -6.959 -7.763 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.615 -7.140 -6.688 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.589 -7.657 -8.362 1.00 0.00 H new ATOM 1630 N PRO B 21 1.205 -6.692 -10.250 1.00 0.00 N ATOM 1631 CA PRO B 21 0.832 -6.418 -11.644 1.00 0.00 C ATOM 1632 C PRO B 21 -0.687 -6.639 -11.867 1.00 0.00 C ATOM 1633 O PRO B 21 -1.523 -5.847 -11.426 1.00 0.00 O ATOM 1634 CB PRO B 21 1.729 -7.379 -12.453 1.00 0.00 C ATOM 1635 CG PRO B 21 1.785 -8.596 -11.522 1.00 0.00 C ATOM 1636 CD PRO B 21 2.014 -7.903 -10.192 1.00 0.00 C ATOM 0 HA PRO B 21 0.989 -5.384 -11.950 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.298 -7.624 -13.424 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.717 -6.959 -12.640 1.00 0.00 H new ATOM 0 HG2 PRO B 21 0.861 -9.174 -11.537 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.593 -9.280 -11.780 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.713 -8.539 -9.359 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.068 -7.666 -10.047 1.00 0.00 H new ATOM 1644 N THR B 22 -1.062 -7.740 -12.536 1.00 0.00 N ATOM 1645 CA THR B 22 -2.433 -8.203 -12.786 1.00 0.00 C ATOM 1646 C THR B 22 -3.324 -8.152 -11.556 1.00 0.00 C ATOM 1647 O THR B 22 -4.500 -7.832 -11.690 1.00 0.00 O ATOM 1648 CB THR B 22 -2.449 -9.646 -13.330 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.158 -10.101 -13.673 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.326 -9.737 -14.578 1.00 0.00 C ATOM 0 H THR B 22 -0.370 -8.370 -12.942 1.00 0.00 H new ATOM 0 HA THR B 22 -2.831 -7.510 -13.527 1.00 0.00 H new ATOM 0 HB THR B 22 -2.846 -10.272 -12.531 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.807 -10.664 -12.952 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.326 -10.762 -14.949 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.345 -9.441 -14.329 1.00 0.00 H new ATOM 0 HG23 THR B 22 -2.933 -9.073 -15.348 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.803 -8.444 -10.360 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.604 -8.452 -9.127 1.00 0.00 C ATOM 1660 C ARG B 23 -4.111 -7.064 -8.716 1.00 0.00 C ATOM 1661 O ARG B 23 -5.232 -6.974 -8.214 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.829 -9.084 -7.969 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.576 -10.230 -7.292 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.247 -10.324 -5.800 1.00 0.00 C ATOM 1665 NE ARG B 23 -1.834 -10.637 -5.514 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.377 -11.492 -4.616 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -2.209 -12.117 -3.819 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.084 -11.714 -4.513 1.00 0.00 N ATOM 0 H ARG B 23 -1.821 -8.680 -10.217 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.482 -9.058 -9.354 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.873 -9.453 -8.340 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.608 -8.316 -7.228 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.649 -10.089 -7.419 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.318 -11.170 -7.780 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.503 -9.378 -5.322 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -3.877 -11.090 -5.347 1.00 0.00 H new ATOM 0 HE ARG B 23 -1.136 -10.141 -6.068 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -3.212 -11.944 -3.891 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -1.854 -12.777 -3.127 1.00 0.00 H new ATOM 0 HH21 ARG B 23 0.568 -11.226 -5.127 1.00 0.00 H new ATOM 0 HH22 ARG B 23 0.266 -12.374 -3.819 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.352 -5.993 -8.970 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.848 -4.623 -8.817 1.00 0.00 C ATOM 1684 C CYS B 24 -5.025 -4.374 -9.783 1.00 0.00 C ATOM 1685 O CYS B 24 -6.120 -3.993 -9.362 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.652 -3.681 -9.023 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.198 -1.956 -8.945 1.00 0.00 S ATOM 0 H CYS B 24 -2.384 -6.051 -9.285 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.255 -4.438 -7.823 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.897 -3.867 -8.259 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.185 -3.879 -9.988 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.581 -1.349 -7.975 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.831 -4.728 -11.061 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.865 -4.678 -12.105 1.00 0.00 C ATOM 1695 C ARG B 25 -7.153 -5.432 -11.718 1.00 0.00 C ATOM 1696 O ARG B 25 -8.237 -4.875 -11.857 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.295 -5.208 -13.426 1.00 0.00 C ATOM 1698 CG ARG B 25 -4.210 -4.293 -14.021 1.00 0.00 C ATOM 1699 CD ARG B 25 -3.564 -4.883 -15.291 1.00 0.00 C ATOM 1700 NE ARG B 25 -2.494 -4.019 -15.827 1.00 0.00 N ATOM 1701 CZ ARG B 25 -2.641 -2.806 -16.351 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -3.822 -2.244 -16.522 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -1.581 -2.128 -16.704 1.00 0.00 N ATOM 0 H ARG B 25 -3.932 -5.064 -11.406 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.153 -3.634 -12.225 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.876 -6.201 -13.263 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -6.105 -5.319 -14.147 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.648 -3.324 -14.258 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -3.437 -4.119 -13.273 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -3.154 -5.867 -15.064 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.330 -5.025 -16.053 1.00 0.00 H new ATOM 0 HE ARG B 25 -1.545 -4.391 -15.792 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -4.669 -2.743 -16.248 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -3.889 -1.311 -16.928 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.652 -2.530 -16.577 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -1.682 -1.196 -17.107 1.00 0.00 H new ATOM 1717 N ILE B 26 -7.050 -6.662 -11.198 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.185 -7.402 -10.580 1.00 0.00 C ATOM 1719 C ILE B 26 -8.980 -6.487 -9.660 1.00 0.00 C ATOM 1720 O ILE B 26 -10.157 -6.235 -9.891 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.747 -8.648 -9.745 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.021 -9.662 -10.634 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.960 -9.251 -9.009 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.000 -11.127 -10.194 1.00 0.00 C ATOM 0 H ILE B 26 -6.175 -7.185 -11.189 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.788 -7.751 -11.419 1.00 0.00 H new ATOM 0 HB ILE B 26 -7.035 -8.341 -8.979 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -7.473 -9.619 -11.625 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.988 -9.332 -10.740 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.641 -10.118 -8.431 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.386 -8.505 -8.338 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.712 -9.557 -9.737 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.450 -11.719 -10.925 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -6.514 -11.208 -9.222 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.022 -11.500 -10.121 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.311 -6.022 -8.611 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.942 -5.313 -7.500 1.00 0.00 C ATOM 1738 C LEU B 27 -9.605 -4.004 -7.923 1.00 0.00 C ATOM 1739 O LEU B 27 -10.707 -3.736 -7.446 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.918 -5.089 -6.379 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.591 -6.339 -5.540 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.506 -5.921 -4.550 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.796 -6.839 -4.733 1.00 0.00 C ATOM 0 H LEU B 27 -7.302 -6.127 -8.505 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.750 -5.942 -7.127 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.995 -4.714 -6.820 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.293 -4.311 -5.714 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.286 -7.144 -6.208 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.235 -6.773 -3.927 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.628 -5.577 -5.096 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.880 -5.114 -3.919 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.510 -7.721 -4.160 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -9.128 -6.056 -4.051 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.608 -7.096 -5.413 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.998 -3.224 -8.829 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.650 -1.986 -9.308 1.00 0.00 C ATOM 1757 C VAL B 28 -10.941 -2.267 -10.077 1.00 0.00 C ATOM 1758 O VAL B 28 -11.823 -1.413 -10.117 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.747 -1.020 -10.118 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.335 -0.887 -9.536 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.591 -1.369 -11.607 1.00 0.00 C ATOM 0 H VAL B 28 -8.083 -3.416 -9.238 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.886 -1.461 -8.382 1.00 0.00 H new ATOM 0 HB VAL B 28 -9.290 -0.078 -10.036 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.753 -0.198 -10.148 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.396 -0.505 -8.517 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.851 -1.864 -9.529 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -7.942 -0.636 -12.087 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -8.151 -2.361 -11.704 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.569 -1.357 -12.088 1.00 0.00 H new ATOM 1771 N ALA B 29 -11.055 -3.464 -10.663 1.00 0.00 N ATOM 1772 CA ALA B 29 -12.263 -3.911 -11.333 1.00 0.00 C ATOM 1773 C ALA B 29 -13.241 -4.641 -10.384 1.00 0.00 C ATOM 1774 O ALA B 29 -14.445 -4.598 -10.609 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.821 -4.767 -12.526 1.00 0.00 C ATOM 0 H ALA B 29 -10.300 -4.150 -10.681 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.840 -3.056 -11.685 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -12.700 -5.126 -13.061 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -11.207 -4.166 -13.197 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -11.241 -5.618 -12.168 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.754 -5.276 -9.304 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.555 -6.093 -8.373 1.00 0.00 C ATOM 1783 C LEU B 30 -14.654 -5.292 -7.674 1.00 0.00 C ATOM 1784 O LEU B 30 -15.757 -5.809 -7.491 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.631 -6.701 -7.292 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.106 -7.961 -6.545 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -13.955 -7.636 -5.311 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.841 -8.931 -7.470 1.00 0.00 C ATOM 0 H LEU B 30 -11.768 -5.235 -9.047 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.034 -6.870 -8.969 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.677 -6.935 -7.765 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.437 -5.928 -6.548 1.00 0.00 H new ATOM 0 HG LEU B 30 -12.201 -8.454 -6.190 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.261 -8.563 -4.825 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -13.369 -7.037 -4.614 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -14.840 -7.077 -5.615 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -14.158 -9.805 -6.902 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -14.715 -8.437 -7.895 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -13.174 -9.243 -8.274 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.314 -4.053 -7.298 1.00 0.00 N ATOM 1801 CA LEU B 31 -15.150 -3.022 -6.669 1.00 0.00 C ATOM 1802 C LEU B 31 -16.541 -2.917 -7.332 1.00 0.00 C ATOM 1803 O LEU B 31 -17.548 -2.915 -6.631 1.00 0.00 O ATOM 1804 CB LEU B 31 -14.352 -1.692 -6.755 1.00 0.00 C ATOM 1805 CG LEU B 31 -14.011 -0.959 -5.438 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -13.172 0.261 -5.816 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -15.267 -0.535 -4.666 1.00 0.00 C ATOM 0 H LEU B 31 -13.362 -3.716 -7.439 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.358 -3.275 -5.629 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -13.416 -1.898 -7.273 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -14.919 -1.004 -7.382 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.465 -1.628 -4.773 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.906 0.813 -4.915 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -12.264 -0.065 -6.323 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -13.747 0.906 -6.480 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.975 -0.024 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -15.863 0.138 -5.282 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.857 -1.417 -4.418 1.00 0.00 H new ATOM 1819 N ASP B 32 -16.567 -2.908 -8.668 1.00 0.00 N ATOM 1820 CA ASP B 32 -17.755 -2.900 -9.547 1.00 0.00 C ATOM 1821 C ASP B 32 -17.940 -4.262 -10.269 1.00 0.00 C ATOM 1822 O ASP B 32 -18.714 -4.416 -11.210 1.00 0.00 O ATOM 1823 CB ASP B 32 -17.560 -1.745 -10.549 1.00 0.00 C ATOM 1824 CG ASP B 32 -18.834 -1.345 -11.306 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -19.850 -1.077 -10.625 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -18.752 -1.224 -12.552 1.00 0.00 O ATOM 0 H ASP B 32 -15.702 -2.906 -9.208 1.00 0.00 H new ATOM 0 HA ASP B 32 -18.664 -2.751 -8.964 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -17.181 -0.875 -10.013 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -16.796 -2.032 -11.272 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.159 -5.263 -9.857 1.00 0.00 N ATOM 1832 CA GLY B 33 -16.996 -6.554 -10.524 1.00 0.00 C ATOM 1833 C GLY B 33 -17.705 -7.706 -9.840 1.00 0.00 C ATOM 1834 O GLY B 33 -18.148 -8.590 -10.558 1.00 0.00 O ATOM 0 H GLY B 33 -16.597 -5.191 -9.009 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.366 -6.471 -11.546 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -15.933 -6.784 -10.588 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.804 -7.702 -8.505 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.594 -8.586 -7.588 1.00 0.00 C ATOM 1840 C VAL B 34 -19.677 -9.570 -8.127 1.00 0.00 C ATOM 1841 O VAL B 34 -20.778 -9.656 -7.582 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.187 -7.770 -6.411 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.078 -7.133 -5.578 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.194 -6.682 -6.836 1.00 0.00 C ATOM 0 H VAL B 34 -17.282 -7.011 -7.966 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.805 -9.282 -7.304 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.742 -8.495 -5.816 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.519 -6.566 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.433 -7.913 -5.174 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.489 -6.465 -6.206 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.560 -6.159 -5.952 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.703 -5.971 -7.501 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -21.032 -7.145 -7.356 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.351 -10.404 -9.116 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.287 -11.330 -9.768 1.00 0.00 C ATOM 1856 C CYS B 35 -19.859 -12.794 -9.626 1.00 0.00 C ATOM 1857 O CYS B 35 -20.578 -13.573 -9.015 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.457 -10.894 -11.233 1.00 0.00 C ATOM 1859 SG CYS B 35 -21.576 -9.464 -11.277 1.00 0.00 S ATOM 0 H CYS B 35 -18.406 -10.458 -9.497 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.254 -11.280 -9.268 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.491 -10.634 -11.666 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.863 -11.712 -11.828 1.00 0.00 H new ATOM 0 HG CYS B 35 -21.734 -9.074 -12.507 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.685 -13.189 -10.128 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.280 -14.603 -10.120 1.00 0.00 C ATOM 1867 C TYR B 36 -16.776 -14.866 -10.333 1.00 0.00 C ATOM 1868 O TYR B 36 -16.063 -13.969 -10.805 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.119 -15.431 -11.140 1.00 0.00 C ATOM 1870 CG TYR B 36 -19.863 -14.716 -12.256 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -19.227 -14.451 -13.485 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -21.219 -14.372 -12.086 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -19.919 -13.777 -14.511 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -21.921 -13.711 -13.109 1.00 0.00 C ATOM 1875 CZ TYR B 36 -21.266 -13.395 -14.320 1.00 0.00 C ATOM 1876 OH TYR B 36 -21.932 -12.723 -15.295 1.00 0.00 O ATOM 0 H TYR B 36 -18.001 -12.557 -10.543 1.00 0.00 H new ATOM 0 HA TYR B 36 -18.487 -14.934 -9.102 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -18.447 -16.152 -11.606 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -19.854 -16.001 -10.571 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -18.206 -14.765 -13.641 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -21.723 -14.618 -11.163 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -19.420 -13.553 -15.442 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -22.958 -13.445 -12.969 1.00 0.00 H new ATOM 0 HH TYR B 36 -22.848 -12.540 -14.999 1.00 0.00 H new ATOM 1886 N PRO B 37 -16.273 -16.091 -10.047 1.00 0.00 N ATOM 1887 CA PRO B 37 -14.942 -16.509 -10.465 1.00 0.00 C ATOM 1888 C PRO B 37 -14.872 -16.398 -11.985 1.00 0.00 C ATOM 1889 O PRO B 37 -15.765 -16.852 -12.700 1.00 0.00 O ATOM 1890 CB PRO B 37 -14.762 -17.957 -9.992 1.00 0.00 C ATOM 1891 CG PRO B 37 -16.192 -18.464 -9.835 1.00 0.00 C ATOM 1892 CD PRO B 37 -16.938 -17.210 -9.394 1.00 0.00 C ATOM 0 HA PRO B 37 -14.149 -15.892 -10.042 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -14.204 -18.549 -10.717 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -14.214 -18.006 -9.051 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -16.586 -18.864 -10.769 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -16.262 -19.260 -9.094 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -17.988 -17.260 -9.682 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -16.909 -17.101 -8.310 1.00 0.00 H new ATOM 1900 N GLY B 38 -13.837 -15.721 -12.479 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.695 -15.468 -13.905 1.00 0.00 C ATOM 1902 C GLY B 38 -14.603 -14.370 -14.457 1.00 0.00 C ATOM 1903 O GLY B 38 -14.504 -14.117 -15.652 1.00 0.00 O ATOM 0 H GLY B 38 -13.084 -15.338 -11.908 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -12.659 -15.200 -14.110 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -13.898 -16.393 -14.445 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.421 -13.668 -13.655 1.00 0.00 N ATOM 1908 CA GLN B 39 -16.129 -12.464 -14.139 1.00 0.00 C ATOM 1909 C GLN B 39 -15.123 -11.417 -14.625 1.00 0.00 C ATOM 1910 O GLN B 39 -15.318 -10.798 -15.666 1.00 0.00 O ATOM 1911 CB GLN B 39 -17.081 -11.874 -13.079 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.462 -10.964 -11.998 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.123 -9.524 -12.416 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -15.187 -8.938 -11.905 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.824 -8.900 -13.339 1.00 0.00 N ATOM 0 H GLN B 39 -15.609 -13.906 -12.681 1.00 0.00 H new ATOM 0 HA GLN B 39 -16.754 -12.767 -14.979 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.852 -11.304 -13.598 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.581 -12.702 -12.577 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -17.152 -10.920 -11.155 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.549 -11.437 -11.638 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -17.614 -9.368 -13.783 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.578 -7.948 -13.610 1.00 0.00 H new ATOM 1924 N LEU B 40 -14.010 -11.300 -13.893 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.904 -10.387 -14.149 1.00 0.00 C ATOM 1926 C LEU B 40 -12.269 -10.605 -15.524 1.00 0.00 C ATOM 1927 O LEU B 40 -11.602 -9.716 -16.033 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.848 -10.633 -13.063 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.287 -10.253 -11.639 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.576 -11.165 -10.641 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -12.015 -8.766 -11.374 1.00 0.00 C ATOM 0 H LEU B 40 -13.854 -11.872 -13.063 1.00 0.00 H new ATOM 0 HA LEU B 40 -13.282 -9.365 -14.132 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.574 -11.688 -13.074 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.950 -10.068 -13.314 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.361 -10.397 -11.523 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.881 -10.903 -9.628 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -11.841 -12.203 -10.843 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.498 -11.041 -10.739 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.331 -8.513 -10.362 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.949 -8.566 -11.482 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.571 -8.161 -12.090 1.00 0.00 H new ATOM 1943 N ALA B 41 -12.457 -11.784 -16.122 1.00 0.00 N ATOM 1944 CA ALA B 41 -11.895 -12.103 -17.432 1.00 0.00 C ATOM 1945 C ALA B 41 -12.457 -11.183 -18.528 1.00 0.00 C ATOM 1946 O ALA B 41 -11.721 -10.785 -19.426 1.00 0.00 O ATOM 1947 CB ALA B 41 -12.190 -13.571 -17.739 1.00 0.00 C ATOM 0 H ALA B 41 -13.002 -12.541 -15.711 1.00 0.00 H new ATOM 0 HA ALA B 41 -10.818 -11.939 -17.413 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -11.778 -13.829 -18.715 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -11.735 -14.201 -16.975 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -13.268 -13.732 -17.747 1.00 0.00 H new ATOM 1953 N ALA B 42 -13.738 -10.809 -18.414 1.00 0.00 N ATOM 1954 CA ALA B 42 -14.351 -9.786 -19.256 1.00 0.00 C ATOM 1955 C ALA B 42 -13.803 -8.393 -18.922 1.00 0.00 C ATOM 1956 O ALA B 42 -13.408 -7.670 -19.829 1.00 0.00 O ATOM 1957 CB ALA B 42 -15.875 -9.858 -19.087 1.00 0.00 C ATOM 0 H ALA B 42 -14.378 -11.213 -17.730 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.102 -9.971 -20.301 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.347 -9.099 -19.711 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.228 -10.845 -19.387 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -16.134 -9.682 -18.043 1.00 0.00 H new ATOM 1963 N HIS B 43 -13.722 -8.032 -17.636 1.00 0.00 N ATOM 1964 CA HIS B 43 -13.181 -6.726 -17.219 1.00 0.00 C ATOM 1965 C HIS B 43 -11.729 -6.464 -17.687 1.00 0.00 C ATOM 1966 O HIS B 43 -11.377 -5.330 -18.016 1.00 0.00 O ATOM 1967 CB HIS B 43 -13.228 -6.618 -15.687 1.00 0.00 C ATOM 1968 CG HIS B 43 -14.548 -6.238 -15.076 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -15.553 -5.490 -15.689 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -14.790 -6.288 -13.735 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -16.364 -5.088 -14.697 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -15.926 -5.539 -13.510 1.00 0.00 N ATOM 0 H HIS B 43 -14.024 -8.625 -16.863 1.00 0.00 H new ATOM 0 HA HIS B 43 -13.809 -5.975 -17.698 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -12.923 -7.577 -15.269 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -12.485 -5.884 -15.375 1.00 0.00 H new ATOM 0 HD1 HIS B 43 -15.652 -5.290 -16.684 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -14.206 -6.812 -12.993 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -17.249 -4.484 -14.835 1.00 0.00 H new ATOM 1980 N LEU B 44 -10.872 -7.493 -17.665 1.00 0.00 N ATOM 1981 CA LEU B 44 -9.435 -7.382 -17.946 1.00 0.00 C ATOM 1982 C LEU B 44 -9.063 -7.742 -19.392 1.00 0.00 C ATOM 1983 O LEU B 44 -7.938 -7.462 -19.801 1.00 0.00 O ATOM 1984 CB LEU B 44 -8.646 -8.257 -16.945 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.909 -7.958 -15.453 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.910 -8.680 -14.550 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.885 -6.471 -15.077 1.00 0.00 C ATOM 0 H LEU B 44 -11.164 -8.446 -17.447 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.164 -6.333 -17.823 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.885 -9.303 -17.136 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.581 -8.133 -17.141 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.924 -8.324 -15.296 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.126 -8.446 -13.508 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.991 -9.756 -14.705 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.899 -8.354 -14.793 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.080 -6.362 -14.010 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.906 -6.052 -15.312 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -9.652 -5.940 -15.642 1.00 0.00 H new ATOM 1999 N GLY B 45 -9.940 -8.420 -20.144 1.00 0.00 N ATOM 2000 CA GLY B 45 -9.626 -9.004 -21.459 1.00 0.00 C ATOM 2001 C GLY B 45 -8.737 -10.256 -21.389 1.00 0.00 C ATOM 2002 O GLY B 45 -8.302 -10.764 -22.421 1.00 0.00 O ATOM 0 H GLY B 45 -10.904 -8.582 -19.853 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -10.558 -9.260 -21.964 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -9.129 -8.251 -22.070 1.00 0.00 H new ATOM 2006 N LEU B 46 -8.430 -10.747 -20.181 1.00 0.00 N ATOM 2007 CA LEU B 46 -7.489 -11.847 -19.935 1.00 0.00 C ATOM 2008 C LEU B 46 -8.224 -13.121 -19.505 1.00 0.00 C ATOM 2009 O LEU B 46 -9.222 -13.056 -18.795 1.00 0.00 O ATOM 2010 CB LEU B 46 -6.467 -11.412 -18.867 1.00 0.00 C ATOM 2011 CG LEU B 46 -5.513 -10.281 -19.306 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -4.654 -9.852 -18.108 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -4.602 -10.721 -20.464 1.00 0.00 C ATOM 0 H LEU B 46 -8.842 -10.379 -19.323 1.00 0.00 H new ATOM 0 HA LEU B 46 -6.963 -12.077 -20.862 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -7.008 -11.087 -17.978 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.872 -12.279 -18.579 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.117 -9.445 -19.658 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -3.978 -9.053 -18.413 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -5.300 -9.495 -17.306 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.073 -10.703 -17.753 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -3.946 -9.897 -20.744 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -4.000 -11.574 -20.150 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -5.214 -11.005 -21.321 1.00 0.00 H new ATOM 2025 N THR B 47 -7.709 -14.296 -19.896 1.00 0.00 N ATOM 2026 CA THR B 47 -8.387 -15.583 -19.667 1.00 0.00 C ATOM 2027 C THR B 47 -8.667 -15.840 -18.186 1.00 0.00 C ATOM 2028 O THR B 47 -7.823 -15.591 -17.316 1.00 0.00 O ATOM 2029 CB THR B 47 -7.663 -16.752 -20.347 1.00 0.00 C ATOM 2030 OG1 THR B 47 -8.405 -17.924 -20.098 1.00 0.00 O ATOM 2031 CG2 THR B 47 -6.234 -16.988 -19.857 1.00 0.00 C ATOM 0 H THR B 47 -6.814 -14.382 -20.378 1.00 0.00 H new ATOM 0 HA THR B 47 -9.362 -15.510 -20.148 1.00 0.00 H new ATOM 0 HB THR B 47 -7.591 -16.500 -21.405 1.00 0.00 H new ATOM 0 HG1 THR B 47 -7.963 -18.688 -20.525 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.801 -17.833 -20.392 1.00 0.00 H new ATOM 0 HG22 THR B 47 -5.635 -16.096 -20.040 1.00 0.00 H new ATOM 0 HG23 THR B 47 -6.247 -17.203 -18.789 1.00 0.00 H new ATOM 2039 N ARG B 48 -9.861 -16.381 -17.913 1.00 0.00 N ATOM 2040 CA ARG B 48 -10.361 -16.635 -16.557 1.00 0.00 C ATOM 2041 C ARG B 48 -9.451 -17.563 -15.751 1.00 0.00 C ATOM 2042 O ARG B 48 -9.310 -17.361 -14.547 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.825 -17.123 -16.579 1.00 0.00 C ATOM 2044 CG ARG B 48 -12.121 -18.403 -17.380 1.00 0.00 C ATOM 2045 CD ARG B 48 -13.637 -18.668 -17.395 1.00 0.00 C ATOM 2046 NE ARG B 48 -13.970 -19.904 -18.127 1.00 0.00 N ATOM 2047 CZ ARG B 48 -15.192 -20.394 -18.327 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -16.281 -19.778 -17.908 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -15.341 -21.535 -18.962 1.00 0.00 N ATOM 0 H ARG B 48 -10.518 -16.659 -18.642 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.345 -15.679 -16.033 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -12.144 -17.286 -15.549 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -12.444 -16.321 -16.981 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.750 -18.299 -18.400 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.599 -19.250 -16.936 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -14.003 -18.742 -16.371 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -14.149 -17.823 -17.856 1.00 0.00 H new ATOM 0 HE ARG B 48 -13.191 -20.434 -18.517 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -16.206 -18.891 -17.410 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -17.198 -20.189 -18.082 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -14.522 -22.042 -19.299 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -16.275 -21.914 -19.117 1.00 0.00 H new ATOM 2063 N SER B 49 -8.774 -18.511 -16.396 1.00 0.00 N ATOM 2064 CA SER B 49 -7.763 -19.358 -15.747 1.00 0.00 C ATOM 2065 C SER B 49 -6.581 -18.533 -15.216 1.00 0.00 C ATOM 2066 O SER B 49 -6.186 -18.703 -14.067 1.00 0.00 O ATOM 2067 CB SER B 49 -7.258 -20.417 -16.742 1.00 0.00 C ATOM 2068 OG SER B 49 -8.334 -20.998 -17.464 1.00 0.00 O ATOM 0 H SER B 49 -8.908 -18.718 -17.386 1.00 0.00 H new ATOM 0 HA SER B 49 -8.234 -19.846 -14.894 1.00 0.00 H new ATOM 0 HB2 SER B 49 -6.555 -19.960 -17.438 1.00 0.00 H new ATOM 0 HB3 SER B 49 -6.715 -21.195 -16.205 1.00 0.00 H new ATOM 0 HG SER B 49 -7.985 -21.666 -18.090 1.00 0.00 H new ATOM 2074 N ASN B 50 -6.063 -17.583 -16.006 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.917 -16.766 -15.599 1.00 0.00 C ATOM 2076 C ASN B 50 -5.300 -15.647 -14.616 1.00 0.00 C ATOM 2077 O ASN B 50 -4.574 -15.422 -13.647 1.00 0.00 O ATOM 2078 CB ASN B 50 -4.206 -16.194 -16.832 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.868 -15.590 -16.420 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -1.963 -16.301 -16.015 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -2.713 -14.280 -16.472 1.00 0.00 N ATOM 0 H ASN B 50 -6.423 -17.362 -16.934 1.00 0.00 H new ATOM 0 HA ASN B 50 -4.231 -17.422 -15.064 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -4.049 -16.980 -17.570 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -4.829 -15.434 -17.303 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.834 -13.858 -16.173 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -3.472 -13.690 -16.811 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.448 -14.975 -14.809 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.924 -13.999 -13.812 1.00 0.00 C ATOM 2090 C VAL B 51 -7.162 -14.683 -12.450 1.00 0.00 C ATOM 2091 O VAL B 51 -6.779 -14.141 -11.414 1.00 0.00 O ATOM 2092 CB VAL B 51 -8.174 -13.223 -14.289 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -8.625 -12.221 -13.219 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.884 -12.423 -15.574 1.00 0.00 C ATOM 0 H VAL B 51 -7.051 -15.084 -15.624 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.137 -13.256 -13.687 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.950 -13.964 -14.479 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.506 -11.684 -13.572 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -8.869 -12.755 -12.301 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -7.821 -11.511 -13.023 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.784 -11.890 -15.881 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.085 -11.707 -15.384 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.578 -13.106 -16.367 1.00 0.00 H new ATOM 2104 N SER B 52 -7.687 -15.913 -12.431 1.00 0.00 N ATOM 2105 CA SER B 52 -7.892 -16.656 -11.175 1.00 0.00 C ATOM 2106 C SER B 52 -6.603 -17.109 -10.482 1.00 0.00 C ATOM 2107 O SER B 52 -6.597 -17.244 -9.261 1.00 0.00 O ATOM 2108 CB SER B 52 -8.795 -17.874 -11.359 1.00 0.00 C ATOM 2109 OG SER B 52 -10.018 -17.509 -11.976 1.00 0.00 O ATOM 0 H SER B 52 -7.979 -16.418 -13.268 1.00 0.00 H new ATOM 0 HA SER B 52 -8.376 -15.924 -10.528 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.285 -18.621 -11.967 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.994 -18.333 -10.391 1.00 0.00 H new ATOM 0 HG SER B 52 -9.880 -17.405 -12.941 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.492 -17.267 -11.207 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.178 -17.571 -10.628 1.00 0.00 C ATOM 2117 C ASN B 53 -3.771 -16.512 -9.574 1.00 0.00 C ATOM 2118 O ASN B 53 -3.419 -16.806 -8.432 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.188 -17.674 -11.805 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.032 -18.634 -11.576 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.909 -19.287 -10.553 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -1.176 -18.778 -12.570 1.00 0.00 N ATOM 0 H ASN B 53 -5.478 -17.187 -12.224 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.189 -18.514 -10.082 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.733 -17.988 -12.695 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.785 -16.683 -12.011 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -0.404 -19.439 -12.486 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -1.286 -18.228 -13.422 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.000 -15.246 -9.928 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.884 -14.088 -9.038 1.00 0.00 C ATOM 2131 C HIS B 54 -5.040 -13.950 -8.002 1.00 0.00 C ATOM 2132 O HIS B 54 -4.863 -13.245 -7.006 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.757 -12.840 -9.935 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.344 -12.470 -10.339 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -1.379 -11.834 -9.578 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -1.813 -12.602 -11.595 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -0.324 -11.576 -10.366 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.560 -11.993 -11.618 1.00 0.00 N ATOM 0 H HIS B 54 -4.281 -14.989 -10.874 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.001 -14.216 -8.411 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.344 -13.002 -10.839 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.201 -11.992 -9.414 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -1.456 -11.601 -8.588 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -2.287 -13.097 -12.430 1.00 0.00 H new ATOM 0 HE1 HIS B 54 0.588 -11.099 -10.038 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.196 -14.618 -8.178 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.241 -14.702 -7.134 1.00 0.00 C ATOM 2148 C LEU B 55 -6.882 -15.693 -6.036 1.00 0.00 C ATOM 2149 O LEU B 55 -7.352 -15.515 -4.916 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.635 -15.108 -7.658 1.00 0.00 C ATOM 2151 CG LEU B 55 -9.298 -14.126 -8.633 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.602 -14.736 -9.163 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -9.598 -12.805 -7.921 1.00 0.00 C ATOM 0 H LEU B 55 -6.433 -15.111 -9.039 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.287 -13.683 -6.749 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.548 -16.076 -8.151 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.297 -15.244 -6.803 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.621 -13.934 -9.465 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.074 -14.040 -9.856 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.383 -15.670 -9.680 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.277 -14.933 -8.330 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -10.068 -12.114 -8.620 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.271 -12.988 -7.083 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -8.669 -12.371 -7.552 1.00 0.00 H new ATOM 2165 N SER B 56 -6.108 -16.736 -6.336 1.00 0.00 N ATOM 2166 CA SER B 56 -5.710 -17.753 -5.356 1.00 0.00 C ATOM 2167 C SER B 56 -5.217 -17.122 -4.042 1.00 0.00 C ATOM 2168 O SER B 56 -5.825 -17.327 -2.985 1.00 0.00 O ATOM 2169 CB SER B 56 -4.650 -18.673 -5.970 1.00 0.00 C ATOM 2170 OG SER B 56 -4.541 -19.846 -5.192 1.00 0.00 O ATOM 0 H SER B 56 -5.736 -16.902 -7.271 1.00 0.00 H new ATOM 0 HA SER B 56 -6.587 -18.348 -5.102 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.922 -18.927 -6.995 1.00 0.00 H new ATOM 0 HB3 SER B 56 -3.689 -18.161 -6.013 1.00 0.00 H new ATOM 0 HG SER B 56 -3.865 -20.437 -5.584 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.207 -16.249 -4.126 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.685 -15.543 -2.966 1.00 0.00 C ATOM 2178 C CYS B 57 -4.563 -14.352 -2.532 1.00 0.00 C ATOM 2179 O CYS B 57 -4.612 -14.070 -1.342 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.237 -15.156 -3.262 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.361 -14.282 -1.913 1.00 0.00 S ATOM 0 H CYS B 57 -3.735 -16.017 -5.000 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.709 -16.203 -2.099 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.680 -16.061 -3.506 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.223 -14.524 -4.150 1.00 0.00 H new ATOM 0 HG CYS B 57 -0.713 -15.144 -1.187 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.305 -13.680 -3.429 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.234 -12.588 -3.059 1.00 0.00 C ATOM 2188 C LEU B 58 -7.201 -13.025 -1.951 1.00 0.00 C ATOM 2189 O LEU B 58 -7.480 -12.259 -1.027 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.033 -12.133 -4.306 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.369 -10.632 -4.370 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.143 -9.750 -4.551 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.294 -10.404 -5.572 1.00 0.00 C ATOM 0 H LEU B 58 -5.281 -13.875 -4.430 1.00 0.00 H new ATOM 0 HA LEU B 58 -5.642 -11.756 -2.679 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.463 -12.398 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.965 -12.697 -4.344 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.833 -10.361 -3.422 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.449 -8.705 -4.588 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.461 -9.899 -3.714 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.639 -10.014 -5.481 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.548 -9.346 -5.640 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.787 -10.715 -6.485 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.205 -10.988 -5.446 1.00 0.00 H new ATOM 2205 N ARG B 59 -7.694 -14.266 -2.064 1.00 0.00 N ATOM 2206 CA ARG B 59 -8.632 -14.893 -1.128 1.00 0.00 C ATOM 2207 C ARG B 59 -7.927 -15.478 0.111 1.00 0.00 C ATOM 2208 O ARG B 59 -8.564 -15.623 1.150 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.434 -15.983 -1.866 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.152 -15.520 -3.162 1.00 0.00 C ATOM 2211 CD ARG B 59 -10.890 -16.642 -3.889 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.058 -17.849 -4.065 1.00 0.00 N ATOM 2213 CZ ARG B 59 -10.443 -19.098 -3.826 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -11.677 -19.377 -3.446 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -9.593 -20.098 -3.941 1.00 0.00 N ATOM 0 H ARG B 59 -7.441 -14.881 -2.837 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.308 -14.121 -0.761 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -8.758 -16.800 -2.118 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.180 -16.387 -1.182 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -10.863 -14.732 -2.912 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.417 -15.083 -3.838 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.788 -16.903 -3.329 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.216 -16.284 -4.866 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.104 -17.712 -4.399 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.357 -18.626 -3.330 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -11.950 -20.344 -3.268 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -8.628 -19.918 -4.216 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -9.900 -21.053 -3.755 1.00 0.00 H new ATOM 2229 N GLY B 60 -6.621 -15.768 0.035 1.00 0.00 N ATOM 2230 CA GLY B 60 -5.786 -16.216 1.168 1.00 0.00 C ATOM 2231 C GLY B 60 -5.296 -15.058 2.047 1.00 0.00 C ATOM 2232 O GLY B 60 -5.310 -15.164 3.267 1.00 0.00 O ATOM 0 H GLY B 60 -6.098 -15.697 -0.838 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.358 -16.913 1.781 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -4.925 -16.763 0.784 1.00 0.00 H new ATOM 2236 N CYS B 61 -4.913 -13.940 1.421 1.00 0.00 N ATOM 2237 CA CYS B 61 -4.629 -12.655 2.050 1.00 0.00 C ATOM 2238 C CYS B 61 -5.930 -11.950 2.546 1.00 0.00 C ATOM 2239 O CYS B 61 -5.879 -10.971 3.290 1.00 0.00 O ATOM 2240 CB CYS B 61 -3.782 -11.867 1.021 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.035 -12.370 1.052 1.00 0.00 S ATOM 0 H CYS B 61 -4.788 -13.910 0.409 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.058 -12.750 2.973 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.187 -12.024 0.021 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -3.856 -10.800 1.231 1.00 0.00 H new ATOM 0 HG CYS B 61 -1.754 -13.031 -0.032 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.108 -12.451 2.137 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.421 -12.057 2.674 1.00 0.00 C ATOM 2248 C GLY B 62 -8.949 -10.722 2.148 1.00 0.00 C ATOM 2249 O GLY B 62 -9.930 -10.205 2.674 1.00 0.00 O ATOM 0 H GLY B 62 -7.175 -13.159 1.406 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.144 -12.837 2.438 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.353 -12.003 3.761 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.318 -10.174 1.104 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.670 -8.893 0.488 1.00 0.00 C ATOM 2255 C LEU B 63 -10.029 -8.963 -0.215 1.00 0.00 C ATOM 2256 O LEU B 63 -10.803 -8.004 -0.231 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.555 -8.550 -0.493 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.149 -8.672 0.130 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.192 -8.098 -0.891 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -5.990 -7.941 1.468 1.00 0.00 C ATOM 0 H LEU B 63 -7.523 -10.625 0.651 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.764 -8.118 1.248 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.622 -9.211 -1.357 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.699 -7.533 -0.857 1.00 0.00 H new ATOM 0 HG LEU B 63 -5.953 -9.719 0.361 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.173 -8.155 -0.508 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.264 -8.668 -1.817 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.448 -7.056 -1.085 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -4.974 -8.076 1.838 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.186 -6.878 1.327 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.697 -8.348 2.191 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.287 -10.150 -0.760 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.546 -10.621 -1.324 1.00 0.00 C ATOM 2274 C VAL B 64 -12.131 -11.729 -0.459 1.00 0.00 C ATOM 2275 O VAL B 64 -11.404 -12.563 0.082 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.395 -11.155 -2.764 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.358 -9.991 -3.752 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.203 -12.076 -2.912 1.00 0.00 C ATOM 0 H VAL B 64 -9.561 -10.863 -0.823 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.210 -9.757 -1.349 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.268 -11.766 -2.994 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.251 -10.377 -4.766 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.284 -9.420 -3.677 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.513 -9.343 -3.520 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.139 -12.426 -3.942 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.292 -11.536 -2.655 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.319 -12.931 -2.245 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.457 -11.748 -0.389 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.247 -12.752 0.340 1.00 0.00 C ATOM 2290 C VAL B 65 -15.334 -13.339 -0.554 1.00 0.00 C ATOM 2291 O VAL B 65 -15.933 -12.633 -1.367 1.00 0.00 O ATOM 2292 CB VAL B 65 -14.896 -12.209 1.646 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -14.440 -13.079 2.829 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.590 -10.735 1.945 1.00 0.00 C ATOM 0 H VAL B 65 -14.037 -11.046 -0.850 1.00 0.00 H new ATOM 0 HA VAL B 65 -13.537 -13.526 0.631 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.975 -12.263 1.498 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -14.890 -12.706 3.749 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -14.753 -14.110 2.664 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -13.354 -13.038 2.913 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.082 -10.442 2.872 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.513 -10.600 2.047 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.957 -10.114 1.128 1.00 0.00 H new ATOM 2304 N ALA B 66 -15.598 -14.635 -0.377 1.00 0.00 N ATOM 2305 CA ALA B 66 -16.712 -15.333 -1.005 1.00 0.00 C ATOM 2306 C ALA B 66 -18.076 -14.881 -0.445 1.00 0.00 C ATOM 2307 O ALA B 66 -18.250 -14.744 0.766 1.00 0.00 O ATOM 2308 CB ALA B 66 -16.501 -16.843 -0.829 1.00 0.00 C ATOM 0 H ALA B 66 -15.030 -15.237 0.219 1.00 0.00 H new ATOM 0 HA ALA B 66 -16.733 -15.086 -2.066 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.326 -17.382 -1.294 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -15.564 -17.137 -1.302 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -16.463 -17.084 0.233 1.00 0.00 H new ATOM 2314 N THR B 67 -19.053 -14.675 -1.331 1.00 0.00 N ATOM 2315 CA THR B 67 -20.475 -14.486 -0.996 1.00 0.00 C ATOM 2316 C THR B 67 -21.253 -15.363 -1.961 1.00 0.00 C ATOM 2317 O THR B 67 -20.868 -15.452 -3.121 1.00 0.00 O ATOM 2318 CB THR B 67 -20.949 -13.042 -1.200 1.00 0.00 C ATOM 2319 OG1 THR B 67 -19.975 -12.108 -0.794 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.263 -12.724 -0.505 1.00 0.00 C ATOM 0 H THR B 67 -18.875 -14.633 -2.335 1.00 0.00 H new ATOM 0 HA THR B 67 -20.627 -14.735 0.054 1.00 0.00 H new ATOM 0 HB THR B 67 -21.115 -12.957 -2.274 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.312 -11.199 -0.940 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.533 -11.685 -0.695 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.045 -13.378 -0.889 1.00 0.00 H new ATOM 0 HG23 THR B 67 -22.154 -12.880 0.568 1.00 0.00 H new ATOM 2328 N TYR B 68 -22.355 -15.959 -1.538 1.00 0.00 N ATOM 2329 CA TYR B 68 -23.270 -16.624 -2.467 1.00 0.00 C ATOM 2330 C TYR B 68 -24.211 -15.588 -3.119 1.00 0.00 C ATOM 2331 O TYR B 68 -25.094 -15.057 -2.442 1.00 0.00 O ATOM 2332 CB TYR B 68 -24.014 -17.713 -1.686 1.00 0.00 C ATOM 2333 CG TYR B 68 -25.032 -18.469 -2.508 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -24.627 -19.510 -3.365 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -26.387 -18.105 -2.436 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.578 -20.189 -4.151 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.338 -18.764 -3.228 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.940 -19.814 -4.082 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.886 -20.448 -4.828 1.00 0.00 O ATOM 0 H TYR B 68 -22.643 -15.999 -0.560 1.00 0.00 H new ATOM 0 HA TYR B 68 -22.734 -17.097 -3.290 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -23.287 -18.420 -1.286 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -24.517 -17.256 -0.834 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -23.585 -19.788 -3.420 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -26.697 -17.315 -1.768 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.269 -20.992 -4.803 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.376 -18.468 -3.184 1.00 0.00 H new ATOM 0 HH TYR B 68 -28.764 -20.053 -4.646 1.00 0.00 H new ATOM 2349 N GLU B 69 -23.968 -15.218 -4.385 1.00 0.00 N ATOM 2350 CA GLU B 69 -24.925 -14.434 -5.183 1.00 0.00 C ATOM 2351 C GLU B 69 -26.167 -15.281 -5.595 1.00 0.00 C ATOM 2352 O GLU B 69 -26.465 -16.283 -4.948 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.173 -13.652 -6.286 1.00 0.00 C ATOM 2354 CG GLU B 69 -23.613 -14.423 -7.490 1.00 0.00 C ATOM 2355 CD GLU B 69 -24.703 -14.871 -8.455 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -25.487 -14.004 -8.896 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -24.852 -16.099 -8.636 1.00 0.00 O ATOM 0 H GLU B 69 -23.109 -15.451 -4.883 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.391 -13.651 -4.585 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -24.850 -12.889 -6.669 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.341 -13.131 -5.812 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -22.899 -13.793 -8.021 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -23.065 -15.296 -7.135 1.00 0.00 H new ATOM 2364 N GLY B 70 -26.944 -14.900 -6.617 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.246 -15.515 -6.926 1.00 0.00 C ATOM 2366 C GLY B 70 -28.211 -17.016 -7.250 1.00 0.00 C ATOM 2367 O GLY B 70 -29.205 -17.708 -7.003 1.00 0.00 O ATOM 0 H GLY B 70 -26.687 -14.150 -7.259 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -28.911 -15.360 -6.077 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -28.684 -14.989 -7.774 1.00 0.00 H new ATOM 2371 N ARG B 71 -27.097 -17.548 -7.776 1.00 0.00 N ATOM 2372 CA ARG B 71 -26.911 -18.991 -8.017 1.00 0.00 C ATOM 2373 C ARG B 71 -25.448 -19.465 -8.113 1.00 0.00 C ATOM 2374 O ARG B 71 -25.191 -20.603 -8.515 1.00 0.00 O ATOM 2375 CB ARG B 71 -27.750 -19.439 -9.235 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.457 -20.787 -9.005 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.596 -20.680 -7.978 1.00 0.00 C ATOM 2378 NE ARG B 71 -30.298 -21.966 -7.799 1.00 0.00 N ATOM 2379 CZ ARG B 71 -29.944 -22.967 -6.998 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.884 -22.907 -6.216 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -30.668 -24.066 -6.973 1.00 0.00 N ATOM 0 H ARG B 71 -26.291 -16.985 -8.049 1.00 0.00 H new ATOM 0 HA ARG B 71 -27.277 -19.489 -7.119 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -28.495 -18.676 -9.458 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -27.102 -19.517 -10.108 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.857 -21.151 -9.951 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -27.729 -21.523 -8.662 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -29.192 -20.351 -7.021 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -30.307 -19.920 -8.302 1.00 0.00 H new ATOM 0 HE ARG B 71 -31.146 -22.102 -8.349 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -28.301 -22.070 -6.211 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -28.647 -23.697 -5.616 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -31.494 -24.146 -7.565 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -30.403 -24.838 -6.361 1.00 0.00 H new ATOM 2395 N GLN B 72 -24.474 -18.635 -7.754 1.00 0.00 N ATOM 2396 CA GLN B 72 -23.043 -18.910 -7.844 1.00 0.00 C ATOM 2397 C GLN B 72 -22.296 -18.318 -6.631 1.00 0.00 C ATOM 2398 O GLN B 72 -22.886 -17.641 -5.793 1.00 0.00 O ATOM 2399 CB GLN B 72 -22.524 -18.289 -9.163 1.00 0.00 C ATOM 2400 CG GLN B 72 -21.423 -19.111 -9.856 1.00 0.00 C ATOM 2401 CD GLN B 72 -21.932 -20.145 -10.865 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -21.279 -20.421 -11.855 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -23.081 -20.773 -10.679 1.00 0.00 N ATOM 0 H GLN B 72 -24.669 -17.709 -7.374 1.00 0.00 H new ATOM 0 HA GLN B 72 -22.866 -19.985 -7.839 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -23.362 -18.172 -9.851 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -22.140 -17.290 -8.955 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -20.746 -18.427 -10.368 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -20.839 -19.626 -9.093 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -23.650 -20.563 -9.859 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -23.398 -21.467 -11.356 1.00 0.00 H new ATOM 2412 N VAL B 73 -20.984 -18.549 -6.546 1.00 0.00 N ATOM 2413 CA VAL B 73 -20.096 -17.852 -5.605 1.00 0.00 C ATOM 2414 C VAL B 73 -19.562 -16.598 -6.302 1.00 0.00 C ATOM 2415 O VAL B 73 -19.131 -16.669 -7.451 1.00 0.00 O ATOM 2416 CB VAL B 73 -18.956 -18.758 -5.080 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -18.046 -19.343 -6.178 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -18.083 -18.028 -4.044 1.00 0.00 C ATOM 0 H VAL B 73 -20.501 -19.230 -7.132 1.00 0.00 H new ATOM 0 HA VAL B 73 -20.661 -17.570 -4.717 1.00 0.00 H new ATOM 0 HB VAL B 73 -19.475 -19.596 -4.614 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -17.276 -19.964 -5.720 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -18.642 -19.949 -6.860 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -17.575 -18.531 -6.731 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -17.294 -18.695 -3.698 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -17.637 -17.145 -4.502 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -18.699 -17.726 -3.197 1.00 0.00 H new ATOM 2428 N ARG B 74 -19.577 -15.466 -5.601 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.021 -14.182 -6.026 1.00 0.00 C ATOM 2430 C ARG B 74 -17.856 -13.783 -5.115 1.00 0.00 C ATOM 2431 O ARG B 74 -17.739 -14.296 -4.000 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.144 -13.126 -6.058 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.568 -12.561 -4.689 1.00 0.00 C ATOM 2434 CD ARG B 74 -20.337 -11.059 -4.555 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.525 -10.352 -4.054 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.561 -9.214 -3.372 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -20.506 -8.453 -3.177 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -22.696 -8.820 -2.839 1.00 0.00 N ATOM 0 H ARG B 74 -19.999 -15.417 -4.674 1.00 0.00 H new ATOM 0 HA ARG B 74 -18.615 -14.261 -7.035 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.821 -12.297 -6.688 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.019 -13.567 -6.535 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.625 -12.774 -4.528 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -20.015 -13.077 -3.904 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -19.500 -10.882 -3.879 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -20.056 -10.649 -5.525 1.00 0.00 H new ATOM 0 HE ARG B 74 -22.426 -10.787 -4.254 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -19.601 -8.728 -3.559 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -20.593 -7.588 -2.644 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -23.536 -9.387 -2.952 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -22.736 -7.947 -2.313 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.008 -12.854 -5.554 1.00 0.00 N ATOM 2453 CA TYR B 75 -15.917 -12.322 -4.728 1.00 0.00 C ATOM 2454 C TYR B 75 -16.114 -10.825 -4.489 1.00 0.00 C ATOM 2455 O TYR B 75 -16.178 -10.060 -5.443 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.561 -12.636 -5.379 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.293 -14.116 -5.609 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.596 -15.070 -4.615 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -13.764 -14.545 -6.842 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.427 -16.444 -4.867 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -13.552 -15.915 -7.082 1.00 0.00 C ATOM 2462 CZ TYR B 75 -13.904 -16.870 -6.106 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.752 -18.196 -6.369 1.00 0.00 O ATOM 0 H TYR B 75 -17.055 -12.448 -6.489 1.00 0.00 H new ATOM 0 HA TYR B 75 -15.929 -12.807 -3.752 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.504 -12.118 -6.336 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -13.769 -12.231 -4.749 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -14.961 -14.743 -3.652 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.521 -13.820 -7.605 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.697 -17.170 -4.114 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.118 -16.236 -8.017 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.433 -18.706 -5.883 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.262 -10.425 -3.226 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.403 -9.038 -2.781 1.00 0.00 C ATOM 2475 C ALA B 76 -15.117 -8.552 -2.106 1.00 0.00 C ATOM 2476 O ALA B 76 -14.455 -9.376 -1.475 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.551 -8.997 -1.762 1.00 0.00 C ATOM 0 H ALA B 76 -16.288 -11.088 -2.451 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.604 -8.393 -3.636 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.686 -7.975 -1.407 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.470 -9.341 -2.236 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.313 -9.646 -0.919 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.793 -7.251 -2.198 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.761 -6.647 -1.350 1.00 0.00 C ATOM 2485 C LEU B 77 -14.187 -6.867 0.120 1.00 0.00 C ATOM 2486 O LEU B 77 -15.386 -6.945 0.391 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.624 -5.131 -1.636 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.185 -4.646 -1.766 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.529 -5.138 -3.049 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -12.241 -3.127 -1.855 1.00 0.00 C ATOM 0 H LEU B 77 -15.232 -6.602 -2.851 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.794 -7.108 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.159 -4.897 -2.556 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -14.111 -4.576 -0.834 1.00 0.00 H new ATOM 0 HG LEU B 77 -11.612 -5.017 -0.916 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.505 -4.768 -3.099 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -11.522 -6.228 -3.059 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.090 -4.771 -3.908 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.230 -2.731 -1.950 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -12.828 -2.835 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -12.705 -2.727 -0.954 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.237 -6.946 1.057 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.534 -7.269 2.457 1.00 0.00 C ATOM 2504 C ALA B 78 -14.485 -6.254 3.118 1.00 0.00 C ATOM 2505 O ALA B 78 -15.640 -6.547 3.421 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.197 -7.398 3.199 1.00 0.00 C ATOM 0 H ALA B 78 -12.247 -6.789 0.869 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.076 -8.214 2.506 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.383 -7.638 4.246 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.604 -8.191 2.745 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.653 -6.456 3.135 1.00 0.00 H new ATOM 2512 N ASP B 79 -13.985 -5.033 3.278 1.00 0.00 N ATOM 2513 CA ASP B 79 -14.687 -3.916 3.903 1.00 0.00 C ATOM 2514 C ASP B 79 -14.376 -2.595 3.181 1.00 0.00 C ATOM 2515 O ASP B 79 -13.389 -2.443 2.453 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.319 -3.859 5.409 1.00 0.00 C ATOM 2517 CG ASP B 79 -14.709 -2.546 6.104 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -15.911 -2.194 6.120 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -13.779 -1.787 6.464 1.00 0.00 O ATOM 0 H ASP B 79 -13.046 -4.785 2.965 1.00 0.00 H new ATOM 0 HA ASP B 79 -15.763 -4.069 3.818 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.807 -4.687 5.922 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.244 -4.007 5.515 1.00 0.00 H new ATOM 2524 N SER B 80 -15.238 -1.623 3.472 1.00 0.00 N ATOM 2525 CA SER B 80 -15.170 -0.182 3.225 1.00 0.00 C ATOM 2526 C SER B 80 -13.737 0.374 3.279 1.00 0.00 C ATOM 2527 O SER B 80 -13.375 1.263 2.506 1.00 0.00 O ATOM 2528 CB SER B 80 -15.993 0.526 4.326 1.00 0.00 C ATOM 2529 OG SER B 80 -17.100 -0.235 4.790 1.00 0.00 O ATOM 0 H SER B 80 -16.110 -1.856 3.946 1.00 0.00 H new ATOM 0 HA SER B 80 -15.557 -0.001 2.222 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.339 0.750 5.169 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.355 1.479 3.941 1.00 0.00 H new ATOM 0 HG SER B 80 -16.819 -0.794 5.544 1.00 0.00 H new ATOM 2535 N HIS B 81 -12.914 -0.190 4.172 1.00 0.00 N ATOM 2536 CA HIS B 81 -11.477 0.002 4.291 1.00 0.00 C ATOM 2537 C HIS B 81 -10.726 -0.137 2.957 1.00 0.00 C ATOM 2538 O HIS B 81 -10.231 0.872 2.452 1.00 0.00 O ATOM 2539 CB HIS B 81 -10.976 -0.940 5.411 1.00 0.00 C ATOM 2540 CG HIS B 81 -11.170 -0.361 6.799 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -11.765 0.848 7.093 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.497 -0.756 7.919 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.328 1.251 8.295 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -10.628 0.249 8.863 1.00 0.00 N ATOM 0 H HIS B 81 -13.267 -0.837 4.877 1.00 0.00 H new ATOM 0 HA HIS B 81 -11.259 1.033 4.571 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -11.504 -1.891 5.342 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -9.918 -1.151 5.255 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -12.424 1.350 6.498 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -9.960 -1.684 8.046 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -11.508 2.220 8.736 1.00 0.00 H new ATOM 2553 N LEU B 82 -10.617 -1.338 2.368 1.00 0.00 N ATOM 2554 CA LEU B 82 -9.913 -1.477 1.077 1.00 0.00 C ATOM 2555 C LEU B 82 -10.664 -0.721 -0.020 1.00 0.00 C ATOM 2556 O LEU B 82 -10.017 -0.170 -0.903 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.682 -2.938 0.633 1.00 0.00 C ATOM 2558 CG LEU B 82 -9.190 -3.931 1.700 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.953 -5.303 1.064 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -7.916 -3.464 2.401 1.00 0.00 C ATOM 0 H LEU B 82 -10.994 -2.206 2.749 1.00 0.00 H new ATOM 0 HA LEU B 82 -8.925 -1.045 1.235 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.618 -3.318 0.225 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.958 -2.932 -0.182 1.00 0.00 H new ATOM 0 HG LEU B 82 -9.970 -3.995 2.458 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.605 -6.001 1.825 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.885 -5.670 0.633 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -8.201 -5.216 0.280 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -7.617 -4.204 3.143 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.120 -3.344 1.666 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.101 -2.510 2.895 1.00 0.00 H new ATOM 2572 N ALA B 83 -11.999 -0.638 0.052 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.811 0.022 -0.978 1.00 0.00 C ATOM 2574 C ALA B 83 -12.454 1.516 -1.085 1.00 0.00 C ATOM 2575 O ALA B 83 -12.288 2.025 -2.189 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.292 -0.206 -0.659 1.00 0.00 C ATOM 0 H ALA B 83 -12.544 -1.025 0.822 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.599 -0.411 -1.956 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.906 0.280 -1.417 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.502 -1.276 -0.652 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.523 0.216 0.319 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.259 2.201 0.054 1.00 0.00 N ATOM 2583 CA ARG B 84 -11.745 3.577 0.124 1.00 0.00 C ATOM 2584 C ARG B 84 -10.280 3.660 -0.305 1.00 0.00 C ATOM 2585 O ARG B 84 -9.983 4.456 -1.184 1.00 0.00 O ATOM 2586 CB ARG B 84 -11.949 4.153 1.543 1.00 0.00 C ATOM 2587 CG ARG B 84 -11.172 5.449 1.875 1.00 0.00 C ATOM 2588 CD ARG B 84 -11.401 6.648 0.934 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.783 7.151 0.995 1.00 0.00 N ATOM 2590 CZ ARG B 84 -13.263 7.976 1.919 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -12.523 8.477 2.883 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -14.533 8.317 1.883 1.00 0.00 N ATOM 0 H ARG B 84 -12.459 1.804 0.972 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.314 4.184 -0.580 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.012 4.346 1.684 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.665 3.389 2.267 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -11.435 5.755 2.888 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -10.107 5.217 1.879 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -10.713 7.451 1.198 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -11.169 6.353 -0.089 1.00 0.00 H new ATOM 0 HE ARG B 84 -13.426 6.840 0.267 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -11.534 8.236 2.944 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -12.938 9.107 3.570 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -15.139 7.949 1.150 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -14.911 8.950 2.588 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.360 2.885 0.280 1.00 0.00 N ATOM 2607 CA ALA B 85 -7.921 3.042 -0.013 1.00 0.00 C ATOM 2608 C ALA B 85 -7.566 2.777 -1.488 1.00 0.00 C ATOM 2609 O ALA B 85 -6.691 3.429 -2.063 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.126 2.136 0.930 1.00 0.00 C ATOM 0 H ALA B 85 -9.577 2.149 0.952 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.652 4.084 0.158 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.061 2.242 0.724 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.326 2.421 1.963 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.424 1.099 0.775 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.292 1.842 -2.104 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.265 1.619 -3.538 1.00 0.00 C ATOM 2618 C LEU B 86 -8.943 2.796 -4.253 1.00 0.00 C ATOM 2619 O LEU B 86 -8.328 3.420 -5.113 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.950 0.263 -3.823 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.609 -0.313 -5.208 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -9.196 -1.720 -5.297 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -9.134 0.544 -6.368 1.00 0.00 C ATOM 0 H LEU B 86 -8.922 1.213 -1.607 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.245 1.570 -3.919 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.654 -0.453 -3.057 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.030 0.386 -3.745 1.00 0.00 H new ATOM 0 HG LEU B 86 -7.524 -0.326 -5.307 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.966 -2.149 -6.272 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -8.764 -2.345 -4.515 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -10.277 -1.672 -5.167 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -8.859 0.081 -7.316 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -10.219 0.619 -6.302 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -8.697 1.541 -6.311 1.00 0.00 H new ATOM 2635 N GLY B 87 -10.187 3.112 -3.876 1.00 0.00 N ATOM 2636 CA GLY B 87 -11.081 4.019 -4.603 1.00 0.00 C ATOM 2637 C GLY B 87 -10.675 5.504 -4.576 1.00 0.00 C ATOM 2638 O GLY B 87 -11.004 6.229 -5.508 1.00 0.00 O ATOM 0 H GLY B 87 -10.612 2.732 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -11.136 3.693 -5.642 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -12.084 3.926 -4.186 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.928 5.939 -3.559 1.00 0.00 N ATOM 2643 CA GLU B 88 -9.228 7.242 -3.475 1.00 0.00 C ATOM 2644 C GLU B 88 -8.027 7.291 -4.446 1.00 0.00 C ATOM 2645 O GLU B 88 -7.641 8.359 -4.920 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.733 7.399 -2.018 1.00 0.00 C ATOM 2647 CG GLU B 88 -7.787 8.571 -1.690 1.00 0.00 C ATOM 2648 CD GLU B 88 -8.423 9.959 -1.761 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -9.663 10.051 -1.646 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -7.639 10.938 -1.843 1.00 0.00 O ATOM 0 H GLU B 88 -9.782 5.370 -2.725 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.905 8.050 -3.753 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -9.610 7.490 -1.377 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -8.227 6.475 -1.737 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -7.386 8.424 -0.687 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -6.943 8.540 -2.379 1.00 0.00 H new ATOM 2657 N LEU B 89 -7.442 6.113 -4.708 1.00 0.00 N ATOM 2658 CA LEU B 89 -6.221 5.812 -5.454 1.00 0.00 C ATOM 2659 C LEU B 89 -5.004 6.026 -4.553 1.00 0.00 C ATOM 2660 O LEU B 89 -4.686 7.143 -4.163 1.00 0.00 O ATOM 2661 CB LEU B 89 -6.106 6.602 -6.779 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.978 6.099 -7.703 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -5.298 4.728 -8.320 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -4.713 7.118 -8.818 1.00 0.00 C ATOM 0 H LEU B 89 -7.866 5.253 -4.360 1.00 0.00 H new ATOM 0 HA LEU B 89 -6.264 4.764 -5.751 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -7.055 6.541 -7.312 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.935 7.654 -6.551 1.00 0.00 H new ATOM 0 HG LEU B 89 -4.086 5.984 -7.087 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -4.474 4.417 -8.962 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -5.436 3.995 -7.525 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -6.211 4.799 -8.910 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.915 6.752 -9.464 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -5.620 7.258 -9.406 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -4.416 8.070 -8.378 1.00 0.00 H new ATOM 2676 N VAL B 90 -4.205 4.978 -4.356 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.973 4.985 -3.529 1.00 0.00 C ATOM 2678 C VAL B 90 -1.871 5.942 -4.022 1.00 0.00 C ATOM 2679 O VAL B 90 -0.750 5.923 -3.518 1.00 0.00 O ATOM 2680 CB VAL B 90 -2.345 3.581 -3.445 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -3.159 2.616 -2.572 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -2.165 3.011 -4.859 1.00 0.00 C ATOM 0 H VAL B 90 -4.393 4.067 -4.775 1.00 0.00 H new ATOM 0 HA VAL B 90 -3.319 5.334 -2.556 1.00 0.00 H new ATOM 0 HB VAL B 90 -1.373 3.686 -2.963 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -2.668 1.643 -2.550 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -3.226 3.011 -1.558 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -4.161 2.508 -2.987 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.721 2.018 -4.797 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -3.136 2.944 -5.351 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -1.511 3.666 -5.435 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.136 6.718 -5.073 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.353 7.874 -5.487 1.00 0.00 C ATOM 2694 C GLN B 91 0.011 7.535 -6.099 1.00 0.00 C ATOM 2695 O GLN B 91 0.612 8.420 -6.680 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.205 8.832 -4.300 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.407 9.760 -4.080 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.698 10.832 -5.124 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.172 11.930 -5.076 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.555 10.579 -6.092 1.00 0.00 N ATOM 0 H GLN B 91 -2.936 6.548 -5.682 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.904 8.353 -6.297 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -1.043 8.247 -3.395 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.314 9.441 -4.450 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.296 9.136 -3.989 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.269 10.260 -3.121 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.005 9.666 -6.149 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -3.768 11.297 -6.785 1.00 0.00 H new ATOM 2709 N VAL B 92 0.476 6.288 -6.039 1.00 0.00 N ATOM 2710 CA VAL B 92 1.670 5.690 -6.706 1.00 0.00 C ATOM 2711 C VAL B 92 1.664 5.755 -8.247 1.00 0.00 C ATOM 2712 O VAL B 92 1.918 4.791 -8.955 1.00 0.00 O ATOM 2713 CB VAL B 92 1.852 4.253 -6.183 1.00 0.00 C ATOM 2714 CG1 VAL B 92 0.718 3.363 -6.726 1.00 0.00 C ATOM 2715 CG2 VAL B 92 3.219 3.608 -6.443 1.00 0.00 C ATOM 0 H VAL B 92 -0.008 5.591 -5.473 1.00 0.00 H new ATOM 0 HA VAL B 92 2.530 6.305 -6.439 1.00 0.00 H new ATOM 0 HB VAL B 92 1.805 4.335 -5.097 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.846 2.345 -6.357 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.243 3.753 -6.391 1.00 0.00 H new ATOM 0 HG13 VAL B 92 0.748 3.360 -7.816 1.00 0.00 H new ATOM 0 HG21 VAL B 92 3.230 2.599 -6.031 1.00 0.00 H new ATOM 0 HG22 VAL B 92 3.402 3.563 -7.517 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.998 4.203 -5.967 1.00 0.00 H new ATOM 2725 N VAL B 93 1.304 6.924 -8.760 1.00 0.00 N ATOM 2726 CA VAL B 93 1.325 7.359 -10.156 1.00 0.00 C ATOM 2727 C VAL B 93 0.386 6.549 -11.073 1.00 0.00 C ATOM 2728 O VAL B 93 0.369 6.785 -12.274 1.00 0.00 O ATOM 2729 CB VAL B 93 2.779 7.421 -10.722 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.901 8.491 -11.823 1.00 0.00 C ATOM 2731 CG2 VAL B 93 3.836 7.813 -9.661 1.00 0.00 C ATOM 0 H VAL B 93 0.956 7.665 -8.152 1.00 0.00 H new ATOM 0 HA VAL B 93 0.926 8.373 -10.153 1.00 0.00 H new ATOM 0 HB VAL B 93 2.967 6.413 -11.092 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.924 8.512 -12.199 1.00 0.00 H new ATOM 0 HG12 VAL B 93 2.220 8.252 -12.640 1.00 0.00 H new ATOM 0 HG13 VAL B 93 2.646 9.467 -11.411 1.00 0.00 H new ATOM 0 HG21 VAL B 93 4.823 7.837 -10.122 1.00 0.00 H new ATOM 0 HG22 VAL B 93 3.600 8.798 -9.259 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.830 7.080 -8.854 1.00 0.00 H new ATOM 2741 N LEU B 94 -0.416 5.646 -10.481 1.00 0.00 N ATOM 2742 CA LEU B 94 -1.163 4.557 -11.120 1.00 0.00 C ATOM 2743 C LEU B 94 -0.160 3.415 -11.336 1.00 0.00 C ATOM 2744 O LEU B 94 0.745 3.500 -12.158 1.00 0.00 O ATOM 2745 CB LEU B 94 -1.873 4.943 -12.439 1.00 0.00 C ATOM 2746 CG LEU B 94 -2.821 3.843 -12.962 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -4.119 3.774 -12.143 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -3.156 4.097 -14.438 1.00 0.00 C ATOM 0 H LEU B 94 -0.567 5.663 -9.472 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.986 4.267 -10.467 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -2.441 5.860 -12.284 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -1.122 5.158 -13.199 1.00 0.00 H new ATOM 0 HG LEU B 94 -2.306 2.888 -12.859 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -4.760 2.988 -12.542 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -3.881 3.555 -11.102 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -4.638 4.731 -12.203 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -3.825 3.316 -14.799 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -3.643 5.067 -14.539 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -2.238 4.088 -15.026 1.00 0.00 H new ATOM 2760 N ALA B 95 -0.318 2.338 -10.569 1.00 0.00 N ATOM 2761 CA ALA B 95 0.419 1.093 -10.766 1.00 0.00 C ATOM 2762 C ALA B 95 0.354 0.581 -12.222 1.00 0.00 C ATOM 2763 O ALA B 95 -0.702 0.645 -12.851 1.00 0.00 O ATOM 2764 CB ALA B 95 -0.187 0.075 -9.805 1.00 0.00 C ATOM 0 H ALA B 95 -0.969 2.306 -9.784 1.00 0.00 H new ATOM 0 HA ALA B 95 1.478 1.257 -10.567 1.00 0.00 H new ATOM 0 HB1 ALA B 95 0.330 -0.879 -9.912 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -0.080 0.433 -8.781 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -1.244 -0.058 -10.035 1.00 0.00 H new