USER MOD reduce.3.24.130724 H: found=0, std=0, add=1488, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1486 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 HIS : no HE2:sc= -1.35 K(o=-2,f=-3.7) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.642 K(o=-2,f=-4.8) USER MOD Set 2.1: A 91 GLN : amide:sc= -0.224 K(o=-2,f=-4.9) USER MOD Set 2.2: B 81 HIS : no HE2:sc= -1.78 K(o=-2,f=-3.3) USER MOD Set 3.1: B 22 THR OG1 : rot -99:sc= -0.0055 USER MOD Set 3.2: B 50 ASN : amide:sc= -0.636 K(o=-1,f=-7.9!) USER MOD Set 3.3: B 54 HIS : no HE2:sc= -0.405 K(o=-1,f=-4.2) USER MOD Set 4.1: A 39 GLN : amide:sc= -1.86 K(o=-2.2,f=-4.8!) USER MOD Set 4.2: A 43 HIS : no HD1:sc= -0.353 K(o=-2.2,f=-4.5) USER MOD Set 5.1: A 22 THR OG1 : rot -176:sc= 0.609 USER MOD Set 5.2: A 50 ASN : amide:sc= -0.0551 K(o=0.96,f=-1.8!) USER MOD Set 5.3: A 54 HIS : no HD1:sc= 0.403 K(o=0.96,f=-5.1!) USER MOD Single : A 24 CYS SG : rot 180:sc= -0.098 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.158 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 68:sc= 1.21 USER MOD Single : A 53 ASN : amide:sc= 0.52 K(o=0.52,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 78:sc= 0.761 USER MOD Single : A 68 TYR OH : rot -134:sc= 0.275 USER MOD Single : A 72 GLN : amide:sc= 0.726 K(o=0.73,f=-0.018) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot -26:sc= 1.15 USER MOD Single : A 100 GLN : amide:sc= -0.28 X(o=-0.28,f=-0.14) USER MOD Single : B 24 CYS SG : rot -129:sc= -0.207 USER MOD Single : B 35 CYS SG : rot 54:sc= 0.615 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 GLN : amide:sc= 1.13 K(o=1.1,f=-6.6!) USER MOD Single : B 43 HIS : no HD1:sc= -1.33 X(o=-1.3,f=-1.6) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.391 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 76:sc= 1.06 USER MOD Single : B 53 ASN : amide:sc= 0.848 K(o=0.85,f=0) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 76:sc= 1.28 USER MOD Single : B 68 TYR OH : rot -135:sc= 0.19 USER MOD Single : B 72 GLN : amide:sc= -0.353 K(o=-0.35,f=-2.4!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 180:sc= 0.00868 USER MOD Single : B 98 THR OG1 : rot 180:sc=-0.00597 USER MOD Single : B 100 GLN : amide:sc=0.000714 K(o=0.00071,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 10 4.893 2.556 -9.066 1.00 0.00 N ATOM 2 CA ALA A 10 4.444 1.203 -9.391 1.00 0.00 C ATOM 3 C ALA A 10 4.109 0.468 -8.091 1.00 0.00 C ATOM 4 O ALA A 10 4.879 0.569 -7.131 1.00 0.00 O ATOM 5 CB ALA A 10 5.553 0.485 -10.170 1.00 0.00 C ATOM 0 HA ALA A 10 3.549 1.228 -10.013 1.00 0.00 H new ATOM 0 HB1 ALA A 10 5.228 -0.526 -10.417 1.00 0.00 H new ATOM 0 HB2 ALA A 10 5.766 1.033 -11.088 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.454 0.437 -9.559 1.00 0.00 H new ATOM 11 N LEU A 11 2.981 -0.255 -8.023 1.00 0.00 N ATOM 12 CA LEU A 11 2.517 -0.828 -6.751 1.00 0.00 C ATOM 13 C LEU A 11 3.492 -1.890 -6.224 1.00 0.00 C ATOM 14 O LEU A 11 3.701 -1.950 -5.019 1.00 0.00 O ATOM 15 CB LEU A 11 1.060 -1.350 -6.832 1.00 0.00 C ATOM 16 CG LEU A 11 0.168 -0.841 -5.670 1.00 0.00 C ATOM 17 CD1 LEU A 11 -1.255 -1.414 -5.768 1.00 0.00 C ATOM 18 CD2 LEU A 11 0.725 -1.163 -4.274 1.00 0.00 C ATOM 0 H LEU A 11 2.380 -0.455 -8.823 1.00 0.00 H new ATOM 0 HA LEU A 11 2.503 -0.017 -6.023 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.622 -1.041 -7.781 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.070 -2.440 -6.825 1.00 0.00 H new ATOM 0 HG LEU A 11 0.154 0.243 -5.783 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -1.856 -1.039 -4.940 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -1.706 -1.108 -6.712 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.213 -2.502 -5.722 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.047 -0.776 -3.514 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.819 -2.243 -4.160 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.704 -0.699 -4.157 1.00 0.00 H new ATOM 30 N ALA A 12 4.172 -2.652 -7.089 1.00 0.00 N ATOM 31 CA ALA A 12 5.164 -3.637 -6.645 1.00 0.00 C ATOM 32 C ALA A 12 6.379 -2.984 -5.956 1.00 0.00 C ATOM 33 O ALA A 12 6.786 -3.413 -4.872 1.00 0.00 O ATOM 34 CB ALA A 12 5.553 -4.507 -7.848 1.00 0.00 C ATOM 0 H ALA A 12 4.053 -2.605 -8.101 1.00 0.00 H new ATOM 0 HA ALA A 12 4.725 -4.272 -5.876 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.291 -5.247 -7.538 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.668 -5.015 -8.231 1.00 0.00 H new ATOM 0 HB3 ALA A 12 5.977 -3.877 -8.630 1.00 0.00 H new ATOM 40 N ARG A 13 6.911 -1.893 -6.527 1.00 0.00 N ATOM 41 CA ARG A 13 7.968 -1.094 -5.887 1.00 0.00 C ATOM 42 C ARG A 13 7.465 -0.436 -4.596 1.00 0.00 C ATOM 43 O ARG A 13 7.969 -0.715 -3.504 1.00 0.00 O ATOM 44 CB ARG A 13 8.505 -0.029 -6.866 1.00 0.00 C ATOM 45 CG ARG A 13 9.587 -0.567 -7.819 1.00 0.00 C ATOM 46 CD ARG A 13 11.031 -0.294 -7.344 1.00 0.00 C ATOM 47 NE ARG A 13 11.282 -0.709 -5.953 1.00 0.00 N ATOM 48 CZ ARG A 13 11.327 -1.956 -5.502 1.00 0.00 C ATOM 49 NH1 ARG A 13 11.294 -3.000 -6.299 1.00 0.00 N ATOM 50 NH2 ARG A 13 11.379 -2.154 -4.206 1.00 0.00 N ATOM 0 H ARG A 13 6.623 -1.541 -7.440 1.00 0.00 H new ATOM 0 HA ARG A 13 8.783 -1.767 -5.621 1.00 0.00 H new ATOM 0 HB2 ARG A 13 7.676 0.364 -7.454 1.00 0.00 H new ATOM 0 HB3 ARG A 13 8.915 0.805 -6.296 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.451 -1.642 -7.937 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.447 -0.118 -8.802 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.726 -0.817 -8.001 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.241 0.771 -7.440 1.00 0.00 H new ATOM 0 HE ARG A 13 11.436 0.034 -5.271 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.231 -2.869 -7.309 1.00 0.00 H new ATOM 0 HH12 ARG A 13 11.331 -3.941 -5.908 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.384 -1.358 -3.568 1.00 0.00 H new ATOM 0 HH22 ARG A 13 11.414 -3.104 -3.836 1.00 0.00 H new ATOM 64 N LEU A 14 6.448 0.418 -4.736 1.00 0.00 N ATOM 65 CA LEU A 14 5.918 1.296 -3.691 1.00 0.00 C ATOM 66 C LEU A 14 5.393 0.465 -2.515 1.00 0.00 C ATOM 67 O LEU A 14 5.815 0.654 -1.379 1.00 0.00 O ATOM 68 CB LEU A 14 4.826 2.203 -4.318 1.00 0.00 C ATOM 69 CG LEU A 14 4.654 3.611 -3.704 1.00 0.00 C ATOM 70 CD1 LEU A 14 4.552 3.602 -2.177 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.773 4.546 -4.184 1.00 0.00 C ATOM 0 H LEU A 14 5.950 0.520 -5.620 1.00 0.00 H new ATOM 0 HA LEU A 14 6.703 1.936 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.049 2.320 -5.379 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.871 1.683 -4.248 1.00 0.00 H new ATOM 0 HG LEU A 14 3.697 3.992 -4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.433 4.623 -1.814 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.691 3.006 -1.873 1.00 0.00 H new ATOM 0 HD13 LEU A 14 5.459 3.170 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.637 5.533 -3.742 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.739 4.143 -3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.739 4.627 -5.270 1.00 0.00 H new ATOM 83 N GLY A 15 4.518 -0.506 -2.784 1.00 0.00 N ATOM 84 CA GLY A 15 3.790 -1.245 -1.755 1.00 0.00 C ATOM 85 C GLY A 15 4.680 -2.177 -0.932 1.00 0.00 C ATOM 86 O GLY A 15 4.439 -2.318 0.262 1.00 0.00 O ATOM 0 H GLY A 15 4.294 -0.803 -3.734 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.302 -0.536 -1.086 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.002 -1.831 -2.228 1.00 0.00 H new ATOM 90 N ARG A 16 5.741 -2.760 -1.514 1.00 0.00 N ATOM 91 CA ARG A 16 6.701 -3.583 -0.758 1.00 0.00 C ATOM 92 C ARG A 16 7.592 -2.716 0.131 1.00 0.00 C ATOM 93 O ARG A 16 7.970 -3.153 1.216 1.00 0.00 O ATOM 94 CB ARG A 16 7.533 -4.492 -1.688 1.00 0.00 C ATOM 95 CG ARG A 16 8.309 -5.594 -0.923 1.00 0.00 C ATOM 96 CD ARG A 16 9.727 -5.195 -0.458 1.00 0.00 C ATOM 97 NE ARG A 16 10.307 -6.138 0.524 1.00 0.00 N ATOM 98 CZ ARG A 16 10.035 -6.185 1.828 1.00 0.00 C ATOM 99 NH1 ARG A 16 9.094 -5.459 2.374 1.00 0.00 N ATOM 100 NH2 ARG A 16 10.722 -6.948 2.651 1.00 0.00 N ATOM 0 H ARG A 16 5.956 -2.677 -2.508 1.00 0.00 H new ATOM 0 HA ARG A 16 6.126 -4.240 -0.105 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.871 -4.961 -2.416 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.240 -3.880 -2.248 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.726 -5.887 -0.050 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.387 -6.472 -1.563 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.383 -5.136 -1.326 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.691 -4.199 -0.017 1.00 0.00 H new ATOM 0 HE ARG A 16 10.980 -6.817 0.169 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.537 -4.828 1.797 1.00 0.00 H new ATOM 0 HH12 ARG A 16 8.917 -5.524 3.376 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.485 -7.524 2.296 1.00 0.00 H new ATOM 0 HH22 ARG A 16 10.491 -6.964 3.644 1.00 0.00 H new ATOM 114 N ALA A 17 7.936 -1.502 -0.299 1.00 0.00 N ATOM 115 CA ALA A 17 8.716 -0.582 0.526 1.00 0.00 C ATOM 116 C ALA A 17 7.922 -0.107 1.759 1.00 0.00 C ATOM 117 O ALA A 17 8.527 0.109 2.813 1.00 0.00 O ATOM 118 CB ALA A 17 9.195 0.568 -0.362 1.00 0.00 C ATOM 0 H ALA A 17 7.686 -1.133 -1.216 1.00 0.00 H new ATOM 0 HA ALA A 17 9.588 -1.092 0.935 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.780 1.268 0.234 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.813 0.172 -1.168 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.333 1.084 -0.785 1.00 0.00 H new ATOM 124 N LEU A 18 6.588 -0.003 1.637 1.00 0.00 N ATOM 125 CA LEU A 18 5.696 0.329 2.757 1.00 0.00 C ATOM 126 C LEU A 18 5.326 -0.924 3.575 1.00 0.00 C ATOM 127 O LEU A 18 5.181 -0.811 4.788 1.00 0.00 O ATOM 128 CB LEU A 18 4.471 1.133 2.243 1.00 0.00 C ATOM 129 CG LEU A 18 4.726 2.663 2.164 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.922 3.017 1.271 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.517 3.485 1.674 1.00 0.00 C ATOM 0 H LEU A 18 6.098 -0.148 0.754 1.00 0.00 H new ATOM 0 HA LEU A 18 6.222 0.978 3.457 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.194 0.767 1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.622 0.947 2.901 1.00 0.00 H new ATOM 0 HG LEU A 18 4.932 2.933 3.200 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.054 4.099 1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.823 2.548 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.740 2.656 0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.782 4.542 1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.236 3.157 0.673 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.677 3.337 2.353 1.00 0.00 H new ATOM 143 N ALA A 19 5.261 -2.111 2.970 1.00 0.00 N ATOM 144 CA ALA A 19 5.090 -3.399 3.646 1.00 0.00 C ATOM 145 C ALA A 19 6.359 -3.906 4.356 1.00 0.00 C ATOM 146 O ALA A 19 6.873 -4.974 4.036 1.00 0.00 O ATOM 147 CB ALA A 19 4.575 -4.406 2.612 1.00 0.00 C ATOM 0 H ALA A 19 5.329 -2.206 1.957 1.00 0.00 H new ATOM 0 HA ALA A 19 4.368 -3.271 4.452 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.438 -5.377 3.087 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.622 -4.060 2.211 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.298 -4.498 1.802 1.00 0.00 H new ATOM 153 N ASP A 20 6.874 -3.154 5.327 1.00 0.00 N ATOM 154 CA ASP A 20 8.015 -3.543 6.171 1.00 0.00 C ATOM 155 C ASP A 20 7.907 -2.816 7.532 1.00 0.00 C ATOM 156 O ASP A 20 7.310 -1.735 7.579 1.00 0.00 O ATOM 157 CB ASP A 20 9.341 -3.258 5.424 1.00 0.00 C ATOM 158 CG ASP A 20 10.270 -4.471 5.202 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.782 -5.607 5.014 1.00 0.00 O ATOM 160 OD2 ASP A 20 11.499 -4.243 5.123 1.00 0.00 O ATOM 0 H ASP A 20 6.504 -2.232 5.559 1.00 0.00 H new ATOM 0 HA ASP A 20 8.002 -4.613 6.376 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.101 -2.827 4.452 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.893 -2.501 5.981 1.00 0.00 H new ATOM 165 N PRO A 21 8.501 -3.358 8.617 1.00 0.00 N ATOM 166 CA PRO A 21 8.275 -2.966 10.017 1.00 0.00 C ATOM 167 C PRO A 21 8.612 -1.493 10.310 1.00 0.00 C ATOM 168 O PRO A 21 7.811 -0.585 10.071 1.00 0.00 O ATOM 169 CB PRO A 21 9.107 -3.980 10.833 1.00 0.00 C ATOM 170 CG PRO A 21 10.280 -4.263 9.889 1.00 0.00 C ATOM 171 CD PRO A 21 9.537 -4.382 8.566 1.00 0.00 C ATOM 0 HA PRO A 21 7.220 -3.006 10.287 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.440 -3.563 11.784 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.540 -4.883 11.061 1.00 0.00 H new ATOM 0 HG2 PRO A 21 11.013 -3.457 9.883 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.813 -5.177 10.150 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.208 -4.222 7.722 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.104 -5.375 8.445 1.00 0.00 H new ATOM 179 N THR A 22 9.832 -1.254 10.794 1.00 0.00 N ATOM 180 CA THR A 22 10.483 0.045 10.959 1.00 0.00 C ATOM 181 C THR A 22 10.326 0.957 9.754 1.00 0.00 C ATOM 182 O THR A 22 10.295 2.172 9.932 1.00 0.00 O ATOM 183 CB THR A 22 11.979 -0.183 11.181 1.00 0.00 C ATOM 184 OG1 THR A 22 12.409 -1.150 10.247 1.00 0.00 O ATOM 185 CG2 THR A 22 12.285 -0.666 12.596 1.00 0.00 C ATOM 0 H THR A 22 10.433 -2.018 11.103 1.00 0.00 H new ATOM 0 HA THR A 22 10.004 0.533 11.808 1.00 0.00 H new ATOM 0 HB THR A 22 12.504 0.763 11.047 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.350 -1.367 10.411 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.359 -0.814 12.706 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.946 0.079 13.316 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.769 -1.608 12.778 1.00 0.00 H new ATOM 193 N ARG A 23 10.216 0.413 8.537 1.00 0.00 N ATOM 194 CA ARG A 23 10.152 1.242 7.338 1.00 0.00 C ATOM 195 C ARG A 23 8.791 1.948 7.184 1.00 0.00 C ATOM 196 O ARG A 23 8.780 3.160 6.953 1.00 0.00 O ATOM 197 CB ARG A 23 10.630 0.457 6.108 1.00 0.00 C ATOM 198 CG ARG A 23 11.386 1.459 5.227 1.00 0.00 C ATOM 199 CD ARG A 23 12.070 0.927 3.959 1.00 0.00 C ATOM 200 NE ARG A 23 13.016 -0.158 4.268 1.00 0.00 N ATOM 201 CZ ARG A 23 12.715 -1.447 4.220 1.00 0.00 C ATOM 202 NH1 ARG A 23 11.594 -1.895 3.702 1.00 0.00 N ATOM 203 NH2 ARG A 23 13.509 -2.347 4.751 1.00 0.00 N ATOM 0 H ARG A 23 10.170 -0.591 8.361 1.00 0.00 H new ATOM 0 HA ARG A 23 10.855 2.069 7.443 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.278 -0.369 6.401 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.786 0.025 5.570 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.684 2.237 4.927 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.148 1.937 5.842 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.314 0.564 3.262 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.598 1.740 3.461 1.00 0.00 H new ATOM 0 HE ARG A 23 13.966 0.100 4.537 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.914 -1.241 3.315 1.00 0.00 H new ATOM 0 HH12 ARG A 23 11.404 -2.897 3.686 1.00 0.00 H new ATOM 0 HH21 ARG A 23 14.373 -2.058 5.210 1.00 0.00 H new ATOM 0 HH22 ARG A 23 13.262 -3.336 4.705 1.00 0.00 H new ATOM 217 N CYS A 24 7.672 1.242 7.430 1.00 0.00 N ATOM 218 CA CYS A 24 6.342 1.856 7.601 1.00 0.00 C ATOM 219 C CYS A 24 6.415 2.931 8.694 1.00 0.00 C ATOM 220 O CYS A 24 6.055 4.091 8.465 1.00 0.00 O ATOM 221 CB CYS A 24 5.319 0.768 7.989 1.00 0.00 C ATOM 222 SG CYS A 24 3.782 1.547 8.579 1.00 0.00 S ATOM 0 H CYS A 24 7.665 0.226 7.516 1.00 0.00 H new ATOM 0 HA CYS A 24 6.026 2.320 6.667 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.108 0.131 7.130 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.734 0.127 8.767 1.00 0.00 H new ATOM 0 HG CYS A 24 2.924 0.625 8.902 1.00 0.00 H new ATOM 228 N ARG A 25 6.949 2.549 9.866 1.00 0.00 N ATOM 229 CA ARG A 25 7.087 3.422 11.036 1.00 0.00 C ATOM 230 C ARG A 25 7.789 4.747 10.721 1.00 0.00 C ATOM 231 O ARG A 25 7.246 5.798 11.037 1.00 0.00 O ATOM 232 CB ARG A 25 7.801 2.692 12.176 1.00 0.00 C ATOM 233 CG ARG A 25 7.036 1.491 12.763 1.00 0.00 C ATOM 234 CD ARG A 25 5.607 1.790 13.243 1.00 0.00 C ATOM 235 NE ARG A 25 4.943 0.554 13.683 1.00 0.00 N ATOM 236 CZ ARG A 25 3.680 0.383 14.040 1.00 0.00 C ATOM 237 NH1 ARG A 25 2.832 1.389 14.101 1.00 0.00 N ATOM 238 NH2 ARG A 25 3.251 -0.826 14.335 1.00 0.00 N ATOM 0 H ARG A 25 7.303 1.606 10.026 1.00 0.00 H new ATOM 0 HA ARG A 25 6.075 3.675 11.351 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.769 2.345 11.815 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.997 3.405 12.977 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.991 0.707 12.008 1.00 0.00 H new ATOM 0 HG3 ARG A 25 7.607 1.093 13.602 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.635 2.507 14.064 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.035 2.250 12.437 1.00 0.00 H new ATOM 0 HE ARG A 25 5.531 -0.279 13.718 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.143 2.333 13.869 1.00 0.00 H new ATOM 0 HH12 ARG A 25 1.865 1.224 14.380 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.890 -1.620 14.287 1.00 0.00 H new ATOM 0 HH22 ARG A 25 2.280 -0.969 14.611 1.00 0.00 H new ATOM 252 N ILE A 26 8.953 4.720 10.071 1.00 0.00 N ATOM 253 CA ILE A 26 9.671 5.931 9.602 1.00 0.00 C ATOM 254 C ILE A 26 8.751 6.862 8.797 1.00 0.00 C ATOM 255 O ILE A 26 8.727 8.053 9.063 1.00 0.00 O ATOM 256 CB ILE A 26 10.922 5.583 8.747 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.975 4.727 9.493 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.560 6.858 8.167 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.200 5.404 10.116 1.00 0.00 C ATOM 0 H ILE A 26 9.439 3.852 9.847 1.00 0.00 H new ATOM 0 HA ILE A 26 10.002 6.447 10.503 1.00 0.00 H new ATOM 0 HB ILE A 26 10.560 4.959 7.929 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.456 4.195 10.290 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.339 3.975 8.793 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.433 6.590 7.573 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.836 7.373 7.536 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.863 7.516 8.981 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.827 4.652 10.596 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.771 5.910 9.338 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.875 6.132 10.859 1.00 0.00 H new ATOM 271 N LEU A 27 7.994 6.337 7.829 1.00 0.00 N ATOM 272 CA LEU A 27 7.129 7.157 6.958 1.00 0.00 C ATOM 273 C LEU A 27 5.995 7.831 7.735 1.00 0.00 C ATOM 274 O LEU A 27 5.798 9.035 7.602 1.00 0.00 O ATOM 275 CB LEU A 27 6.530 6.308 5.826 1.00 0.00 C ATOM 276 CG LEU A 27 7.558 5.750 4.830 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.848 4.702 3.980 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.133 6.817 3.894 1.00 0.00 C ATOM 0 H LEU A 27 7.959 5.339 7.623 1.00 0.00 H new ATOM 0 HA LEU A 27 7.764 7.936 6.537 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.981 5.475 6.266 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.807 6.913 5.280 1.00 0.00 H new ATOM 0 HG LEU A 27 8.391 5.341 5.401 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.549 4.282 3.259 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.470 3.907 4.623 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.016 5.166 3.450 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.852 6.357 3.216 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.326 7.267 3.316 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.631 7.588 4.483 1.00 0.00 H new ATOM 290 N VAL A 28 5.284 7.071 8.566 1.00 0.00 N ATOM 291 CA VAL A 28 4.175 7.587 9.396 1.00 0.00 C ATOM 292 C VAL A 28 4.668 8.516 10.515 1.00 0.00 C ATOM 293 O VAL A 28 3.948 9.428 10.912 1.00 0.00 O ATOM 294 CB VAL A 28 3.275 6.448 9.928 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.962 5.520 10.937 1.00 0.00 C ATOM 296 CG2 VAL A 28 1.963 6.950 10.542 1.00 0.00 C ATOM 0 H VAL A 28 5.455 6.073 8.690 1.00 0.00 H new ATOM 0 HA VAL A 28 3.552 8.200 8.745 1.00 0.00 H new ATOM 0 HB VAL A 28 3.056 5.871 9.030 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.261 4.750 11.259 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.827 5.050 10.469 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.287 6.099 11.801 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.378 6.101 10.896 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.183 7.613 11.379 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.393 7.494 9.789 1.00 0.00 H new ATOM 306 N ALA A 29 5.907 8.329 10.978 1.00 0.00 N ATOM 307 CA ALA A 29 6.586 9.258 11.868 1.00 0.00 C ATOM 308 C ALA A 29 7.025 10.535 11.130 1.00 0.00 C ATOM 309 O ALA A 29 6.885 11.615 11.692 1.00 0.00 O ATOM 310 CB ALA A 29 7.758 8.513 12.520 1.00 0.00 C ATOM 0 H ALA A 29 6.470 7.513 10.738 1.00 0.00 H new ATOM 0 HA ALA A 29 5.905 9.602 12.647 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.287 9.186 13.194 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.379 7.660 13.083 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.442 8.163 11.747 1.00 0.00 H new ATOM 316 N LEU A 30 7.497 10.464 9.875 1.00 0.00 N ATOM 317 CA LEU A 30 8.012 11.628 9.159 1.00 0.00 C ATOM 318 C LEU A 30 6.979 12.704 8.878 1.00 0.00 C ATOM 319 O LEU A 30 7.347 13.872 8.788 1.00 0.00 O ATOM 320 CB LEU A 30 8.573 11.169 7.829 1.00 0.00 C ATOM 321 CG LEU A 30 9.873 11.914 7.521 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.060 11.506 8.401 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.131 11.482 6.102 1.00 0.00 C ATOM 0 H LEU A 30 7.530 9.599 9.335 1.00 0.00 H new ATOM 0 HA LEU A 30 8.765 12.072 9.810 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.758 10.095 7.855 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.846 11.349 7.037 1.00 0.00 H new ATOM 0 HG LEU A 30 9.774 12.986 7.693 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.940 12.083 8.115 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.822 11.701 9.447 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.263 10.443 8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.049 11.947 5.741 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.235 10.398 6.065 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.297 11.789 5.471 1.00 0.00 H new ATOM 335 N LEU A 31 5.717 12.290 8.744 1.00 0.00 N ATOM 336 CA LEU A 31 4.531 13.151 8.691 1.00 0.00 C ATOM 337 C LEU A 31 4.581 14.296 9.728 1.00 0.00 C ATOM 338 O LEU A 31 4.068 15.370 9.439 1.00 0.00 O ATOM 339 CB LEU A 31 3.278 12.250 8.825 1.00 0.00 C ATOM 340 CG LEU A 31 2.425 12.189 7.546 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.394 11.057 7.658 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.709 13.521 7.275 1.00 0.00 C ATOM 0 H LEU A 31 5.482 11.300 8.666 1.00 0.00 H new ATOM 0 HA LEU A 31 4.492 13.668 7.732 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.593 11.241 9.090 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.662 12.618 9.646 1.00 0.00 H new ATOM 0 HG LEU A 31 3.096 11.994 6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.794 11.020 6.749 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.910 10.106 7.791 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.745 11.240 8.514 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.117 13.437 6.363 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.053 13.759 8.113 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.448 14.314 7.156 1.00 0.00 H new ATOM 354 N ASP A 32 5.243 14.077 10.871 1.00 0.00 N ATOM 355 CA ASP A 32 5.644 15.084 11.871 1.00 0.00 C ATOM 356 C ASP A 32 7.183 15.278 11.895 1.00 0.00 C ATOM 357 O ASP A 32 7.714 16.375 12.058 1.00 0.00 O ATOM 358 CB ASP A 32 5.165 14.547 13.234 1.00 0.00 C ATOM 359 CG ASP A 32 5.685 15.347 14.433 1.00 0.00 C ATOM 360 OD1 ASP A 32 5.019 16.336 14.801 1.00 0.00 O ATOM 361 OD2 ASP A 32 6.723 14.927 14.996 1.00 0.00 O ATOM 0 H ASP A 32 5.532 13.137 11.142 1.00 0.00 H new ATOM 0 HA ASP A 32 5.206 16.054 11.634 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.075 14.550 13.252 1.00 0.00 H new ATOM 0 HB3 ASP A 32 5.482 13.509 13.337 1.00 0.00 H new ATOM 366 N GLY A 33 7.914 14.195 11.617 1.00 0.00 N ATOM 367 CA GLY A 33 9.345 13.983 11.817 1.00 0.00 C ATOM 368 C GLY A 33 10.264 14.640 10.803 1.00 0.00 C ATOM 369 O GLY A 33 11.474 14.444 10.845 1.00 0.00 O ATOM 0 H GLY A 33 7.475 13.370 11.208 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.611 14.348 12.809 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.537 12.910 11.810 1.00 0.00 H new ATOM 373 N VAL A 34 9.714 15.473 9.933 1.00 0.00 N ATOM 374 CA VAL A 34 10.412 16.403 9.023 1.00 0.00 C ATOM 375 C VAL A 34 11.333 17.462 9.685 1.00 0.00 C ATOM 376 O VAL A 34 11.571 18.523 9.105 1.00 0.00 O ATOM 377 CB VAL A 34 9.403 17.090 8.082 1.00 0.00 C ATOM 378 CG1 VAL A 34 8.770 16.093 7.115 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.325 17.920 8.797 1.00 0.00 C ATOM 0 H VAL A 34 8.701 15.530 9.828 1.00 0.00 H new ATOM 0 HA VAL A 34 11.098 15.763 8.468 1.00 0.00 H new ATOM 0 HB VAL A 34 9.995 17.808 7.514 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.064 16.613 6.467 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.548 15.631 6.507 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.245 15.322 7.679 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.660 18.366 8.058 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.749 17.275 9.460 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.800 18.709 9.380 1.00 0.00 H new ATOM 389 N CYS A 35 11.876 17.188 10.875 1.00 0.00 N ATOM 390 CA CYS A 35 12.874 18.026 11.542 1.00 0.00 C ATOM 391 C CYS A 35 14.286 17.744 11.015 1.00 0.00 C ATOM 392 O CYS A 35 14.771 18.460 10.150 1.00 0.00 O ATOM 393 CB CYS A 35 12.745 17.856 13.065 1.00 0.00 C ATOM 394 SG CYS A 35 11.124 18.436 13.633 1.00 0.00 S ATOM 0 H CYS A 35 11.627 16.358 11.413 1.00 0.00 H new ATOM 0 HA CYS A 35 12.686 19.075 11.311 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.877 16.808 13.332 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.534 18.415 13.568 1.00 0.00 H new ATOM 0 HG CYS A 35 11.035 18.282 14.921 1.00 0.00 H new ATOM 400 N TYR A 36 14.958 16.696 11.504 1.00 0.00 N ATOM 401 CA TYR A 36 16.372 16.452 11.183 1.00 0.00 C ATOM 402 C TYR A 36 16.624 14.976 10.841 1.00 0.00 C ATOM 403 O TYR A 36 15.873 14.131 11.329 1.00 0.00 O ATOM 404 CB TYR A 36 17.272 16.910 12.356 1.00 0.00 C ATOM 405 CG TYR A 36 16.661 17.897 13.341 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.429 19.232 12.961 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.275 17.458 14.624 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.818 20.129 13.856 1.00 0.00 C ATOM 409 CE2 TYR A 36 15.658 18.348 15.522 1.00 0.00 C ATOM 410 CZ TYR A 36 15.429 19.692 15.142 1.00 0.00 C ATOM 411 OH TYR A 36 14.815 20.547 16.005 1.00 0.00 O ATOM 0 H TYR A 36 14.546 16.000 12.126 1.00 0.00 H new ATOM 0 HA TYR A 36 16.625 17.037 10.299 1.00 0.00 H new ATOM 0 HB2 TYR A 36 17.585 16.025 12.911 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.173 17.359 11.938 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.721 19.569 11.978 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.454 16.434 14.919 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.646 21.153 13.560 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.359 18.006 16.502 1.00 0.00 H new ATOM 0 HH TYR A 36 14.616 20.079 16.843 1.00 0.00 H new ATOM 421 N PRO A 37 17.682 14.612 10.086 1.00 0.00 N ATOM 422 CA PRO A 37 17.906 13.237 9.636 1.00 0.00 C ATOM 423 C PRO A 37 17.980 12.223 10.785 1.00 0.00 C ATOM 424 O PRO A 37 17.445 11.127 10.655 1.00 0.00 O ATOM 425 CB PRO A 37 19.203 13.287 8.816 1.00 0.00 C ATOM 426 CG PRO A 37 19.916 14.540 9.312 1.00 0.00 C ATOM 427 CD PRO A 37 18.737 15.469 9.572 1.00 0.00 C ATOM 0 HA PRO A 37 17.064 12.883 9.042 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.809 12.395 8.976 1.00 0.00 H new ATOM 0 HB3 PRO A 37 18.996 13.344 7.747 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.498 14.352 10.214 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.602 14.945 8.568 1.00 0.00 H new ATOM 0 HD2 PRO A 37 18.999 16.245 10.291 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.424 15.973 8.658 1.00 0.00 H new ATOM 435 N GLY A 38 18.562 12.602 11.930 1.00 0.00 N ATOM 436 CA GLY A 38 18.638 11.738 13.116 1.00 0.00 C ATOM 437 C GLY A 38 17.411 11.776 14.035 1.00 0.00 C ATOM 438 O GLY A 38 17.432 11.115 15.070 1.00 0.00 O ATOM 0 H GLY A 38 18.994 13.517 12.061 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.793 10.710 12.787 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.515 12.023 13.697 1.00 0.00 H new ATOM 442 N GLN A 39 16.359 12.539 13.710 1.00 0.00 N ATOM 443 CA GLN A 39 15.243 12.789 14.636 1.00 0.00 C ATOM 444 C GLN A 39 14.355 11.565 14.856 1.00 0.00 C ATOM 445 O GLN A 39 13.838 11.406 15.959 1.00 0.00 O ATOM 446 CB GLN A 39 14.420 14.010 14.195 1.00 0.00 C ATOM 447 CG GLN A 39 13.390 13.747 13.080 1.00 0.00 C ATOM 448 CD GLN A 39 12.060 13.144 13.537 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.615 12.122 13.046 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.387 13.729 14.500 1.00 0.00 N ATOM 0 H GLN A 39 16.256 12.998 12.805 1.00 0.00 H new ATOM 0 HA GLN A 39 15.692 13.010 15.604 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.895 14.406 15.064 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.106 14.786 13.856 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.185 14.688 12.570 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.839 13.078 12.346 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.743 14.586 14.924 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.508 13.327 14.825 1.00 0.00 H new ATOM 459 N LEU A 40 14.228 10.683 13.853 1.00 0.00 N ATOM 460 CA LEU A 40 13.392 9.479 13.945 1.00 0.00 C ATOM 461 C LEU A 40 13.850 8.554 15.074 1.00 0.00 C ATOM 462 O LEU A 40 13.099 7.688 15.500 1.00 0.00 O ATOM 463 CB LEU A 40 13.387 8.726 12.603 1.00 0.00 C ATOM 464 CG LEU A 40 12.792 9.549 11.442 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.571 9.261 10.156 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.292 9.241 11.344 1.00 0.00 C ATOM 0 H LEU A 40 14.702 10.785 12.956 1.00 0.00 H new ATOM 0 HA LEU A 40 12.376 9.801 14.176 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.408 8.441 12.351 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.817 7.804 12.714 1.00 0.00 H new ATOM 0 HG LEU A 40 12.888 10.620 11.618 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.149 9.843 9.337 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.617 9.535 10.295 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.503 8.199 9.919 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.855 9.815 10.527 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.151 8.177 11.155 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.803 9.512 12.280 1.00 0.00 H new ATOM 478 N ALA A 41 15.073 8.742 15.570 1.00 0.00 N ATOM 479 CA ALA A 41 15.613 7.998 16.705 1.00 0.00 C ATOM 480 C ALA A 41 14.755 8.187 17.970 1.00 0.00 C ATOM 481 O ALA A 41 14.555 7.234 18.714 1.00 0.00 O ATOM 482 CB ALA A 41 17.051 8.485 16.936 1.00 0.00 C ATOM 0 H ALA A 41 15.725 9.426 15.188 1.00 0.00 H new ATOM 0 HA ALA A 41 15.602 6.930 16.486 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.486 7.948 17.779 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.646 8.299 16.042 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.043 9.554 17.151 1.00 0.00 H new ATOM 488 N ALA A 42 14.214 9.394 18.180 1.00 0.00 N ATOM 489 CA ALA A 42 13.294 9.699 19.276 1.00 0.00 C ATOM 490 C ALA A 42 11.907 9.088 19.027 1.00 0.00 C ATOM 491 O ALA A 42 11.412 8.348 19.869 1.00 0.00 O ATOM 492 CB ALA A 42 13.230 11.224 19.449 1.00 0.00 C ATOM 0 H ALA A 42 14.408 10.197 17.582 1.00 0.00 H new ATOM 0 HA ALA A 42 13.660 9.252 20.200 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.548 11.470 20.263 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.224 11.606 19.681 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.873 11.680 18.526 1.00 0.00 H new ATOM 498 N HIS A 43 11.315 9.338 17.852 1.00 0.00 N ATOM 499 CA HIS A 43 10.017 8.772 17.468 1.00 0.00 C ATOM 500 C HIS A 43 9.963 7.232 17.528 1.00 0.00 C ATOM 501 O HIS A 43 8.899 6.668 17.788 1.00 0.00 O ATOM 502 CB HIS A 43 9.682 9.242 16.042 1.00 0.00 C ATOM 503 CG HIS A 43 9.181 10.656 15.923 1.00 0.00 C ATOM 504 ND1 HIS A 43 8.599 11.406 16.944 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.043 11.324 14.742 1.00 0.00 C ATOM 506 CE1 HIS A 43 8.103 12.502 16.349 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.346 12.480 15.025 1.00 0.00 N ATOM 0 H HIS A 43 11.725 9.941 17.139 1.00 0.00 H new ATOM 0 HA HIS A 43 9.285 9.128 18.193 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.575 9.139 15.426 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.929 8.573 15.626 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.408 11.010 13.775 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.580 13.295 16.863 1.00 0.00 H new ATOM 0 HE2 HIS A 43 8.065 13.192 14.351 1.00 0.00 H new ATOM 515 N LEU A 44 11.077 6.548 17.234 1.00 0.00 N ATOM 516 CA LEU A 44 11.145 5.083 17.135 1.00 0.00 C ATOM 517 C LEU A 44 11.837 4.402 18.326 1.00 0.00 C ATOM 518 O LEU A 44 11.731 3.186 18.450 1.00 0.00 O ATOM 519 CB LEU A 44 11.834 4.701 15.803 1.00 0.00 C ATOM 520 CG LEU A 44 11.163 5.273 14.535 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.683 4.640 13.251 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.628 5.162 14.509 1.00 0.00 C ATOM 0 H LEU A 44 11.971 7.005 17.055 1.00 0.00 H new ATOM 0 HA LEU A 44 10.120 4.713 17.157 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.868 5.044 15.835 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.860 3.614 15.723 1.00 0.00 H new ATOM 0 HG LEU A 44 11.435 6.327 14.583 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.174 5.083 12.395 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.755 4.817 13.167 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.492 3.567 13.271 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.248 5.590 13.581 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.338 4.113 14.571 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.210 5.705 15.357 1.00 0.00 H new ATOM 534 N GLY A 45 12.581 5.131 19.164 1.00 0.00 N ATOM 535 CA GLY A 45 13.437 4.545 20.206 1.00 0.00 C ATOM 536 C GLY A 45 14.677 3.827 19.664 1.00 0.00 C ATOM 537 O GLY A 45 15.336 3.099 20.404 1.00 0.00 O ATOM 0 H GLY A 45 12.608 6.150 19.140 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.756 5.335 20.886 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.848 3.839 20.791 1.00 0.00 H new ATOM 541 N LEU A 46 14.984 3.992 18.371 1.00 0.00 N ATOM 542 CA LEU A 46 16.113 3.332 17.708 1.00 0.00 C ATOM 543 C LEU A 46 17.370 4.214 17.671 1.00 0.00 C ATOM 544 O LEU A 46 17.290 5.439 17.651 1.00 0.00 O ATOM 545 CB LEU A 46 15.694 2.907 16.292 1.00 0.00 C ATOM 546 CG LEU A 46 15.201 1.450 16.208 1.00 0.00 C ATOM 547 CD1 LEU A 46 13.933 1.170 17.021 1.00 0.00 C ATOM 548 CD2 LEU A 46 14.938 1.134 14.736 1.00 0.00 C ATOM 0 H LEU A 46 14.447 4.596 17.749 1.00 0.00 H new ATOM 0 HA LEU A 46 16.378 2.449 18.290 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.903 3.570 15.941 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.541 3.035 15.617 1.00 0.00 H new ATOM 0 HG LEU A 46 15.976 0.816 16.639 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.652 0.123 16.908 1.00 0.00 H new ATOM 0 HD12 LEU A 46 14.121 1.384 18.073 1.00 0.00 H new ATOM 0 HD13 LEU A 46 13.122 1.803 16.661 1.00 0.00 H new ATOM 0 HD21 LEU A 46 14.587 0.107 14.642 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.180 1.814 14.348 1.00 0.00 H new ATOM 0 HD23 LEU A 46 15.860 1.256 14.167 1.00 0.00 H new ATOM 560 N THR A 47 18.546 3.582 17.567 1.00 0.00 N ATOM 561 CA THR A 47 19.818 4.280 17.324 1.00 0.00 C ATOM 562 C THR A 47 19.804 4.946 15.944 1.00 0.00 C ATOM 563 O THR A 47 19.165 4.448 15.008 1.00 0.00 O ATOM 564 CB THR A 47 21.041 3.367 17.529 1.00 0.00 C ATOM 565 OG1 THR A 47 21.242 2.524 16.423 1.00 0.00 O ATOM 566 CG2 THR A 47 20.926 2.458 18.754 1.00 0.00 C ATOM 0 H THR A 47 18.644 2.570 17.649 1.00 0.00 H new ATOM 0 HA THR A 47 19.917 5.066 18.072 1.00 0.00 H new ATOM 0 HB THR A 47 21.874 4.057 17.666 1.00 0.00 H new ATOM 0 HG1 THR A 47 22.026 1.958 16.581 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.822 1.843 18.836 1.00 0.00 H new ATOM 0 HG22 THR A 47 20.821 3.068 19.651 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.053 1.814 18.649 1.00 0.00 H new ATOM 574 N ARG A 48 20.557 6.044 15.784 1.00 0.00 N ATOM 575 CA ARG A 48 20.691 6.739 14.490 1.00 0.00 C ATOM 576 C ARG A 48 21.234 5.796 13.409 1.00 0.00 C ATOM 577 O ARG A 48 20.746 5.802 12.281 1.00 0.00 O ATOM 578 CB ARG A 48 21.613 7.969 14.604 1.00 0.00 C ATOM 579 CG ARG A 48 20.918 9.249 15.112 1.00 0.00 C ATOM 580 CD ARG A 48 21.570 9.883 16.353 1.00 0.00 C ATOM 581 NE ARG A 48 21.013 9.330 17.599 1.00 0.00 N ATOM 582 CZ ARG A 48 21.387 8.221 18.223 1.00 0.00 C ATOM 583 NH1 ARG A 48 22.485 7.559 17.919 1.00 0.00 N ATOM 584 NH2 ARG A 48 20.614 7.727 19.161 1.00 0.00 N ATOM 0 H ARG A 48 21.088 6.475 16.541 1.00 0.00 H new ATOM 0 HA ARG A 48 19.693 7.073 14.204 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.437 7.728 15.276 1.00 0.00 H new ATOM 0 HB3 ARG A 48 22.048 8.172 13.626 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.908 9.985 14.308 1.00 0.00 H new ATOM 0 HG3 ARG A 48 19.879 9.015 15.343 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.646 9.712 16.327 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.418 10.962 16.333 1.00 0.00 H new ATOM 0 HE ARG A 48 20.255 9.859 18.030 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.093 7.895 17.172 1.00 0.00 H new ATOM 0 HH12 ARG A 48 22.727 6.710 18.431 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.740 8.195 19.401 1.00 0.00 H new ATOM 0 HH22 ARG A 48 20.887 6.875 19.651 1.00 0.00 H new ATOM 598 N SER A 49 22.209 4.953 13.744 1.00 0.00 N ATOM 599 CA SER A 49 22.764 3.952 12.822 1.00 0.00 C ATOM 600 C SER A 49 21.719 2.911 12.398 1.00 0.00 C ATOM 601 O SER A 49 21.659 2.540 11.226 1.00 0.00 O ATOM 602 CB SER A 49 23.958 3.255 13.484 1.00 0.00 C ATOM 603 OG SER A 49 24.874 4.225 13.960 1.00 0.00 O ATOM 0 H SER A 49 22.642 4.942 14.668 1.00 0.00 H new ATOM 0 HA SER A 49 23.086 4.473 11.920 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.615 2.630 14.308 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.450 2.597 12.768 1.00 0.00 H new ATOM 0 HG SER A 49 25.635 3.776 14.384 1.00 0.00 H new ATOM 609 N ASN A 50 20.845 2.486 13.318 1.00 0.00 N ATOM 610 CA ASN A 50 19.768 1.548 13.008 1.00 0.00 C ATOM 611 C ASN A 50 18.676 2.217 12.143 1.00 0.00 C ATOM 612 O ASN A 50 18.344 1.733 11.064 1.00 0.00 O ATOM 613 CB ASN A 50 19.241 0.972 14.334 1.00 0.00 C ATOM 614 CG ASN A 50 18.381 -0.267 14.141 1.00 0.00 C ATOM 615 OD1 ASN A 50 17.911 -0.563 13.058 1.00 0.00 O ATOM 616 ND2 ASN A 50 18.152 -1.035 15.187 1.00 0.00 N ATOM 0 H ASN A 50 20.867 2.783 14.294 1.00 0.00 H new ATOM 0 HA ASN A 50 20.137 0.721 12.401 1.00 0.00 H new ATOM 0 HB2 ASN A 50 20.085 0.725 14.978 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.659 1.735 14.850 1.00 0.00 H new ATOM 0 HD21 ASN A 50 17.582 -1.875 15.088 1.00 0.00 H new ATOM 0 HD22 ASN A 50 18.545 -0.789 16.096 1.00 0.00 H new ATOM 623 N VAL A 51 18.189 3.402 12.531 1.00 0.00 N ATOM 624 CA VAL A 51 17.257 4.211 11.714 1.00 0.00 C ATOM 625 C VAL A 51 17.810 4.522 10.313 1.00 0.00 C ATOM 626 O VAL A 51 17.050 4.491 9.347 1.00 0.00 O ATOM 627 CB VAL A 51 16.890 5.508 12.494 1.00 0.00 C ATOM 628 CG1 VAL A 51 16.720 6.789 11.664 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.612 5.282 13.315 1.00 0.00 C ATOM 0 H VAL A 51 18.427 3.834 13.424 1.00 0.00 H new ATOM 0 HA VAL A 51 16.354 3.625 11.544 1.00 0.00 H new ATOM 0 HB VAL A 51 17.764 5.688 13.120 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.466 7.619 12.323 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.651 7.011 11.143 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.922 6.647 10.935 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.362 6.194 13.858 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.792 5.021 12.647 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.774 4.471 14.024 1.00 0.00 H new ATOM 639 N SER A 52 19.121 4.745 10.174 1.00 0.00 N ATOM 640 CA SER A 52 19.748 5.053 8.874 1.00 0.00 C ATOM 641 C SER A 52 19.703 3.884 7.882 1.00 0.00 C ATOM 642 O SER A 52 19.532 4.117 6.687 1.00 0.00 O ATOM 643 CB SER A 52 21.202 5.503 9.043 1.00 0.00 C ATOM 644 OG SER A 52 21.265 6.721 9.760 1.00 0.00 O ATOM 0 H SER A 52 19.779 4.718 10.953 1.00 0.00 H new ATOM 0 HA SER A 52 19.153 5.867 8.460 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.767 4.735 9.570 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.667 5.626 8.065 1.00 0.00 H new ATOM 0 HG SER A 52 20.984 6.570 10.687 1.00 0.00 H new ATOM 650 N ASN A 53 19.773 2.634 8.356 1.00 0.00 N ATOM 651 CA ASN A 53 19.558 1.449 7.511 1.00 0.00 C ATOM 652 C ASN A 53 18.176 1.477 6.837 1.00 0.00 C ATOM 653 O ASN A 53 18.036 1.165 5.653 1.00 0.00 O ATOM 654 CB ASN A 53 19.754 0.180 8.353 1.00 0.00 C ATOM 655 CG ASN A 53 21.216 -0.243 8.402 1.00 0.00 C ATOM 656 OD1 ASN A 53 21.661 -1.060 7.614 1.00 0.00 O ATOM 657 ND2 ASN A 53 22.021 0.313 9.291 1.00 0.00 N ATOM 0 H ASN A 53 19.979 2.414 9.331 1.00 0.00 H new ATOM 0 HA ASN A 53 20.293 1.452 6.706 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.392 0.356 9.366 1.00 0.00 H new ATOM 0 HB3 ASN A 53 19.155 -0.629 7.936 1.00 0.00 H new ATOM 0 HD21 ASN A 53 23.008 0.058 9.315 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.655 0.997 9.953 1.00 0.00 H new ATOM 664 N HIS A 54 17.155 1.937 7.559 1.00 0.00 N ATOM 665 CA HIS A 54 15.812 2.106 7.007 1.00 0.00 C ATOM 666 C HIS A 54 15.733 3.256 5.985 1.00 0.00 C ATOM 667 O HIS A 54 15.083 3.091 4.949 1.00 0.00 O ATOM 668 CB HIS A 54 14.812 2.290 8.158 1.00 0.00 C ATOM 669 CG HIS A 54 14.976 1.245 9.229 1.00 0.00 C ATOM 670 ND1 HIS A 54 15.383 1.446 10.528 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.864 -0.104 9.058 1.00 0.00 C ATOM 672 CE1 HIS A 54 15.498 0.248 11.118 1.00 0.00 C ATOM 673 NE2 HIS A 54 15.173 -0.728 10.259 1.00 0.00 N ATOM 0 H HIS A 54 17.235 2.202 8.541 1.00 0.00 H new ATOM 0 HA HIS A 54 15.552 1.205 6.451 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.943 3.280 8.596 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.796 2.248 7.764 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.582 -0.603 8.142 1.00 0.00 H new ATOM 0 HE1 HIS A 54 15.808 0.091 12.140 1.00 0.00 H new ATOM 0 HE2 HIS A 54 15.156 -1.730 10.450 1.00 0.00 H new ATOM 681 N LEU A 55 16.422 4.379 6.240 1.00 0.00 N ATOM 682 CA LEU A 55 16.481 5.530 5.322 1.00 0.00 C ATOM 683 C LEU A 55 17.392 5.290 4.113 1.00 0.00 C ATOM 684 O LEU A 55 17.349 6.069 3.167 1.00 0.00 O ATOM 685 CB LEU A 55 16.903 6.809 6.066 1.00 0.00 C ATOM 686 CG LEU A 55 15.909 7.224 7.175 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.653 7.927 8.311 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.812 8.126 6.594 1.00 0.00 C ATOM 0 H LEU A 55 16.959 4.516 7.096 1.00 0.00 H new ATOM 0 HA LEU A 55 15.471 5.660 4.934 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.888 6.656 6.508 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.998 7.624 5.349 1.00 0.00 H new ATOM 0 HG LEU A 55 15.434 6.331 7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.944 8.215 9.087 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.397 7.251 8.732 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.150 8.817 7.925 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.119 8.411 7.385 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.265 9.021 6.168 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.272 7.587 5.815 1.00 0.00 H new ATOM 700 N SER A 56 18.219 4.248 4.115 1.00 0.00 N ATOM 701 CA SER A 56 18.931 3.829 2.906 1.00 0.00 C ATOM 702 C SER A 56 17.936 3.446 1.794 1.00 0.00 C ATOM 703 O SER A 56 17.916 4.078 0.738 1.00 0.00 O ATOM 704 CB SER A 56 19.895 2.686 3.245 1.00 0.00 C ATOM 705 OG SER A 56 20.872 2.562 2.230 1.00 0.00 O ATOM 0 H SER A 56 18.414 3.678 4.938 1.00 0.00 H new ATOM 0 HA SER A 56 19.523 4.661 2.524 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.377 2.878 4.204 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.343 1.752 3.347 1.00 0.00 H new ATOM 0 HG SER A 56 21.485 1.831 2.454 1.00 0.00 H new ATOM 711 N CYS A 57 17.013 2.512 2.065 1.00 0.00 N ATOM 712 CA CYS A 57 15.995 2.103 1.111 1.00 0.00 C ATOM 713 C CYS A 57 14.982 3.232 0.838 1.00 0.00 C ATOM 714 O CYS A 57 14.584 3.442 -0.303 1.00 0.00 O ATOM 715 CB CYS A 57 15.332 0.847 1.684 1.00 0.00 C ATOM 716 SG CYS A 57 14.024 0.160 0.610 1.00 0.00 S ATOM 0 H CYS A 57 16.959 2.022 2.958 1.00 0.00 H new ATOM 0 HA CYS A 57 16.439 1.883 0.140 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.095 0.085 1.847 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.904 1.084 2.658 1.00 0.00 H new ATOM 721 N LEU A 58 14.585 3.985 1.874 1.00 0.00 N ATOM 722 CA LEU A 58 13.553 5.027 1.776 1.00 0.00 C ATOM 723 C LEU A 58 13.927 6.163 0.818 1.00 0.00 C ATOM 724 O LEU A 58 13.075 6.675 0.088 1.00 0.00 O ATOM 725 CB LEU A 58 13.285 5.582 3.187 1.00 0.00 C ATOM 726 CG LEU A 58 11.793 5.767 3.502 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.141 4.400 3.656 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.674 6.496 4.839 1.00 0.00 C ATOM 0 H LEU A 58 14.975 3.887 2.812 1.00 0.00 H new ATOM 0 HA LEU A 58 12.655 4.570 1.360 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.722 4.907 3.923 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.792 6.541 3.293 1.00 0.00 H new ATOM 0 HG LEU A 58 11.311 6.328 2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.082 4.525 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.252 3.837 2.729 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.622 3.857 4.470 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.621 6.639 5.083 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.151 5.904 5.620 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.165 7.467 4.769 1.00 0.00 H new ATOM 740 N ARG A 59 15.208 6.537 0.813 1.00 0.00 N ATOM 741 CA ARG A 59 15.756 7.561 -0.080 1.00 0.00 C ATOM 742 C ARG A 59 16.089 6.990 -1.475 1.00 0.00 C ATOM 743 O ARG A 59 16.419 7.759 -2.371 1.00 0.00 O ATOM 744 CB ARG A 59 16.965 8.220 0.582 1.00 0.00 C ATOM 745 CG ARG A 59 16.595 8.873 1.935 1.00 0.00 C ATOM 746 CD ARG A 59 17.792 9.552 2.575 1.00 0.00 C ATOM 747 NE ARG A 59 18.876 8.589 2.840 1.00 0.00 N ATOM 748 CZ ARG A 59 20.092 8.578 2.304 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.505 9.514 1.468 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.924 7.608 2.610 1.00 0.00 N ATOM 0 H ARG A 59 15.904 6.131 1.438 1.00 0.00 H new ATOM 0 HA ARG A 59 14.997 8.325 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.744 7.474 0.739 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.378 8.976 -0.086 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.801 9.604 1.782 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.203 8.113 2.611 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.157 10.343 1.920 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.488 10.026 3.508 1.00 0.00 H new ATOM 0 HE ARG A 59 18.670 7.848 3.510 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.882 10.281 1.213 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.446 9.470 1.078 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.634 6.872 3.254 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.859 7.591 2.204 1.00 0.00 H new ATOM 764 N GLY A 60 15.998 5.663 -1.673 1.00 0.00 N ATOM 765 CA GLY A 60 16.242 4.957 -2.944 1.00 0.00 C ATOM 766 C GLY A 60 14.973 4.534 -3.696 1.00 0.00 C ATOM 767 O GLY A 60 14.855 4.763 -4.895 1.00 0.00 O ATOM 0 H GLY A 60 15.741 5.026 -0.919 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.835 5.601 -3.593 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.841 4.069 -2.742 1.00 0.00 H new ATOM 771 N CYS A 61 13.994 3.962 -2.988 1.00 0.00 N ATOM 772 CA CYS A 61 12.631 3.713 -3.452 1.00 0.00 C ATOM 773 C CYS A 61 11.833 5.037 -3.680 1.00 0.00 C ATOM 774 O CYS A 61 10.628 5.004 -3.936 1.00 0.00 O ATOM 775 CB CYS A 61 11.979 2.746 -2.436 1.00 0.00 C ATOM 776 SG CYS A 61 12.314 0.976 -2.729 1.00 0.00 S ATOM 0 H CYS A 61 14.141 3.646 -2.029 1.00 0.00 H new ATOM 0 HA CYS A 61 12.630 3.246 -4.437 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.327 3.005 -1.436 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.900 2.903 -2.449 1.00 0.00 H new ATOM 781 N GLY A 62 12.493 6.196 -3.521 1.00 0.00 N ATOM 782 CA GLY A 62 11.990 7.530 -3.868 1.00 0.00 C ATOM 783 C GLY A 62 10.880 8.041 -2.955 1.00 0.00 C ATOM 784 O GLY A 62 10.113 8.898 -3.373 1.00 0.00 O ATOM 0 H GLY A 62 13.434 6.227 -3.129 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.820 8.236 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.621 7.511 -4.893 1.00 0.00 H new ATOM 788 N LEU A 63 10.766 7.497 -1.738 1.00 0.00 N ATOM 789 CA LEU A 63 9.694 7.786 -0.783 1.00 0.00 C ATOM 790 C LEU A 63 9.956 9.025 0.076 1.00 0.00 C ATOM 791 O LEU A 63 9.021 9.624 0.606 1.00 0.00 O ATOM 792 CB LEU A 63 9.520 6.571 0.110 1.00 0.00 C ATOM 793 CG LEU A 63 9.103 5.323 -0.683 1.00 0.00 C ATOM 794 CD1 LEU A 63 9.104 4.205 0.330 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.729 5.427 -1.356 1.00 0.00 C ATOM 0 H LEU A 63 11.441 6.821 -1.380 1.00 0.00 H new ATOM 0 HA LEU A 63 8.790 8.002 -1.353 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.454 6.371 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.768 6.785 0.869 1.00 0.00 H new ATOM 0 HG LEU A 63 9.794 5.169 -1.512 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.816 3.273 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.103 4.099 0.754 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.395 4.434 1.125 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.516 4.503 -1.893 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.964 5.590 -0.597 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.729 6.262 -2.057 1.00 0.00 H new ATOM 807 N VAL A 64 11.225 9.403 0.222 1.00 0.00 N ATOM 808 CA VAL A 64 11.696 10.539 1.025 1.00 0.00 C ATOM 809 C VAL A 64 12.774 11.327 0.290 1.00 0.00 C ATOM 810 O VAL A 64 13.568 10.761 -0.461 1.00 0.00 O ATOM 811 CB VAL A 64 12.251 10.116 2.408 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.121 9.864 3.413 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.118 8.879 2.335 1.00 0.00 C ATOM 0 H VAL A 64 11.990 8.906 -0.235 1.00 0.00 H new ATOM 0 HA VAL A 64 10.817 11.164 1.186 1.00 0.00 H new ATOM 0 HB VAL A 64 12.866 10.951 2.744 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.546 9.569 4.372 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.537 10.776 3.540 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.475 9.068 3.042 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.479 8.629 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.533 8.048 1.942 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.967 9.068 1.678 1.00 0.00 H new ATOM 823 N VAL A 65 12.790 12.637 0.536 1.00 0.00 N ATOM 824 CA VAL A 65 13.714 13.614 -0.061 1.00 0.00 C ATOM 825 C VAL A 65 14.338 14.481 1.040 1.00 0.00 C ATOM 826 O VAL A 65 13.689 14.803 2.037 1.00 0.00 O ATOM 827 CB VAL A 65 12.980 14.484 -1.115 1.00 0.00 C ATOM 828 CG1 VAL A 65 13.892 15.566 -1.716 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.450 13.614 -2.273 1.00 0.00 C ATOM 0 H VAL A 65 12.132 13.070 1.185 1.00 0.00 H new ATOM 0 HA VAL A 65 14.515 13.081 -0.573 1.00 0.00 H new ATOM 0 HB VAL A 65 12.156 14.964 -0.588 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.332 16.148 -2.448 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.247 16.225 -0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.745 15.093 -2.204 1.00 0.00 H new ATOM 0 HG21 VAL A 65 11.939 14.247 -2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.284 13.106 -2.757 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.752 12.874 -1.882 1.00 0.00 H new ATOM 839 N ALA A 66 15.609 14.857 0.861 1.00 0.00 N ATOM 840 CA ALA A 66 16.310 15.807 1.728 1.00 0.00 C ATOM 841 C ALA A 66 16.018 17.267 1.330 1.00 0.00 C ATOM 842 O ALA A 66 16.096 17.616 0.154 1.00 0.00 O ATOM 843 CB ALA A 66 17.810 15.495 1.680 1.00 0.00 C ATOM 0 H ALA A 66 16.187 14.504 0.098 1.00 0.00 H new ATOM 0 HA ALA A 66 15.950 15.697 2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.348 16.194 2.321 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.981 14.477 2.029 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.169 15.592 0.655 1.00 0.00 H new ATOM 849 N THR A 67 15.725 18.132 2.313 1.00 0.00 N ATOM 850 CA THR A 67 15.596 19.589 2.105 1.00 0.00 C ATOM 851 C THR A 67 16.200 20.322 3.275 1.00 0.00 C ATOM 852 O THR A 67 16.398 19.744 4.331 1.00 0.00 O ATOM 853 CB THR A 67 14.148 20.093 1.873 1.00 0.00 C ATOM 854 OG1 THR A 67 13.526 20.628 3.022 1.00 0.00 O ATOM 855 CG2 THR A 67 13.177 19.037 1.356 1.00 0.00 C ATOM 0 H THR A 67 15.570 17.843 3.279 1.00 0.00 H new ATOM 0 HA THR A 67 16.133 19.800 1.180 1.00 0.00 H new ATOM 0 HB THR A 67 14.321 20.862 1.121 1.00 0.00 H new ATOM 0 HG1 THR A 67 13.863 21.534 3.185 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.191 19.483 1.225 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.532 18.653 0.400 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.113 18.219 2.074 1.00 0.00 H new ATOM 863 N TYR A 68 16.409 21.618 3.117 1.00 0.00 N ATOM 864 CA TYR A 68 16.686 22.497 4.247 1.00 0.00 C ATOM 865 C TYR A 68 15.332 22.833 4.915 1.00 0.00 C ATOM 866 O TYR A 68 14.394 23.187 4.195 1.00 0.00 O ATOM 867 CB TYR A 68 17.416 23.724 3.686 1.00 0.00 C ATOM 868 CG TYR A 68 18.030 24.638 4.721 1.00 0.00 C ATOM 869 CD1 TYR A 68 19.057 24.158 5.554 1.00 0.00 C ATOM 870 CD2 TYR A 68 17.612 25.977 4.817 1.00 0.00 C ATOM 871 CE1 TYR A 68 19.645 25.004 6.510 1.00 0.00 C ATOM 872 CE2 TYR A 68 18.208 26.832 5.760 1.00 0.00 C ATOM 873 CZ TYR A 68 19.217 26.345 6.622 1.00 0.00 C ATOM 874 OH TYR A 68 19.752 27.155 7.575 1.00 0.00 O ATOM 0 H TYR A 68 16.392 22.090 2.213 1.00 0.00 H new ATOM 0 HA TYR A 68 17.322 22.050 5.011 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.203 23.382 3.014 1.00 0.00 H new ATOM 0 HB3 TYR A 68 16.713 24.302 3.086 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.395 23.137 5.459 1.00 0.00 H new ATOM 0 HD2 TYR A 68 16.834 26.348 4.167 1.00 0.00 H new ATOM 0 HE1 TYR A 68 20.423 24.629 7.158 1.00 0.00 H new ATOM 0 HE2 TYR A 68 17.894 27.863 5.826 1.00 0.00 H new ATOM 0 HH TYR A 68 19.035 27.650 8.023 1.00 0.00 H new ATOM 884 N GLU A 69 15.168 22.643 6.231 1.00 0.00 N ATOM 885 CA GLU A 69 13.976 23.102 6.969 1.00 0.00 C ATOM 886 C GLU A 69 13.978 24.610 7.306 1.00 0.00 C ATOM 887 O GLU A 69 12.907 25.170 7.531 1.00 0.00 O ATOM 888 CB GLU A 69 13.617 22.175 8.159 1.00 0.00 C ATOM 889 CG GLU A 69 14.653 21.649 9.164 1.00 0.00 C ATOM 890 CD GLU A 69 15.195 22.693 10.124 1.00 0.00 C ATOM 891 OE1 GLU A 69 15.680 23.715 9.608 1.00 0.00 O ATOM 892 OE2 GLU A 69 15.250 22.454 11.347 1.00 0.00 O ATOM 0 H GLU A 69 15.855 22.168 6.816 1.00 0.00 H new ATOM 0 HA GLU A 69 13.145 23.006 6.271 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.863 22.703 8.743 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.132 21.298 7.730 1.00 0.00 H new ATOM 0 HG2 GLU A 69 14.201 20.843 9.743 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.487 21.216 8.612 1.00 0.00 H new ATOM 899 N GLY A 70 15.133 25.287 7.222 1.00 0.00 N ATOM 900 CA GLY A 70 15.305 26.730 7.486 1.00 0.00 C ATOM 901 C GLY A 70 16.468 27.057 8.435 1.00 0.00 C ATOM 902 O GLY A 70 17.015 28.159 8.400 1.00 0.00 O ATOM 0 H GLY A 70 16.007 24.831 6.959 1.00 0.00 H new ATOM 0 HA2 GLY A 70 15.466 27.245 6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 70 14.381 27.124 7.910 1.00 0.00 H new ATOM 906 N ARG A 71 16.882 26.077 9.239 1.00 0.00 N ATOM 907 CA ARG A 71 17.956 26.106 10.238 1.00 0.00 C ATOM 908 C ARG A 71 18.848 24.844 10.189 1.00 0.00 C ATOM 909 O ARG A 71 19.980 24.887 10.695 1.00 0.00 O ATOM 910 CB ARG A 71 17.275 26.282 11.613 1.00 0.00 C ATOM 911 CG ARG A 71 18.197 26.840 12.709 1.00 0.00 C ATOM 912 CD ARG A 71 18.860 25.764 13.583 1.00 0.00 C ATOM 913 NE ARG A 71 19.959 26.327 14.390 1.00 0.00 N ATOM 914 CZ ARG A 71 21.166 26.666 13.943 1.00 0.00 C ATOM 915 NH1 ARG A 71 21.522 26.475 12.686 1.00 0.00 N ATOM 916 NH2 ARG A 71 22.039 27.212 14.764 1.00 0.00 N ATOM 0 H ARG A 71 16.436 25.160 9.206 1.00 0.00 H new ATOM 0 HA ARG A 71 18.638 26.932 10.035 1.00 0.00 H new ATOM 0 HB2 ARG A 71 16.420 26.949 11.499 1.00 0.00 H new ATOM 0 HB3 ARG A 71 16.886 25.317 11.939 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.976 27.442 12.241 1.00 0.00 H new ATOM 0 HG3 ARG A 71 17.619 27.507 13.349 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.115 25.318 14.242 1.00 0.00 H new ATOM 0 HD3 ARG A 71 19.244 24.965 12.949 1.00 0.00 H new ATOM 0 HE ARG A 71 19.777 26.470 15.383 1.00 0.00 H new ATOM 0 HH11 ARG A 71 20.865 26.057 12.028 1.00 0.00 H new ATOM 0 HH12 ARG A 71 22.454 26.745 12.373 1.00 0.00 H new ATOM 0 HH21 ARG A 71 21.789 27.374 15.740 1.00 0.00 H new ATOM 0 HH22 ARG A 71 22.965 27.473 14.424 1.00 0.00 H new ATOM 930 N GLN A 72 18.379 23.740 9.605 1.00 0.00 N ATOM 931 CA GLN A 72 19.001 22.416 9.471 1.00 0.00 C ATOM 932 C GLN A 72 18.563 21.728 8.164 1.00 0.00 C ATOM 933 O GLN A 72 17.676 22.199 7.456 1.00 0.00 O ATOM 934 CB GLN A 72 18.559 21.514 10.648 1.00 0.00 C ATOM 935 CG GLN A 72 19.152 21.853 12.020 1.00 0.00 C ATOM 936 CD GLN A 72 20.661 21.640 12.050 1.00 0.00 C ATOM 937 OE1 GLN A 72 21.152 20.554 12.294 1.00 0.00 O ATOM 938 NE2 GLN A 72 21.458 22.633 11.719 1.00 0.00 N ATOM 0 H GLN A 72 17.458 23.750 9.168 1.00 0.00 H new ATOM 0 HA GLN A 72 20.082 22.555 9.467 1.00 0.00 H new ATOM 0 HB2 GLN A 72 17.473 21.558 10.724 1.00 0.00 H new ATOM 0 HB3 GLN A 72 18.820 20.484 10.407 1.00 0.00 H new ATOM 0 HG2 GLN A 72 18.926 22.890 12.268 1.00 0.00 H new ATOM 0 HG3 GLN A 72 18.682 21.233 12.783 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.068 23.552 11.510 1.00 0.00 H new ATOM 0 HE22 GLN A 72 22.466 22.484 11.671 1.00 0.00 H new ATOM 947 N VAL A 73 19.171 20.576 7.857 1.00 0.00 N ATOM 948 CA VAL A 73 18.701 19.656 6.807 1.00 0.00 C ATOM 949 C VAL A 73 17.702 18.674 7.437 1.00 0.00 C ATOM 950 O VAL A 73 17.886 18.280 8.590 1.00 0.00 O ATOM 951 CB VAL A 73 19.880 18.931 6.112 1.00 0.00 C ATOM 952 CG1 VAL A 73 20.686 18.025 7.063 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.436 18.112 4.887 1.00 0.00 C ATOM 0 H VAL A 73 20.012 20.250 8.334 1.00 0.00 H new ATOM 0 HA VAL A 73 18.199 20.219 6.020 1.00 0.00 H new ATOM 0 HB VAL A 73 20.532 19.738 5.778 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.496 17.548 6.512 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.102 18.625 7.872 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.031 17.260 7.479 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.303 17.626 4.440 1.00 0.00 H new ATOM 0 HG22 VAL A 73 18.716 17.355 5.197 1.00 0.00 H new ATOM 0 HG23 VAL A 73 18.974 18.774 4.155 1.00 0.00 H new ATOM 963 N ARG A 74 16.673 18.267 6.687 1.00 0.00 N ATOM 964 CA ARG A 74 15.612 17.346 7.107 1.00 0.00 C ATOM 965 C ARG A 74 15.465 16.187 6.124 1.00 0.00 C ATOM 966 O ARG A 74 15.923 16.259 4.985 1.00 0.00 O ATOM 967 CB ARG A 74 14.263 18.089 7.200 1.00 0.00 C ATOM 968 CG ARG A 74 13.591 18.464 5.868 1.00 0.00 C ATOM 969 CD ARG A 74 12.189 18.995 6.109 1.00 0.00 C ATOM 970 NE ARG A 74 11.692 19.709 4.935 1.00 0.00 N ATOM 971 CZ ARG A 74 10.710 20.593 4.912 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.847 20.711 5.902 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.624 21.386 3.869 1.00 0.00 N ATOM 0 H ARG A 74 16.551 18.586 5.726 1.00 0.00 H new ATOM 0 HA ARG A 74 15.890 16.952 8.085 1.00 0.00 H new ATOM 0 HB2 ARG A 74 13.570 17.468 7.768 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.416 19.003 7.774 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.187 19.217 5.353 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.548 17.591 5.217 1.00 0.00 H new ATOM 0 HD2 ARG A 74 11.519 18.169 6.348 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.192 19.662 6.971 1.00 0.00 H new ATOM 0 HE ARG A 74 12.148 19.505 4.046 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.925 20.108 6.721 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.102 21.405 5.849 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.302 21.307 3.111 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.879 22.081 3.817 1.00 0.00 H new ATOM 987 N TYR A 75 14.750 15.145 6.537 1.00 0.00 N ATOM 988 CA TYR A 75 14.229 14.109 5.639 1.00 0.00 C ATOM 989 C TYR A 75 12.701 14.248 5.641 1.00 0.00 C ATOM 990 O TYR A 75 12.079 14.206 6.697 1.00 0.00 O ATOM 991 CB TYR A 75 14.679 12.707 6.087 1.00 0.00 C ATOM 992 CG TYR A 75 16.158 12.366 5.934 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.967 12.953 4.934 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.727 11.414 6.803 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.329 12.608 4.821 1.00 0.00 C ATOM 996 CE2 TYR A 75 18.084 11.055 6.686 1.00 0.00 C ATOM 997 CZ TYR A 75 18.889 11.648 5.695 1.00 0.00 C ATOM 998 OH TYR A 75 20.206 11.318 5.617 1.00 0.00 O ATOM 0 H TYR A 75 14.511 14.991 7.516 1.00 0.00 H new ATOM 0 HA TYR A 75 14.618 14.236 4.629 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.412 12.586 7.137 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.103 11.972 5.525 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.538 13.671 4.251 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.117 10.955 7.567 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.944 13.077 4.067 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.508 10.323 7.358 1.00 0.00 H new ATOM 0 HH TYR A 75 20.415 10.643 6.296 1.00 0.00 H new ATOM 1008 N ALA A 76 12.100 14.488 4.481 1.00 0.00 N ATOM 1009 CA ALA A 76 10.661 14.683 4.308 1.00 0.00 C ATOM 1010 C ALA A 76 10.111 13.643 3.335 1.00 0.00 C ATOM 1011 O ALA A 76 10.870 13.172 2.491 1.00 0.00 O ATOM 1012 CB ALA A 76 10.433 16.111 3.790 1.00 0.00 C ATOM 0 H ALA A 76 12.617 14.555 3.604 1.00 0.00 H new ATOM 0 HA ALA A 76 10.136 14.556 5.255 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.365 16.282 3.652 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.825 16.827 4.512 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.947 16.239 2.837 1.00 0.00 H new ATOM 1018 N LEU A 77 8.821 13.295 3.418 1.00 0.00 N ATOM 1019 CA LEU A 77 8.152 12.479 2.401 1.00 0.00 C ATOM 1020 C LEU A 77 8.257 13.154 1.025 1.00 0.00 C ATOM 1021 O LEU A 77 8.335 14.380 0.943 1.00 0.00 O ATOM 1022 CB LEU A 77 6.697 12.243 2.836 1.00 0.00 C ATOM 1023 CG LEU A 77 6.540 11.287 4.026 1.00 0.00 C ATOM 1024 CD1 LEU A 77 5.085 11.345 4.468 1.00 0.00 C ATOM 1025 CD2 LEU A 77 6.912 9.848 3.679 1.00 0.00 C ATOM 0 H LEU A 77 8.214 13.571 4.190 1.00 0.00 H new ATOM 0 HA LEU A 77 8.638 11.508 2.307 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.247 13.202 3.094 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.137 11.845 1.989 1.00 0.00 H new ATOM 0 HG LEU A 77 7.219 11.601 4.819 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.935 10.676 5.315 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.834 12.364 4.762 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.442 11.037 3.644 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.782 9.217 4.558 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.268 9.489 2.876 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.952 9.809 3.355 1.00 0.00 H new ATOM 1037 N ALA A 78 8.260 12.357 -0.044 1.00 0.00 N ATOM 1038 CA ALA A 78 8.601 12.819 -1.402 1.00 0.00 C ATOM 1039 C ALA A 78 7.715 13.957 -1.938 1.00 0.00 C ATOM 1040 O ALA A 78 8.199 14.890 -2.576 1.00 0.00 O ATOM 1041 CB ALA A 78 8.578 11.605 -2.337 1.00 0.00 C ATOM 0 H ALA A 78 8.025 11.365 0.002 1.00 0.00 H new ATOM 0 HA ALA A 78 9.596 13.262 -1.357 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.828 11.921 -3.350 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.307 10.870 -1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.583 11.160 -2.331 1.00 0.00 H new ATOM 1047 N ASP A 79 6.427 13.903 -1.611 1.00 0.00 N ATOM 1048 CA ASP A 79 5.414 14.910 -1.918 1.00 0.00 C ATOM 1049 C ASP A 79 4.199 14.693 -1.006 1.00 0.00 C ATOM 1050 O ASP A 79 4.034 13.641 -0.373 1.00 0.00 O ATOM 1051 CB ASP A 79 5.036 14.859 -3.422 1.00 0.00 C ATOM 1052 CG ASP A 79 3.810 15.717 -3.782 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.823 16.934 -3.471 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.783 15.137 -4.201 1.00 0.00 O ATOM 0 H ASP A 79 6.040 13.112 -1.096 1.00 0.00 H new ATOM 0 HA ASP A 79 5.809 15.908 -1.727 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.889 15.193 -4.013 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.839 13.824 -3.703 1.00 0.00 H new ATOM 1059 N SER A 80 3.308 15.684 -0.997 1.00 0.00 N ATOM 1060 CA SER A 80 1.979 15.594 -0.420 1.00 0.00 C ATOM 1061 C SER A 80 1.299 14.285 -0.814 1.00 0.00 C ATOM 1062 O SER A 80 0.612 13.734 0.022 1.00 0.00 O ATOM 1063 CB SER A 80 1.121 16.780 -0.876 1.00 0.00 C ATOM 1064 OG SER A 80 1.729 18.001 -0.495 1.00 0.00 O ATOM 0 H SER A 80 3.503 16.598 -1.406 1.00 0.00 H new ATOM 0 HA SER A 80 2.081 15.619 0.665 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.994 16.751 -1.958 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.126 16.708 -0.436 1.00 0.00 H new ATOM 0 HG SER A 80 1.173 18.751 -0.793 1.00 0.00 H new ATOM 1070 N HIS A 81 1.560 13.725 -2.005 1.00 0.00 N ATOM 1071 CA HIS A 81 1.166 12.379 -2.420 1.00 0.00 C ATOM 1072 C HIS A 81 1.252 11.327 -1.299 1.00 0.00 C ATOM 1073 O HIS A 81 0.208 10.799 -0.918 1.00 0.00 O ATOM 1074 CB HIS A 81 1.993 11.995 -3.668 1.00 0.00 C ATOM 1075 CG HIS A 81 1.357 12.399 -4.981 1.00 0.00 C ATOM 1076 ND1 HIS A 81 0.161 13.072 -5.141 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.678 11.858 -6.191 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.292 12.842 -6.386 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.658 12.170 -7.070 1.00 0.00 N ATOM 0 H HIS A 81 2.073 14.223 -2.733 1.00 0.00 H new ATOM 0 HA HIS A 81 0.106 12.393 -2.672 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.977 12.459 -3.595 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.149 10.916 -3.669 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.300 13.646 -4.435 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.567 11.289 -6.421 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.254 13.144 -6.773 1.00 0.00 H new ATOM 1088 N LEU A 82 2.432 10.995 -0.761 1.00 0.00 N ATOM 1089 CA LEU A 82 2.510 9.938 0.265 1.00 0.00 C ATOM 1090 C LEU A 82 1.953 10.434 1.600 1.00 0.00 C ATOM 1091 O LEU A 82 1.188 9.711 2.223 1.00 0.00 O ATOM 1092 CB LEU A 82 3.923 9.349 0.435 1.00 0.00 C ATOM 1093 CG LEU A 82 4.656 9.023 -0.883 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.122 8.721 -0.583 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.013 7.842 -1.618 1.00 0.00 C ATOM 0 H LEU A 82 3.323 11.426 -1.007 1.00 0.00 H new ATOM 0 HA LEU A 82 1.887 9.118 -0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.528 10.054 1.005 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.851 8.438 1.029 1.00 0.00 H new ATOM 0 HG LEU A 82 4.581 9.891 -1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.643 8.490 -1.512 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.584 9.590 -0.114 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.187 7.867 0.091 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.560 7.646 -2.540 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.045 6.957 -0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.976 8.082 -1.855 1.00 0.00 H new ATOM 1107 N ALA A 83 2.246 11.676 1.998 1.00 0.00 N ATOM 1108 CA ALA A 83 1.721 12.281 3.229 1.00 0.00 C ATOM 1109 C ALA A 83 0.179 12.360 3.271 1.00 0.00 C ATOM 1110 O ALA A 83 -0.411 12.346 4.347 1.00 0.00 O ATOM 1111 CB ALA A 83 2.355 13.672 3.363 1.00 0.00 C ATOM 0 H ALA A 83 2.860 12.297 1.471 1.00 0.00 H new ATOM 0 HA ALA A 83 1.987 11.645 4.073 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.987 14.154 4.269 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.439 13.574 3.418 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.089 14.278 2.497 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.472 12.417 2.105 1.00 0.00 N ATOM 1118 CA ARG A 84 -1.921 12.459 1.912 1.00 0.00 C ATOM 1119 C ARG A 84 -2.497 11.048 2.062 1.00 0.00 C ATOM 1120 O ARG A 84 -3.196 10.813 3.042 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.219 13.123 0.550 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.662 13.499 0.210 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.250 14.506 1.207 1.00 0.00 C ATOM 1124 NE ARG A 84 -4.910 13.802 2.300 1.00 0.00 N ATOM 1125 CZ ARG A 84 -4.791 13.897 3.612 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -3.926 14.691 4.209 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -5.591 13.145 4.322 1.00 0.00 N ATOM 0 H ARG A 84 0.031 12.436 1.218 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.413 13.066 2.672 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.619 14.031 0.488 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.861 12.450 -0.230 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.698 13.921 -0.794 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.277 12.599 0.200 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.459 15.144 1.600 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.963 15.157 0.701 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.591 13.106 1.994 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -3.302 15.275 3.653 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -3.880 14.722 5.228 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.259 12.530 3.857 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -5.547 13.174 5.341 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.064 10.091 1.230 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.539 8.699 1.278 1.00 0.00 C ATOM 1143 C ALA A 85 -2.226 7.986 2.609 1.00 0.00 C ATOM 1144 O ALA A 85 -3.053 7.226 3.121 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.939 7.938 0.091 1.00 0.00 C ATOM 0 H ALA A 85 -1.371 10.260 0.501 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.627 8.715 1.212 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.281 6.903 0.112 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.257 8.407 -0.840 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.851 7.962 0.156 1.00 0.00 H new ATOM 1151 N LEU A 86 -1.052 8.250 3.198 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.732 7.807 4.557 1.00 0.00 C ATOM 1153 C LEU A 86 -1.640 8.548 5.569 1.00 0.00 C ATOM 1154 O LEU A 86 -2.225 7.916 6.446 1.00 0.00 O ATOM 1155 CB LEU A 86 0.790 7.973 4.821 1.00 0.00 C ATOM 1156 CG LEU A 86 1.398 6.907 5.752 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.878 7.238 5.985 1.00 0.00 C ATOM 1158 CD2 LEU A 86 0.675 6.749 7.094 1.00 0.00 C ATOM 0 H LEU A 86 -0.302 8.774 2.747 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.941 6.745 4.682 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.316 7.946 3.867 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.965 8.958 5.254 1.00 0.00 H new ATOM 0 HG LEU A 86 1.281 5.948 5.248 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.319 6.489 6.643 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.405 7.238 5.031 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.963 8.222 6.447 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.170 5.978 7.685 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.702 7.695 7.635 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.361 6.461 6.917 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.838 9.861 5.385 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.572 10.764 6.282 1.00 0.00 C ATOM 1172 C GLY A 87 -4.093 10.575 6.371 1.00 0.00 C ATOM 1173 O GLY A 87 -4.627 10.793 7.454 1.00 0.00 O ATOM 0 H GLY A 87 -1.472 10.346 4.566 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.158 10.655 7.285 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.376 11.788 5.966 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.817 10.191 5.306 1.00 0.00 N ATOM 1178 CA GLU A 88 -6.226 9.753 5.474 1.00 0.00 C ATOM 1179 C GLU A 88 -6.329 8.330 6.040 1.00 0.00 C ATOM 1180 O GLU A 88 -7.413 7.915 6.456 1.00 0.00 O ATOM 1181 CB GLU A 88 -7.107 9.889 4.214 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.523 9.458 2.849 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.150 10.636 1.940 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -6.658 11.758 2.171 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.287 10.469 1.052 1.00 0.00 O ATOM 0 H GLU A 88 -4.471 10.172 4.347 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.629 10.458 6.201 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -8.015 9.311 4.382 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.405 10.934 4.131 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.637 8.847 3.019 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.250 8.829 2.335 1.00 0.00 H new ATOM 1192 N LEU A 89 -5.201 7.604 6.067 1.00 0.00 N ATOM 1193 CA LEU A 89 -5.048 6.201 6.437 1.00 0.00 C ATOM 1194 C LEU A 89 -5.811 5.329 5.435 1.00 0.00 C ATOM 1195 O LEU A 89 -7.042 5.272 5.447 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.448 5.968 7.915 1.00 0.00 C ATOM 1197 CG LEU A 89 -5.557 4.495 8.353 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -4.233 3.732 8.219 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -6.059 4.435 9.801 1.00 0.00 C ATOM 0 H LEU A 89 -4.307 8.021 5.810 1.00 0.00 H new ATOM 0 HA LEU A 89 -4.000 5.907 6.380 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.717 6.464 8.553 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.408 6.453 8.093 1.00 0.00 H new ATOM 0 HG LEU A 89 -6.265 4.005 7.685 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -4.373 2.701 8.542 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -3.909 3.745 7.178 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.475 4.207 8.841 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.138 3.394 10.116 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.358 4.959 10.451 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.038 4.909 9.867 1.00 0.00 H new ATOM 1211 N VAL A 90 -5.071 4.534 4.654 1.00 0.00 N ATOM 1212 CA VAL A 90 -5.569 3.678 3.551 1.00 0.00 C ATOM 1213 C VAL A 90 -6.468 2.515 3.991 1.00 0.00 C ATOM 1214 O VAL A 90 -6.499 1.448 3.379 1.00 0.00 O ATOM 1215 CB VAL A 90 -4.444 3.107 2.658 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -3.544 4.195 2.059 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -3.574 2.106 3.447 1.00 0.00 C ATOM 0 H VAL A 90 -4.061 4.460 4.772 1.00 0.00 H new ATOM 0 HA VAL A 90 -6.176 4.377 2.975 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.943 2.599 1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -2.774 3.731 1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.144 4.867 1.446 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -3.073 4.761 2.863 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.789 1.717 2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -3.123 2.611 4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.195 1.282 3.799 1.00 0.00 H new ATOM 1227 N GLN A 91 -7.157 2.652 5.121 1.00 0.00 N ATOM 1228 CA GLN A 91 -8.353 1.905 5.422 1.00 0.00 C ATOM 1229 C GLN A 91 -8.017 0.492 5.917 1.00 0.00 C ATOM 1230 O GLN A 91 -8.897 -0.204 6.393 1.00 0.00 O ATOM 1231 CB GLN A 91 -9.288 2.012 4.214 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.767 3.452 3.916 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.614 4.107 5.004 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.817 3.911 5.074 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -10.029 4.843 5.930 1.00 0.00 N ATOM 0 H GLN A 91 -6.886 3.300 5.860 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.901 2.322 6.267 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.776 1.621 3.335 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.158 1.378 4.384 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.892 4.077 3.738 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.343 3.439 2.991 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.025 5.016 5.885 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.581 5.239 6.691 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.733 0.135 5.943 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.054 -1.016 6.582 1.00 0.00 C ATOM 1246 C VAL A 92 -6.212 -1.061 8.117 1.00 0.00 C ATOM 1247 O VAL A 92 -5.333 -1.509 8.840 1.00 0.00 O ATOM 1248 CB VAL A 92 -4.583 -1.046 6.079 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -3.795 0.190 6.547 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -3.772 -2.321 6.367 1.00 0.00 C ATOM 0 H VAL A 92 -6.049 0.714 5.457 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.543 -1.941 6.278 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.707 -1.038 4.996 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.772 0.132 6.175 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.270 1.092 6.161 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.784 0.223 7.636 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.765 -2.211 5.964 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -3.716 -2.481 7.444 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -4.259 -3.176 5.898 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.353 -0.566 8.602 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.871 -0.663 9.977 1.00 0.00 C ATOM 1262 C VAL A 93 -6.909 -0.100 11.054 1.00 0.00 C ATOM 1263 O VAL A 93 -7.055 -0.423 12.226 1.00 0.00 O ATOM 1264 CB VAL A 93 -8.365 -2.110 10.295 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -9.501 -2.072 11.330 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -8.985 -2.828 9.074 1.00 0.00 C ATOM 0 H VAL A 93 -7.991 -0.046 8.000 1.00 0.00 H new ATOM 0 HA VAL A 93 -8.739 -0.005 10.024 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.475 -2.636 10.641 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -9.835 -3.088 11.541 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -9.141 -1.610 12.249 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.334 -1.491 10.934 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.307 -3.828 9.365 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.844 -2.260 8.715 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -8.242 -2.903 8.280 1.00 0.00 H new ATOM 1276 N LEU A 94 -5.942 0.740 10.633 1.00 0.00 N ATOM 1277 CA LEU A 94 -4.764 1.267 11.354 1.00 0.00 C ATOM 1278 C LEU A 94 -3.556 0.425 10.921 1.00 0.00 C ATOM 1279 O LEU A 94 -3.406 -0.728 11.303 1.00 0.00 O ATOM 1280 CB LEU A 94 -4.933 1.337 12.892 1.00 0.00 C ATOM 1281 CG LEU A 94 -3.973 2.287 13.640 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -4.363 2.320 15.125 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -2.487 1.911 13.530 1.00 0.00 C ATOM 0 H LEU A 94 -5.969 1.104 9.681 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.619 2.313 11.083 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.956 1.642 13.111 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.806 0.333 13.297 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.079 3.261 13.163 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.691 2.988 15.663 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.388 2.679 15.224 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.288 1.316 15.543 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.887 2.632 14.085 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.332 0.915 13.944 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.186 1.919 12.482 1.00 0.00 H new ATOM 1295 N ALA A 95 -2.700 1.014 10.083 1.00 0.00 N ATOM 1296 CA ALA A 95 -1.517 0.411 9.463 1.00 0.00 C ATOM 1297 C ALA A 95 -0.417 -0.086 10.435 1.00 0.00 C ATOM 1298 O ALA A 95 0.715 0.382 10.378 1.00 0.00 O ATOM 1299 CB ALA A 95 -0.979 1.425 8.440 1.00 0.00 C ATOM 0 H ALA A 95 -2.822 1.987 9.801 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.830 -0.518 8.986 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.094 1.015 7.953 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.745 1.628 7.691 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.716 2.352 8.950 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.737 -1.049 11.305 1.00 0.00 N ATOM 1306 CA VAL A 96 0.229 -1.820 12.114 1.00 0.00 C ATOM 1307 C VAL A 96 1.112 -2.646 11.161 1.00 0.00 C ATOM 1308 O VAL A 96 0.682 -2.991 10.067 1.00 0.00 O ATOM 1309 CB VAL A 96 -0.485 -2.742 13.142 1.00 0.00 C ATOM 1310 CG1 VAL A 96 0.509 -3.396 14.121 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.479 -1.956 14.018 1.00 0.00 C ATOM 0 H VAL A 96 -1.704 -1.327 11.475 1.00 0.00 H new ATOM 0 HA VAL A 96 0.844 -1.128 12.690 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.994 -3.495 12.540 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.034 -4.031 14.821 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.225 -4.000 13.563 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.040 -2.620 14.672 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.958 -2.635 14.724 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -0.946 -1.180 14.566 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.238 -1.497 13.385 1.00 0.00 H new ATOM 1321 N ASP A 97 2.344 -2.964 11.549 1.00 0.00 N ATOM 1322 CA ASP A 97 3.304 -3.774 10.785 1.00 0.00 C ATOM 1323 C ASP A 97 3.029 -5.289 10.877 1.00 0.00 C ATOM 1324 O ASP A 97 2.563 -5.846 9.881 1.00 0.00 O ATOM 1325 CB ASP A 97 4.744 -3.409 11.196 1.00 0.00 C ATOM 1326 CG ASP A 97 4.904 -2.959 12.656 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.181 -3.477 13.536 1.00 0.00 O ATOM 1328 OD2 ASP A 97 5.625 -1.969 12.898 1.00 0.00 O ATOM 0 H ASP A 97 2.723 -2.653 12.444 1.00 0.00 H new ATOM 0 HA ASP A 97 3.176 -3.532 9.730 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.386 -4.273 11.025 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.102 -2.612 10.544 1.00 0.00 H new ATOM 1333 N THR A 98 3.305 -5.912 12.041 1.00 0.00 N ATOM 1334 CA THR A 98 3.051 -7.326 12.447 1.00 0.00 C ATOM 1335 C THR A 98 3.931 -8.368 11.756 1.00 0.00 C ATOM 1336 O THR A 98 4.207 -8.260 10.567 1.00 0.00 O ATOM 1337 CB THR A 98 1.588 -7.780 12.284 1.00 0.00 C ATOM 1338 OG1 THR A 98 1.254 -7.936 10.929 1.00 0.00 O ATOM 1339 CG2 THR A 98 0.579 -6.825 12.917 1.00 0.00 C ATOM 0 H THR A 98 3.754 -5.397 12.798 1.00 0.00 H new ATOM 0 HA THR A 98 3.311 -7.289 13.505 1.00 0.00 H new ATOM 0 HB THR A 98 1.528 -8.734 12.808 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.828 -7.360 10.382 1.00 0.00 H new ATOM 0 HG21 THR A 98 -0.430 -7.208 12.764 1.00 0.00 H new ATOM 0 HG22 THR A 98 0.777 -6.742 13.986 1.00 0.00 H new ATOM 0 HG23 THR A 98 0.668 -5.842 12.454 1.00 0.00 H new ATOM 1347 N ASP A 99 4.300 -9.420 12.498 1.00 0.00 N ATOM 1348 CA ASP A 99 4.820 -10.653 11.897 1.00 0.00 C ATOM 1349 C ASP A 99 3.599 -11.550 11.667 1.00 0.00 C ATOM 1350 O ASP A 99 2.778 -11.696 12.574 1.00 0.00 O ATOM 1351 CB ASP A 99 5.825 -11.375 12.809 1.00 0.00 C ATOM 1352 CG ASP A 99 6.127 -12.767 12.235 1.00 0.00 C ATOM 1353 OD1 ASP A 99 6.604 -12.821 11.084 1.00 0.00 O ATOM 1354 OD2 ASP A 99 5.737 -13.770 12.874 1.00 0.00 O ATOM 0 H ASP A 99 4.248 -9.441 13.516 1.00 0.00 H new ATOM 0 HA ASP A 99 5.357 -10.422 10.977 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.744 -10.794 12.887 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.419 -11.465 13.816 1.00 0.00 H new ATOM 1359 N GLN A 100 3.447 -12.137 10.478 1.00 0.00 N ATOM 1360 CA GLN A 100 2.310 -13.001 10.156 1.00 0.00 C ATOM 1361 C GLN A 100 2.561 -13.751 8.834 1.00 0.00 C ATOM 1362 O GLN A 100 3.022 -13.112 7.885 1.00 0.00 O ATOM 1363 CB GLN A 100 1.021 -12.145 10.051 1.00 0.00 C ATOM 1364 CG GLN A 100 -0.279 -12.870 10.444 1.00 0.00 C ATOM 1365 CD GLN A 100 -0.379 -13.289 11.919 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -0.965 -14.318 12.228 1.00 0.00 O ATOM 1367 NE2 GLN A 100 0.168 -12.535 12.851 1.00 0.00 N ATOM 0 H GLN A 100 4.110 -12.026 9.711 1.00 0.00 H new ATOM 0 HA GLN A 100 2.188 -13.738 10.950 1.00 0.00 H new ATOM 0 HB2 GLN A 100 1.135 -11.266 10.686 1.00 0.00 H new ATOM 0 HB3 GLN A 100 0.924 -11.787 9.026 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.122 -12.220 10.210 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -0.381 -13.760 9.823 1.00 0.00 H new ATOM 0 HE21 GLN A 100 0.656 -11.678 12.592 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.103 -12.809 13.831 1.00 0.00 H new ATOM 1376 N PRO A 101 2.224 -15.054 8.720 1.00 0.00 N ATOM 1377 CA PRO A 101 2.329 -15.789 7.461 1.00 0.00 C ATOM 1378 C PRO A 101 1.286 -15.311 6.437 1.00 0.00 C ATOM 1379 O PRO A 101 0.345 -14.597 6.782 1.00 0.00 O ATOM 1380 CB PRO A 101 2.151 -17.264 7.835 1.00 0.00 C ATOM 1381 CG PRO A 101 1.228 -17.194 9.049 1.00 0.00 C ATOM 1382 CD PRO A 101 1.720 -15.936 9.766 1.00 0.00 C ATOM 0 HA PRO A 101 3.290 -15.624 6.973 1.00 0.00 H new ATOM 0 HB2 PRO A 101 1.707 -17.837 7.021 1.00 0.00 H new ATOM 0 HB3 PRO A 101 3.102 -17.738 8.077 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.181 -17.112 8.758 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.316 -18.080 9.678 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.911 -15.461 10.322 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.503 -16.177 10.485 1.00 0.00 H new ATOM 1390 N CYS A 102 1.472 -15.707 5.174 1.00 0.00 N ATOM 1391 CA CYS A 102 0.663 -15.331 4.014 1.00 0.00 C ATOM 1392 C CYS A 102 -0.270 -16.494 3.581 1.00 0.00 C ATOM 1393 O CYS A 102 -0.596 -17.376 4.369 1.00 0.00 O ATOM 1394 CB CYS A 102 1.705 -14.885 2.963 1.00 0.00 C ATOM 1395 SG CYS A 102 1.257 -13.799 1.551 1.00 0.00 S ATOM 0 H CYS A 102 2.235 -16.334 4.921 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.043 -14.522 4.201 1.00 0.00 H new ATOM 0 HB2 CYS A 102 2.504 -14.381 3.506 1.00 0.00 H new ATOM 0 HB3 CYS A 102 2.132 -15.793 2.538 1.00 0.00 H new ATOM 1400 N VAL A 103 -0.692 -16.479 2.318 1.00 0.00 N ATOM 1401 CA VAL A 103 -1.373 -17.589 1.611 1.00 0.00 C ATOM 1402 C VAL A 103 -2.440 -18.323 2.463 1.00 0.00 C ATOM 1403 O VAL A 103 -2.370 -19.530 2.673 1.00 0.00 O ATOM 1404 CB VAL A 103 -0.324 -18.578 1.027 1.00 0.00 C ATOM 1405 CG1 VAL A 103 -0.938 -19.520 -0.034 1.00 0.00 C ATOM 1406 CG2 VAL A 103 0.853 -17.867 0.324 1.00 0.00 C ATOM 0 H VAL A 103 -0.568 -15.660 1.723 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.933 -17.136 0.793 1.00 0.00 H new ATOM 0 HB VAL A 103 0.028 -19.131 1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.168 -20.192 -0.413 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -1.739 -20.104 0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -1.340 -18.929 -0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.550 -18.611 -0.062 1.00 0.00 H new ATOM 0 HG22 VAL A 103 0.473 -17.264 -0.501 1.00 0.00 H new ATOM 0 HG23 VAL A 103 1.368 -17.223 1.037 1.00 0.00 H new ATOM 1416 N ALA A 104 -3.394 -17.573 3.034 1.00 0.00 N ATOM 1417 CA ALA A 104 -4.534 -18.063 3.841 1.00 0.00 C ATOM 1418 C ALA A 104 -4.191 -18.496 5.281 1.00 0.00 C ATOM 1419 O ALA A 104 -5.103 -18.634 6.099 1.00 0.00 O ATOM 1420 CB ALA A 104 -5.318 -19.153 3.086 1.00 0.00 C ATOM 0 H ALA A 104 -3.396 -16.557 2.944 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.175 -17.192 3.976 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.150 -19.495 3.702 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.702 -18.744 2.152 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.657 -19.993 2.870 1.00 0.00 H new ATOM 1426 N GLU A 105 -2.913 -18.666 5.619 1.00 0.00 N ATOM 1427 CA GLU A 105 -2.483 -18.966 6.982 1.00 0.00 C ATOM 1428 C GLU A 105 -2.690 -17.772 7.931 1.00 0.00 C ATOM 1429 O GLU A 105 -2.851 -16.612 7.526 1.00 0.00 O ATOM 1430 CB GLU A 105 -1.016 -19.435 7.008 1.00 0.00 C ATOM 1431 CG GLU A 105 -0.777 -20.716 6.185 1.00 0.00 C ATOM 1432 CD GLU A 105 0.637 -21.290 6.330 1.00 0.00 C ATOM 1433 OE1 GLU A 105 1.347 -20.892 7.282 1.00 0.00 O ATOM 1434 OE2 GLU A 105 0.980 -22.164 5.505 1.00 0.00 O ATOM 0 H GLU A 105 -2.145 -18.599 4.951 1.00 0.00 H new ATOM 0 HA GLU A 105 -3.112 -19.780 7.343 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.379 -18.639 6.623 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -0.716 -19.612 8.041 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -1.499 -21.473 6.491 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -0.966 -20.501 5.133 1.00 0.00 H new ATOM 1441 N ARG A 106 -2.668 -18.069 9.234 1.00 0.00 N ATOM 1442 CA ARG A 106 -2.769 -17.111 10.337 1.00 0.00 C ATOM 1443 C ARG A 106 -2.377 -17.779 11.654 1.00 0.00 C ATOM 1444 O ARG A 106 -2.703 -18.940 11.894 1.00 0.00 O ATOM 1445 CB ARG A 106 -4.188 -16.513 10.433 1.00 0.00 C ATOM 1446 CG ARG A 106 -4.168 -14.999 10.183 1.00 0.00 C ATOM 1447 CD ARG A 106 -5.558 -14.387 10.363 1.00 0.00 C ATOM 1448 NE ARG A 106 -5.921 -14.256 11.785 1.00 0.00 N ATOM 1449 CZ ARG A 106 -6.908 -13.499 12.251 1.00 0.00 C ATOM 1450 NH1 ARG A 106 -7.773 -12.925 11.446 1.00 0.00 N ATOM 1451 NH2 ARG A 106 -7.036 -13.294 13.542 1.00 0.00 N ATOM 0 H ARG A 106 -2.575 -19.030 9.563 1.00 0.00 H new ATOM 0 HA ARG A 106 -2.078 -16.292 10.138 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.840 -16.996 9.705 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -4.606 -16.716 11.419 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.468 -14.524 10.870 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.809 -14.800 9.173 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -5.587 -13.406 9.889 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -6.296 -15.008 9.856 1.00 0.00 H new ATOM 0 HE ARG A 106 -5.373 -14.786 12.462 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -7.696 -13.056 10.437 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -8.522 -12.348 11.830 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -6.375 -13.717 14.194 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -7.796 -12.712 13.893 1.00 0.00 H new TER 1465 ARG A 106 ATOM 1466 N ALA B 10 -2.902 -5.281 8.489 1.00 0.00 N ATOM 1467 CA ALA B 10 -1.530 -4.866 8.751 1.00 0.00 C ATOM 1468 C ALA B 10 -0.786 -4.583 7.436 1.00 0.00 C ATOM 1469 O ALA B 10 -0.996 -5.287 6.444 1.00 0.00 O ATOM 1470 CB ALA B 10 -0.836 -5.963 9.560 1.00 0.00 C ATOM 0 HA ALA B 10 -1.526 -3.939 9.325 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.193 -5.668 9.765 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -1.365 -6.111 10.501 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.841 -6.893 8.991 1.00 0.00 H new ATOM 1476 N LEU B 11 0.076 -3.563 7.425 1.00 0.00 N ATOM 1477 CA LEU B 11 0.747 -3.054 6.228 1.00 0.00 C ATOM 1478 C LEU B 11 1.743 -4.058 5.638 1.00 0.00 C ATOM 1479 O LEU B 11 1.927 -4.043 4.427 1.00 0.00 O ATOM 1480 CB LEU B 11 1.421 -1.690 6.515 1.00 0.00 C ATOM 1481 CG LEU B 11 1.148 -0.618 5.431 1.00 0.00 C ATOM 1482 CD1 LEU B 11 1.957 0.651 5.721 1.00 0.00 C ATOM 1483 CD2 LEU B 11 1.452 -1.058 3.990 1.00 0.00 C ATOM 0 H LEU B 11 0.333 -3.055 8.272 1.00 0.00 H new ATOM 0 HA LEU B 11 -0.022 -2.904 5.470 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.071 -1.317 7.478 1.00 0.00 H new ATOM 0 HB3 LEU B 11 2.497 -1.838 6.603 1.00 0.00 H new ATOM 0 HG LEU B 11 0.074 -0.439 5.489 1.00 0.00 H new ATOM 0 HD11 LEU B 11 1.755 1.395 4.951 1.00 0.00 H new ATOM 0 HD12 LEU B 11 1.672 1.050 6.695 1.00 0.00 H new ATOM 0 HD13 LEU B 11 3.020 0.412 5.724 1.00 0.00 H new ATOM 0 HD21 LEU B 11 1.229 -0.240 3.305 1.00 0.00 H new ATOM 0 HD22 LEU B 11 2.505 -1.325 3.906 1.00 0.00 H new ATOM 0 HD23 LEU B 11 0.837 -1.922 3.736 1.00 0.00 H new ATOM 1495 N ALA B 12 2.326 -4.967 6.430 1.00 0.00 N ATOM 1496 CA ALA B 12 3.133 -6.067 5.896 1.00 0.00 C ATOM 1497 C ALA B 12 2.294 -7.021 5.030 1.00 0.00 C ATOM 1498 O ALA B 12 2.581 -7.196 3.845 1.00 0.00 O ATOM 1499 CB ALA B 12 3.836 -6.788 7.056 1.00 0.00 C ATOM 0 H ALA B 12 2.252 -4.960 7.447 1.00 0.00 H new ATOM 0 HA ALA B 12 3.896 -5.662 5.231 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.438 -7.608 6.664 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.480 -6.085 7.584 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.089 -7.184 7.745 1.00 0.00 H new ATOM 1505 N ARG B 13 1.206 -7.585 5.576 1.00 0.00 N ATOM 1506 CA ARG B 13 0.265 -8.452 4.830 1.00 0.00 C ATOM 1507 C ARG B 13 -0.357 -7.720 3.628 1.00 0.00 C ATOM 1508 O ARG B 13 -0.225 -8.143 2.479 1.00 0.00 O ATOM 1509 CB ARG B 13 -0.859 -8.938 5.771 1.00 0.00 C ATOM 1510 CG ARG B 13 -0.464 -10.122 6.672 1.00 0.00 C ATOM 1511 CD ARG B 13 -0.839 -11.500 6.095 1.00 0.00 C ATOM 1512 NE ARG B 13 -2.306 -11.722 6.083 1.00 0.00 N ATOM 1513 CZ ARG B 13 -2.953 -12.864 6.335 1.00 0.00 C ATOM 1514 NH1 ARG B 13 -2.343 -13.993 6.629 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -4.268 -12.879 6.307 1.00 0.00 N ATOM 0 H ARG B 13 0.948 -7.455 6.554 1.00 0.00 H new ATOM 0 HA ARG B 13 0.831 -9.303 4.452 1.00 0.00 H new ATOM 0 HB2 ARG B 13 -1.174 -8.106 6.401 1.00 0.00 H new ATOM 0 HB3 ARG B 13 -1.721 -9.226 5.169 1.00 0.00 H new ATOM 0 HG2 ARG B 13 0.612 -10.092 6.843 1.00 0.00 H new ATOM 0 HG3 ARG B 13 -0.945 -10.003 7.643 1.00 0.00 H new ATOM 0 HD2 ARG B 13 -0.452 -11.584 5.079 1.00 0.00 H new ATOM 0 HD3 ARG B 13 -0.360 -12.282 6.685 1.00 0.00 H new ATOM 0 HE ARG B 13 -2.885 -10.913 5.857 1.00 0.00 H new ATOM 0 HH11 ARG B 13 -1.324 -14.026 6.673 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -2.889 -14.835 6.812 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -4.783 -12.025 6.095 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -4.772 -13.745 6.498 1.00 0.00 H new ATOM 1529 N LEU B 14 -1.041 -6.609 3.918 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.850 -5.829 2.978 1.00 0.00 C ATOM 1531 C LEU B 14 -0.958 -5.228 1.899 1.00 0.00 C ATOM 1532 O LEU B 14 -1.202 -5.458 0.720 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.631 -4.754 3.773 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.644 -3.865 3.012 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.994 -2.824 2.087 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.702 -4.691 2.273 1.00 0.00 C ATOM 0 H LEU B 14 -1.046 -6.211 4.857 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.574 -6.465 2.468 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -3.170 -5.260 4.574 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.902 -4.096 4.246 1.00 0.00 H new ATOM 0 HG LEU B 14 -4.151 -3.293 3.789 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.771 -2.242 1.591 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.362 -2.159 2.675 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.387 -3.332 1.338 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.389 -4.022 1.755 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.214 -5.343 1.548 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.257 -5.297 2.990 1.00 0.00 H new ATOM 1548 N GLY B 15 0.108 -4.520 2.280 1.00 0.00 N ATOM 1549 CA GLY B 15 0.985 -3.815 1.350 1.00 0.00 C ATOM 1550 C GLY B 15 1.721 -4.768 0.416 1.00 0.00 C ATOM 1551 O GLY B 15 1.783 -4.484 -0.775 1.00 0.00 O ATOM 0 H GLY B 15 0.387 -4.421 3.256 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.396 -3.113 0.759 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.711 -3.228 1.912 1.00 0.00 H new ATOM 1555 N ARG B 16 2.183 -5.931 0.901 1.00 0.00 N ATOM 1556 CA ARG B 16 2.790 -6.958 0.043 1.00 0.00 C ATOM 1557 C ARG B 16 1.746 -7.588 -0.875 1.00 0.00 C ATOM 1558 O ARG B 16 2.059 -7.898 -2.017 1.00 0.00 O ATOM 1559 CB ARG B 16 3.533 -8.031 0.863 1.00 0.00 C ATOM 1560 CG ARG B 16 4.312 -9.038 -0.019 1.00 0.00 C ATOM 1561 CD ARG B 16 3.498 -10.287 -0.410 1.00 0.00 C ATOM 1562 NE ARG B 16 4.146 -11.115 -1.449 1.00 0.00 N ATOM 1563 CZ ARG B 16 4.026 -10.950 -2.765 1.00 0.00 C ATOM 1564 NH1 ARG B 16 3.558 -9.866 -3.330 1.00 0.00 N ATOM 1565 NH2 ARG B 16 4.347 -11.905 -3.607 1.00 0.00 N ATOM 0 H ARG B 16 2.147 -6.184 1.889 1.00 0.00 H new ATOM 0 HA ARG B 16 3.534 -6.462 -0.580 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.228 -7.542 1.546 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.814 -8.574 1.476 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.641 -8.532 -0.927 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.209 -9.353 0.513 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.335 -10.897 0.479 1.00 0.00 H new ATOM 0 HD3 ARG B 16 2.517 -9.974 -0.767 1.00 0.00 H new ATOM 0 HE ARG B 16 4.738 -11.881 -1.129 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.258 -9.080 -2.754 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.494 -9.808 -4.346 1.00 0.00 H new ATOM 0 HH21 ARG B 16 4.697 -12.797 -3.257 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.246 -11.755 -4.611 1.00 0.00 H new ATOM 1579 N ALA B 17 0.515 -7.805 -0.410 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.552 -8.383 -1.230 1.00 0.00 C ATOM 1581 C ALA B 17 -1.142 -7.400 -2.261 1.00 0.00 C ATOM 1582 O ALA B 17 -1.790 -7.853 -3.206 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.612 -8.963 -0.291 1.00 0.00 C ATOM 0 H ALA B 17 0.229 -7.586 0.544 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.130 -9.178 -1.845 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.419 -9.400 -0.879 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.161 -9.733 0.335 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.012 -8.170 0.340 1.00 0.00 H new ATOM 1589 N LEU B 18 -0.909 -6.087 -2.114 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.205 -5.092 -3.160 1.00 0.00 C ATOM 1591 C LEU B 18 0.028 -4.899 -4.071 1.00 0.00 C ATOM 1592 O LEU B 18 -0.134 -4.747 -5.281 1.00 0.00 O ATOM 1593 CB LEU B 18 -1.766 -3.787 -2.525 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.312 -3.808 -2.378 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.799 -4.944 -1.472 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -3.955 -2.511 -1.845 1.00 0.00 C ATOM 0 H LEU B 18 -0.510 -5.683 -1.267 1.00 0.00 H new ATOM 0 HA LEU B 18 -1.998 -5.450 -3.816 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.314 -3.642 -1.544 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.475 -2.935 -3.139 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.632 -3.947 -3.411 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.886 -4.914 -1.403 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.489 -5.901 -1.890 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.369 -4.826 -0.477 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.036 -2.639 -1.783 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -3.559 -2.289 -0.854 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -3.725 -1.687 -2.520 1.00 0.00 H new ATOM 1608 N ALA B 19 1.241 -5.024 -3.520 1.00 0.00 N ATOM 1609 CA ALA B 19 2.520 -5.087 -4.236 1.00 0.00 C ATOM 1610 C ALA B 19 2.773 -6.439 -4.931 1.00 0.00 C ATOM 1611 O ALA B 19 3.779 -7.104 -4.692 1.00 0.00 O ATOM 1612 CB ALA B 19 3.639 -4.732 -3.251 1.00 0.00 C ATOM 0 H ALA B 19 1.363 -5.087 -2.509 1.00 0.00 H new ATOM 0 HA ALA B 19 2.493 -4.364 -5.051 1.00 0.00 H new ATOM 0 HB1 ALA B 19 4.601 -4.773 -3.763 1.00 0.00 H new ATOM 0 HB2 ALA B 19 3.477 -3.726 -2.863 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.637 -5.444 -2.426 1.00 0.00 H new ATOM 1618 N ASP B 20 1.848 -6.851 -5.792 1.00 0.00 N ATOM 1619 CA ASP B 20 1.910 -8.084 -6.578 1.00 0.00 C ATOM 1620 C ASP B 20 1.218 -7.799 -7.928 1.00 0.00 C ATOM 1621 O ASP B 20 0.141 -7.189 -7.914 1.00 0.00 O ATOM 1622 CB ASP B 20 1.271 -9.223 -5.759 1.00 0.00 C ATOM 1623 CG ASP B 20 1.724 -10.617 -6.184 1.00 0.00 C ATOM 1624 OD1 ASP B 20 2.871 -10.985 -5.834 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.910 -11.301 -6.842 1.00 0.00 O ATOM 0 H ASP B 20 0.999 -6.315 -5.970 1.00 0.00 H new ATOM 0 HA ASP B 20 2.928 -8.408 -6.796 1.00 0.00 H new ATOM 0 HB2 ASP B 20 1.511 -9.079 -4.705 1.00 0.00 H new ATOM 0 HB3 ASP B 20 0.187 -9.160 -5.851 1.00 0.00 H new ATOM 1630 N PRO B 21 1.796 -8.217 -9.078 1.00 0.00 N ATOM 1631 CA PRO B 21 1.421 -7.784 -10.431 1.00 0.00 C ATOM 1632 C PRO B 21 -0.088 -7.806 -10.683 1.00 0.00 C ATOM 1633 O PRO B 21 -0.729 -6.756 -10.761 1.00 0.00 O ATOM 1634 CB PRO B 21 2.201 -8.704 -11.390 1.00 0.00 C ATOM 1635 CG PRO B 21 2.496 -9.932 -10.527 1.00 0.00 C ATOM 1636 CD PRO B 21 2.796 -9.269 -9.188 1.00 0.00 C ATOM 0 HA PRO B 21 1.681 -6.737 -10.586 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.612 -8.962 -12.270 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.117 -8.232 -11.746 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.646 -10.612 -10.471 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.342 -10.508 -10.902 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.718 -9.980 -8.365 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.807 -8.862 -9.163 1.00 0.00 H new ATOM 1644 N THR B 22 -0.675 -9.002 -10.763 1.00 0.00 N ATOM 1645 CA THR B 22 -2.102 -9.163 -11.037 1.00 0.00 C ATOM 1646 C THR B 22 -2.974 -8.717 -9.874 1.00 0.00 C ATOM 1647 O THR B 22 -4.180 -8.580 -10.079 1.00 0.00 O ATOM 1648 CB THR B 22 -2.421 -10.607 -11.445 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.747 -11.473 -10.555 1.00 0.00 O ATOM 1650 CG2 THR B 22 -2.019 -10.860 -12.892 1.00 0.00 C ATOM 0 H THR B 22 -0.175 -9.883 -10.640 1.00 0.00 H new ATOM 0 HA THR B 22 -2.339 -8.507 -11.874 1.00 0.00 H new ATOM 0 HB THR B 22 -3.494 -10.790 -11.384 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.920 -11.793 -10.973 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.254 -11.890 -13.160 1.00 0.00 H new ATOM 0 HG22 THR B 22 -2.566 -10.181 -13.546 1.00 0.00 H new ATOM 0 HG23 THR B 22 -0.948 -10.690 -13.007 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.451 -8.552 -8.649 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.299 -8.196 -7.505 1.00 0.00 C ATOM 1660 C ARG B 23 -3.781 -6.757 -7.572 1.00 0.00 C ATOM 1661 O ARG B 23 -4.993 -6.576 -7.448 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.646 -8.487 -6.152 1.00 0.00 C ATOM 1663 CG ARG B 23 -2.936 -9.925 -5.706 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.156 -11.074 -6.352 1.00 0.00 C ATOM 1665 NE ARG B 23 -3.103 -12.150 -6.695 1.00 0.00 N ATOM 1666 CZ ARG B 23 -4.102 -11.929 -7.534 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -3.908 -11.300 -8.663 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -5.315 -12.332 -7.241 1.00 0.00 N ATOM 0 H ARG B 23 -1.461 -8.658 -8.429 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.169 -8.848 -7.582 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.569 -8.333 -6.222 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -3.020 -7.787 -5.405 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -2.767 -9.976 -4.630 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.997 -10.113 -5.871 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -1.640 -10.725 -7.246 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -1.393 -11.445 -5.668 1.00 0.00 H new ATOM 0 HE ARG B 23 -2.987 -13.075 -6.281 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -2.975 -10.971 -8.909 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -4.690 -11.138 -9.298 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -5.492 -12.819 -6.362 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -6.081 -12.159 -7.892 1.00 0.00 H new ATOM 1682 N CYS B 24 -2.908 -5.782 -7.866 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.333 -4.404 -8.165 1.00 0.00 C ATOM 1684 C CYS B 24 -4.517 -4.409 -9.151 1.00 0.00 C ATOM 1685 O CYS B 24 -5.603 -3.905 -8.850 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.126 -3.634 -8.734 1.00 0.00 C ATOM 1687 SG CYS B 24 -2.706 -1.988 -9.240 1.00 0.00 S ATOM 0 H CYS B 24 -1.898 -5.922 -7.903 1.00 0.00 H new ATOM 0 HA CYS B 24 -3.675 -3.909 -7.256 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.340 -3.548 -7.984 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -1.699 -4.167 -9.584 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.325 -1.750 -10.460 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.331 -5.119 -10.269 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.321 -5.273 -11.333 1.00 0.00 C ATOM 1695 C ARG B 25 -6.627 -5.942 -10.901 1.00 0.00 C ATOM 1696 O ARG B 25 -7.688 -5.390 -11.165 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.682 -6.011 -12.510 1.00 0.00 C ATOM 1698 CG ARG B 25 -3.650 -5.142 -13.248 1.00 0.00 C ATOM 1699 CD ARG B 25 -4.232 -3.898 -13.946 1.00 0.00 C ATOM 1700 NE ARG B 25 -3.165 -2.980 -14.368 1.00 0.00 N ATOM 1701 CZ ARG B 25 -3.283 -1.697 -14.694 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -4.444 -1.068 -14.687 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -2.218 -1.012 -15.037 1.00 0.00 N ATOM 0 H ARG B 25 -3.461 -5.616 -10.461 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.619 -4.268 -11.630 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.198 -6.919 -12.148 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.460 -6.321 -13.208 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -2.892 -4.819 -12.535 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -3.145 -5.757 -13.994 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -4.817 -4.204 -14.813 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.913 -3.382 -13.269 1.00 0.00 H new ATOM 0 HE ARG B 25 -2.225 -3.373 -14.416 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -5.293 -1.568 -14.425 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -4.491 -0.082 -14.944 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -1.304 -1.464 -15.053 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -2.304 -0.027 -15.288 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.592 -7.097 -10.226 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.813 -7.694 -9.630 1.00 0.00 C ATOM 1719 C ILE B 26 -8.550 -6.664 -8.773 1.00 0.00 C ATOM 1720 O ILE B 26 -9.729 -6.426 -8.998 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.527 -8.941 -8.754 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.990 -10.157 -9.529 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.778 -9.357 -7.954 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.990 -11.091 -10.206 1.00 0.00 C ATOM 0 H ILE B 26 -5.742 -7.641 -10.075 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.426 -8.011 -10.474 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.732 -8.627 -8.078 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.311 -9.787 -10.297 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.395 -10.754 -8.838 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.548 -10.234 -7.349 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.083 -8.537 -7.304 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.588 -9.594 -8.643 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.454 -11.896 -10.709 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.659 -11.514 -9.456 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.573 -10.531 -10.938 1.00 0.00 H new ATOM 1736 N LEU B 27 -7.874 -6.090 -7.774 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.508 -5.260 -6.748 1.00 0.00 C ATOM 1738 C LEU B 27 -9.161 -4.010 -7.347 1.00 0.00 C ATOM 1739 O LEU B 27 -10.295 -3.708 -6.988 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.467 -4.885 -5.684 1.00 0.00 C ATOM 1741 CG LEU B 27 -6.882 -6.066 -4.884 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -5.643 -5.557 -4.160 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -7.837 -6.648 -3.836 1.00 0.00 C ATOM 0 H LEU B 27 -6.866 -6.189 -7.654 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.308 -5.836 -6.283 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.647 -4.358 -6.172 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -7.924 -4.185 -4.984 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.672 -6.866 -5.595 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.201 -6.368 -3.582 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -4.919 -5.194 -4.889 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -5.922 -4.744 -3.490 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -7.349 -7.474 -3.318 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.102 -5.874 -3.116 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -8.740 -7.011 -4.328 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.492 -3.334 -8.288 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.031 -2.145 -8.980 1.00 0.00 C ATOM 1757 C VAL B 28 -10.128 -2.497 -9.995 1.00 0.00 C ATOM 1758 O VAL B 28 -11.065 -1.726 -10.166 1.00 0.00 O ATOM 1759 CB VAL B 28 -7.912 -1.302 -9.645 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.331 -1.916 -10.929 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.372 0.130 -9.955 1.00 0.00 C ATOM 0 H VAL B 28 -7.555 -3.594 -8.597 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.494 -1.534 -8.205 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.120 -1.289 -8.896 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.556 -1.261 -11.327 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.901 -2.892 -10.703 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.124 -2.031 -11.668 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -7.555 0.682 -10.420 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -9.223 0.100 -10.636 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -8.665 0.626 -9.030 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.047 -3.669 -10.641 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.076 -4.141 -11.565 1.00 0.00 C ATOM 1773 C ALA B 29 -12.323 -4.646 -10.824 1.00 0.00 C ATOM 1774 O ALA B 29 -13.432 -4.511 -11.337 1.00 0.00 O ATOM 1775 CB ALA B 29 -10.465 -5.229 -12.458 1.00 0.00 C ATOM 0 H ALA B 29 -9.264 -4.313 -10.534 1.00 0.00 H new ATOM 0 HA ALA B 29 -11.414 -3.310 -12.184 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.219 -5.594 -13.155 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.626 -4.813 -13.016 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.115 -6.054 -11.838 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.183 -5.210 -9.615 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.319 -5.743 -8.871 1.00 0.00 C ATOM 1783 C LEU B 30 -14.345 -4.674 -8.529 1.00 0.00 C ATOM 1784 O LEU B 30 -15.539 -4.938 -8.661 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.790 -6.410 -7.604 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.734 -7.471 -7.030 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.356 -8.439 -8.051 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -12.852 -8.250 -6.072 1.00 0.00 C ATOM 0 H LEU B 30 -11.288 -5.306 -9.136 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.837 -6.469 -9.498 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.827 -6.872 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.613 -5.645 -6.848 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.600 -6.980 -6.586 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -15.005 -9.145 -7.534 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.940 -7.875 -8.778 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -13.564 -8.984 -8.565 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.436 -9.042 -5.602 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.019 -8.690 -6.620 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.467 -7.579 -5.304 1.00 0.00 H new ATOM 1800 N LEU B 31 -13.826 -3.503 -8.142 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.485 -2.218 -7.885 1.00 0.00 C ATOM 1802 C LEU B 31 -15.506 -1.799 -8.963 1.00 0.00 C ATOM 1803 O LEU B 31 -16.473 -1.128 -8.622 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.345 -1.170 -7.759 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.342 -0.332 -6.469 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.017 0.441 -6.389 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.532 0.632 -6.388 1.00 0.00 C ATOM 0 H LEU B 31 -12.821 -3.425 -7.984 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.082 -2.298 -6.977 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.390 -1.690 -7.834 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.406 -0.491 -8.610 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.440 -1.010 -5.621 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.000 1.040 -5.479 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.185 -0.263 -6.375 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -11.924 1.095 -7.256 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.479 1.198 -5.458 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.501 1.320 -7.233 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.462 0.065 -6.416 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.277 -2.195 -10.220 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.094 -1.890 -11.411 1.00 0.00 C ATOM 1821 C ASP B 32 -17.013 -3.068 -11.821 1.00 0.00 C ATOM 1822 O ASP B 32 -17.928 -2.901 -12.624 1.00 0.00 O ATOM 1823 CB ASP B 32 -15.101 -1.550 -12.543 1.00 0.00 C ATOM 1824 CG ASP B 32 -15.730 -0.875 -13.771 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -16.110 0.312 -13.646 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -15.750 -1.520 -14.846 1.00 0.00 O ATOM 0 H ASP B 32 -14.469 -2.772 -10.452 1.00 0.00 H new ATOM 0 HA ASP B 32 -16.766 -1.059 -11.198 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -14.326 -0.896 -12.143 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -14.609 -2.468 -12.863 1.00 0.00 H new ATOM 1831 N GLY B 33 -16.765 -4.270 -11.273 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.388 -5.531 -11.697 1.00 0.00 C ATOM 1833 C GLY B 33 -18.297 -6.199 -10.666 1.00 0.00 C ATOM 1834 O GLY B 33 -19.506 -6.271 -10.860 1.00 0.00 O ATOM 0 H GLY B 33 -16.108 -4.392 -10.503 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.970 -5.342 -12.599 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.599 -6.232 -11.967 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.706 -6.767 -9.606 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.337 -7.665 -8.594 1.00 0.00 C ATOM 1840 C VAL B 34 -19.479 -8.597 -9.082 1.00 0.00 C ATOM 1841 O VAL B 34 -20.410 -8.895 -8.338 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.743 -6.908 -7.311 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.549 -6.283 -6.594 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.784 -5.830 -7.617 1.00 0.00 C ATOM 0 H VAL B 34 -16.717 -6.611 -9.409 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.526 -8.357 -8.367 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.177 -7.651 -6.642 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -17.893 -5.764 -5.699 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.844 -7.065 -6.311 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.056 -5.573 -7.259 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.053 -5.312 -6.696 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.369 -5.115 -8.328 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.673 -6.294 -8.045 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.400 -9.091 -10.319 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.340 -10.035 -10.931 1.00 0.00 C ATOM 1856 C CYS B 35 -20.039 -11.486 -10.548 1.00 0.00 C ATOM 1857 O CYS B 35 -20.625 -11.989 -9.605 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.354 -9.793 -12.449 1.00 0.00 C ATOM 1859 SG CYS B 35 -21.205 -8.231 -12.793 1.00 0.00 S ATOM 0 H CYS B 35 -18.643 -8.832 -10.952 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.343 -9.857 -10.544 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.335 -9.758 -12.834 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.858 -10.616 -12.956 1.00 0.00 H new ATOM 0 HG CYS B 35 -20.663 -7.279 -12.093 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.117 -12.173 -11.238 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.891 -13.614 -11.034 1.00 0.00 C ATOM 1867 C TYR B 36 -17.429 -14.064 -10.830 1.00 0.00 C ATOM 1868 O TYR B 36 -16.526 -13.305 -11.166 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.604 -14.416 -12.151 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.652 -13.679 -12.973 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -21.948 -13.468 -12.460 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.313 -13.174 -14.246 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -22.908 -12.773 -13.222 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -21.267 -12.472 -15.008 1.00 0.00 C ATOM 1875 CZ TYR B 36 -22.572 -12.276 -14.502 1.00 0.00 C ATOM 1876 OH TYR B 36 -23.488 -11.595 -15.244 1.00 0.00 O ATOM 0 H TYR B 36 -18.513 -11.753 -11.945 1.00 0.00 H new ATOM 0 HA TYR B 36 -19.336 -13.839 -10.065 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -18.843 -14.794 -12.834 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.081 -15.283 -11.693 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -22.206 -13.840 -11.480 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -19.318 -13.326 -14.638 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -23.902 -12.620 -12.828 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -21.001 -12.083 -15.980 1.00 0.00 H new ATOM 0 HH TYR B 36 -23.085 -11.326 -16.096 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.129 -15.276 -10.312 1.00 0.00 N ATOM 1887 CA PRO B 37 -15.746 -15.733 -10.134 1.00 0.00 C ATOM 1888 C PRO B 37 -14.967 -15.733 -11.457 1.00 0.00 C ATOM 1889 O PRO B 37 -13.858 -15.208 -11.516 1.00 0.00 O ATOM 1890 CB PRO B 37 -15.841 -17.129 -9.503 1.00 0.00 C ATOM 1891 CG PRO B 37 -17.254 -17.598 -9.840 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.040 -16.290 -9.803 1.00 0.00 C ATOM 0 HA PRO B 37 -15.185 -15.058 -9.488 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.089 -17.803 -9.913 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -15.681 -17.091 -8.426 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -17.303 -18.076 -10.819 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -17.628 -18.320 -9.114 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -18.938 -16.354 -10.417 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.363 -16.054 -8.789 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.594 -16.188 -12.548 1.00 0.00 N ATOM 1901 CA GLY B 38 -15.007 -16.126 -13.889 1.00 0.00 C ATOM 1902 C GLY B 38 -14.947 -14.720 -14.496 1.00 0.00 C ATOM 1903 O GLY B 38 -14.440 -14.594 -15.605 1.00 0.00 O ATOM 0 H GLY B 38 -16.523 -16.609 -12.525 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.997 -16.533 -13.848 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.583 -16.770 -14.553 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.449 -13.680 -13.809 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.478 -12.307 -14.327 1.00 0.00 C ATOM 1909 C GLN B 39 -14.062 -11.760 -14.535 1.00 0.00 C ATOM 1910 O GLN B 39 -13.761 -11.302 -15.629 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.350 -11.366 -13.483 1.00 0.00 C ATOM 1912 CG GLN B 39 -15.586 -10.732 -12.319 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.453 -10.029 -11.345 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.997 -8.974 -11.595 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.675 -10.675 -10.240 1.00 0.00 N ATOM 0 H GLN B 39 -15.847 -13.772 -12.874 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.958 -12.351 -15.305 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -16.749 -10.578 -14.122 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.202 -11.922 -13.092 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -15.026 -11.509 -11.798 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -14.857 -10.026 -12.717 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -16.200 -11.560 -10.062 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -17.324 -10.297 -9.550 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.182 -11.838 -13.520 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.849 -11.237 -13.585 1.00 0.00 C ATOM 1926 C LEU B 40 -11.025 -11.959 -14.637 1.00 0.00 C ATOM 1927 O LEU B 40 -10.218 -11.345 -15.315 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.146 -11.244 -12.215 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.919 -10.469 -11.121 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.729 -11.132 -9.752 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.495 -8.992 -11.115 1.00 0.00 C ATOM 0 H LEU B 40 -13.378 -12.317 -12.641 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.953 -10.190 -13.869 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.010 -12.276 -11.891 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.152 -10.810 -12.323 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.985 -10.502 -11.346 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -12.280 -10.572 -8.997 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.102 -12.156 -9.789 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.670 -11.141 -9.496 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.046 -8.458 -10.341 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.426 -8.921 -10.914 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.711 -8.547 -12.086 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.321 -13.235 -14.864 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.732 -14.016 -15.943 1.00 0.00 C ATOM 1945 C ALA B 41 -11.298 -13.680 -17.349 1.00 0.00 C ATOM 1946 O ALA B 41 -11.303 -14.523 -18.247 1.00 0.00 O ATOM 1947 CB ALA B 41 -10.879 -15.488 -15.564 1.00 0.00 C ATOM 0 H ALA B 41 -11.985 -13.761 -14.296 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.678 -13.759 -16.045 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.449 -16.110 -16.349 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.358 -15.676 -14.625 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -11.935 -15.730 -15.447 1.00 0.00 H new ATOM 1953 N ALA B 42 -11.833 -12.471 -17.507 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.224 -11.808 -18.747 1.00 0.00 C ATOM 1955 C ALA B 42 -11.907 -10.307 -18.608 1.00 0.00 C ATOM 1956 O ALA B 42 -11.231 -9.744 -19.459 1.00 0.00 O ATOM 1957 CB ALA B 42 -13.709 -12.082 -19.022 1.00 0.00 C ATOM 0 H ALA B 42 -12.020 -11.879 -16.698 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.669 -12.192 -19.603 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.005 -11.588 -19.948 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -13.869 -13.156 -19.116 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.309 -11.697 -18.198 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.262 -9.704 -17.466 1.00 0.00 N ATOM 1964 CA HIS B 43 -11.890 -8.340 -17.046 1.00 0.00 C ATOM 1965 C HIS B 43 -10.364 -8.067 -17.085 1.00 0.00 C ATOM 1966 O HIS B 43 -9.934 -6.933 -17.282 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.424 -8.162 -15.608 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.025 -6.833 -15.247 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -13.417 -5.829 -16.127 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -13.376 -6.484 -13.974 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -13.993 -4.883 -15.363 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -13.978 -5.246 -14.070 1.00 0.00 N ATOM 0 H HIS B 43 -12.845 -10.174 -16.774 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.325 -7.626 -17.746 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -13.177 -8.930 -15.432 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.603 -8.357 -14.918 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.215 -7.060 -13.075 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -14.410 -3.960 -15.738 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -14.348 -4.700 -13.292 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.545 -9.108 -16.879 1.00 0.00 N ATOM 1981 CA LEU B 44 -8.077 -9.083 -16.959 1.00 0.00 C ATOM 1982 C LEU B 44 -7.530 -9.667 -18.268 1.00 0.00 C ATOM 1983 O LEU B 44 -6.362 -9.456 -18.575 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.493 -9.864 -15.756 1.00 0.00 C ATOM 1985 CG LEU B 44 -7.888 -9.301 -14.376 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.069 -9.880 -13.237 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.758 -7.771 -14.283 1.00 0.00 C ATOM 0 H LEU B 44 -9.904 -10.033 -16.641 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.770 -8.037 -16.934 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.821 -10.901 -15.819 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.406 -9.868 -15.835 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.933 -9.595 -14.276 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.397 -9.442 -12.294 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.206 -10.961 -13.203 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.015 -9.653 -13.395 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.051 -7.441 -13.286 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.724 -7.482 -14.472 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.406 -7.305 -15.025 1.00 0.00 H new ATOM 1999 N GLY B 45 -8.333 -10.451 -18.992 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.895 -11.238 -20.150 1.00 0.00 C ATOM 2001 C GLY B 45 -7.094 -12.495 -19.802 1.00 0.00 C ATOM 2002 O GLY B 45 -6.731 -13.244 -20.705 1.00 0.00 O ATOM 0 H GLY B 45 -9.326 -10.559 -18.786 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.773 -11.531 -20.726 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -7.287 -10.603 -20.795 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.814 -12.753 -18.518 1.00 0.00 N ATOM 2007 CA LEU B 46 -6.021 -13.910 -18.081 1.00 0.00 C ATOM 2008 C LEU B 46 -6.942 -15.096 -17.749 1.00 0.00 C ATOM 2009 O LEU B 46 -8.044 -14.895 -17.242 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.110 -13.504 -16.911 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.797 -12.818 -17.360 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.991 -11.463 -18.047 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.920 -12.572 -16.135 1.00 0.00 C ATOM 0 H LEU B 46 -7.132 -12.163 -17.750 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.371 -14.244 -18.890 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.657 -12.829 -16.253 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -4.866 -14.391 -16.326 1.00 0.00 H new ATOM 0 HG LEU B 46 -3.346 -13.496 -18.085 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -3.020 -11.055 -18.328 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.602 -11.592 -18.940 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.489 -10.776 -17.363 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.993 -12.089 -16.443 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.449 -11.928 -15.432 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.691 -13.523 -15.654 1.00 0.00 H new ATOM 2025 N THR B 47 -6.492 -16.327 -18.034 1.00 0.00 N ATOM 2026 CA THR B 47 -7.330 -17.544 -17.997 1.00 0.00 C ATOM 2027 C THR B 47 -7.962 -17.810 -16.628 1.00 0.00 C ATOM 2028 O THR B 47 -7.433 -17.396 -15.591 1.00 0.00 O ATOM 2029 CB THR B 47 -6.575 -18.778 -18.516 1.00 0.00 C ATOM 2030 OG1 THR B 47 -5.619 -19.188 -17.570 1.00 0.00 O ATOM 2031 CG2 THR B 47 -5.844 -18.535 -19.841 1.00 0.00 C ATOM 0 H THR B 47 -5.525 -16.512 -18.300 1.00 0.00 H new ATOM 0 HA THR B 47 -8.158 -17.347 -18.678 1.00 0.00 H new ATOM 0 HB THR B 47 -7.334 -19.542 -18.683 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.143 -19.976 -17.906 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.333 -19.448 -20.147 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.565 -18.248 -20.607 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.114 -17.736 -19.712 1.00 0.00 H new ATOM 2039 N ARG B 48 -9.076 -18.555 -16.596 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.767 -18.922 -15.341 1.00 0.00 C ATOM 2041 C ARG B 48 -8.844 -19.727 -14.409 1.00 0.00 C ATOM 2042 O ARG B 48 -8.830 -19.514 -13.196 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.086 -19.686 -15.606 1.00 0.00 C ATOM 2044 CG ARG B 48 -12.365 -18.817 -15.593 1.00 0.00 C ATOM 2045 CD ARG B 48 -12.984 -18.416 -16.947 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.132 -17.539 -17.770 1.00 0.00 N ATOM 2047 CZ ARG B 48 -11.301 -17.919 -18.726 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -11.115 -19.183 -19.038 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -10.601 -17.022 -19.373 1.00 0.00 N ATOM 0 H ARG B 48 -9.526 -18.922 -17.434 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.027 -17.990 -14.839 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -11.012 -20.181 -16.574 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.191 -20.469 -14.855 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -13.126 -19.352 -15.024 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -12.141 -17.902 -15.045 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -13.207 -19.321 -17.513 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -13.933 -17.912 -16.764 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.189 -16.538 -17.583 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -11.621 -19.912 -18.536 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -10.465 -19.434 -19.782 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -10.697 -16.034 -19.139 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -9.959 -17.311 -20.111 1.00 0.00 H new ATOM 2063 N SER B 49 -8.012 -20.599 -14.974 1.00 0.00 N ATOM 2064 CA SER B 49 -6.933 -21.283 -14.251 1.00 0.00 C ATOM 2065 C SER B 49 -5.881 -20.296 -13.722 1.00 0.00 C ATOM 2066 O SER B 49 -5.537 -20.342 -12.545 1.00 0.00 O ATOM 2067 CB SER B 49 -6.274 -22.321 -15.170 1.00 0.00 C ATOM 2068 OG SER B 49 -7.251 -23.219 -15.669 1.00 0.00 O ATOM 0 H SER B 49 -8.066 -20.856 -15.960 1.00 0.00 H new ATOM 0 HA SER B 49 -7.371 -21.783 -13.387 1.00 0.00 H new ATOM 0 HB2 SER B 49 -5.773 -21.819 -15.998 1.00 0.00 H new ATOM 0 HB3 SER B 49 -5.510 -22.871 -14.621 1.00 0.00 H new ATOM 0 HG SER B 49 -6.822 -23.876 -16.256 1.00 0.00 H new ATOM 2074 N ASN B 50 -5.408 -19.350 -14.543 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.432 -18.336 -14.124 1.00 0.00 C ATOM 2076 C ASN B 50 -4.982 -17.414 -13.012 1.00 0.00 C ATOM 2077 O ASN B 50 -4.343 -17.253 -11.970 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.991 -17.556 -15.375 1.00 0.00 C ATOM 2079 CG ASN B 50 -3.119 -16.354 -15.054 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -3.566 -15.417 -14.415 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.873 -16.328 -15.485 1.00 0.00 N ATOM 0 H ASN B 50 -5.692 -19.266 -15.519 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.566 -18.823 -13.677 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -3.445 -18.226 -16.039 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -4.875 -17.221 -15.917 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.281 -15.522 -15.284 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.502 -17.113 -16.019 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.176 -16.837 -13.184 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.767 -15.921 -12.193 1.00 0.00 C ATOM 2090 C VAL B 51 -7.145 -16.656 -10.889 1.00 0.00 C ATOM 2091 O VAL B 51 -7.206 -16.013 -9.846 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.928 -15.074 -12.802 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -8.934 -14.524 -11.786 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.364 -13.884 -13.607 1.00 0.00 C ATOM 0 H VAL B 51 -6.759 -16.988 -14.007 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.002 -15.198 -11.909 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.469 -15.776 -13.437 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.701 -13.950 -12.307 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -9.400 -15.351 -11.251 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -8.418 -13.878 -11.076 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.187 -13.304 -14.024 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -6.770 -13.249 -12.950 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -6.736 -14.257 -14.416 1.00 0.00 H new ATOM 2104 N SER B 52 -7.300 -17.988 -10.879 1.00 0.00 N ATOM 2105 CA SER B 52 -7.479 -18.728 -9.614 1.00 0.00 C ATOM 2106 C SER B 52 -6.200 -18.822 -8.768 1.00 0.00 C ATOM 2107 O SER B 52 -6.254 -18.519 -7.578 1.00 0.00 O ATOM 2108 CB SER B 52 -7.982 -20.147 -9.847 1.00 0.00 C ATOM 2109 OG SER B 52 -9.245 -20.150 -10.493 1.00 0.00 O ATOM 0 H SER B 52 -7.306 -18.570 -11.716 1.00 0.00 H new ATOM 0 HA SER B 52 -8.220 -18.144 -9.068 1.00 0.00 H new ATOM 0 HB2 SER B 52 -7.261 -20.695 -10.453 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.059 -20.669 -8.893 1.00 0.00 H new ATOM 0 HG SER B 52 -9.127 -19.944 -11.444 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.050 -19.169 -9.368 1.00 0.00 N ATOM 2116 CA ASN B 53 -3.725 -19.169 -8.707 1.00 0.00 C ATOM 2117 C ASN B 53 -3.468 -17.846 -7.982 1.00 0.00 C ATOM 2118 O ASN B 53 -3.138 -17.770 -6.802 1.00 0.00 O ATOM 2119 CB ASN B 53 -2.645 -19.376 -9.781 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.501 -20.831 -10.185 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.714 -21.570 -9.621 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -3.256 -21.296 -11.161 1.00 0.00 N ATOM 0 H ASN B 53 -5.009 -19.464 -10.344 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.698 -19.971 -7.969 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -2.892 -18.781 -10.660 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -1.689 -19.010 -9.406 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -3.181 -22.273 -11.443 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -3.915 -20.678 -11.634 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.756 -16.787 -8.717 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.803 -15.426 -8.248 1.00 0.00 C ATOM 2131 C HIS B 54 -4.829 -15.192 -7.113 1.00 0.00 C ATOM 2132 O HIS B 54 -4.463 -14.651 -6.060 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.065 -14.645 -9.547 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.864 -14.539 -10.458 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -2.873 -14.576 -11.834 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -1.561 -14.352 -10.080 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -1.619 -14.383 -12.269 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.792 -14.199 -11.237 1.00 0.00 N ATOM 0 H HIS B 54 -3.974 -16.865 -9.710 1.00 0.00 H new ATOM 0 HA HIS B 54 -2.890 -15.100 -7.750 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.878 -15.127 -10.090 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.404 -13.641 -9.292 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -3.693 -14.725 -12.422 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.192 -14.327 -9.065 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -1.320 -14.377 -13.307 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.115 -15.530 -7.281 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.152 -15.298 -6.256 1.00 0.00 C ATOM 2148 C LEU B 55 -6.957 -16.160 -5.013 1.00 0.00 C ATOM 2149 O LEU B 55 -7.548 -15.835 -3.988 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.566 -15.490 -6.829 1.00 0.00 C ATOM 2151 CG LEU B 55 -9.029 -14.315 -7.713 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.283 -14.734 -8.480 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -9.350 -13.073 -6.865 1.00 0.00 C ATOM 0 H LEU B 55 -6.469 -15.972 -8.129 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.042 -14.258 -5.947 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.592 -16.409 -7.415 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.270 -15.617 -6.007 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.223 -14.062 -8.402 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -10.618 -13.909 -9.108 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.055 -15.597 -9.106 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.071 -14.995 -7.774 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -9.674 -12.261 -7.517 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.145 -13.310 -6.159 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -8.459 -12.766 -6.318 1.00 0.00 H new ATOM 2165 N SER B 56 -6.129 -17.202 -5.062 1.00 0.00 N ATOM 2166 CA SER B 56 -5.711 -17.920 -3.859 1.00 0.00 C ATOM 2167 C SER B 56 -5.192 -16.952 -2.793 1.00 0.00 C ATOM 2168 O SER B 56 -5.718 -16.965 -1.681 1.00 0.00 O ATOM 2169 CB SER B 56 -4.649 -18.974 -4.190 1.00 0.00 C ATOM 2170 OG SER B 56 -4.508 -19.877 -3.107 1.00 0.00 O ATOM 0 H SER B 56 -5.732 -17.570 -5.927 1.00 0.00 H new ATOM 0 HA SER B 56 -6.586 -18.431 -3.457 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.932 -19.517 -5.092 1.00 0.00 H new ATOM 0 HB3 SER B 56 -3.695 -18.489 -4.396 1.00 0.00 H new ATOM 0 HG SER B 56 -3.829 -20.548 -3.327 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.258 -16.042 -3.115 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.627 -15.246 -2.060 1.00 0.00 C ATOM 2178 C CYS B 57 -4.456 -14.010 -1.666 1.00 0.00 C ATOM 2179 O CYS B 57 -4.299 -13.439 -0.589 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.198 -14.901 -2.482 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.102 -14.901 -1.017 1.00 0.00 S ATOM 0 H CYS B 57 -3.935 -15.846 -4.062 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.584 -15.843 -1.149 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.841 -15.625 -3.215 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.177 -13.923 -2.963 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.345 -13.579 -2.565 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.253 -12.464 -2.307 1.00 0.00 C ATOM 2188 C LEU B 58 -7.364 -12.854 -1.331 1.00 0.00 C ATOM 2189 O LEU B 58 -7.629 -12.128 -0.369 1.00 0.00 O ATOM 2190 CB LEU B 58 -6.786 -11.938 -3.655 1.00 0.00 C ATOM 2191 CG LEU B 58 -6.805 -10.400 -3.737 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.411 -9.828 -3.475 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.307 -10.029 -5.131 1.00 0.00 C ATOM 0 H LEU B 58 -5.454 -13.994 -3.490 1.00 0.00 H new ATOM 0 HA LEU B 58 -5.715 -11.655 -1.814 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.168 -12.332 -4.462 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.796 -12.317 -3.813 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.463 -9.978 -2.977 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.446 -8.740 -3.538 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.077 -10.124 -2.480 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -4.714 -10.212 -4.220 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.336 -8.944 -5.231 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -6.635 -10.445 -5.882 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.309 -10.433 -5.276 1.00 0.00 H new ATOM 2205 N ARG B 59 -7.983 -14.015 -1.585 1.00 0.00 N ATOM 2206 CA ARG B 59 -8.994 -14.608 -0.707 1.00 0.00 C ATOM 2207 C ARG B 59 -8.352 -15.165 0.571 1.00 0.00 C ATOM 2208 O ARG B 59 -9.009 -15.194 1.607 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.789 -15.692 -1.461 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.504 -15.189 -2.740 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.403 -16.257 -3.368 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.683 -17.505 -3.702 1.00 0.00 N ATOM 2213 CZ ARG B 59 -11.080 -18.742 -3.402 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -12.170 -18.978 -2.691 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -10.387 -19.779 -3.823 1.00 0.00 N ATOM 0 H ARG B 59 -7.791 -14.573 -2.417 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.693 -13.828 -0.405 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -9.110 -16.500 -1.733 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.533 -16.115 -0.786 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.103 -14.312 -2.496 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.758 -14.873 -3.469 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.216 -16.488 -2.680 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.856 -15.854 -4.274 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.802 -17.411 -4.208 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.737 -18.200 -2.353 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -12.444 -19.938 -2.480 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -9.544 -19.637 -4.380 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.693 -20.724 -3.592 1.00 0.00 H new ATOM 2229 N GLY B 60 -7.069 -15.549 0.527 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.320 -16.021 1.695 1.00 0.00 C ATOM 2231 C GLY B 60 -5.883 -14.901 2.640 1.00 0.00 C ATOM 2232 O GLY B 60 -6.056 -15.033 3.849 1.00 0.00 O ATOM 0 H GLY B 60 -6.518 -15.540 -0.331 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.936 -16.731 2.248 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -5.437 -16.562 1.355 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.324 -13.800 2.130 1.00 0.00 N ATOM 2237 CA CYS B 61 -4.884 -12.707 2.985 1.00 0.00 C ATOM 2238 C CYS B 61 -6.044 -11.832 3.528 1.00 0.00 C ATOM 2239 O CYS B 61 -5.833 -11.102 4.503 1.00 0.00 O ATOM 2240 CB CYS B 61 -3.751 -11.970 2.267 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.202 -12.935 2.359 1.00 0.00 S ATOM 0 H CYS B 61 -5.168 -13.647 1.134 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.475 -13.096 3.917 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.021 -11.803 1.224 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -3.603 -10.989 2.719 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.235 -11.951 2.917 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.502 -11.392 3.411 1.00 0.00 C ATOM 2248 C GLY B 62 -9.040 -10.190 2.637 1.00 0.00 C ATOM 2249 O GLY B 62 -9.968 -9.552 3.117 1.00 0.00 O ATOM 0 H GLY B 62 -7.344 -12.456 2.037 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.256 -12.179 3.395 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.368 -11.100 4.453 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.470 -9.829 1.477 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.769 -8.571 0.782 1.00 0.00 C ATOM 2255 C LEU B 63 -9.998 -8.625 -0.132 1.00 0.00 C ATOM 2256 O LEU B 63 -10.520 -7.599 -0.566 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.553 -8.231 -0.063 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.174 -8.549 0.553 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.228 -7.747 -0.291 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -5.965 -8.140 2.026 1.00 0.00 C ATOM 0 H LEU B 63 -7.784 -10.408 0.993 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.995 -7.823 1.542 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.635 -8.766 -1.009 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.586 -7.166 -0.295 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.037 -9.630 0.561 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.208 -7.899 0.061 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.305 -8.069 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.483 -6.690 -0.219 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -4.959 -8.417 2.341 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.093 -7.062 2.126 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.695 -8.652 2.653 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.411 -9.840 -0.459 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.587 -10.172 -1.272 1.00 0.00 C ATOM 2274 C VAL B 64 -12.443 -11.213 -0.568 1.00 0.00 C ATOM 2275 O VAL B 64 -11.918 -12.129 0.064 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.226 -10.696 -2.681 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -10.886 -9.542 -3.625 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.074 -11.680 -2.668 1.00 0.00 C ATOM 0 H VAL B 64 -9.911 -10.673 -0.150 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.138 -9.240 -1.395 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.112 -11.221 -3.039 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.636 -9.939 -4.609 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.745 -8.876 -3.710 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.035 -8.988 -3.230 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -9.868 -12.012 -3.685 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.188 -11.197 -2.257 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.337 -12.540 -2.052 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.759 -11.065 -0.713 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.768 -11.917 -0.058 1.00 0.00 C ATOM 2290 C VAL B 65 -15.799 -12.394 -1.086 1.00 0.00 C ATOM 2291 O VAL B 65 -16.185 -11.642 -1.980 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.440 -11.180 1.135 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.559 -12.021 1.772 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.404 -10.863 2.231 1.00 0.00 C ATOM 0 H VAL B 65 -14.168 -10.337 -1.299 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.270 -12.794 0.354 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.865 -10.261 0.731 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.002 -11.469 2.601 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.325 -12.232 1.026 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.144 -12.959 2.141 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.894 -10.347 3.057 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.962 -11.791 2.594 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.622 -10.226 1.819 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.231 -13.653 -0.957 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.307 -14.246 -1.753 1.00 0.00 C ATOM 2306 C ALA B 66 -18.696 -13.959 -1.156 1.00 0.00 C ATOM 2307 O ALA B 66 -18.889 -14.099 0.050 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.054 -15.754 -1.882 1.00 0.00 C ATOM 0 H ALA B 66 -15.831 -14.302 -0.279 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.304 -13.789 -2.743 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.850 -16.207 -2.473 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.096 -15.921 -2.374 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.037 -16.206 -0.890 1.00 0.00 H new ATOM 2314 N THR B 67 -19.672 -13.608 -2.007 1.00 0.00 N ATOM 2315 CA THR B 67 -21.089 -13.460 -1.625 1.00 0.00 C ATOM 2316 C THR B 67 -21.966 -13.971 -2.738 1.00 0.00 C ATOM 2317 O THR B 67 -21.528 -14.095 -3.872 1.00 0.00 O ATOM 2318 CB THR B 67 -21.520 -12.019 -1.246 1.00 0.00 C ATOM 2319 OG1 THR B 67 -22.207 -11.325 -2.266 1.00 0.00 O ATOM 2320 CG2 THR B 67 -20.385 -11.092 -0.824 1.00 0.00 C ATOM 0 H THR B 67 -19.499 -13.416 -2.994 1.00 0.00 H new ATOM 0 HA THR B 67 -21.210 -14.050 -0.717 1.00 0.00 H new ATOM 0 HB THR B 67 -22.176 -12.228 -0.401 1.00 0.00 H new ATOM 0 HG1 THR B 67 -23.128 -11.655 -2.323 1.00 0.00 H new ATOM 0 HG21 THR B 67 -20.789 -10.110 -0.580 1.00 0.00 H new ATOM 0 HG22 THR B 67 -19.883 -11.506 0.051 1.00 0.00 H new ATOM 0 HG23 THR B 67 -19.670 -10.997 -1.641 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.239 -14.165 -2.432 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.263 -14.357 -3.450 1.00 0.00 C ATOM 2330 C TYR B 68 -24.589 -12.966 -4.043 1.00 0.00 C ATOM 2331 O TYR B 68 -24.798 -12.024 -3.271 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.460 -15.026 -2.756 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.573 -15.512 -3.657 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -26.347 -16.585 -4.541 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.857 -14.947 -3.554 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -27.395 -17.079 -5.338 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -28.913 -15.448 -4.334 1.00 0.00 C ATOM 2338 CZ TYR B 68 -28.685 -16.512 -5.237 1.00 0.00 C ATOM 2339 OH TYR B 68 -29.690 -16.971 -6.028 1.00 0.00 O ATOM 0 H TYR B 68 -23.592 -14.194 -1.475 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.955 -14.998 -4.276 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.091 -15.875 -2.181 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -25.882 -14.317 -2.043 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.365 -17.030 -4.607 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -28.032 -14.126 -2.874 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -27.214 -17.891 -6.027 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -29.900 -15.020 -4.244 1.00 0.00 H new ATOM 0 HH TYR B 68 -30.184 -16.212 -6.403 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.543 -12.791 -5.369 1.00 0.00 N ATOM 2350 CA GLU B 69 -24.984 -11.553 -6.043 1.00 0.00 C ATOM 2351 C GLU B 69 -26.519 -11.396 -6.118 1.00 0.00 C ATOM 2352 O GLU B 69 -26.998 -10.266 -6.176 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.250 -11.300 -7.390 1.00 0.00 C ATOM 2354 CG GLU B 69 -23.977 -12.397 -8.427 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.182 -12.773 -9.270 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.221 -13.049 -8.651 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -25.058 -12.954 -10.499 1.00 0.00 O ATOM 0 H GLU B 69 -24.198 -13.504 -6.012 1.00 0.00 H new ATOM 0 HA GLU B 69 -24.667 -10.738 -5.392 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -24.816 -10.524 -7.906 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.281 -10.871 -7.135 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.176 -12.065 -9.087 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -23.617 -13.287 -7.911 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.282 -12.493 -5.997 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.755 -12.534 -6.086 1.00 0.00 C ATOM 2366 C GLY B 70 -29.298 -13.687 -6.945 1.00 0.00 C ATOM 2367 O GLY B 70 -30.446 -14.099 -6.787 1.00 0.00 O ATOM 0 H GLY B 70 -26.877 -13.414 -5.828 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.167 -12.618 -5.080 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.110 -11.589 -6.498 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.445 -14.242 -7.804 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.662 -15.333 -8.763 1.00 0.00 C ATOM 2373 C ARG B 71 -27.426 -16.253 -8.867 1.00 0.00 C ATOM 2374 O ARG B 71 -27.551 -17.420 -9.243 1.00 0.00 O ATOM 2375 CB ARG B 71 -29.001 -14.667 -10.113 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.567 -15.596 -11.203 1.00 0.00 C ATOM 2377 CD ARG B 71 -28.509 -16.158 -12.163 1.00 0.00 C ATOM 2378 NE ARG B 71 -29.144 -16.926 -13.248 1.00 0.00 N ATOM 2379 CZ ARG B 71 -28.531 -17.576 -14.233 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -27.224 -17.646 -14.360 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -29.257 -18.193 -15.138 1.00 0.00 N ATOM 0 H ARG B 71 -27.483 -13.906 -7.853 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.477 -15.980 -8.439 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.723 -13.871 -9.931 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.098 -14.195 -10.499 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -30.084 -16.427 -10.724 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -30.311 -15.048 -11.781 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -27.923 -15.341 -12.584 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -27.817 -16.798 -11.615 1.00 0.00 H new ATOM 0 HE ARG B 71 -30.163 -16.963 -13.243 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -26.620 -17.185 -13.679 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -26.814 -18.161 -15.139 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -30.275 -18.169 -15.078 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -28.803 -18.696 -15.900 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.221 -15.768 -8.570 1.00 0.00 N ATOM 2396 CA GLN B 72 -24.931 -16.461 -8.660 1.00 0.00 C ATOM 2397 C GLN B 72 -24.050 -16.133 -7.446 1.00 0.00 C ATOM 2398 O GLN B 72 -24.425 -15.339 -6.589 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.161 -15.997 -9.920 1.00 0.00 C ATOM 2400 CG GLN B 72 -24.904 -16.023 -11.266 1.00 0.00 C ATOM 2401 CD GLN B 72 -25.107 -17.415 -11.859 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -24.762 -17.682 -12.994 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -25.743 -18.353 -11.192 1.00 0.00 N ATOM 0 H GLN B 72 -26.110 -14.811 -8.236 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.139 -17.530 -8.701 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -23.819 -14.977 -9.746 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.271 -16.619 -10.017 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -25.879 -15.553 -11.136 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -24.351 -15.416 -11.982 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -26.053 -18.178 -10.236 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -25.926 -19.256 -11.630 1.00 0.00 H new ATOM 2412 N VAL B 73 -22.847 -16.714 -7.400 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.775 -16.312 -6.475 1.00 0.00 C ATOM 2414 C VAL B 73 -20.900 -15.247 -7.160 1.00 0.00 C ATOM 2415 O VAL B 73 -20.662 -15.327 -8.368 1.00 0.00 O ATOM 2416 CB VAL B 73 -20.950 -17.529 -5.988 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -20.190 -18.245 -7.118 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -19.967 -17.160 -4.862 1.00 0.00 C ATOM 0 H VAL B 73 -22.584 -17.487 -8.011 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.216 -15.878 -5.577 1.00 0.00 H new ATOM 0 HB VAL B 73 -21.693 -18.223 -5.595 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -19.634 -19.087 -6.706 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -20.900 -18.608 -7.861 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -19.497 -17.548 -7.589 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -19.414 -18.048 -4.557 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -19.270 -16.403 -5.221 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -20.521 -16.767 -4.010 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.393 -14.287 -6.382 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.483 -13.224 -6.802 1.00 0.00 C ATOM 2430 C ARG B 74 -18.279 -13.174 -5.880 1.00 0.00 C ATOM 2431 O ARG B 74 -18.302 -13.692 -4.767 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.175 -11.844 -6.759 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.299 -11.152 -5.391 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.028 -9.817 -5.516 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.651 -9.416 -4.256 1.00 0.00 N ATOM 2436 CZ ARG B 74 -22.438 -8.370 -4.067 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -22.510 -7.386 -4.943 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -23.173 -8.331 -2.978 1.00 0.00 N ATOM 0 H ARG B 74 -20.620 -14.230 -5.389 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.176 -13.444 -7.824 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.632 -11.175 -7.426 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.178 -11.958 -7.170 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -20.837 -11.800 -4.699 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.307 -10.990 -4.970 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.324 -9.048 -5.834 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.791 -9.891 -6.291 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.460 -10.001 -3.442 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.949 -7.419 -5.794 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -23.127 -6.592 -4.769 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -23.127 -9.095 -2.304 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -23.789 -7.536 -2.807 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.246 -12.484 -6.342 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.158 -12.002 -5.498 1.00 0.00 C ATOM 2454 C TYR B 75 -16.342 -10.478 -5.398 1.00 0.00 C ATOM 2455 O TYR B 75 -16.871 -9.853 -6.317 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.789 -12.398 -6.075 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.502 -13.894 -6.149 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.939 -14.782 -5.141 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -13.776 -14.403 -7.243 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.680 -16.165 -5.241 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -13.514 -15.782 -7.347 1.00 0.00 C ATOM 2462 CZ TYR B 75 -13.961 -16.668 -6.345 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.718 -18.001 -6.471 1.00 0.00 O ATOM 0 H TYR B 75 -17.137 -12.239 -7.326 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.186 -12.452 -4.506 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.706 -11.982 -7.079 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.013 -11.929 -5.471 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -15.476 -14.399 -4.286 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.418 -13.730 -8.008 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -15.032 -16.838 -4.473 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -12.968 -16.163 -8.198 1.00 0.00 H new ATOM 0 HH TYR B 75 -13.211 -18.165 -7.293 1.00 0.00 H new ATOM 2473 N ALA B 76 -15.945 -9.880 -4.286 1.00 0.00 N ATOM 2474 CA ALA B 76 -15.981 -8.441 -4.045 1.00 0.00 C ATOM 2475 C ALA B 76 -14.790 -8.065 -3.161 1.00 0.00 C ATOM 2476 O ALA B 76 -14.259 -8.951 -2.489 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.325 -8.092 -3.388 1.00 0.00 C ATOM 0 H ALA B 76 -15.573 -10.403 -3.493 1.00 0.00 H new ATOM 0 HA ALA B 76 -15.902 -7.875 -4.973 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.370 -7.019 -3.200 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.140 -8.379 -4.052 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.419 -8.630 -2.445 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.349 -6.799 -3.155 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.394 -6.339 -2.141 1.00 0.00 C ATOM 2485 C LEU B 77 -14.006 -6.530 -0.741 1.00 0.00 C ATOM 2486 O LEU B 77 -15.230 -6.518 -0.593 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.010 -4.875 -2.410 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.084 -4.674 -3.613 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -12.087 -3.187 -3.953 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -10.664 -5.135 -3.304 1.00 0.00 C ATOM 0 H LEU B 77 -14.633 -6.088 -3.829 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.479 -6.929 -2.190 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.920 -4.296 -2.567 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -12.525 -4.470 -1.522 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.441 -5.269 -4.454 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -11.435 -3.008 -4.808 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -13.101 -2.872 -4.197 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.726 -2.617 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.032 -4.979 -4.178 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.270 -4.562 -2.465 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -10.673 -6.194 -3.048 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.161 -6.705 0.277 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.590 -7.141 1.615 1.00 0.00 C ATOM 2504 C ALA B 78 -14.559 -6.176 2.314 1.00 0.00 C ATOM 2505 O ALA B 78 -15.501 -6.603 2.981 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.338 -7.380 2.459 1.00 0.00 C ATOM 0 H ALA B 78 -12.156 -6.549 0.200 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.164 -8.060 1.498 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.629 -7.705 3.458 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.725 -8.151 1.991 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.766 -6.455 2.531 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.367 -4.879 2.086 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.170 -3.798 2.645 1.00 0.00 C ATOM 2514 C ASP B 79 -15.006 -2.520 1.802 1.00 0.00 C ATOM 2515 O ASP B 79 -14.102 -2.370 0.970 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.805 -3.577 4.139 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.550 -2.402 4.798 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.798 -2.336 4.654 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.875 -1.464 5.278 1.00 0.00 O ATOM 0 H ASP B 79 -13.618 -4.540 1.483 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.225 -4.071 2.609 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.023 -4.489 4.694 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.732 -3.404 4.218 1.00 0.00 H new ATOM 2524 N SER B 80 -15.892 -1.567 2.078 1.00 0.00 N ATOM 2525 CA SER B 80 -15.819 -0.191 1.628 1.00 0.00 C ATOM 2526 C SER B 80 -14.440 0.395 1.932 1.00 0.00 C ATOM 2527 O SER B 80 -13.963 1.191 1.140 1.00 0.00 O ATOM 2528 CB SER B 80 -16.906 0.633 2.345 1.00 0.00 C ATOM 2529 OG SER B 80 -18.192 0.029 2.250 1.00 0.00 O ATOM 0 H SER B 80 -16.718 -1.748 2.649 1.00 0.00 H new ATOM 0 HA SER B 80 -15.981 -0.156 0.551 1.00 0.00 H new ATOM 0 HB2 SER B 80 -16.638 0.748 3.395 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.944 1.633 1.914 1.00 0.00 H new ATOM 0 HG SER B 80 -18.849 0.584 2.719 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.762 -0.046 3.002 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.379 0.290 3.315 1.00 0.00 C ATOM 2537 C HIS B 81 -11.425 0.165 2.118 1.00 0.00 C ATOM 2538 O HIS B 81 -10.899 1.200 1.700 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.935 -0.517 4.558 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.165 0.202 5.872 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.633 1.492 6.035 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -11.628 -0.176 7.069 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -12.307 1.911 7.269 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -11.756 0.886 7.946 1.00 0.00 N ATOM 0 H HIS B 81 -14.183 -0.668 3.693 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.327 1.351 3.558 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.473 -1.465 4.575 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.875 -0.754 4.466 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -13.140 2.035 5.336 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -11.182 -1.134 7.292 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.462 2.908 7.655 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.173 -1.026 1.555 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.213 -1.132 0.439 1.00 0.00 C ATOM 2555 C LEU B 82 -10.749 -0.436 -0.815 1.00 0.00 C ATOM 2556 O LEU B 82 -10.008 0.304 -1.451 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.748 -2.574 0.138 1.00 0.00 C ATOM 2558 CG LEU B 82 -9.450 -3.472 1.356 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.937 -4.827 0.860 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.422 -2.865 2.317 1.00 0.00 C ATOM 0 H LEU B 82 -11.604 -1.906 1.840 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.315 -0.610 0.770 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.515 -3.061 -0.464 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.848 -2.521 -0.474 1.00 0.00 H new ATOM 0 HG LEU B 82 -10.381 -3.579 1.913 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.723 -5.470 1.714 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.696 -5.296 0.234 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -8.026 -4.681 0.279 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -8.258 -3.546 3.152 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.482 -2.704 1.790 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.794 -1.913 2.694 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.043 -0.583 -1.123 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.689 0.070 -2.269 1.00 0.00 C ATOM 2574 C ALA B 83 -12.650 1.615 -2.216 1.00 0.00 C ATOM 2575 O ALA B 83 -12.724 2.266 -3.257 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.129 -0.456 -2.348 1.00 0.00 C ATOM 0 H ALA B 83 -12.679 -1.165 -0.578 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.130 -0.180 -3.171 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.641 0.009 -3.191 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.114 -1.537 -2.484 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.656 -0.214 -1.425 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.522 2.197 -1.016 1.00 0.00 N ATOM 2583 CA ARG B 84 -12.419 3.637 -0.790 1.00 0.00 C ATOM 2584 C ARG B 84 -10.993 4.127 -1.060 1.00 0.00 C ATOM 2585 O ARG B 84 -10.792 4.774 -2.079 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.975 3.978 0.610 1.00 0.00 C ATOM 2587 CG ARG B 84 -13.188 5.451 0.971 1.00 0.00 C ATOM 2588 CD ARG B 84 -14.245 6.161 0.109 1.00 0.00 C ATOM 2589 NE ARG B 84 -13.713 6.543 -1.203 1.00 0.00 N ATOM 2590 CZ ARG B 84 -14.074 6.225 -2.439 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -15.079 5.418 -2.714 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -13.357 6.725 -3.415 1.00 0.00 N ATOM 0 H ARG B 84 -12.487 1.658 -0.151 1.00 0.00 H new ATOM 0 HA ARG B 84 -13.037 4.186 -1.501 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.932 3.468 0.720 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -12.298 3.550 1.349 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -13.483 5.519 2.018 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -12.240 5.979 0.873 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -15.105 5.505 -0.025 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -14.601 7.050 0.630 1.00 0.00 H new ATOM 0 HE ARG B 84 -12.913 7.174 -1.156 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -15.623 5.004 -1.957 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -15.313 5.207 -3.684 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -12.562 7.329 -3.206 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -13.594 6.510 -4.384 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.996 3.689 -0.281 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.602 4.127 -0.459 1.00 0.00 C ATOM 2608 C ALA B 85 -7.989 3.740 -1.820 1.00 0.00 C ATOM 2609 O ALA B 85 -7.210 4.506 -2.387 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.759 3.576 0.695 1.00 0.00 C ATOM 0 H ALA B 85 -10.128 3.027 0.484 1.00 0.00 H new ATOM 0 HA ALA B 85 -8.603 5.217 -0.449 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.724 3.894 0.574 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -8.146 3.954 1.641 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.806 2.487 0.693 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.350 2.573 -2.375 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.996 2.222 -3.756 1.00 0.00 C ATOM 2618 C LEU B 86 -8.711 3.184 -4.731 1.00 0.00 C ATOM 2619 O LEU B 86 -8.088 3.686 -5.663 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.319 0.726 -4.005 1.00 0.00 C ATOM 2621 CG LEU B 86 -7.448 0.025 -5.063 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.963 -1.406 -5.253 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -7.392 0.726 -6.423 1.00 0.00 C ATOM 0 H LEU B 86 -8.887 1.857 -1.887 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.927 2.343 -3.931 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.217 0.189 -3.062 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.363 0.644 -4.307 1.00 0.00 H new ATOM 0 HG LEU B 86 -6.428 0.049 -4.680 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.355 -1.915 -6.001 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -7.901 -1.944 -4.307 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -9.000 -1.378 -5.587 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -6.755 0.157 -7.100 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -8.397 0.792 -6.840 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -6.985 1.729 -6.299 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.985 3.498 -4.465 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.880 4.308 -5.297 1.00 0.00 C ATOM 2637 C GLY B 87 -10.493 5.785 -5.454 1.00 0.00 C ATOM 2638 O GLY B 87 -10.608 6.290 -6.567 1.00 0.00 O ATOM 0 H GLY B 87 -10.444 3.174 -3.614 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.930 3.858 -6.288 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.883 4.258 -4.873 1.00 0.00 H new ATOM 2642 N GLU B 88 -10.018 6.488 -4.412 1.00 0.00 N ATOM 2643 CA GLU B 88 -9.434 7.845 -4.601 1.00 0.00 C ATOM 2644 C GLU B 88 -8.070 7.816 -5.312 1.00 0.00 C ATOM 2645 O GLU B 88 -7.597 8.860 -5.761 1.00 0.00 O ATOM 2646 CB GLU B 88 -9.293 8.686 -3.305 1.00 0.00 C ATOM 2647 CG GLU B 88 -9.076 7.943 -1.974 1.00 0.00 C ATOM 2648 CD GLU B 88 -10.391 7.590 -1.282 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -11.464 7.847 -1.879 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -10.354 7.005 -0.180 1.00 0.00 O ATOM 0 H GLU B 88 -10.022 6.157 -3.447 1.00 0.00 H new ATOM 0 HA GLU B 88 -10.174 8.335 -5.233 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -8.457 9.372 -3.443 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -10.192 9.294 -3.204 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -8.510 7.030 -2.159 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -8.474 8.563 -1.309 1.00 0.00 H new ATOM 2657 N LEU B 89 -7.442 6.634 -5.384 1.00 0.00 N ATOM 2658 CA LEU B 89 -6.070 6.379 -5.812 1.00 0.00 C ATOM 2659 C LEU B 89 -5.086 6.970 -4.789 1.00 0.00 C ATOM 2660 O LEU B 89 -4.853 8.178 -4.734 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.838 6.849 -7.269 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.381 6.837 -7.758 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -3.750 5.437 -7.724 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -4.335 7.411 -9.181 1.00 0.00 C ATOM 0 H LEU B 89 -7.920 5.771 -5.124 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.883 5.305 -5.834 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.428 6.216 -7.932 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -6.225 7.863 -7.368 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.792 7.452 -7.077 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -2.721 5.493 -8.081 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -3.760 5.058 -6.702 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -4.320 4.765 -8.365 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.306 7.409 -9.541 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.952 6.800 -9.840 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -4.714 8.433 -9.174 1.00 0.00 H new ATOM 2676 N VAL B 90 -4.388 6.071 -4.089 1.00 0.00 N ATOM 2677 CA VAL B 90 -3.298 6.314 -3.112 1.00 0.00 C ATOM 2678 C VAL B 90 -2.053 7.013 -3.680 1.00 0.00 C ATOM 2679 O VAL B 90 -0.930 6.780 -3.238 1.00 0.00 O ATOM 2680 CB VAL B 90 -2.845 5.018 -2.399 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -3.998 4.298 -1.689 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -2.157 4.047 -3.374 1.00 0.00 C ATOM 0 H VAL B 90 -4.577 5.074 -4.191 1.00 0.00 H new ATOM 0 HA VAL B 90 -3.760 6.999 -2.401 1.00 0.00 H new ATOM 0 HB VAL B 90 -2.128 5.333 -1.641 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -3.622 3.396 -1.206 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -4.431 4.958 -0.937 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -4.762 4.028 -2.418 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.852 3.148 -2.838 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -2.852 3.777 -4.170 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -1.279 4.527 -3.806 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.197 7.829 -4.721 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.269 8.900 -5.051 1.00 0.00 C ATOM 2694 C GLN B 91 -0.036 8.411 -5.824 1.00 0.00 C ATOM 2695 O GLN B 91 0.597 9.203 -6.506 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.966 9.690 -3.768 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.201 10.433 -3.215 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.783 11.474 -4.166 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.359 12.618 -4.181 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.692 11.135 -5.058 1.00 0.00 N ATOM 0 H GLN B 91 -2.980 7.760 -5.371 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.730 9.587 -5.761 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.588 9.007 -3.007 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.174 10.411 -3.970 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.974 9.702 -2.977 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.928 10.923 -2.281 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.065 10.186 -5.070 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.022 11.822 -5.736 1.00 0.00 H new ATOM 2709 N VAL B 92 0.205 7.100 -5.829 1.00 0.00 N ATOM 2710 CA VAL B 92 1.125 6.248 -6.617 1.00 0.00 C ATOM 2711 C VAL B 92 0.974 6.342 -8.152 1.00 0.00 C ATOM 2712 O VAL B 92 1.183 5.377 -8.878 1.00 0.00 O ATOM 2713 CB VAL B 92 0.970 4.808 -6.055 1.00 0.00 C ATOM 2714 CG1 VAL B 92 -0.420 4.237 -6.383 1.00 0.00 C ATOM 2715 CG2 VAL B 92 2.044 3.770 -6.416 1.00 0.00 C ATOM 0 H VAL B 92 -0.320 6.512 -5.181 1.00 0.00 H new ATOM 0 HA VAL B 92 2.145 6.610 -6.493 1.00 0.00 H new ATOM 0 HB VAL B 92 1.109 4.966 -4.985 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -0.504 3.228 -5.979 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -1.188 4.871 -5.939 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.555 4.207 -7.464 1.00 0.00 H new ATOM 0 HG21 VAL B 92 1.798 2.815 -5.951 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.082 3.647 -7.498 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.015 4.110 -6.055 1.00 0.00 H new ATOM 2725 N VAL B 93 0.584 7.525 -8.629 1.00 0.00 N ATOM 2726 CA VAL B 93 0.594 7.990 -10.024 1.00 0.00 C ATOM 2727 C VAL B 93 -0.206 7.078 -10.981 1.00 0.00 C ATOM 2728 O VAL B 93 0.079 7.027 -12.171 1.00 0.00 O ATOM 2729 CB VAL B 93 2.055 8.280 -10.492 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.089 9.296 -11.644 1.00 0.00 C ATOM 2731 CG2 VAL B 93 2.905 8.937 -9.376 1.00 0.00 C ATOM 0 H VAL B 93 0.223 8.244 -8.002 1.00 0.00 H new ATOM 0 HA VAL B 93 0.054 8.936 -10.063 1.00 0.00 H new ATOM 0 HB VAL B 93 2.450 7.307 -10.784 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.122 9.473 -11.943 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.528 8.903 -12.492 1.00 0.00 H new ATOM 0 HG13 VAL B 93 1.641 10.234 -11.315 1.00 0.00 H new ATOM 0 HG21 VAL B 93 3.913 9.120 -9.747 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.450 9.882 -9.081 1.00 0.00 H new ATOM 0 HG23 VAL B 93 2.951 8.271 -8.514 1.00 0.00 H new ATOM 2741 N LEU B 94 -1.206 6.364 -10.430 1.00 0.00 N ATOM 2742 CA LEU B 94 -1.952 5.252 -11.037 1.00 0.00 C ATOM 2743 C LEU B 94 -1.050 4.028 -10.869 1.00 0.00 C ATOM 2744 O LEU B 94 -0.011 3.913 -11.502 1.00 0.00 O ATOM 2745 CB LEU B 94 -2.383 5.515 -12.501 1.00 0.00 C ATOM 2746 CG LEU B 94 -3.545 4.633 -13.009 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -3.987 5.128 -14.394 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -3.188 3.140 -13.104 1.00 0.00 C ATOM 0 H LEU B 94 -1.534 6.565 -9.485 1.00 0.00 H new ATOM 0 HA LEU B 94 -2.912 5.104 -10.542 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -2.673 6.561 -12.596 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -1.521 5.363 -13.150 1.00 0.00 H new ATOM 0 HG LEU B 94 -4.348 4.722 -12.277 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -4.807 4.509 -14.757 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -4.319 6.164 -14.321 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -3.149 5.064 -15.088 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -4.051 2.582 -13.467 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.354 3.008 -13.794 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -2.906 2.770 -12.118 1.00 0.00 H new ATOM 2760 N ALA B 95 -1.420 3.140 -9.951 1.00 0.00 N ATOM 2761 CA ALA B 95 -0.619 2.018 -9.464 1.00 0.00 C ATOM 2762 C ALA B 95 -0.145 1.009 -10.546 1.00 0.00 C ATOM 2763 O ALA B 95 -0.671 -0.096 -10.634 1.00 0.00 O ATOM 2764 CB ALA B 95 -1.461 1.368 -8.356 1.00 0.00 C ATOM 0 H ALA B 95 -2.335 3.185 -9.502 1.00 0.00 H new ATOM 0 HA ALA B 95 0.337 2.387 -9.092 1.00 0.00 H new ATOM 0 HB1 ALA B 95 -0.922 0.516 -7.942 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -1.649 2.096 -7.567 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -2.410 1.030 -8.771 1.00 0.00 H new ATOM 2770 N VAL B 96 0.867 1.388 -11.331 1.00 0.00 N ATOM 2771 CA VAL B 96 1.463 0.601 -12.429 1.00 0.00 C ATOM 2772 C VAL B 96 1.987 -0.769 -11.966 1.00 0.00 C ATOM 2773 O VAL B 96 2.498 -0.921 -10.855 1.00 0.00 O ATOM 2774 CB VAL B 96 2.609 1.364 -13.159 1.00 0.00 C ATOM 2775 CG1 VAL B 96 2.832 0.801 -14.574 1.00 0.00 C ATOM 2776 CG2 VAL B 96 2.340 2.870 -13.323 1.00 0.00 C ATOM 0 H VAL B 96 1.319 2.295 -11.218 1.00 0.00 H new ATOM 0 HA VAL B 96 0.644 0.440 -13.130 1.00 0.00 H new ATOM 0 HB VAL B 96 3.483 1.223 -12.523 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.637 1.351 -15.062 1.00 0.00 H new ATOM 0 HG12 VAL B 96 3.101 -0.253 -14.508 1.00 0.00 H new ATOM 0 HG13 VAL B 96 1.916 0.906 -15.156 1.00 0.00 H new ATOM 0 HG21 VAL B 96 3.180 3.335 -13.839 1.00 0.00 H new ATOM 0 HG22 VAL B 96 1.430 3.016 -13.905 1.00 0.00 H new ATOM 0 HG23 VAL B 96 2.219 3.327 -12.341 1.00 0.00 H new ATOM 2786 N ASP B 97 1.877 -1.757 -12.854 1.00 0.00 N ATOM 2787 CA ASP B 97 2.300 -3.153 -12.693 1.00 0.00 C ATOM 2788 C ASP B 97 3.831 -3.354 -12.748 1.00 0.00 C ATOM 2789 O ASP B 97 4.320 -4.381 -12.280 1.00 0.00 O ATOM 2790 CB ASP B 97 1.662 -3.981 -13.831 1.00 0.00 C ATOM 2791 CG ASP B 97 0.219 -3.578 -14.157 1.00 0.00 C ATOM 2792 OD1 ASP B 97 0.032 -2.531 -14.825 1.00 0.00 O ATOM 2793 OD2 ASP B 97 -0.732 -4.266 -13.731 1.00 0.00 O ATOM 0 H ASP B 97 1.461 -1.594 -13.771 1.00 0.00 H new ATOM 0 HA ASP B 97 1.975 -3.473 -11.703 1.00 0.00 H new ATOM 0 HB2 ASP B 97 2.270 -3.875 -14.729 1.00 0.00 H new ATOM 0 HB3 ASP B 97 1.681 -5.035 -13.555 1.00 0.00 H new ATOM 2798 N THR B 98 4.561 -2.387 -13.330 1.00 0.00 N ATOM 2799 CA THR B 98 5.991 -2.479 -13.689 1.00 0.00 C ATOM 2800 C THR B 98 6.870 -2.988 -12.566 1.00 0.00 C ATOM 2801 O THR B 98 6.960 -2.383 -11.494 1.00 0.00 O ATOM 2802 CB THR B 98 6.584 -1.157 -14.194 1.00 0.00 C ATOM 2803 OG1 THR B 98 6.251 -0.126 -13.304 1.00 0.00 O ATOM 2804 CG2 THR B 98 6.099 -0.799 -15.597 1.00 0.00 C ATOM 0 H THR B 98 4.157 -1.483 -13.574 1.00 0.00 H new ATOM 0 HA THR B 98 5.992 -3.207 -14.501 1.00 0.00 H new ATOM 0 HB THR B 98 7.666 -1.281 -14.246 1.00 0.00 H new ATOM 0 HG1 THR B 98 6.631 0.719 -13.625 1.00 0.00 H new ATOM 0 HG21 THR B 98 6.548 0.145 -15.907 1.00 0.00 H new ATOM 0 HG22 THR B 98 6.389 -1.585 -16.294 1.00 0.00 H new ATOM 0 HG23 THR B 98 5.013 -0.700 -15.593 1.00 0.00 H new ATOM 2812 N ASP B 99 7.601 -4.052 -12.882 1.00 0.00 N ATOM 2813 CA ASP B 99 8.711 -4.507 -12.076 1.00 0.00 C ATOM 2814 C ASP B 99 9.794 -3.433 -12.185 1.00 0.00 C ATOM 2815 O ASP B 99 9.884 -2.708 -13.181 1.00 0.00 O ATOM 2816 CB ASP B 99 9.228 -5.857 -12.594 1.00 0.00 C ATOM 2817 CG ASP B 99 10.594 -6.161 -11.977 1.00 0.00 C ATOM 2818 OD1 ASP B 99 10.654 -6.266 -10.729 1.00 0.00 O ATOM 2819 OD2 ASP B 99 11.593 -6.097 -12.735 1.00 0.00 O ATOM 0 H ASP B 99 7.433 -4.621 -13.711 1.00 0.00 H new ATOM 0 HA ASP B 99 8.414 -4.655 -11.038 1.00 0.00 H new ATOM 0 HB2 ASP B 99 8.521 -6.648 -12.343 1.00 0.00 H new ATOM 0 HB3 ASP B 99 9.307 -5.834 -13.681 1.00 0.00 H new ATOM 2824 N GLN B 100 10.631 -3.330 -11.163 1.00 0.00 N ATOM 2825 CA GLN B 100 11.802 -2.479 -11.191 1.00 0.00 C ATOM 2826 C GLN B 100 12.677 -2.845 -9.982 1.00 0.00 C ATOM 2827 O GLN B 100 12.089 -3.105 -8.927 1.00 0.00 O ATOM 2828 CB GLN B 100 11.353 -1.001 -11.152 1.00 0.00 C ATOM 2829 CG GLN B 100 12.336 -0.010 -11.773 1.00 0.00 C ATOM 2830 CD GLN B 100 12.615 -0.220 -13.262 1.00 0.00 C ATOM 2831 OE1 GLN B 100 13.702 0.083 -13.733 1.00 0.00 O ATOM 2832 NE2 GLN B 100 11.678 -0.720 -14.041 1.00 0.00 N ATOM 0 H GLN B 100 10.512 -3.840 -10.287 1.00 0.00 H new ATOM 0 HA GLN B 100 12.383 -2.622 -12.102 1.00 0.00 H new ATOM 0 HB2 GLN B 100 10.397 -0.914 -11.669 1.00 0.00 H new ATOM 0 HB3 GLN B 100 11.181 -0.717 -10.114 1.00 0.00 H new ATOM 0 HG2 GLN B 100 11.949 0.999 -11.630 1.00 0.00 H new ATOM 0 HG3 GLN B 100 13.280 -0.070 -11.230 1.00 0.00 H new ATOM 0 HE21 GLN B 100 10.771 -0.973 -13.650 1.00 0.00 H new ATOM 0 HE22 GLN B 100 11.860 -0.854 -15.036 1.00 0.00 H new ATOM 2841 N PRO B 101 14.023 -2.838 -10.070 1.00 0.00 N ATOM 2842 CA PRO B 101 14.895 -3.118 -8.926 1.00 0.00 C ATOM 2843 C PRO B 101 14.701 -2.115 -7.779 1.00 0.00 C ATOM 2844 O PRO B 101 14.164 -1.023 -7.976 1.00 0.00 O ATOM 2845 CB PRO B 101 16.326 -3.124 -9.476 1.00 0.00 C ATOM 2846 CG PRO B 101 16.227 -2.251 -10.724 1.00 0.00 C ATOM 2847 CD PRO B 101 14.835 -2.592 -11.253 1.00 0.00 C ATOM 0 HA PRO B 101 14.652 -4.081 -8.476 1.00 0.00 H new ATOM 0 HB2 PRO B 101 17.035 -2.717 -8.756 1.00 0.00 H new ATOM 0 HB3 PRO B 101 16.660 -4.133 -9.717 1.00 0.00 H new ATOM 0 HG2 PRO B 101 16.323 -1.191 -10.487 1.00 0.00 H new ATOM 0 HG3 PRO B 101 17.006 -2.488 -11.448 1.00 0.00 H new ATOM 0 HD2 PRO B 101 14.428 -1.773 -11.846 1.00 0.00 H new ATOM 0 HD3 PRO B 101 14.864 -3.469 -11.899 1.00 0.00 H new ATOM 2855 N CYS B 102 15.103 -2.524 -6.568 1.00 0.00 N ATOM 2856 CA CYS B 102 14.932 -1.752 -5.346 1.00 0.00 C ATOM 2857 C CYS B 102 16.068 -0.737 -5.115 1.00 0.00 C ATOM 2858 O CYS B 102 16.590 -0.115 -6.029 1.00 0.00 O ATOM 2859 CB CYS B 102 14.695 -2.770 -4.205 1.00 0.00 C ATOM 2860 SG CYS B 102 14.077 -2.123 -2.590 1.00 0.00 S ATOM 0 H CYS B 102 15.565 -3.421 -6.416 1.00 0.00 H new ATOM 0 HA CYS B 102 14.063 -1.096 -5.405 1.00 0.00 H new ATOM 0 HB2 CYS B 102 13.983 -3.514 -4.562 1.00 0.00 H new ATOM 0 HB3 CYS B 102 15.635 -3.291 -4.020 1.00 0.00 H new ATOM 2865 N VAL B 103 16.366 -0.575 -3.831 1.00 0.00 N ATOM 2866 CA VAL B 103 17.437 0.201 -3.181 1.00 0.00 C ATOM 2867 C VAL B 103 18.175 1.178 -4.126 1.00 0.00 C ATOM 2868 O VAL B 103 19.325 0.963 -4.495 1.00 0.00 O ATOM 2869 CB VAL B 103 18.403 -0.779 -2.472 1.00 0.00 C ATOM 2870 CG1 VAL B 103 19.478 -0.078 -1.614 1.00 0.00 C ATOM 2871 CG2 VAL B 103 17.636 -1.716 -1.513 1.00 0.00 C ATOM 0 H VAL B 103 15.795 -1.040 -3.125 1.00 0.00 H new ATOM 0 HA VAL B 103 16.972 0.856 -2.444 1.00 0.00 H new ATOM 0 HB VAL B 103 18.883 -1.323 -3.285 1.00 0.00 H new ATOM 0 HG11 VAL B 103 20.118 -0.828 -1.148 1.00 0.00 H new ATOM 0 HG12 VAL B 103 20.082 0.572 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL B 103 18.994 0.518 -0.840 1.00 0.00 H new ATOM 0 HG21 VAL B 103 18.338 -2.394 -1.028 1.00 0.00 H new ATOM 0 HG22 VAL B 103 17.124 -1.122 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL B 103 16.904 -2.294 -2.077 1.00 0.00 H new ATOM 2881 N ALA B 104 17.469 2.232 -4.562 1.00 0.00 N ATOM 2882 CA ALA B 104 17.981 3.383 -5.328 1.00 0.00 C ATOM 2883 C ALA B 104 18.238 3.125 -6.829 1.00 0.00 C ATOM 2884 O ALA B 104 18.450 4.083 -7.572 1.00 0.00 O ATOM 2885 CB ALA B 104 19.192 3.995 -4.597 1.00 0.00 C ATOM 0 H ALA B 104 16.468 2.310 -4.380 1.00 0.00 H new ATOM 0 HA ALA B 104 17.175 4.117 -5.357 1.00 0.00 H new ATOM 0 HB1 ALA B 104 19.568 4.845 -5.165 1.00 0.00 H new ATOM 0 HB2 ALA B 104 18.888 4.328 -3.605 1.00 0.00 H new ATOM 0 HB3 ALA B 104 19.977 3.245 -4.503 1.00 0.00 H new ATOM 2891 N GLU B 105 18.167 1.879 -7.292 1.00 0.00 N ATOM 2892 CA GLU B 105 18.276 1.510 -8.699 1.00 0.00 C ATOM 2893 C GLU B 105 17.017 1.885 -9.499 1.00 0.00 C ATOM 2894 O GLU B 105 15.932 2.120 -8.954 1.00 0.00 O ATOM 2895 CB GLU B 105 18.535 0.002 -8.843 1.00 0.00 C ATOM 2896 CG GLU B 105 19.851 -0.478 -8.224 1.00 0.00 C ATOM 2897 CD GLU B 105 20.095 -1.931 -8.630 1.00 0.00 C ATOM 2898 OE1 GLU B 105 20.624 -2.128 -9.747 1.00 0.00 O ATOM 2899 OE2 GLU B 105 19.672 -2.820 -7.855 1.00 0.00 O ATOM 0 H GLU B 105 18.028 1.075 -6.679 1.00 0.00 H new ATOM 0 HA GLU B 105 19.117 2.072 -9.106 1.00 0.00 H new ATOM 0 HB2 GLU B 105 17.711 -0.541 -8.380 1.00 0.00 H new ATOM 0 HB3 GLU B 105 18.531 -0.255 -9.902 1.00 0.00 H new ATOM 0 HG2 GLU B 105 20.676 0.150 -8.561 1.00 0.00 H new ATOM 0 HG3 GLU B 105 19.809 -0.393 -7.138 1.00 0.00 H new ATOM 2906 N ARG B 106 17.182 1.881 -10.829 1.00 0.00 N ATOM 2907 CA ARG B 106 16.157 2.050 -11.867 1.00 0.00 C ATOM 2908 C ARG B 106 16.813 2.046 -13.246 1.00 0.00 C ATOM 2909 O ARG B 106 17.886 2.618 -13.430 1.00 0.00 O ATOM 2910 CB ARG B 106 15.324 3.328 -11.642 1.00 0.00 C ATOM 2911 CG ARG B 106 13.918 2.982 -11.128 1.00 0.00 C ATOM 2912 CD ARG B 106 13.335 4.076 -10.242 1.00 0.00 C ATOM 2913 NE ARG B 106 13.090 5.310 -10.999 1.00 0.00 N ATOM 2914 CZ ARG B 106 12.673 6.456 -10.484 1.00 0.00 C ATOM 2915 NH1 ARG B 106 12.386 6.582 -9.206 1.00 0.00 N ATOM 2916 NH2 ARG B 106 12.537 7.490 -11.270 1.00 0.00 N ATOM 0 H ARG B 106 18.107 1.749 -11.238 1.00 0.00 H new ATOM 0 HA ARG B 106 15.464 1.211 -11.808 1.00 0.00 H new ATOM 0 HB2 ARG B 106 15.829 3.975 -10.924 1.00 0.00 H new ATOM 0 HB3 ARG B 106 15.247 3.886 -12.575 1.00 0.00 H new ATOM 0 HG2 ARG B 106 13.255 2.815 -11.977 1.00 0.00 H new ATOM 0 HG3 ARG B 106 13.959 2.048 -10.567 1.00 0.00 H new ATOM 0 HD2 ARG B 106 12.401 3.728 -9.800 1.00 0.00 H new ATOM 0 HD3 ARG B 106 14.020 4.283 -9.420 1.00 0.00 H new ATOM 0 HE ARG B 106 13.255 5.282 -12.005 1.00 0.00 H new ATOM 0 HH11 ARG B 106 12.483 5.782 -8.580 1.00 0.00 H new ATOM 0 HH12 ARG B 106 12.067 7.479 -8.841 1.00 0.00 H new ATOM 0 HH21 ARG B 106 12.751 7.407 -12.264 1.00 0.00 H new ATOM 0 HH22 ARG B 106 12.217 8.381 -10.890 1.00 0.00 H new TER 2930 ARG B 106 HETATM 2931 CD CD A 107 14.313 0.204 -1.789 1.00 0.00 CD HETATM 2932 CD CD B 107 -0.760 -13.102 0.491 1.00 0.00 CD