USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 765 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 107 TYR OH : rot -110:sc= 2.54 USER MOD Set 1.2: A 120 HIS : no HE2:sc= 0.729 K(o=3.3,f=-8!) USER MOD Set 2.1: A 93 SER OG : rot 171:sc= 0.489 USER MOD Set 2.2: A 117 HIS : no HD1:sc= 0.088 K(o=0.58,f=-1.6) USER MOD Set 3.1: A 51 CYS SG : rot -28:sc= 0.21 USER MOD Set 3.2: A 58 MET CE :methyl -149:sc= -0.0638 (180deg=-0.371) USER MOD Set 4.1: A 50 ASN : amide:sc= -0.446 K(o=-0.46,f=-4.3!) USER MOD Set 4.2: A 55 THR OG1 : rot 130:sc= -0.0146 USER MOD Set 5.1: A 37 THR OG1 : rot 13:sc= 1.14 USER MOD Set 5.2: A 40 THR OG1 : rot -24:sc= 2.2 USER MOD Set 5.3: A 41 GLN :FLIP amide:sc= -0.815 F(o=1.4!,f=2.5) USER MOD Set 6.1: A 29 MET CE :methyl 140:sc= -3.36! (180deg=-3.83!) USER MOD Set 6.2: A 47 MET CE :methyl 164:sc= -2.06 (180deg=-2.81!) USER MOD Set 7.1: A 25 TYR OH : rot 180:sc= 1.11 USER MOD Set 7.2: A 28 SER OG : rot -87:sc= 1.29 USER MOD Set 8.1: A 19 CYS SG : rot 180:sc= -0.307 USER MOD Set 8.2: A 136 THR OG1 : rot 69:sc= 0.608 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0486 X(o=-0.049,f=-0.11) USER MOD Single : A 18 SER OG : rot 100:sc= 1.28 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -165:sc= -0.0405 (180deg=-0.249) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot -120:sc= -0.151 USER MOD Single : A 44 CYS SG : rot -146:sc= 2.17 USER MOD Single : A 46 LYS NZ :NH3+ -169:sc= -0.0334 (180deg=-0.186) USER MOD Single : A 52 GLN :FLIP amide:sc= -1.52 F(o=-2.9!,f=-1.5) USER MOD Single : A 53 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.07) USER MOD Single : A 54 SER OG : rot -46:sc= 0.433 USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.149 USER MOD Single : A 67 SER OG : rot 109:sc= 1.23 USER MOD Single : A 69 SER OG : rot -45:sc= 1.23 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 93:sc= 1.03 USER MOD Single : A 80 ASN : amide:sc= -0.223 K(o=-0.22,f=-0.84) USER MOD Single : A 81 LYS NZ :NH3+ 167:sc= -0.0129 (180deg=-0.158) USER MOD Single : A 82 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.00099) USER MOD Single : A 91 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.082) USER MOD Single : A 94 CYS SG : rot 180:sc= -0.442 USER MOD Single : A 97 GLN :FLIP amide:sc= -0.0373 F(o=-1.4!,f=-0.037) USER MOD Single : A 103 SER OG : rot -48:sc= 0.364 USER MOD Single : A 104 THR OG1 : rot 65:sc= 1.06 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ -162:sc= -0.0796 (180deg=-0.491) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 86:sc= 1.27 USER MOD Single : A 115 ASN : amide:sc= -0.162 K(o=-0.16,f=-1.4!) USER MOD Single : A 116 HIS : no HD1:sc= -0.219 X(o=-0.22,f=-0.0029) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 CYS SG : rot 150:sc= -1.25 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.717 USER MOD Single : A 128 ASN :FLIP amide:sc= 0 F(o=-0.83,f=0) USER MOD Single : A 139 GLN : amide:sc= -0.0082 K(o=-0.0082,f=-0.95) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= -0.0765 K(o=-0.077,f=-0.77) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 12 -17.785 8.745 -2.904 1.00 0.00 N ATOM 2 CA GLU A 12 -19.039 9.422 -2.490 1.00 0.00 C ATOM 3 C GLU A 12 -20.225 8.459 -2.603 1.00 0.00 C ATOM 4 O GLU A 12 -21.365 8.803 -2.275 1.00 0.00 O ATOM 5 CB GLU A 12 -19.277 10.657 -3.362 1.00 0.00 C ATOM 6 CG GLU A 12 -20.349 11.595 -2.833 1.00 0.00 C ATOM 7 CD GLU A 12 -20.566 12.782 -3.731 1.00 0.00 C ATOM 8 OE1 GLU A 12 -19.746 13.714 -3.696 1.00 0.00 O ATOM 9 OE2 GLU A 12 -21.556 12.790 -4.481 1.00 0.00 O ATOM 0 HA GLU A 12 -18.944 9.735 -1.450 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -18.341 11.208 -3.455 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -19.557 10.332 -4.364 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -21.286 11.048 -2.726 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -20.066 11.942 -1.839 1.00 0.00 H new ATOM 11 N LYS A 13 -19.950 7.258 -3.069 1.00 0.00 N ATOM 12 CA LYS A 13 -20.970 6.240 -3.216 1.00 0.00 C ATOM 13 C LYS A 13 -20.455 4.929 -2.672 1.00 0.00 C ATOM 14 O LYS A 13 -19.326 4.541 -2.967 1.00 0.00 O ATOM 15 CB LYS A 13 -21.361 6.080 -4.682 1.00 0.00 C ATOM 16 CG LYS A 13 -22.449 5.042 -4.919 1.00 0.00 C ATOM 17 CD LYS A 13 -22.717 4.843 -6.401 1.00 0.00 C ATOM 18 CE LYS A 13 -23.138 6.140 -7.069 1.00 0.00 C ATOM 19 NZ LYS A 13 -23.410 5.953 -8.509 1.00 0.00 N ATOM 0 H LYS A 13 -19.017 6.961 -3.355 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.855 6.543 -2.656 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.701 7.042 -5.065 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.477 5.803 -5.256 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -22.152 4.094 -4.472 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.367 5.355 -4.421 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -21.820 4.457 -6.886 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.498 4.094 -6.533 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.030 6.529 -6.578 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -22.353 6.886 -6.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -23.694 6.861 -8.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -22.551 5.606 -8.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -24.176 5.260 -8.630 1.00 0.00 H new ATOM 22 N LEU A 14 -21.277 4.264 -1.856 1.00 0.00 N ATOM 23 CA LEU A 14 -20.913 2.988 -1.228 1.00 0.00 C ATOM 24 C LEU A 14 -19.767 3.202 -0.230 1.00 0.00 C ATOM 25 O LEU A 14 -19.176 2.254 0.270 1.00 0.00 O ATOM 26 CB LEU A 14 -20.531 1.941 -2.299 1.00 0.00 C ATOM 27 CG LEU A 14 -20.325 0.506 -1.805 1.00 0.00 C ATOM 28 CD1 LEU A 14 -21.613 -0.049 -1.217 1.00 0.00 C ATOM 29 CD2 LEU A 14 -19.827 -0.379 -2.937 1.00 0.00 C ATOM 0 H LEU A 14 -22.211 4.592 -1.612 1.00 0.00 H new ATOM 0 HA LEU A 14 -21.776 2.605 -0.684 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -21.310 1.932 -3.061 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -19.613 2.270 -2.786 1.00 0.00 H new ATOM 0 HG LEU A 14 -19.570 0.517 -1.019 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -21.445 -1.069 -0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -21.926 0.571 -0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -22.392 -0.047 -1.980 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -19.686 -1.395 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -20.559 -0.384 -3.744 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -18.878 0.007 -3.310 1.00 0.00 H new ATOM 41 N ILE A 15 -19.533 4.473 0.106 1.00 0.00 N ATOM 42 CA ILE A 15 -18.440 4.896 0.992 1.00 0.00 C ATOM 43 C ILE A 15 -18.603 4.325 2.423 1.00 0.00 C ATOM 44 O ILE A 15 -17.725 4.480 3.282 1.00 0.00 O ATOM 45 CB ILE A 15 -18.355 6.454 1.036 1.00 0.00 C ATOM 46 CG1 ILE A 15 -17.078 6.934 1.739 1.00 0.00 C ATOM 47 CG2 ILE A 15 -19.589 7.048 1.703 1.00 0.00 C ATOM 48 CD1 ILE A 15 -15.802 6.591 1.000 1.00 0.00 C ATOM 0 H ILE A 15 -20.103 5.248 -0.232 1.00 0.00 H new ATOM 0 HA ILE A 15 -17.511 4.497 0.584 1.00 0.00 H new ATOM 0 HB ILE A 15 -18.316 6.805 0.005 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -17.131 8.015 1.869 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -17.038 6.495 2.736 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -19.505 8.135 1.721 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -20.479 6.762 1.142 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -19.667 6.673 2.723 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -14.945 6.964 1.561 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -15.723 5.509 0.893 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -15.818 7.053 0.013 1.00 0.00 H new ATOM 59 N ALA A 16 -19.726 3.672 2.665 1.00 0.00 N ATOM 60 CA ALA A 16 -19.981 3.046 3.943 1.00 0.00 C ATOM 61 C ALA A 16 -19.352 1.666 3.979 1.00 0.00 C ATOM 62 O ALA A 16 -18.956 1.179 5.034 1.00 0.00 O ATOM 63 CB ALA A 16 -21.478 2.949 4.202 1.00 0.00 C ATOM 0 H ALA A 16 -20.479 3.563 1.985 1.00 0.00 H new ATOM 0 HA ALA A 16 -19.536 3.659 4.726 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -21.650 2.475 5.168 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -21.912 3.949 4.206 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -21.945 2.353 3.418 1.00 0.00 H new ATOM 69 N GLN A 17 -19.249 1.050 2.812 1.00 0.00 N ATOM 70 CA GLN A 17 -18.688 -0.285 2.698 1.00 0.00 C ATOM 71 C GLN A 17 -17.319 -0.238 2.055 1.00 0.00 C ATOM 72 O GLN A 17 -16.462 -1.086 2.319 1.00 0.00 O ATOM 73 CB GLN A 17 -19.620 -1.194 1.896 1.00 0.00 C ATOM 74 CG GLN A 17 -20.992 -1.375 2.526 1.00 0.00 C ATOM 75 CD GLN A 17 -20.932 -2.094 3.860 1.00 0.00 C ATOM 76 OE1 GLN A 17 -20.793 -1.470 4.913 1.00 0.00 O ATOM 77 NE2 GLN A 17 -21.052 -3.407 3.830 1.00 0.00 N ATOM 0 H GLN A 17 -19.549 1.457 1.926 1.00 0.00 H new ATOM 0 HA GLN A 17 -18.583 -0.695 3.702 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -19.742 -0.781 0.895 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -19.151 -2.171 1.783 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -21.456 -0.398 2.665 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -21.630 -1.937 1.843 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -21.166 -3.888 2.938 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -21.031 -3.941 4.699 1.00 0.00 H new ATOM 86 N SER A 18 -17.116 0.747 1.224 1.00 0.00 N ATOM 87 CA SER A 18 -15.852 0.921 0.552 1.00 0.00 C ATOM 88 C SER A 18 -15.186 2.200 1.012 1.00 0.00 C ATOM 89 O SER A 18 -15.818 3.250 1.089 1.00 0.00 O ATOM 90 CB SER A 18 -16.033 0.927 -0.978 1.00 0.00 C ATOM 91 OG SER A 18 -16.861 1.998 -1.405 1.00 0.00 O ATOM 0 H SER A 18 -17.817 1.451 0.992 1.00 0.00 H new ATOM 0 HA SER A 18 -15.211 0.078 0.810 1.00 0.00 H new ATOM 0 HB2 SER A 18 -15.058 1.006 -1.459 1.00 0.00 H new ATOM 0 HB3 SER A 18 -16.470 -0.020 -1.296 1.00 0.00 H new ATOM 0 HG SER A 18 -16.302 2.733 -1.732 1.00 0.00 H new ATOM 97 N CYS A 19 -13.932 2.104 1.354 1.00 0.00 N ATOM 98 CA CYS A 19 -13.179 3.255 1.748 1.00 0.00 C ATOM 99 C CYS A 19 -12.364 3.737 0.563 1.00 0.00 C ATOM 100 O CYS A 19 -11.283 3.217 0.279 1.00 0.00 O ATOM 101 CB CYS A 19 -12.290 2.917 2.933 1.00 0.00 C ATOM 102 SG CYS A 19 -13.198 2.300 4.371 1.00 0.00 S ATOM 0 H CYS A 19 -13.408 1.229 1.367 1.00 0.00 H new ATOM 0 HA CYS A 19 -13.851 4.054 2.060 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -11.560 2.168 2.626 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -11.731 3.807 3.222 1.00 0.00 H new ATOM 0 HG CYS A 19 -12.362 2.036 5.331 1.00 0.00 H new ATOM 108 N ASP A 20 -12.926 4.685 -0.155 1.00 0.00 N ATOM 109 CA ASP A 20 -12.319 5.228 -1.363 1.00 0.00 C ATOM 110 C ASP A 20 -11.440 6.433 -1.040 1.00 0.00 C ATOM 111 O ASP A 20 -11.939 7.535 -0.788 1.00 0.00 O ATOM 112 CB ASP A 20 -13.416 5.628 -2.369 1.00 0.00 C ATOM 113 CG ASP A 20 -14.346 4.472 -2.732 1.00 0.00 C ATOM 114 OD1 ASP A 20 -15.232 4.133 -1.916 1.00 0.00 O ATOM 115 OD2 ASP A 20 -14.200 3.906 -3.831 1.00 0.00 O ATOM 0 H ASP A 20 -13.824 5.108 0.080 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.689 4.457 -1.806 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.006 6.443 -1.949 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.947 6.008 -3.277 1.00 0.00 H new ATOM 118 N TYR A 21 -10.135 6.221 -1.035 1.00 0.00 N ATOM 119 CA TYR A 21 -9.182 7.289 -0.742 1.00 0.00 C ATOM 120 C TYR A 21 -8.268 7.535 -1.929 1.00 0.00 C ATOM 121 O TYR A 21 -8.341 6.832 -2.925 1.00 0.00 O ATOM 122 CB TYR A 21 -8.354 6.948 0.494 1.00 0.00 C ATOM 123 CG TYR A 21 -9.182 6.706 1.730 1.00 0.00 C ATOM 124 CD1 TYR A 21 -9.989 7.705 2.258 1.00 0.00 C ATOM 125 CD2 TYR A 21 -9.161 5.476 2.367 1.00 0.00 C ATOM 126 CE1 TYR A 21 -10.749 7.483 3.386 1.00 0.00 C ATOM 127 CE2 TYR A 21 -9.917 5.246 3.494 1.00 0.00 C ATOM 128 CZ TYR A 21 -10.709 6.250 4.001 1.00 0.00 C ATOM 129 OH TYR A 21 -11.467 6.019 5.122 1.00 0.00 O ATOM 0 H TYR A 21 -9.706 5.317 -1.231 1.00 0.00 H new ATOM 0 HA TYR A 21 -9.748 8.199 -0.544 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -7.758 6.059 0.287 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -7.656 7.762 0.689 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -10.022 8.671 1.777 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.541 4.684 1.973 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -11.372 8.270 3.785 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -9.888 4.281 3.978 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.324 5.100 5.430 1.00 0.00 H new ATOM 135 N LYS A 22 -7.410 8.533 -1.825 1.00 0.00 N ATOM 136 CA LYS A 22 -6.505 8.864 -2.912 1.00 0.00 C ATOM 137 C LYS A 22 -5.047 8.819 -2.460 1.00 0.00 C ATOM 138 O LYS A 22 -4.670 9.441 -1.467 1.00 0.00 O ATOM 139 CB LYS A 22 -6.825 10.248 -3.472 1.00 0.00 C ATOM 140 CG LYS A 22 -8.245 10.389 -3.994 1.00 0.00 C ATOM 141 CD LYS A 22 -8.526 11.804 -4.474 1.00 0.00 C ATOM 142 CE LYS A 22 -8.491 12.803 -3.325 1.00 0.00 C ATOM 143 NZ LYS A 22 -9.538 12.519 -2.308 1.00 0.00 N ATOM 0 H LYS A 22 -7.320 9.128 -1.001 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.646 8.116 -3.693 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.660 10.992 -2.692 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -6.128 10.472 -4.279 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.404 9.688 -4.813 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -8.951 10.124 -3.207 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.789 12.087 -5.226 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.503 11.838 -4.957 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -7.509 12.777 -2.852 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -8.630 13.811 -3.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.652 13.345 -1.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -10.440 12.318 -2.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.255 11.695 -1.740 1.00 0.00 H new ATOM 146 N ALA A 23 -4.246 8.079 -3.192 1.00 0.00 N ATOM 147 CA ALA A 23 -2.821 7.981 -2.941 1.00 0.00 C ATOM 148 C ALA A 23 -2.074 8.359 -4.198 1.00 0.00 C ATOM 149 O ALA A 23 -2.685 8.728 -5.188 1.00 0.00 O ATOM 150 CB ALA A 23 -2.453 6.570 -2.503 1.00 0.00 C ATOM 0 H ALA A 23 -4.565 7.523 -3.985 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.545 8.663 -2.137 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.380 6.514 -2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.991 6.321 -1.589 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.724 5.863 -3.287 1.00 0.00 H new ATOM 156 N ALA A 24 -0.773 8.283 -4.168 1.00 0.00 N ATOM 157 CA ALA A 24 0.012 8.600 -5.338 1.00 0.00 C ATOM 158 C ALA A 24 0.878 7.411 -5.756 1.00 0.00 C ATOM 159 O ALA A 24 1.823 7.039 -5.056 1.00 0.00 O ATOM 160 CB ALA A 24 0.846 9.839 -5.099 1.00 0.00 C ATOM 0 H ALA A 24 -0.230 8.005 -3.350 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.669 8.811 -6.162 1.00 0.00 H new ATOM 0 HB1 ALA A 24 1.430 10.062 -5.992 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.191 10.681 -4.875 1.00 0.00 H new ATOM 0 HB3 ALA A 24 1.518 9.668 -4.258 1.00 0.00 H new ATOM 166 N TYR A 25 0.537 6.843 -6.907 1.00 0.00 N ATOM 167 CA TYR A 25 1.174 5.632 -7.462 1.00 0.00 C ATOM 168 C TYR A 25 2.686 5.821 -7.650 1.00 0.00 C ATOM 169 O TYR A 25 3.110 6.642 -8.448 1.00 0.00 O ATOM 170 CB TYR A 25 0.499 5.314 -8.822 1.00 0.00 C ATOM 171 CG TYR A 25 0.899 4.003 -9.496 1.00 0.00 C ATOM 172 CD1 TYR A 25 2.204 3.776 -9.922 1.00 0.00 C ATOM 173 CD2 TYR A 25 -0.044 3.001 -9.724 1.00 0.00 C ATOM 174 CE1 TYR A 25 2.557 2.596 -10.546 1.00 0.00 C ATOM 175 CE2 TYR A 25 0.305 1.822 -10.350 1.00 0.00 C ATOM 176 CZ TYR A 25 1.605 1.625 -10.758 1.00 0.00 C ATOM 177 OH TYR A 25 1.954 0.451 -11.381 1.00 0.00 O ATOM 0 H TYR A 25 -0.205 7.212 -7.501 1.00 0.00 H new ATOM 0 HA TYR A 25 1.042 4.805 -6.764 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -0.581 5.304 -8.672 1.00 0.00 H new ATOM 0 HB3 TYR A 25 0.718 6.131 -9.510 1.00 0.00 H new ATOM 0 HD1 TYR A 25 2.954 4.536 -9.762 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -1.065 3.151 -9.405 1.00 0.00 H new ATOM 0 HE1 TYR A 25 3.576 2.436 -10.866 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -0.438 1.057 -10.519 1.00 0.00 H new ATOM 0 HH TYR A 25 1.167 -0.128 -11.452 1.00 0.00 H new ATOM 183 N LEU A 26 3.491 5.038 -6.919 1.00 0.00 N ATOM 184 CA LEU A 26 4.947 5.127 -7.040 1.00 0.00 C ATOM 185 C LEU A 26 5.488 4.007 -7.948 1.00 0.00 C ATOM 186 O LEU A 26 6.127 4.285 -8.963 1.00 0.00 O ATOM 187 CB LEU A 26 5.627 5.108 -5.651 1.00 0.00 C ATOM 188 CG LEU A 26 7.126 5.493 -5.620 1.00 0.00 C ATOM 189 CD1 LEU A 26 7.343 6.852 -6.264 1.00 0.00 C ATOM 190 CD2 LEU A 26 7.655 5.509 -4.185 1.00 0.00 C ATOM 0 H LEU A 26 3.161 4.345 -6.247 1.00 0.00 H new ATOM 0 HA LEU A 26 5.190 6.082 -7.507 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.085 5.788 -4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.521 4.108 -5.231 1.00 0.00 H new ATOM 0 HG LEU A 26 7.676 4.741 -6.186 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.403 7.105 -6.232 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.008 6.821 -7.301 1.00 0.00 H new ATOM 0 HD13 LEU A 26 6.774 7.607 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.710 5.782 -4.189 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.094 6.237 -3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.538 4.519 -3.743 1.00 0.00 H new ATOM 202 N GLY A 27 5.242 2.740 -7.584 1.00 0.00 N ATOM 203 CA GLY A 27 5.678 1.648 -8.434 1.00 0.00 C ATOM 204 C GLY A 27 5.133 0.292 -8.005 1.00 0.00 C ATOM 205 O GLY A 27 4.974 0.022 -6.806 1.00 0.00 O ATOM 0 H GLY A 27 4.757 2.461 -6.731 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.366 1.849 -9.459 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.767 1.610 -8.434 1.00 0.00 H new ATOM 209 N SER A 28 4.833 -0.554 -8.983 1.00 0.00 N ATOM 210 CA SER A 28 4.370 -1.908 -8.726 1.00 0.00 C ATOM 211 C SER A 28 5.455 -2.900 -9.135 1.00 0.00 C ATOM 212 O SER A 28 5.786 -3.027 -10.315 1.00 0.00 O ATOM 213 CB SER A 28 3.059 -2.184 -9.478 1.00 0.00 C ATOM 214 OG SER A 28 3.169 -1.843 -10.851 1.00 0.00 O ATOM 0 H SER A 28 4.904 -0.320 -9.973 1.00 0.00 H new ATOM 0 HA SER A 28 4.169 -2.024 -7.661 1.00 0.00 H new ATOM 0 HB2 SER A 28 2.798 -3.238 -9.383 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.250 -1.613 -9.023 1.00 0.00 H new ATOM 0 HG SER A 28 2.945 -0.897 -10.972 1.00 0.00 H new ATOM 220 N MET A 29 6.013 -3.588 -8.167 1.00 0.00 N ATOM 221 CA MET A 29 7.120 -4.484 -8.422 1.00 0.00 C ATOM 222 C MET A 29 6.693 -5.931 -8.303 1.00 0.00 C ATOM 223 O MET A 29 5.843 -6.266 -7.491 1.00 0.00 O ATOM 224 CB MET A 29 8.252 -4.176 -7.448 1.00 0.00 C ATOM 225 CG MET A 29 9.554 -3.776 -8.119 1.00 0.00 C ATOM 226 SD MET A 29 9.333 -2.553 -9.441 1.00 0.00 S ATOM 227 CE MET A 29 8.503 -1.213 -8.568 1.00 0.00 C ATOM 0 H MET A 29 5.718 -3.545 -7.191 1.00 0.00 H new ATOM 0 HA MET A 29 7.468 -4.330 -9.443 1.00 0.00 H new ATOM 0 HB2 MET A 29 7.936 -3.372 -6.783 1.00 0.00 H new ATOM 0 HB3 MET A 29 8.431 -5.053 -6.826 1.00 0.00 H new ATOM 0 HG2 MET A 29 10.232 -3.371 -7.368 1.00 0.00 H new ATOM 0 HG3 MET A 29 10.030 -4.665 -8.532 1.00 0.00 H new ATOM 0 HE1 MET A 29 8.899 -0.256 -8.909 1.00 0.00 H new ATOM 0 HE2 MET A 29 7.433 -1.255 -8.770 1.00 0.00 H new ATOM 0 HE3 MET A 29 8.674 -1.316 -7.496 1.00 0.00 H new ATOM 237 N LEU A 30 7.272 -6.780 -9.121 1.00 0.00 N ATOM 238 CA LEU A 30 6.954 -8.193 -9.087 1.00 0.00 C ATOM 239 C LEU A 30 8.083 -8.968 -8.445 1.00 0.00 C ATOM 240 O LEU A 30 9.199 -8.978 -8.950 1.00 0.00 O ATOM 241 CB LEU A 30 6.683 -8.725 -10.500 1.00 0.00 C ATOM 242 CG LEU A 30 6.409 -10.229 -10.603 1.00 0.00 C ATOM 243 CD1 LEU A 30 5.195 -10.613 -9.779 1.00 0.00 C ATOM 244 CD2 LEU A 30 6.221 -10.641 -12.054 1.00 0.00 C ATOM 0 H LEU A 30 7.967 -6.518 -9.820 1.00 0.00 H new ATOM 0 HA LEU A 30 6.051 -8.326 -8.492 1.00 0.00 H new ATOM 0 HB2 LEU A 30 5.828 -8.190 -10.912 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.541 -8.487 -11.129 1.00 0.00 H new ATOM 0 HG LEU A 30 7.274 -10.759 -10.204 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.020 -11.685 -9.867 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.370 -10.359 -8.734 1.00 0.00 H new ATOM 0 HD13 LEU A 30 4.322 -10.071 -10.143 1.00 0.00 H new ATOM 0 HD21 LEU A 30 6.028 -11.712 -12.106 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.377 -10.099 -12.480 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.124 -10.408 -12.618 1.00 0.00 H new ATOM 256 N ILE A 31 7.796 -9.601 -7.326 1.00 0.00 N ATOM 257 CA ILE A 31 8.797 -10.374 -6.627 1.00 0.00 C ATOM 258 C ILE A 31 8.343 -11.840 -6.513 1.00 0.00 C ATOM 259 O ILE A 31 7.227 -12.190 -6.927 1.00 0.00 O ATOM 260 CB ILE A 31 9.102 -9.816 -5.208 1.00 0.00 C ATOM 261 CG1 ILE A 31 8.578 -8.363 -5.010 1.00 0.00 C ATOM 262 CG2 ILE A 31 10.605 -9.866 -4.958 1.00 0.00 C ATOM 263 CD1 ILE A 31 9.432 -7.274 -5.655 1.00 0.00 C ATOM 0 H ILE A 31 6.877 -9.594 -6.883 1.00 0.00 H new ATOM 0 HA ILE A 31 9.715 -10.306 -7.210 1.00 0.00 H new ATOM 0 HB ILE A 31 8.577 -10.443 -4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.568 -8.299 -5.415 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.506 -8.162 -3.941 1.00 0.00 H new ATOM 0 HG21 ILE A 31 10.822 -9.475 -3.964 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.951 -10.897 -5.026 1.00 0.00 H new ATOM 0 HG23 ILE A 31 11.118 -9.261 -5.705 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.985 -6.299 -5.462 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.437 -7.303 -5.234 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.484 -7.442 -6.731 1.00 0.00 H new ATOM 274 N LYS A 32 9.192 -12.694 -5.952 1.00 0.00 N ATOM 275 CA LYS A 32 8.871 -14.110 -5.831 1.00 0.00 C ATOM 276 C LYS A 32 8.695 -14.535 -4.364 1.00 0.00 C ATOM 277 O LYS A 32 7.573 -14.755 -3.905 1.00 0.00 O ATOM 278 CB LYS A 32 9.948 -14.959 -6.526 1.00 0.00 C ATOM 279 CG LYS A 32 9.687 -16.461 -6.497 1.00 0.00 C ATOM 280 CD LYS A 32 10.666 -17.214 -7.395 1.00 0.00 C ATOM 281 CE LYS A 32 12.109 -17.029 -6.944 1.00 0.00 C ATOM 282 NZ LYS A 32 13.067 -17.654 -7.889 1.00 0.00 N ATOM 0 H LYS A 32 10.103 -12.432 -5.576 1.00 0.00 H new ATOM 0 HA LYS A 32 7.916 -14.280 -6.328 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.032 -14.638 -7.564 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.910 -14.761 -6.053 1.00 0.00 H new ATOM 0 HG2 LYS A 32 9.774 -16.827 -5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 32 8.666 -16.661 -6.822 1.00 0.00 H new ATOM 0 HD2 LYS A 32 10.418 -18.275 -7.392 1.00 0.00 H new ATOM 0 HD3 LYS A 32 10.559 -16.864 -8.422 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.328 -15.965 -6.855 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.239 -17.465 -5.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 14.038 -17.506 -7.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 12.874 -18.674 -7.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 12.961 -17.220 -8.828 1.00 0.00 H new ATOM 285 N GLU A 33 9.796 -14.628 -3.637 1.00 0.00 N ATOM 286 CA GLU A 33 9.762 -15.059 -2.240 1.00 0.00 C ATOM 287 C GLU A 33 10.215 -13.940 -1.316 1.00 0.00 C ATOM 288 O GLU A 33 11.305 -13.381 -1.484 1.00 0.00 O ATOM 289 CB GLU A 33 10.605 -16.326 -2.054 1.00 0.00 C ATOM 290 CG GLU A 33 11.934 -16.304 -2.788 1.00 0.00 C ATOM 291 CD GLU A 33 12.569 -17.671 -2.862 1.00 0.00 C ATOM 292 OE1 GLU A 33 12.017 -18.547 -3.555 1.00 0.00 O ATOM 293 OE2 GLU A 33 13.634 -17.879 -2.240 1.00 0.00 O ATOM 0 H GLU A 33 10.729 -14.411 -3.988 1.00 0.00 H new ATOM 0 HA GLU A 33 8.733 -15.300 -1.973 1.00 0.00 H new ATOM 0 HB2 GLU A 33 10.793 -16.471 -0.990 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.028 -17.186 -2.396 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.783 -15.921 -3.797 1.00 0.00 H new ATOM 0 HG3 GLU A 33 12.614 -15.617 -2.284 1.00 0.00 H new ATOM 296 N LEU A 34 9.382 -13.618 -0.334 1.00 0.00 N ATOM 297 CA LEU A 34 9.635 -12.479 0.543 1.00 0.00 C ATOM 298 C LEU A 34 9.542 -12.866 2.008 1.00 0.00 C ATOM 299 O LEU A 34 9.103 -13.972 2.345 1.00 0.00 O ATOM 300 CB LEU A 34 8.606 -11.386 0.255 1.00 0.00 C ATOM 301 CG LEU A 34 8.410 -11.048 -1.216 1.00 0.00 C ATOM 302 CD1 LEU A 34 7.304 -10.025 -1.396 1.00 0.00 C ATOM 303 CD2 LEU A 34 9.706 -10.555 -1.817 1.00 0.00 C ATOM 0 H LEU A 34 8.525 -14.129 -0.124 1.00 0.00 H new ATOM 0 HA LEU A 34 10.646 -12.122 0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 34 7.647 -11.694 0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.905 -10.480 0.782 1.00 0.00 H new ATOM 0 HG LEU A 34 8.110 -11.955 -1.741 1.00 0.00 H new ATOM 0 HD11 LEU A 34 7.184 -9.801 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 34 6.370 -10.426 -1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.562 -9.112 -0.859 1.00 0.00 H new ATOM 0 HD21 LEU A 34 9.552 -10.317 -2.869 1.00 0.00 H new ATOM 0 HD22 LEU A 34 10.036 -9.661 -1.287 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.467 -11.331 -1.728 1.00 0.00 H new ATOM 315 N ARG A 35 9.967 -11.954 2.874 1.00 0.00 N ATOM 316 CA ARG A 35 9.869 -12.141 4.310 1.00 0.00 C ATOM 317 C ARG A 35 9.676 -10.808 5.043 1.00 0.00 C ATOM 318 O ARG A 35 10.645 -10.163 5.465 1.00 0.00 O ATOM 319 CB ARG A 35 11.078 -12.908 4.881 1.00 0.00 C ATOM 320 CG ARG A 35 12.439 -12.421 4.402 1.00 0.00 C ATOM 321 CD ARG A 35 13.557 -12.959 5.290 1.00 0.00 C ATOM 322 NE ARG A 35 13.606 -12.260 6.586 1.00 0.00 N ATOM 323 CZ ARG A 35 13.738 -12.852 7.782 1.00 0.00 C ATOM 324 NH1 ARG A 35 13.770 -14.179 7.881 1.00 0.00 N ATOM 325 NH2 ARG A 35 13.824 -12.109 8.884 1.00 0.00 N ATOM 0 H ARG A 35 10.388 -11.067 2.598 1.00 0.00 H new ATOM 0 HA ARG A 35 8.983 -12.752 4.482 1.00 0.00 H new ATOM 0 HB2 ARG A 35 11.049 -12.843 5.969 1.00 0.00 H new ATOM 0 HB3 ARG A 35 10.975 -13.962 4.622 1.00 0.00 H new ATOM 0 HG2 ARG A 35 12.602 -12.741 3.373 1.00 0.00 H new ATOM 0 HG3 ARG A 35 12.461 -11.331 4.404 1.00 0.00 H new ATOM 0 HD2 ARG A 35 13.408 -14.026 5.457 1.00 0.00 H new ATOM 0 HD3 ARG A 35 14.513 -12.847 4.779 1.00 0.00 H new ATOM 0 HE ARG A 35 13.534 -11.243 6.572 1.00 0.00 H new ATOM 0 HH11 ARG A 35 13.694 -14.755 7.043 1.00 0.00 H new ATOM 0 HH12 ARG A 35 13.871 -14.620 8.795 1.00 0.00 H new ATOM 0 HH21 ARG A 35 13.789 -11.092 8.817 1.00 0.00 H new ATOM 0 HH22 ARG A 35 13.924 -12.557 9.795 1.00 0.00 H new ATOM 328 N GLY A 36 8.428 -10.382 5.150 1.00 0.00 N ATOM 329 CA GLY A 36 8.108 -9.180 5.898 1.00 0.00 C ATOM 330 C GLY A 36 8.139 -7.909 5.067 1.00 0.00 C ATOM 331 O GLY A 36 8.019 -7.949 3.840 1.00 0.00 O ATOM 0 H GLY A 36 7.624 -10.849 4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 36 7.117 -9.291 6.337 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.813 -9.080 6.723 1.00 0.00 H new ATOM 335 N THR A 37 8.326 -6.780 5.747 1.00 0.00 N ATOM 336 CA THR A 37 8.323 -5.467 5.110 1.00 0.00 C ATOM 337 C THR A 37 9.651 -5.192 4.374 1.00 0.00 C ATOM 338 O THR A 37 9.831 -4.137 3.761 1.00 0.00 O ATOM 339 CB THR A 37 8.054 -4.349 6.158 1.00 0.00 C ATOM 340 OG1 THR A 37 7.694 -3.129 5.505 1.00 0.00 O ATOM 341 CG2 THR A 37 9.281 -4.106 7.029 1.00 0.00 C ATOM 0 H THR A 37 8.484 -6.751 6.754 1.00 0.00 H new ATOM 0 HA THR A 37 7.520 -5.464 4.373 1.00 0.00 H new ATOM 0 HB THR A 37 7.232 -4.682 6.791 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.497 -3.309 4.562 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.064 -3.320 7.752 1.00 0.00 H new ATOM 0 HG22 THR A 37 9.540 -5.024 7.557 1.00 0.00 H new ATOM 0 HG23 THR A 37 10.118 -3.801 6.401 1.00 0.00 H new ATOM 348 N GLU A 38 10.570 -6.145 4.436 1.00 0.00 N ATOM 349 CA GLU A 38 11.850 -6.020 3.756 1.00 0.00 C ATOM 350 C GLU A 38 11.646 -5.757 2.258 1.00 0.00 C ATOM 351 O GLU A 38 12.326 -4.921 1.663 1.00 0.00 O ATOM 352 CB GLU A 38 12.675 -7.291 3.961 1.00 0.00 C ATOM 353 CG GLU A 38 14.020 -7.278 3.258 1.00 0.00 C ATOM 354 CD GLU A 38 14.755 -8.586 3.403 1.00 0.00 C ATOM 355 OE1 GLU A 38 14.550 -9.484 2.563 1.00 0.00 O ATOM 356 OE2 GLU A 38 15.536 -8.725 4.358 1.00 0.00 O ATOM 0 H GLU A 38 10.452 -7.016 4.953 1.00 0.00 H new ATOM 0 HA GLU A 38 12.388 -5.173 4.182 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.837 -7.438 5.029 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.100 -8.146 3.605 1.00 0.00 H new ATOM 0 HG2 GLU A 38 13.872 -7.062 2.200 1.00 0.00 H new ATOM 0 HG3 GLU A 38 14.632 -6.473 3.665 1.00 0.00 H new ATOM 359 N SER A 39 10.684 -6.452 1.673 1.00 0.00 N ATOM 360 CA SER A 39 10.405 -6.325 0.255 1.00 0.00 C ATOM 361 C SER A 39 9.791 -4.969 -0.080 1.00 0.00 C ATOM 362 O SER A 39 10.140 -4.352 -1.097 1.00 0.00 O ATOM 363 CB SER A 39 9.478 -7.435 -0.200 1.00 0.00 C ATOM 364 OG SER A 39 9.292 -7.398 -1.604 1.00 0.00 O ATOM 0 H SER A 39 10.081 -7.113 2.163 1.00 0.00 H new ATOM 0 HA SER A 39 11.355 -6.405 -0.274 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.892 -8.401 0.090 1.00 0.00 H new ATOM 0 HB3 SER A 39 8.515 -7.337 0.301 1.00 0.00 H new ATOM 0 HG SER A 39 8.341 -7.272 -1.805 1.00 0.00 H new ATOM 370 N THR A 40 8.881 -4.500 0.768 1.00 0.00 N ATOM 371 CA THR A 40 8.235 -3.231 0.526 1.00 0.00 C ATOM 372 C THR A 40 9.259 -2.115 0.568 1.00 0.00 C ATOM 373 O THR A 40 9.212 -1.190 -0.239 1.00 0.00 O ATOM 374 CB THR A 40 7.094 -2.951 1.534 1.00 0.00 C ATOM 375 OG1 THR A 40 7.598 -2.960 2.866 1.00 0.00 O ATOM 376 CG2 THR A 40 5.995 -3.996 1.406 1.00 0.00 C ATOM 0 H THR A 40 8.582 -4.979 1.617 1.00 0.00 H new ATOM 0 HA THR A 40 7.783 -3.276 -0.465 1.00 0.00 H new ATOM 0 HB THR A 40 6.679 -1.968 1.309 1.00 0.00 H new ATOM 0 HG1 THR A 40 8.417 -3.497 2.902 1.00 0.00 H new ATOM 0 HG21 THR A 40 5.203 -3.781 2.123 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.586 -3.972 0.396 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.408 -4.985 1.607 1.00 0.00 H new ATOM 383 N GLN A 41 10.208 -2.227 1.494 1.00 0.00 N ATOM 384 CA GLN A 41 11.267 -1.246 1.612 1.00 0.00 C ATOM 385 C GLN A 41 12.237 -1.346 0.450 1.00 0.00 C ATOM 386 O GLN A 41 12.749 -0.335 -0.015 1.00 0.00 O ATOM 387 CB GLN A 41 12.003 -1.375 2.942 1.00 0.00 C ATOM 388 CG GLN A 41 11.160 -0.972 4.136 1.00 0.00 C ATOM 389 CD GLN A 41 10.319 0.256 3.847 1.00 0.00 C ATOM 390 OE1 GLN A 41 10.913 1.427 3.990 1.00 0.00 O flip ATOM 391 NE2 GLN A 41 9.154 0.147 3.458 1.00 0.00 N flip ATOM 0 H GLN A 41 10.260 -2.989 2.170 1.00 0.00 H new ATOM 0 HA GLN A 41 10.802 -0.261 1.583 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.331 -2.407 3.069 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.900 -0.757 2.914 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.509 -1.800 4.416 1.00 0.00 H new ATOM 0 HG3 GLN A 41 11.810 -0.774 4.989 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.733 -0.777 3.361 1.00 0.00 H new ATOM 0 HE22 GLN A 41 8.611 0.981 3.233 1.00 0.00 H new ATOM 400 N ASP A 42 12.485 -2.567 -0.012 1.00 0.00 N ATOM 401 CA ASP A 42 13.354 -2.791 -1.167 1.00 0.00 C ATOM 402 C ASP A 42 12.848 -1.991 -2.356 1.00 0.00 C ATOM 403 O ASP A 42 13.557 -1.119 -2.902 1.00 0.00 O ATOM 404 CB ASP A 42 13.388 -4.282 -1.535 1.00 0.00 C ATOM 405 CG ASP A 42 14.216 -4.558 -2.773 1.00 0.00 C ATOM 406 OD1 ASP A 42 15.373 -4.089 -2.834 1.00 0.00 O ATOM 407 OD2 ASP A 42 13.721 -5.259 -3.687 1.00 0.00 O ATOM 0 H ASP A 42 12.097 -3.419 0.394 1.00 0.00 H new ATOM 0 HA ASP A 42 14.362 -2.467 -0.908 1.00 0.00 H new ATOM 0 HB2 ASP A 42 13.793 -4.850 -0.697 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.370 -4.636 -1.697 1.00 0.00 H new ATOM 410 N ALA A 43 11.613 -2.267 -2.735 1.00 0.00 N ATOM 411 CA ALA A 43 10.989 -1.583 -3.838 1.00 0.00 C ATOM 412 C ALA A 43 10.894 -0.076 -3.554 1.00 0.00 C ATOM 413 O ALA A 43 11.311 0.743 -4.378 1.00 0.00 O ATOM 414 CB ALA A 43 9.615 -2.190 -4.124 1.00 0.00 C ATOM 0 H ALA A 43 11.023 -2.968 -2.286 1.00 0.00 H new ATOM 0 HA ALA A 43 11.604 -1.710 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.152 -1.665 -4.960 1.00 0.00 H new ATOM 0 HB2 ALA A 43 9.728 -3.244 -4.376 1.00 0.00 H new ATOM 0 HB3 ALA A 43 8.984 -2.094 -3.241 1.00 0.00 H new ATOM 420 N CYS A 44 10.382 0.275 -2.366 1.00 0.00 N ATOM 421 CA CYS A 44 10.230 1.677 -1.960 1.00 0.00 C ATOM 422 C CYS A 44 11.530 2.455 -2.144 1.00 0.00 C ATOM 423 O CYS A 44 11.561 3.457 -2.856 1.00 0.00 O ATOM 424 CB CYS A 44 9.778 1.764 -0.495 1.00 0.00 C ATOM 425 SG CYS A 44 9.545 3.451 0.125 1.00 0.00 S ATOM 0 H CYS A 44 10.065 -0.397 -1.667 1.00 0.00 H new ATOM 0 HA CYS A 44 9.470 2.124 -2.600 1.00 0.00 H new ATOM 0 HB2 CYS A 44 8.841 1.218 -0.385 1.00 0.00 H new ATOM 0 HB3 CYS A 44 10.516 1.260 0.129 1.00 0.00 H new ATOM 0 HG CYS A 44 9.877 3.502 1.381 1.00 0.00 H new ATOM 431 N ALA A 45 12.601 1.969 -1.519 1.00 0.00 N ATOM 432 CA ALA A 45 13.903 2.622 -1.579 1.00 0.00 C ATOM 433 C ALA A 45 14.376 2.801 -3.012 1.00 0.00 C ATOM 434 O ALA A 45 14.917 3.860 -3.370 1.00 0.00 O ATOM 435 CB ALA A 45 14.927 1.837 -0.779 1.00 0.00 C ATOM 0 H ALA A 45 12.589 1.116 -0.960 1.00 0.00 H new ATOM 0 HA ALA A 45 13.795 3.614 -1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.894 2.338 -0.834 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.608 1.778 0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 45 15.016 0.831 -1.189 1.00 0.00 H new ATOM 441 N LYS A 46 14.161 1.783 -3.840 1.00 0.00 N ATOM 442 CA LYS A 46 14.587 1.849 -5.228 1.00 0.00 C ATOM 443 C LYS A 46 13.891 3.000 -5.966 1.00 0.00 C ATOM 444 O LYS A 46 14.556 3.851 -6.569 1.00 0.00 O ATOM 445 CB LYS A 46 14.348 0.521 -5.938 1.00 0.00 C ATOM 446 CG LYS A 46 15.033 0.430 -7.293 1.00 0.00 C ATOM 447 CD LYS A 46 14.912 -0.961 -7.896 1.00 0.00 C ATOM 448 CE LYS A 46 15.549 -2.025 -7.005 1.00 0.00 C ATOM 449 NZ LYS A 46 16.977 -1.736 -6.713 1.00 0.00 N ATOM 0 H LYS A 46 13.699 0.913 -3.575 1.00 0.00 H new ATOM 0 HA LYS A 46 15.659 2.046 -5.238 1.00 0.00 H new ATOM 0 HB2 LYS A 46 14.704 -0.291 -5.304 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.276 0.376 -6.070 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.593 1.160 -7.972 1.00 0.00 H new ATOM 0 HG3 LYS A 46 16.086 0.689 -7.186 1.00 0.00 H new ATOM 0 HD2 LYS A 46 13.860 -1.199 -8.051 1.00 0.00 H new ATOM 0 HD3 LYS A 46 15.389 -0.975 -8.876 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.995 -2.090 -6.068 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.470 -2.997 -7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.415 -2.567 -6.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.475 -1.515 -7.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.042 -0.923 -6.068 1.00 0.00 H new ATOM 452 N MET A 47 12.557 3.048 -5.905 1.00 0.00 N ATOM 453 CA MET A 47 11.837 4.134 -6.573 1.00 0.00 C ATOM 454 C MET A 47 12.091 5.464 -5.898 1.00 0.00 C ATOM 455 O MET A 47 11.970 6.507 -6.529 1.00 0.00 O ATOM 456 CB MET A 47 10.336 3.878 -6.695 1.00 0.00 C ATOM 457 CG MET A 47 9.965 2.879 -7.781 1.00 0.00 C ATOM 458 SD MET A 47 10.169 1.190 -7.252 1.00 0.00 S ATOM 459 CE MET A 47 8.830 1.089 -6.081 1.00 0.00 C ATOM 0 H MET A 47 11.970 2.371 -5.417 1.00 0.00 H new ATOM 0 HA MET A 47 12.235 4.171 -7.587 1.00 0.00 H new ATOM 0 HB2 MET A 47 9.961 3.515 -5.738 1.00 0.00 H new ATOM 0 HB3 MET A 47 9.832 4.823 -6.897 1.00 0.00 H new ATOM 0 HG2 MET A 47 8.929 3.040 -8.080 1.00 0.00 H new ATOM 0 HG3 MET A 47 10.583 3.058 -8.661 1.00 0.00 H new ATOM 0 HE1 MET A 47 8.620 0.043 -5.858 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.109 1.606 -5.163 1.00 0.00 H new ATOM 0 HE3 MET A 47 7.941 1.556 -6.504 1.00 0.00 H new ATOM 469 N ARG A 48 12.437 5.436 -4.609 1.00 0.00 N ATOM 470 CA ARG A 48 12.797 6.663 -3.908 1.00 0.00 C ATOM 471 C ARG A 48 13.974 7.313 -4.616 1.00 0.00 C ATOM 472 O ARG A 48 13.947 8.495 -4.952 1.00 0.00 O ATOM 473 CB ARG A 48 13.224 6.396 -2.464 1.00 0.00 C ATOM 474 CG ARG A 48 12.114 6.121 -1.477 1.00 0.00 C ATOM 475 CD ARG A 48 12.699 6.043 -0.077 1.00 0.00 C ATOM 476 NE ARG A 48 11.707 5.765 0.950 1.00 0.00 N ATOM 477 CZ ARG A 48 11.671 6.386 2.131 1.00 0.00 C ATOM 478 NH1 ARG A 48 12.510 7.382 2.392 1.00 0.00 N ATOM 479 NH2 ARG A 48 10.806 6.015 3.041 1.00 0.00 N ATOM 0 H ARG A 48 12.474 4.590 -4.040 1.00 0.00 H new ATOM 0 HA ARG A 48 11.916 7.305 -3.905 1.00 0.00 H new ATOM 0 HB2 ARG A 48 13.904 5.544 -2.460 1.00 0.00 H new ATOM 0 HB3 ARG A 48 13.791 7.257 -2.110 1.00 0.00 H new ATOM 0 HG2 ARG A 48 11.363 6.909 -1.527 1.00 0.00 H new ATOM 0 HG3 ARG A 48 11.612 5.186 -1.727 1.00 0.00 H new ATOM 0 HD2 ARG A 48 13.463 5.266 -0.053 1.00 0.00 H new ATOM 0 HD3 ARG A 48 13.196 6.985 0.154 1.00 0.00 H new ATOM 0 HE ARG A 48 11.000 5.056 0.757 1.00 0.00 H new ATOM 0 HH11 ARG A 48 13.187 7.676 1.688 1.00 0.00 H new ATOM 0 HH12 ARG A 48 12.477 7.853 3.296 1.00 0.00 H new ATOM 0 HH21 ARG A 48 10.159 5.251 2.848 1.00 0.00 H new ATOM 0 HH22 ARG A 48 10.779 6.490 3.943 1.00 0.00 H new ATOM 482 N ALA A 49 15.014 6.511 -4.839 1.00 0.00 N ATOM 483 CA ALA A 49 16.227 6.975 -5.492 1.00 0.00 C ATOM 484 C ALA A 49 15.967 7.324 -6.951 1.00 0.00 C ATOM 485 O ALA A 49 16.592 8.225 -7.508 1.00 0.00 O ATOM 486 CB ALA A 49 17.321 5.926 -5.381 1.00 0.00 C ATOM 0 H ALA A 49 15.035 5.527 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 49 16.559 7.881 -4.985 1.00 0.00 H new ATOM 0 HB1 ALA A 49 18.223 6.288 -5.875 1.00 0.00 H new ATOM 0 HB2 ALA A 49 17.535 5.733 -4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 49 16.991 5.004 -5.859 1.00 0.00 H new ATOM 492 N ASN A 50 15.045 6.612 -7.558 1.00 0.00 N ATOM 493 CA ASN A 50 14.697 6.841 -8.954 1.00 0.00 C ATOM 494 C ASN A 50 13.909 8.150 -9.134 1.00 0.00 C ATOM 495 O ASN A 50 14.208 8.950 -10.024 1.00 0.00 O ATOM 496 CB ASN A 50 13.879 5.655 -9.489 1.00 0.00 C ATOM 497 CG ASN A 50 13.592 5.750 -10.976 1.00 0.00 C ATOM 498 OD1 ASN A 50 14.375 6.314 -11.738 1.00 0.00 O ATOM 499 ND2 ASN A 50 12.470 5.192 -11.396 1.00 0.00 N ATOM 0 H ASN A 50 14.516 5.864 -7.109 1.00 0.00 H new ATOM 0 HA ASN A 50 15.623 6.931 -9.521 1.00 0.00 H new ATOM 0 HB2 ASN A 50 14.419 4.730 -9.288 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.935 5.598 -8.946 1.00 0.00 H new ATOM 0 HD21 ASN A 50 12.226 5.219 -12.386 1.00 0.00 H new ATOM 0 HD22 ASN A 50 11.848 4.734 -10.730 1.00 0.00 H new ATOM 506 N CYS A 51 12.937 8.374 -8.258 1.00 0.00 N ATOM 507 CA CYS A 51 12.044 9.529 -8.356 1.00 0.00 C ATOM 508 C CYS A 51 12.696 10.833 -7.874 1.00 0.00 C ATOM 509 O CYS A 51 12.185 11.921 -8.147 1.00 0.00 O ATOM 510 CB CYS A 51 10.747 9.265 -7.578 1.00 0.00 C ATOM 511 SG CYS A 51 9.494 10.560 -7.745 1.00 0.00 S ATOM 0 H CYS A 51 12.744 7.765 -7.463 1.00 0.00 H new ATOM 0 HA CYS A 51 11.817 9.663 -9.414 1.00 0.00 H new ATOM 0 HB2 CYS A 51 10.322 8.320 -7.916 1.00 0.00 H new ATOM 0 HB3 CYS A 51 10.990 9.146 -6.522 1.00 0.00 H new ATOM 0 HG CYS A 51 10.076 11.702 -7.964 1.00 0.00 H new ATOM 517 N GLN A 52 13.811 10.734 -7.159 1.00 0.00 N ATOM 518 CA GLN A 52 14.492 11.937 -6.669 1.00 0.00 C ATOM 519 C GLN A 52 15.404 12.522 -7.738 1.00 0.00 C ATOM 520 O GLN A 52 16.033 13.559 -7.532 1.00 0.00 O ATOM 521 CB GLN A 52 15.278 11.659 -5.387 1.00 0.00 C ATOM 522 CG GLN A 52 16.378 10.632 -5.542 1.00 0.00 C ATOM 523 CD GLN A 52 17.088 10.350 -4.240 1.00 0.00 C ATOM 524 OE1 GLN A 52 16.543 9.440 -3.467 1.00 0.00 O flip ATOM 525 NE2 GLN A 52 18.108 10.961 -3.923 1.00 0.00 N flip ATOM 0 H GLN A 52 14.260 9.853 -6.907 1.00 0.00 H new ATOM 0 HA GLN A 52 13.721 12.671 -6.434 1.00 0.00 H new ATOM 0 HB2 GLN A 52 15.716 12.593 -5.033 1.00 0.00 H new ATOM 0 HB3 GLN A 52 14.586 11.319 -4.617 1.00 0.00 H new ATOM 0 HG2 GLN A 52 15.955 9.706 -5.930 1.00 0.00 H new ATOM 0 HG3 GLN A 52 17.100 10.985 -6.278 1.00 0.00 H new ATOM 0 HE21 GLN A 52 18.500 11.661 -4.553 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.562 10.767 -3.030 1.00 0.00 H new ATOM 534 N LYS A 53 15.483 11.849 -8.869 1.00 0.00 N ATOM 535 CA LYS A 53 16.272 12.335 -9.982 1.00 0.00 C ATOM 536 C LYS A 53 15.352 12.981 -11.006 1.00 0.00 C ATOM 537 O LYS A 53 14.142 13.040 -10.808 1.00 0.00 O ATOM 538 CB LYS A 53 17.055 11.194 -10.646 1.00 0.00 C ATOM 539 CG LYS A 53 17.950 10.399 -9.708 1.00 0.00 C ATOM 540 CD LYS A 53 18.890 9.499 -10.495 1.00 0.00 C ATOM 541 CE LYS A 53 19.633 8.522 -9.596 1.00 0.00 C ATOM 542 NZ LYS A 53 18.734 7.477 -9.045 1.00 0.00 N ATOM 0 H LYS A 53 15.009 10.962 -9.041 1.00 0.00 H new ATOM 0 HA LYS A 53 16.987 13.066 -9.605 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.346 10.511 -11.114 1.00 0.00 H new ATOM 0 HB3 LYS A 53 17.669 11.611 -11.444 1.00 0.00 H new ATOM 0 HG2 LYS A 53 18.529 11.081 -9.085 1.00 0.00 H new ATOM 0 HG3 LYS A 53 17.338 9.796 -9.037 1.00 0.00 H new ATOM 0 HD2 LYS A 53 18.320 8.944 -11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 53 19.610 10.113 -11.036 1.00 0.00 H new ATOM 0 HE2 LYS A 53 20.436 8.048 -10.161 1.00 0.00 H new ATOM 0 HE3 LYS A 53 20.100 9.068 -8.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 19.304 6.715 -8.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 18.123 7.895 -8.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 18.145 7.088 -9.809 1.00 0.00 H new ATOM 545 N SER A 54 15.916 13.448 -12.095 1.00 0.00 N ATOM 546 CA SER A 54 15.133 14.051 -13.158 1.00 0.00 C ATOM 547 C SER A 54 14.786 12.981 -14.201 1.00 0.00 C ATOM 548 O SER A 54 14.622 13.269 -15.392 1.00 0.00 O ATOM 549 CB SER A 54 15.921 15.208 -13.795 1.00 0.00 C ATOM 550 OG SER A 54 15.131 15.933 -14.727 1.00 0.00 O ATOM 0 H SER A 54 16.920 13.423 -12.272 1.00 0.00 H new ATOM 0 HA SER A 54 14.206 14.456 -12.752 1.00 0.00 H new ATOM 0 HB2 SER A 54 16.272 15.882 -13.014 1.00 0.00 H new ATOM 0 HB3 SER A 54 16.805 14.813 -14.297 1.00 0.00 H new ATOM 0 HG SER A 54 14.656 15.306 -15.311 1.00 0.00 H new ATOM 556 N THR A 55 14.656 11.746 -13.723 1.00 0.00 N ATOM 557 CA THR A 55 14.353 10.596 -14.553 1.00 0.00 C ATOM 558 C THR A 55 13.069 10.810 -15.342 1.00 0.00 C ATOM 559 O THR A 55 11.985 10.818 -14.778 1.00 0.00 O ATOM 560 CB THR A 55 14.205 9.337 -13.680 1.00 0.00 C ATOM 561 OG1 THR A 55 15.270 9.297 -12.715 1.00 0.00 O ATOM 562 CG2 THR A 55 14.250 8.077 -14.535 1.00 0.00 C ATOM 0 H THR A 55 14.761 11.519 -12.734 1.00 0.00 H new ATOM 0 HA THR A 55 15.178 10.466 -15.254 1.00 0.00 H new ATOM 0 HB THR A 55 13.242 9.378 -13.172 1.00 0.00 H new ATOM 0 HG1 THR A 55 14.896 9.150 -11.821 1.00 0.00 H new ATOM 0 HG21 THR A 55 14.144 7.200 -13.896 1.00 0.00 H new ATOM 0 HG22 THR A 55 13.436 8.100 -15.259 1.00 0.00 H new ATOM 0 HG23 THR A 55 15.203 8.029 -15.062 1.00 0.00 H new ATOM 569 N GLU A 56 13.211 11.024 -16.645 1.00 0.00 N ATOM 570 CA GLU A 56 12.069 11.225 -17.538 1.00 0.00 C ATOM 571 C GLU A 56 11.250 12.450 -17.109 1.00 0.00 C ATOM 572 O GLU A 56 10.052 12.533 -17.386 1.00 0.00 O ATOM 573 CB GLU A 56 11.178 9.970 -17.558 1.00 0.00 C ATOM 574 CG GLU A 56 11.927 8.676 -17.865 1.00 0.00 C ATOM 575 CD GLU A 56 12.610 8.696 -19.213 1.00 0.00 C ATOM 576 OE1 GLU A 56 11.945 8.389 -20.222 1.00 0.00 O ATOM 577 OE2 GLU A 56 13.819 9.010 -19.273 1.00 0.00 O ATOM 0 H GLU A 56 14.116 11.064 -17.114 1.00 0.00 H new ATOM 0 HA GLU A 56 12.450 11.402 -18.544 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.687 9.871 -16.590 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.393 10.107 -18.301 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.672 8.501 -17.089 1.00 0.00 H new ATOM 0 HG3 GLU A 56 11.228 7.841 -17.830 1.00 0.00 H new ATOM 580 N GLN A 57 11.920 13.398 -16.430 1.00 0.00 N ATOM 581 CA GLN A 57 11.292 14.640 -15.947 1.00 0.00 C ATOM 582 C GLN A 57 10.287 14.348 -14.811 1.00 0.00 C ATOM 583 O GLN A 57 9.391 15.152 -14.527 1.00 0.00 O ATOM 584 CB GLN A 57 10.599 15.384 -17.105 1.00 0.00 C ATOM 585 CG GLN A 57 10.201 16.818 -16.783 1.00 0.00 C ATOM 586 CD GLN A 57 9.241 17.394 -17.799 1.00 0.00 C ATOM 587 OE1 GLN A 57 9.257 17.021 -18.971 1.00 0.00 O ATOM 588 NE2 GLN A 57 8.400 18.309 -17.362 1.00 0.00 N ATOM 0 H GLN A 57 12.911 13.325 -16.201 1.00 0.00 H new ATOM 0 HA GLN A 57 12.078 15.280 -15.546 1.00 0.00 H new ATOM 0 HB2 GLN A 57 11.266 15.390 -17.967 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.707 14.829 -17.395 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.742 16.851 -15.795 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.096 17.439 -16.740 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.418 18.592 -16.382 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.731 18.735 -18.004 1.00 0.00 H new ATOM 597 N MET A 58 10.443 13.205 -14.159 1.00 0.00 N ATOM 598 CA MET A 58 9.550 12.837 -13.067 1.00 0.00 C ATOM 599 C MET A 58 9.855 13.667 -11.824 1.00 0.00 C ATOM 600 O MET A 58 11.015 13.893 -11.479 1.00 0.00 O ATOM 601 CB MET A 58 9.653 11.332 -12.743 1.00 0.00 C ATOM 602 CG MET A 58 10.928 10.925 -12.003 1.00 0.00 C ATOM 603 SD MET A 58 11.162 9.133 -11.929 1.00 0.00 S ATOM 604 CE MET A 58 9.646 8.618 -11.133 1.00 0.00 C ATOM 0 H MET A 58 11.172 12.521 -14.363 1.00 0.00 H new ATOM 0 HA MET A 58 8.529 13.045 -13.387 1.00 0.00 H new ATOM 0 HB2 MET A 58 8.791 11.044 -12.141 1.00 0.00 H new ATOM 0 HB3 MET A 58 9.594 10.769 -13.674 1.00 0.00 H new ATOM 0 HG2 MET A 58 11.788 11.378 -12.496 1.00 0.00 H new ATOM 0 HG3 MET A 58 10.896 11.324 -10.989 1.00 0.00 H new ATOM 0 HE1 MET A 58 9.833 7.724 -10.538 1.00 0.00 H new ATOM 0 HE2 MET A 58 9.286 9.417 -10.484 1.00 0.00 H new ATOM 0 HE3 MET A 58 8.893 8.399 -11.891 1.00 0.00 H new ATOM 614 N LYS A 59 8.814 14.143 -11.180 1.00 0.00 N ATOM 615 CA LYS A 59 8.955 14.912 -9.954 1.00 0.00 C ATOM 616 C LYS A 59 7.851 14.544 -8.984 1.00 0.00 C ATOM 617 O LYS A 59 8.034 14.581 -7.770 1.00 0.00 O ATOM 618 CB LYS A 59 8.951 16.420 -10.242 1.00 0.00 C ATOM 619 CG LYS A 59 7.746 16.910 -11.041 1.00 0.00 C ATOM 620 CD LYS A 59 7.795 18.418 -11.254 1.00 0.00 C ATOM 621 CE LYS A 59 9.077 18.837 -11.957 1.00 0.00 C ATOM 622 NZ LYS A 59 9.144 20.301 -12.169 1.00 0.00 N ATOM 0 H LYS A 59 7.849 14.012 -11.485 1.00 0.00 H new ATOM 0 HA LYS A 59 9.916 14.668 -9.501 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.985 16.958 -9.295 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.860 16.675 -10.787 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.719 16.405 -12.007 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.828 16.645 -10.517 1.00 0.00 H new ATOM 0 HD2 LYS A 59 6.935 18.732 -11.845 1.00 0.00 H new ATOM 0 HD3 LYS A 59 7.723 18.926 -10.292 1.00 0.00 H new ATOM 0 HE2 LYS A 59 9.935 18.517 -11.366 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.145 18.329 -12.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 10.034 20.542 -12.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 8.340 20.604 -12.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.105 20.787 -11.250 1.00 0.00 H new ATOM 625 N LYS A 60 6.707 14.191 -9.528 1.00 0.00 N ATOM 626 CA LYS A 60 5.585 13.752 -8.740 1.00 0.00 C ATOM 627 C LYS A 60 5.016 12.483 -9.331 1.00 0.00 C ATOM 628 O LYS A 60 5.399 12.069 -10.432 1.00 0.00 O ATOM 629 CB LYS A 60 4.498 14.836 -8.653 1.00 0.00 C ATOM 630 CG LYS A 60 4.875 16.046 -7.798 1.00 0.00 C ATOM 631 CD LYS A 60 5.166 15.659 -6.343 1.00 0.00 C ATOM 632 CE LYS A 60 3.959 15.010 -5.669 1.00 0.00 C ATOM 633 NZ LYS A 60 4.244 14.645 -4.255 1.00 0.00 N ATOM 0 H LYS A 60 6.532 14.202 -10.533 1.00 0.00 H new ATOM 0 HA LYS A 60 5.935 13.556 -7.726 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.263 15.178 -9.661 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.590 14.390 -8.248 1.00 0.00 H new ATOM 0 HG2 LYS A 60 5.752 16.532 -8.225 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.064 16.774 -7.823 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.011 14.971 -6.313 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.459 16.547 -5.784 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.112 15.695 -5.704 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.670 14.117 -6.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.400 14.207 -3.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.036 13.972 -4.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.495 15.500 -3.720 1.00 0.00 H new ATOM 636 N VAL A 61 4.117 11.872 -8.612 1.00 0.00 N ATOM 637 CA VAL A 61 3.506 10.643 -9.040 1.00 0.00 C ATOM 638 C VAL A 61 1.988 10.798 -9.136 1.00 0.00 C ATOM 639 O VAL A 61 1.381 11.520 -8.335 1.00 0.00 O ATOM 640 CB VAL A 61 3.886 9.478 -8.102 1.00 0.00 C ATOM 641 CG1 VAL A 61 5.249 8.931 -8.484 1.00 0.00 C ATOM 642 CG2 VAL A 61 3.915 9.940 -6.654 1.00 0.00 C ATOM 0 H VAL A 61 3.785 12.212 -7.709 1.00 0.00 H new ATOM 0 HA VAL A 61 3.885 10.406 -10.034 1.00 0.00 H new ATOM 0 HB VAL A 61 3.134 8.696 -8.206 1.00 0.00 H new ATOM 0 HG11 VAL A 61 5.511 8.109 -7.818 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.221 8.570 -9.512 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.995 9.721 -8.397 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.185 9.103 -6.010 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.650 10.737 -6.541 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.930 10.312 -6.371 1.00 0.00 H new ATOM 652 N PRO A 62 1.367 10.140 -10.132 1.00 0.00 N ATOM 653 CA PRO A 62 -0.078 10.252 -10.400 1.00 0.00 C ATOM 654 C PRO A 62 -0.948 9.767 -9.242 1.00 0.00 C ATOM 655 O PRO A 62 -0.626 8.783 -8.565 1.00 0.00 O ATOM 656 CB PRO A 62 -0.288 9.362 -11.633 1.00 0.00 C ATOM 657 CG PRO A 62 0.878 8.435 -11.638 1.00 0.00 C ATOM 658 CD PRO A 62 2.026 9.219 -11.075 1.00 0.00 C ATOM 0 HA PRO A 62 -0.371 11.292 -10.546 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -1.228 8.814 -11.570 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -0.326 9.955 -12.547 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.676 7.550 -11.035 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.098 8.089 -12.648 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.747 8.574 -10.572 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.567 9.757 -11.853 1.00 0.00 H new ATOM 666 N THR A 63 -2.052 10.459 -9.026 1.00 0.00 N ATOM 667 CA THR A 63 -2.972 10.118 -7.969 1.00 0.00 C ATOM 668 C THR A 63 -3.813 8.897 -8.343 1.00 0.00 C ATOM 669 O THR A 63 -4.438 8.854 -9.406 1.00 0.00 O ATOM 670 CB THR A 63 -3.894 11.301 -7.639 1.00 0.00 C ATOM 671 OG1 THR A 63 -3.096 12.472 -7.418 1.00 0.00 O ATOM 672 CG2 THR A 63 -4.718 11.010 -6.391 1.00 0.00 C ATOM 0 H THR A 63 -2.331 11.269 -9.579 1.00 0.00 H new ATOM 0 HA THR A 63 -2.379 9.877 -7.087 1.00 0.00 H new ATOM 0 HB THR A 63 -4.574 11.461 -8.476 1.00 0.00 H new ATOM 0 HG1 THR A 63 -3.680 13.231 -7.208 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.364 11.861 -6.175 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.329 10.123 -6.557 1.00 0.00 H new ATOM 0 HG23 THR A 63 -4.051 10.838 -5.546 1.00 0.00 H new ATOM 679 N ILE A 64 -3.812 7.921 -7.469 1.00 0.00 N ATOM 680 CA ILE A 64 -4.548 6.703 -7.667 1.00 0.00 C ATOM 681 C ILE A 64 -5.587 6.544 -6.543 1.00 0.00 C ATOM 682 O ILE A 64 -5.273 6.700 -5.361 1.00 0.00 O ATOM 683 CB ILE A 64 -3.567 5.474 -7.736 1.00 0.00 C ATOM 684 CG1 ILE A 64 -4.299 4.158 -8.083 1.00 0.00 C ATOM 685 CG2 ILE A 64 -2.759 5.330 -6.448 1.00 0.00 C ATOM 686 CD1 ILE A 64 -4.971 3.475 -6.912 1.00 0.00 C ATOM 0 H ILE A 64 -3.293 7.953 -6.591 1.00 0.00 H new ATOM 0 HA ILE A 64 -5.079 6.745 -8.618 1.00 0.00 H new ATOM 0 HB ILE A 64 -2.870 5.677 -8.549 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.051 4.367 -8.843 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -3.582 3.466 -8.526 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.092 4.472 -6.531 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.170 6.233 -6.285 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.437 5.183 -5.608 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.457 2.561 -7.254 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.224 3.228 -6.157 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -5.716 4.143 -6.480 1.00 0.00 H new ATOM 697 N ILE A 65 -6.819 6.275 -6.927 1.00 0.00 N ATOM 698 CA ILE A 65 -7.902 6.110 -5.980 1.00 0.00 C ATOM 699 C ILE A 65 -7.946 4.682 -5.463 1.00 0.00 C ATOM 700 O ILE A 65 -8.148 3.732 -6.227 1.00 0.00 O ATOM 701 CB ILE A 65 -9.269 6.477 -6.604 1.00 0.00 C ATOM 702 CG1 ILE A 65 -9.230 7.911 -7.137 1.00 0.00 C ATOM 703 CG2 ILE A 65 -10.392 6.310 -5.579 1.00 0.00 C ATOM 704 CD1 ILE A 65 -10.543 8.392 -7.710 1.00 0.00 C ATOM 0 H ILE A 65 -7.096 6.165 -7.902 1.00 0.00 H new ATOM 0 HA ILE A 65 -7.711 6.791 -5.151 1.00 0.00 H new ATOM 0 HB ILE A 65 -9.470 5.800 -7.435 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.932 8.579 -6.329 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -8.462 7.980 -7.908 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -11.345 6.573 -6.038 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -10.425 5.274 -5.241 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -10.207 6.964 -4.727 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -10.431 9.416 -8.066 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -10.835 7.749 -8.541 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -11.311 8.358 -6.938 1.00 0.00 H new ATOM 715 N LEU A 66 -7.748 4.548 -4.175 1.00 0.00 N ATOM 716 CA LEU A 66 -7.742 3.267 -3.521 1.00 0.00 C ATOM 717 C LEU A 66 -9.089 2.988 -2.904 1.00 0.00 C ATOM 718 O LEU A 66 -9.449 3.575 -1.886 1.00 0.00 O ATOM 719 CB LEU A 66 -6.667 3.237 -2.439 1.00 0.00 C ATOM 720 CG LEU A 66 -5.233 3.366 -2.935 1.00 0.00 C ATOM 721 CD1 LEU A 66 -4.289 3.547 -1.776 1.00 0.00 C ATOM 722 CD2 LEU A 66 -4.844 2.144 -3.733 1.00 0.00 C ATOM 0 H LEU A 66 -7.585 5.335 -3.546 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.526 2.499 -4.264 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.863 4.045 -1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -6.759 2.302 -1.886 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.168 4.244 -3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.269 3.637 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.556 4.450 -1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.358 2.685 -1.113 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.817 2.249 -4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.925 1.258 -3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.509 2.042 -4.590 1.00 0.00 H new ATOM 734 N SER A 67 -9.837 2.116 -3.529 1.00 0.00 N ATOM 735 CA SER A 67 -11.126 1.731 -3.026 1.00 0.00 C ATOM 736 C SER A 67 -11.002 0.414 -2.302 1.00 0.00 C ATOM 737 O SER A 67 -10.941 -0.652 -2.916 1.00 0.00 O ATOM 738 CB SER A 67 -12.124 1.636 -4.166 1.00 0.00 C ATOM 739 OG SER A 67 -13.434 1.376 -3.700 1.00 0.00 O ATOM 0 H SER A 67 -9.569 1.655 -4.398 1.00 0.00 H new ATOM 0 HA SER A 67 -11.489 2.484 -2.326 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.118 2.567 -4.732 1.00 0.00 H new ATOM 0 HB3 SER A 67 -11.819 0.845 -4.851 1.00 0.00 H new ATOM 0 HG SER A 67 -13.986 2.179 -3.810 1.00 0.00 H new ATOM 745 N VAL A 68 -10.925 0.493 -1.004 1.00 0.00 N ATOM 746 CA VAL A 68 -10.744 -0.692 -0.185 1.00 0.00 C ATOM 747 C VAL A 68 -12.006 -1.044 0.594 1.00 0.00 C ATOM 748 O VAL A 68 -12.510 -0.250 1.391 1.00 0.00 O ATOM 749 CB VAL A 68 -9.517 -0.552 0.779 1.00 0.00 C ATOM 750 CG1 VAL A 68 -9.579 0.739 1.575 1.00 0.00 C ATOM 751 CG2 VAL A 68 -9.418 -1.751 1.719 1.00 0.00 C ATOM 0 H VAL A 68 -10.984 1.366 -0.480 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.538 -1.514 -0.870 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.621 -0.523 0.159 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.712 0.803 2.233 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.579 1.588 0.892 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.490 0.754 2.173 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.558 -1.628 2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.326 -1.820 2.318 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.299 -2.663 1.134 1.00 0.00 H new ATOM 761 N SER A 69 -12.525 -2.226 0.339 1.00 0.00 N ATOM 762 CA SER A 69 -13.687 -2.713 1.039 1.00 0.00 C ATOM 763 C SER A 69 -13.389 -4.090 1.608 1.00 0.00 C ATOM 764 O SER A 69 -12.485 -4.784 1.129 1.00 0.00 O ATOM 765 CB SER A 69 -14.905 -2.769 0.102 1.00 0.00 C ATOM 766 OG SER A 69 -14.715 -3.716 -0.935 1.00 0.00 O ATOM 0 H SER A 69 -12.153 -2.872 -0.357 1.00 0.00 H new ATOM 0 HA SER A 69 -13.925 -2.029 1.854 1.00 0.00 H new ATOM 0 HB2 SER A 69 -15.795 -3.028 0.675 1.00 0.00 H new ATOM 0 HB3 SER A 69 -15.079 -1.784 -0.330 1.00 0.00 H new ATOM 0 HG SER A 69 -13.816 -3.613 -1.311 1.00 0.00 H new ATOM 772 N ALA A 70 -14.158 -4.501 2.603 1.00 0.00 N ATOM 773 CA ALA A 70 -13.948 -5.790 3.259 1.00 0.00 C ATOM 774 C ALA A 70 -14.263 -6.973 2.333 1.00 0.00 C ATOM 775 O ALA A 70 -14.136 -8.132 2.726 1.00 0.00 O ATOM 776 CB ALA A 70 -14.779 -5.870 4.528 1.00 0.00 C ATOM 0 H ALA A 70 -14.938 -3.961 2.978 1.00 0.00 H new ATOM 0 HA ALA A 70 -12.891 -5.859 3.515 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.616 -6.834 5.010 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.484 -5.070 5.207 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.835 -5.763 4.279 1.00 0.00 H new ATOM 782 N LYS A 71 -14.673 -6.680 1.106 1.00 0.00 N ATOM 783 CA LYS A 71 -15.003 -7.723 0.154 1.00 0.00 C ATOM 784 C LYS A 71 -14.217 -7.564 -1.148 1.00 0.00 C ATOM 785 O LYS A 71 -14.468 -8.281 -2.120 1.00 0.00 O ATOM 786 CB LYS A 71 -16.511 -7.744 -0.123 1.00 0.00 C ATOM 787 CG LYS A 71 -17.345 -8.063 1.109 1.00 0.00 C ATOM 788 CD LYS A 71 -18.830 -8.098 0.797 1.00 0.00 C ATOM 789 CE LYS A 71 -19.636 -8.412 2.048 1.00 0.00 C ATOM 790 NZ LYS A 71 -21.095 -8.453 1.783 1.00 0.00 N ATOM 0 H LYS A 71 -14.784 -5.730 0.751 1.00 0.00 H new ATOM 0 HA LYS A 71 -14.718 -8.677 0.597 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.814 -6.774 -0.517 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -16.721 -8.483 -0.897 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -17.037 -9.026 1.516 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.154 -7.316 1.879 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -19.143 -7.137 0.388 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.028 -8.849 0.033 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -19.315 -9.372 2.452 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -19.428 -7.660 2.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -21.602 -8.670 2.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -21.408 -7.529 1.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -21.299 -9.188 1.076 1.00 0.00 H new ATOM 793 N GLY A 72 -13.259 -6.644 -1.167 1.00 0.00 N ATOM 794 CA GLY A 72 -12.464 -6.445 -2.368 1.00 0.00 C ATOM 795 C GLY A 72 -11.798 -5.090 -2.410 1.00 0.00 C ATOM 796 O GLY A 72 -12.219 -4.162 -1.717 1.00 0.00 O ATOM 0 H GLY A 72 -13.019 -6.038 -0.383 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.702 -7.222 -2.427 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.103 -6.558 -3.244 1.00 0.00 H new ATOM 800 N VAL A 73 -10.758 -4.966 -3.219 1.00 0.00 N ATOM 801 CA VAL A 73 -10.036 -3.713 -3.339 1.00 0.00 C ATOM 802 C VAL A 73 -9.861 -3.335 -4.805 1.00 0.00 C ATOM 803 O VAL A 73 -9.463 -4.162 -5.638 1.00 0.00 O ATOM 804 CB VAL A 73 -8.654 -3.770 -2.639 1.00 0.00 C ATOM 805 CG1 VAL A 73 -7.999 -2.399 -2.630 1.00 0.00 C ATOM 806 CG2 VAL A 73 -8.799 -4.286 -1.223 1.00 0.00 C ATOM 0 H VAL A 73 -10.396 -5.720 -3.803 1.00 0.00 H new ATOM 0 HA VAL A 73 -10.632 -2.950 -2.838 1.00 0.00 H new ATOM 0 HB VAL A 73 -8.017 -4.455 -3.199 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -7.030 -2.462 -2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -7.860 -2.055 -3.655 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -8.636 -1.695 -2.094 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -7.820 -4.320 -0.746 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -9.455 -3.622 -0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -9.228 -5.288 -1.243 1.00 0.00 H new ATOM 816 N LYS A 74 -10.157 -2.095 -5.108 1.00 0.00 N ATOM 817 CA LYS A 74 -10.105 -1.592 -6.470 1.00 0.00 C ATOM 818 C LYS A 74 -9.128 -0.418 -6.563 1.00 0.00 C ATOM 819 O LYS A 74 -9.051 0.408 -5.651 1.00 0.00 O ATOM 820 CB LYS A 74 -11.508 -1.162 -6.887 1.00 0.00 C ATOM 821 CG LYS A 74 -11.706 -0.954 -8.378 1.00 0.00 C ATOM 822 CD LYS A 74 -13.125 -0.484 -8.674 1.00 0.00 C ATOM 823 CE LYS A 74 -14.160 -1.483 -8.173 1.00 0.00 C ATOM 824 NZ LYS A 74 -15.543 -0.983 -8.332 1.00 0.00 N ATOM 0 H LYS A 74 -10.442 -1.399 -4.419 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.752 -2.375 -7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.218 -1.915 -6.544 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.754 -0.234 -6.371 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.990 -0.219 -8.746 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -11.508 -1.885 -8.909 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.294 0.484 -8.203 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -13.246 -0.341 -9.748 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -14.050 -2.421 -8.717 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.973 -1.701 -7.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -16.213 -1.696 -7.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -15.658 -0.102 -7.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -15.732 -0.800 -9.338 1.00 0.00 H new ATOM 827 N PHE A 75 -8.383 -0.355 -7.659 1.00 0.00 N ATOM 828 CA PHE A 75 -7.371 0.679 -7.846 1.00 0.00 C ATOM 829 C PHE A 75 -7.592 1.402 -9.184 1.00 0.00 C ATOM 830 O PHE A 75 -7.413 0.807 -10.260 1.00 0.00 O ATOM 831 CB PHE A 75 -5.967 0.042 -7.819 1.00 0.00 C ATOM 832 CG PHE A 75 -5.819 -1.064 -6.801 1.00 0.00 C ATOM 833 CD1 PHE A 75 -5.456 -0.782 -5.501 1.00 0.00 C ATOM 834 CD2 PHE A 75 -6.046 -2.387 -7.154 1.00 0.00 C ATOM 835 CE1 PHE A 75 -5.322 -1.790 -4.569 1.00 0.00 C ATOM 836 CE2 PHE A 75 -5.914 -3.400 -6.230 1.00 0.00 C ATOM 837 CZ PHE A 75 -5.552 -3.102 -4.935 1.00 0.00 C ATOM 0 H PHE A 75 -8.461 -1.011 -8.436 1.00 0.00 H new ATOM 0 HA PHE A 75 -7.452 1.406 -7.038 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.739 -0.355 -8.808 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -5.230 0.817 -7.609 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -5.274 0.242 -5.209 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.330 -2.626 -8.168 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -5.038 -1.554 -3.554 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -6.094 -4.425 -6.520 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.448 -3.893 -4.207 1.00 0.00 H new ATOM 843 N ILE A 76 -7.984 2.676 -9.115 1.00 0.00 N ATOM 844 CA ILE A 76 -8.268 3.465 -10.323 1.00 0.00 C ATOM 845 C ILE A 76 -7.396 4.720 -10.373 1.00 0.00 C ATOM 846 O ILE A 76 -7.081 5.296 -9.353 1.00 0.00 O ATOM 847 CB ILE A 76 -9.764 3.928 -10.389 1.00 0.00 C ATOM 848 CG1 ILE A 76 -10.735 2.777 -10.086 1.00 0.00 C ATOM 849 CG2 ILE A 76 -10.085 4.543 -11.747 1.00 0.00 C ATOM 850 CD1 ILE A 76 -11.006 2.577 -8.607 1.00 0.00 C ATOM 0 H ILE A 76 -8.113 3.185 -8.240 1.00 0.00 H new ATOM 0 HA ILE A 76 -8.052 2.810 -11.167 1.00 0.00 H new ATOM 0 HB ILE A 76 -9.896 4.687 -9.618 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -11.679 2.967 -10.596 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.329 1.854 -10.500 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.129 4.856 -11.767 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -9.443 5.408 -11.916 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -9.912 3.805 -12.531 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.700 1.747 -8.473 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.071 2.355 -8.093 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.442 3.485 -8.191 1.00 0.00 H new ATOM 861 N ASP A 77 -7.020 5.126 -11.568 1.00 0.00 N ATOM 862 CA ASP A 77 -6.246 6.351 -11.765 1.00 0.00 C ATOM 863 C ASP A 77 -7.172 7.564 -11.747 1.00 0.00 C ATOM 864 O ASP A 77 -8.261 7.529 -12.327 1.00 0.00 O ATOM 865 CB ASP A 77 -5.495 6.297 -13.095 1.00 0.00 C ATOM 866 CG ASP A 77 -4.959 7.646 -13.519 1.00 0.00 C ATOM 867 OD1 ASP A 77 -3.927 8.089 -12.972 1.00 0.00 O ATOM 868 OD2 ASP A 77 -5.571 8.270 -14.400 1.00 0.00 O ATOM 0 H ASP A 77 -7.237 4.625 -12.430 1.00 0.00 H new ATOM 0 HA ASP A 77 -5.523 6.439 -10.954 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -4.668 5.592 -13.012 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -6.162 5.916 -13.869 1.00 0.00 H new ATOM 871 N ALA A 78 -6.745 8.629 -11.085 1.00 0.00 N ATOM 872 CA ALA A 78 -7.549 9.842 -10.993 1.00 0.00 C ATOM 873 C ALA A 78 -7.080 10.898 -11.991 1.00 0.00 C ATOM 874 O ALA A 78 -7.633 11.996 -12.051 1.00 0.00 O ATOM 875 CB ALA A 78 -7.506 10.397 -9.578 1.00 0.00 C ATOM 0 H ALA A 78 -5.847 8.680 -10.603 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.578 9.581 -11.241 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.110 11.302 -9.524 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -7.901 9.655 -8.884 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.476 10.632 -9.310 1.00 0.00 H new ATOM 881 N THR A 79 -6.075 10.557 -12.774 1.00 0.00 N ATOM 882 CA THR A 79 -5.517 11.473 -13.750 1.00 0.00 C ATOM 883 C THR A 79 -6.381 11.525 -15.011 1.00 0.00 C ATOM 884 O THR A 79 -6.814 12.600 -15.439 1.00 0.00 O ATOM 885 CB THR A 79 -4.084 11.050 -14.134 1.00 0.00 C ATOM 886 OG1 THR A 79 -3.322 10.783 -12.945 1.00 0.00 O ATOM 887 CG2 THR A 79 -3.394 12.139 -14.950 1.00 0.00 C ATOM 0 H THR A 79 -5.624 9.642 -12.752 1.00 0.00 H new ATOM 0 HA THR A 79 -5.493 12.463 -13.295 1.00 0.00 H new ATOM 0 HB THR A 79 -4.144 10.148 -14.743 1.00 0.00 H new ATOM 0 HG1 THR A 79 -3.381 9.830 -12.726 1.00 0.00 H new ATOM 0 HG21 THR A 79 -2.385 11.816 -15.208 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.961 12.324 -15.863 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.342 13.056 -14.363 1.00 0.00 H new ATOM 894 N ASN A 80 -6.640 10.366 -15.591 1.00 0.00 N ATOM 895 CA ASN A 80 -7.420 10.276 -16.820 1.00 0.00 C ATOM 896 C ASN A 80 -8.512 9.221 -16.668 1.00 0.00 C ATOM 897 O ASN A 80 -9.212 8.883 -17.624 1.00 0.00 O ATOM 898 CB ASN A 80 -6.489 9.930 -18.003 1.00 0.00 C ATOM 899 CG ASN A 80 -7.187 9.962 -19.358 1.00 0.00 C ATOM 900 OD1 ASN A 80 -8.136 10.718 -19.570 1.00 0.00 O ATOM 901 ND2 ASN A 80 -6.720 9.144 -20.280 1.00 0.00 N ATOM 0 H ASN A 80 -6.321 9.467 -15.230 1.00 0.00 H new ATOM 0 HA ASN A 80 -7.895 11.237 -17.019 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -5.656 10.632 -18.016 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -6.067 8.938 -17.844 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -7.147 9.123 -21.206 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -5.932 8.532 -20.067 1.00 0.00 H new ATOM 908 N LYS A 81 -8.654 8.714 -15.445 1.00 0.00 N ATOM 909 CA LYS A 81 -9.634 7.684 -15.125 1.00 0.00 C ATOM 910 C LYS A 81 -9.275 6.376 -15.821 1.00 0.00 C ATOM 911 O LYS A 81 -9.742 6.084 -16.927 1.00 0.00 O ATOM 912 CB LYS A 81 -11.074 8.132 -15.472 1.00 0.00 C ATOM 913 CG LYS A 81 -12.148 7.094 -15.152 1.00 0.00 C ATOM 914 CD LYS A 81 -12.216 6.786 -13.660 1.00 0.00 C ATOM 915 CE LYS A 81 -12.830 7.934 -12.866 1.00 0.00 C ATOM 916 NZ LYS A 81 -14.275 8.105 -13.162 1.00 0.00 N ATOM 0 H LYS A 81 -8.090 9.008 -14.648 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.607 7.519 -14.048 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.298 9.049 -14.928 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.122 8.372 -16.534 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -13.117 7.458 -15.492 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.941 6.176 -15.703 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.804 5.882 -13.503 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.213 6.583 -13.286 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -12.698 7.749 -11.800 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.301 8.858 -13.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.702 8.737 -12.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.389 8.519 -14.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.748 7.179 -13.130 1.00 0.00 H new ATOM 919 N ASN A 82 -8.417 5.615 -15.185 1.00 0.00 N ATOM 920 CA ASN A 82 -7.970 4.343 -15.722 1.00 0.00 C ATOM 921 C ASN A 82 -8.130 3.260 -14.687 1.00 0.00 C ATOM 922 O ASN A 82 -7.658 3.403 -13.559 1.00 0.00 O ATOM 923 CB ASN A 82 -6.496 4.427 -16.145 1.00 0.00 C ATOM 924 CG ASN A 82 -5.982 3.121 -16.726 1.00 0.00 C ATOM 925 OD1 ASN A 82 -6.738 2.348 -17.312 1.00 0.00 O ATOM 926 ND2 ASN A 82 -4.698 2.869 -16.571 1.00 0.00 N ATOM 0 H ASN A 82 -8.007 5.855 -14.282 1.00 0.00 H new ATOM 0 HA ASN A 82 -8.579 4.106 -16.594 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -6.378 5.221 -16.883 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -5.889 4.701 -15.282 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.299 2.007 -16.943 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.103 3.536 -16.079 1.00 0.00 H new ATOM 933 N ILE A 83 -8.799 2.183 -15.047 1.00 0.00 N ATOM 934 CA ILE A 83 -8.953 1.076 -14.135 1.00 0.00 C ATOM 935 C ILE A 83 -7.665 0.270 -14.131 1.00 0.00 C ATOM 936 O ILE A 83 -7.453 -0.611 -14.969 1.00 0.00 O ATOM 937 CB ILE A 83 -10.174 0.165 -14.476 1.00 0.00 C ATOM 938 CG1 ILE A 83 -11.499 0.947 -14.356 1.00 0.00 C ATOM 939 CG2 ILE A 83 -10.209 -1.055 -13.556 1.00 0.00 C ATOM 940 CD1 ILE A 83 -11.784 1.893 -15.507 1.00 0.00 C ATOM 0 H ILE A 83 -9.240 2.054 -15.958 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.154 1.481 -13.143 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.060 -0.170 -15.507 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.320 0.234 -14.278 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -11.484 1.519 -13.428 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.067 -1.677 -13.810 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -9.293 -1.632 -13.682 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -10.292 -0.727 -12.520 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -12.735 2.398 -15.336 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.987 2.633 -15.575 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -11.835 1.328 -16.438 1.00 0.00 H new ATOM 951 N ILE A 84 -6.793 0.622 -13.209 1.00 0.00 N ATOM 952 CA ILE A 84 -5.482 0.025 -13.104 1.00 0.00 C ATOM 953 C ILE A 84 -5.573 -1.426 -12.680 1.00 0.00 C ATOM 954 O ILE A 84 -4.989 -2.302 -13.321 1.00 0.00 O ATOM 955 CB ILE A 84 -4.605 0.823 -12.112 1.00 0.00 C ATOM 956 CG1 ILE A 84 -4.517 2.278 -12.572 1.00 0.00 C ATOM 957 CG2 ILE A 84 -3.209 0.211 -11.989 1.00 0.00 C ATOM 958 CD1 ILE A 84 -3.824 3.187 -11.596 1.00 0.00 C ATOM 0 H ILE A 84 -6.978 1.337 -12.506 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.017 0.058 -14.089 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.066 0.782 -11.125 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -3.990 2.316 -13.525 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -5.525 2.654 -12.750 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.617 0.795 -11.284 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.292 -0.815 -11.631 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -2.722 0.217 -12.964 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -3.802 4.201 -11.995 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.362 3.182 -10.648 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.804 2.839 -11.436 1.00 0.00 H new ATOM 969 N ALA A 85 -6.308 -1.688 -11.615 1.00 0.00 N ATOM 970 CA ALA A 85 -6.469 -3.054 -11.143 1.00 0.00 C ATOM 971 C ALA A 85 -7.693 -3.206 -10.253 1.00 0.00 C ATOM 972 O ALA A 85 -8.151 -2.246 -9.631 1.00 0.00 O ATOM 973 CB ALA A 85 -5.212 -3.517 -10.412 1.00 0.00 C ATOM 0 H ALA A 85 -6.799 -0.983 -11.065 1.00 0.00 H new ATOM 0 HA ALA A 85 -6.622 -3.687 -12.017 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -5.349 -4.541 -10.065 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -4.360 -3.475 -11.091 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -5.028 -2.866 -9.557 1.00 0.00 H new ATOM 979 N GLU A 86 -8.223 -4.412 -10.216 1.00 0.00 N ATOM 980 CA GLU A 86 -9.365 -4.748 -9.385 1.00 0.00 C ATOM 981 C GLU A 86 -9.211 -6.183 -8.903 1.00 0.00 C ATOM 982 O GLU A 86 -9.248 -7.118 -9.702 1.00 0.00 O ATOM 983 CB GLU A 86 -10.665 -4.589 -10.179 1.00 0.00 C ATOM 984 CG GLU A 86 -11.925 -4.861 -9.372 1.00 0.00 C ATOM 985 CD GLU A 86 -13.181 -4.722 -10.198 1.00 0.00 C ATOM 986 OE1 GLU A 86 -13.689 -3.596 -10.331 1.00 0.00 O ATOM 987 OE2 GLU A 86 -13.675 -5.745 -10.721 1.00 0.00 O ATOM 0 H GLU A 86 -7.871 -5.195 -10.767 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.408 -4.075 -8.528 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -10.713 -3.575 -10.576 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -10.641 -5.265 -11.033 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -11.877 -5.868 -8.957 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -11.969 -4.171 -8.530 1.00 0.00 H new ATOM 990 N HIS A 87 -9.015 -6.366 -7.606 1.00 0.00 N ATOM 991 CA HIS A 87 -8.782 -7.701 -7.067 1.00 0.00 C ATOM 992 C HIS A 87 -9.581 -7.959 -5.803 1.00 0.00 C ATOM 993 O HIS A 87 -10.070 -7.030 -5.157 1.00 0.00 O ATOM 994 CB HIS A 87 -7.289 -7.931 -6.793 1.00 0.00 C ATOM 995 CG HIS A 87 -6.459 -8.117 -8.026 1.00 0.00 C ATOM 996 ND1 HIS A 87 -6.183 -9.353 -8.567 1.00 0.00 N ATOM 997 CD2 HIS A 87 -5.834 -7.215 -8.820 1.00 0.00 C ATOM 998 CE1 HIS A 87 -5.429 -9.208 -9.637 1.00 0.00 C ATOM 999 NE2 HIS A 87 -5.202 -7.919 -9.814 1.00 0.00 N ATOM 0 H HIS A 87 -9.012 -5.618 -6.913 1.00 0.00 H new ATOM 0 HA HIS A 87 -9.121 -8.406 -7.827 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -6.899 -7.082 -6.231 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -7.179 -8.811 -6.159 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -5.833 -6.142 -8.694 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -5.059 -10.007 -10.263 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -4.647 -7.513 -10.567 1.00 0.00 H new ATOM 1004 N GLU A 88 -9.699 -9.231 -5.459 1.00 0.00 N ATOM 1005 CA GLU A 88 -10.399 -9.649 -4.259 1.00 0.00 C ATOM 1006 C GLU A 88 -9.578 -9.295 -3.028 1.00 0.00 C ATOM 1007 O GLU A 88 -8.363 -9.118 -3.115 1.00 0.00 O ATOM 1008 CB GLU A 88 -10.652 -11.157 -4.296 1.00 0.00 C ATOM 1009 CG GLU A 88 -11.538 -11.609 -5.444 1.00 0.00 C ATOM 1010 CD GLU A 88 -11.636 -13.117 -5.542 1.00 0.00 C ATOM 1011 OE1 GLU A 88 -12.378 -13.726 -4.743 1.00 0.00 O ATOM 1012 OE2 GLU A 88 -10.970 -13.706 -6.422 1.00 0.00 O ATOM 0 H GLU A 88 -9.312 -10.001 -6.004 1.00 0.00 H new ATOM 0 HA GLU A 88 -11.356 -9.129 -4.212 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.695 -11.674 -4.365 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -11.111 -11.461 -3.355 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.536 -11.191 -5.315 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.145 -11.212 -6.380 1.00 0.00 H new ATOM 1015 N ILE A 89 -10.231 -9.203 -1.891 1.00 0.00 N ATOM 1016 CA ILE A 89 -9.550 -8.853 -0.656 1.00 0.00 C ATOM 1017 C ILE A 89 -8.454 -9.878 -0.307 1.00 0.00 C ATOM 1018 O ILE A 89 -7.313 -9.508 -0.012 1.00 0.00 O ATOM 1019 CB ILE A 89 -10.556 -8.693 0.520 1.00 0.00 C ATOM 1020 CG1 ILE A 89 -9.821 -8.421 1.831 1.00 0.00 C ATOM 1021 CG2 ILE A 89 -11.467 -9.911 0.646 1.00 0.00 C ATOM 1022 CD1 ILE A 89 -10.745 -8.240 3.008 1.00 0.00 C ATOM 0 H ILE A 89 -11.233 -9.365 -1.792 1.00 0.00 H new ATOM 0 HA ILE A 89 -9.066 -7.890 -0.815 1.00 0.00 H new ATOM 0 HB ILE A 89 -11.188 -7.833 0.300 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -9.141 -9.248 2.036 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.210 -7.526 1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -12.157 -9.765 1.477 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -12.033 -10.039 -0.277 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -10.863 -10.800 0.828 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.157 -8.050 3.906 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -11.408 -7.395 2.823 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -11.339 -9.144 3.147 1.00 0.00 H new ATOM 1033 N ARG A 90 -8.785 -11.166 -0.407 1.00 0.00 N ATOM 1034 CA ARG A 90 -7.829 -12.222 -0.082 1.00 0.00 C ATOM 1035 C ARG A 90 -6.761 -12.377 -1.162 1.00 0.00 C ATOM 1036 O ARG A 90 -5.912 -13.266 -1.085 1.00 0.00 O ATOM 1037 CB ARG A 90 -8.537 -13.554 0.172 1.00 0.00 C ATOM 1038 CG ARG A 90 -9.400 -13.559 1.424 1.00 0.00 C ATOM 1039 CD ARG A 90 -9.920 -14.951 1.729 1.00 0.00 C ATOM 1040 NE ARG A 90 -10.727 -14.985 2.950 1.00 0.00 N ATOM 1041 CZ ARG A 90 -10.725 -15.997 3.824 1.00 0.00 C ATOM 1042 NH1 ARG A 90 -9.921 -17.037 3.644 1.00 0.00 N ATOM 1043 NH2 ARG A 90 -11.518 -15.960 4.884 1.00 0.00 N ATOM 0 H ARG A 90 -9.700 -11.500 -0.708 1.00 0.00 H new ATOM 0 HA ARG A 90 -7.326 -11.922 0.837 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.161 -13.794 -0.689 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.789 -14.343 0.254 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -8.819 -13.192 2.270 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.239 -12.876 1.293 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.519 -15.305 0.890 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -9.079 -15.637 1.832 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.329 -14.186 3.147 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.300 -17.068 2.835 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.924 -17.806 4.314 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.131 -15.159 5.034 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.516 -16.733 5.550 1.00 0.00 H new ATOM 1046 N ASN A 91 -6.801 -11.507 -2.165 1.00 0.00 N ATOM 1047 CA ASN A 91 -5.786 -11.505 -3.204 1.00 0.00 C ATOM 1048 C ASN A 91 -4.540 -10.819 -2.664 1.00 0.00 C ATOM 1049 O ASN A 91 -3.438 -10.967 -3.204 1.00 0.00 O ATOM 1050 CB ASN A 91 -6.301 -10.780 -4.457 1.00 0.00 C ATOM 1051 CG ASN A 91 -5.328 -10.815 -5.626 1.00 0.00 C ATOM 1052 OD1 ASN A 91 -5.366 -11.725 -6.451 1.00 0.00 O ATOM 1053 ND2 ASN A 91 -4.470 -9.816 -5.717 1.00 0.00 N ATOM 0 H ASN A 91 -7.525 -10.797 -2.278 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.547 -12.530 -3.487 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.243 -11.232 -4.766 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.514 -9.741 -4.204 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -3.808 -9.781 -6.492 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -4.469 -9.079 -5.012 1.00 0.00 H new ATOM 1060 N ILE A 92 -4.723 -10.063 -1.586 1.00 0.00 N ATOM 1061 CA ILE A 92 -3.622 -9.384 -0.951 1.00 0.00 C ATOM 1062 C ILE A 92 -2.987 -10.310 0.081 1.00 0.00 C ATOM 1063 O ILE A 92 -3.681 -10.934 0.882 1.00 0.00 O ATOM 1064 CB ILE A 92 -4.066 -8.065 -0.266 1.00 0.00 C ATOM 1065 CG1 ILE A 92 -4.953 -7.237 -1.210 1.00 0.00 C ATOM 1066 CG2 ILE A 92 -2.844 -7.255 0.161 1.00 0.00 C ATOM 1067 CD1 ILE A 92 -5.463 -5.946 -0.596 1.00 0.00 C ATOM 0 H ILE A 92 -5.628 -9.911 -1.141 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.899 -9.124 -1.724 1.00 0.00 H new ATOM 0 HB ILE A 92 -4.648 -8.315 0.621 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -4.387 -7.001 -2.111 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -5.805 -7.843 -1.518 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.169 -6.332 0.640 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -2.248 -7.838 0.863 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -2.241 -7.016 -0.715 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.081 -5.417 -1.322 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -6.057 -6.174 0.289 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -4.618 -5.319 -0.314 1.00 0.00 H new ATOM 1078 N SER A 93 -1.679 -10.414 0.036 1.00 0.00 N ATOM 1079 CA SER A 93 -0.949 -11.276 0.936 1.00 0.00 C ATOM 1080 C SER A 93 -0.672 -10.563 2.255 1.00 0.00 C ATOM 1081 O SER A 93 -0.795 -11.156 3.329 1.00 0.00 O ATOM 1082 CB SER A 93 0.362 -11.704 0.279 1.00 0.00 C ATOM 1083 OG SER A 93 0.136 -12.144 -1.055 1.00 0.00 O ATOM 0 H SER A 93 -1.092 -9.904 -0.624 1.00 0.00 H new ATOM 0 HA SER A 93 -1.551 -12.160 1.148 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.063 -10.870 0.278 1.00 0.00 H new ATOM 0 HB3 SER A 93 0.820 -12.505 0.859 1.00 0.00 H new ATOM 0 HG SER A 93 0.996 -12.271 -1.508 1.00 0.00 H new ATOM 1089 N CYS A 94 -0.312 -9.287 2.170 1.00 0.00 N ATOM 1090 CA CYS A 94 -0.011 -8.504 3.361 1.00 0.00 C ATOM 1091 C CYS A 94 0.036 -7.018 3.023 1.00 0.00 C ATOM 1092 O CYS A 94 0.125 -6.644 1.855 1.00 0.00 O ATOM 1093 CB CYS A 94 1.328 -8.952 3.971 1.00 0.00 C ATOM 1094 SG CYS A 94 1.722 -8.193 5.565 1.00 0.00 S ATOM 0 H CYS A 94 -0.222 -8.775 1.292 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.802 -8.670 4.093 1.00 0.00 H new ATOM 0 HB2 CYS A 94 1.312 -10.035 4.093 1.00 0.00 H new ATOM 0 HB3 CYS A 94 2.128 -8.723 3.267 1.00 0.00 H new ATOM 0 HG CYS A 94 2.867 -8.641 5.988 1.00 0.00 H new ATOM 1100 N ALA A 95 -0.024 -6.182 4.044 1.00 0.00 N ATOM 1101 CA ALA A 95 0.032 -4.743 3.873 1.00 0.00 C ATOM 1102 C ALA A 95 0.915 -4.134 4.945 1.00 0.00 C ATOM 1103 O ALA A 95 0.759 -4.436 6.132 1.00 0.00 O ATOM 1104 CB ALA A 95 -1.366 -4.146 3.930 1.00 0.00 C ATOM 0 H ALA A 95 -0.113 -6.482 5.015 1.00 0.00 H new ATOM 0 HA ALA A 95 0.458 -4.518 2.895 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.306 -3.065 3.800 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.977 -4.574 3.135 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.818 -4.371 4.896 1.00 0.00 H new ATOM 1110 N ALA A 96 1.840 -3.288 4.537 1.00 0.00 N ATOM 1111 CA ALA A 96 2.768 -2.669 5.465 1.00 0.00 C ATOM 1112 C ALA A 96 2.979 -1.208 5.113 1.00 0.00 C ATOM 1113 O ALA A 96 2.563 -0.748 4.054 1.00 0.00 O ATOM 1114 CB ALA A 96 4.098 -3.416 5.449 1.00 0.00 C ATOM 0 H ALA A 96 1.970 -3.012 3.564 1.00 0.00 H new ATOM 0 HA ALA A 96 2.346 -2.722 6.468 1.00 0.00 H new ATOM 0 HB1 ALA A 96 4.788 -2.945 6.148 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.936 -4.453 5.742 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.521 -3.385 4.445 1.00 0.00 H new ATOM 1120 N GLN A 97 3.621 -0.479 5.996 1.00 0.00 N ATOM 1121 CA GLN A 97 3.897 0.916 5.743 1.00 0.00 C ATOM 1122 C GLN A 97 5.369 1.197 5.927 1.00 0.00 C ATOM 1123 O GLN A 97 6.066 0.461 6.632 1.00 0.00 O ATOM 1124 CB GLN A 97 3.068 1.828 6.647 1.00 0.00 C ATOM 1125 CG GLN A 97 3.401 1.712 8.121 1.00 0.00 C ATOM 1126 CD GLN A 97 2.677 2.743 8.966 1.00 0.00 C ATOM 1127 OE1 GLN A 97 2.413 3.908 8.395 1.00 0.00 O flip ATOM 1128 NE2 GLN A 97 2.370 2.496 10.126 1.00 0.00 N flip ATOM 0 H GLN A 97 3.961 -0.827 6.893 1.00 0.00 H new ATOM 0 HA GLN A 97 3.617 1.129 4.711 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.214 2.862 6.333 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.012 1.598 6.506 1.00 0.00 H new ATOM 0 HG2 GLN A 97 3.140 0.713 8.471 1.00 0.00 H new ATOM 0 HG3 GLN A 97 4.476 1.827 8.257 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.591 1.586 10.529 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.893 3.201 10.688 1.00 0.00 H new ATOM 1137 N ASP A 98 5.832 2.253 5.303 1.00 0.00 N ATOM 1138 CA ASP A 98 7.226 2.631 5.366 1.00 0.00 C ATOM 1139 C ASP A 98 7.575 3.157 6.770 1.00 0.00 C ATOM 1140 O ASP A 98 6.922 4.075 7.276 1.00 0.00 O ATOM 1141 CB ASP A 98 7.508 3.694 4.314 1.00 0.00 C ATOM 1142 CG ASP A 98 8.971 3.969 4.147 1.00 0.00 C ATOM 1143 OD1 ASP A 98 9.595 4.475 5.089 1.00 0.00 O ATOM 1144 OD2 ASP A 98 9.512 3.685 3.055 1.00 0.00 O ATOM 0 H ASP A 98 5.255 2.875 4.737 1.00 0.00 H new ATOM 0 HA ASP A 98 7.846 1.757 5.167 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.092 3.374 3.359 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.998 4.617 4.590 1.00 0.00 H new ATOM 1147 N PRO A 99 8.587 2.559 7.429 1.00 0.00 N ATOM 1148 CA PRO A 99 9.005 2.950 8.784 1.00 0.00 C ATOM 1149 C PRO A 99 9.636 4.345 8.857 1.00 0.00 C ATOM 1150 O PRO A 99 9.423 5.078 9.829 1.00 0.00 O ATOM 1151 CB PRO A 99 10.050 1.891 9.165 1.00 0.00 C ATOM 1152 CG PRO A 99 9.882 0.791 8.175 1.00 0.00 C ATOM 1153 CD PRO A 99 9.387 1.438 6.923 1.00 0.00 C ATOM 0 HA PRO A 99 8.144 2.998 9.451 1.00 0.00 H new ATOM 0 HB2 PRO A 99 11.058 2.303 9.126 1.00 0.00 H new ATOM 0 HB3 PRO A 99 9.892 1.531 10.182 1.00 0.00 H new ATOM 0 HG2 PRO A 99 10.826 0.275 8.001 1.00 0.00 H new ATOM 0 HG3 PRO A 99 9.173 0.046 8.536 1.00 0.00 H new ATOM 0 HD2 PRO A 99 10.208 1.779 6.293 1.00 0.00 H new ATOM 0 HD3 PRO A 99 8.788 0.752 6.323 1.00 0.00 H new ATOM 1161 N GLU A 100 10.401 4.713 7.838 1.00 0.00 N ATOM 1162 CA GLU A 100 11.107 5.988 7.849 1.00 0.00 C ATOM 1163 C GLU A 100 10.261 7.116 7.264 1.00 0.00 C ATOM 1164 O GLU A 100 10.474 8.288 7.571 1.00 0.00 O ATOM 1165 CB GLU A 100 12.473 5.871 7.163 1.00 0.00 C ATOM 1166 CG GLU A 100 12.444 5.163 5.821 1.00 0.00 C ATOM 1167 CD GLU A 100 13.828 4.894 5.281 1.00 0.00 C ATOM 1168 OE1 GLU A 100 14.437 3.876 5.676 1.00 0.00 O ATOM 1169 OE2 GLU A 100 14.318 5.693 4.462 1.00 0.00 O ATOM 0 H GLU A 100 10.548 4.152 6.999 1.00 0.00 H new ATOM 0 HA GLU A 100 11.290 6.252 8.891 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.882 6.872 7.023 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.154 5.338 7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 100 11.907 4.220 5.923 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.889 5.770 5.105 1.00 0.00 H new ATOM 1172 N ASP A 101 9.318 6.765 6.418 1.00 0.00 N ATOM 1173 CA ASP A 101 8.363 7.733 5.897 1.00 0.00 C ATOM 1174 C ASP A 101 6.962 7.224 6.142 1.00 0.00 C ATOM 1175 O ASP A 101 6.426 6.430 5.372 1.00 0.00 O ATOM 1176 CB ASP A 101 8.572 8.024 4.408 1.00 0.00 C ATOM 1177 CG ASP A 101 7.664 9.143 3.907 1.00 0.00 C ATOM 1178 OD1 ASP A 101 6.502 8.866 3.556 1.00 0.00 O ATOM 1179 OD2 ASP A 101 8.109 10.308 3.866 1.00 0.00 O ATOM 0 H ASP A 101 9.187 5.814 6.072 1.00 0.00 H new ATOM 0 HA ASP A 101 8.520 8.675 6.422 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.613 8.298 4.236 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.381 7.118 3.832 1.00 0.00 H new ATOM 1182 N LEU A 102 6.379 7.678 7.227 1.00 0.00 N ATOM 1183 CA LEU A 102 5.056 7.235 7.657 1.00 0.00 C ATOM 1184 C LEU A 102 3.922 7.758 6.758 1.00 0.00 C ATOM 1185 O LEU A 102 2.745 7.591 7.073 1.00 0.00 O ATOM 1186 CB LEU A 102 4.807 7.592 9.146 1.00 0.00 C ATOM 1187 CG LEU A 102 4.790 9.088 9.545 1.00 0.00 C ATOM 1188 CD1 LEU A 102 4.404 9.226 11.007 1.00 0.00 C ATOM 1189 CD2 LEU A 102 6.142 9.758 9.308 1.00 0.00 C ATOM 0 H LEU A 102 6.804 8.369 7.845 1.00 0.00 H new ATOM 0 HA LEU A 102 5.045 6.150 7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 102 3.850 7.159 9.437 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.575 7.097 9.740 1.00 0.00 H new ATOM 0 HG LEU A 102 4.055 9.588 8.915 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.394 10.281 11.283 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.413 8.800 11.163 1.00 0.00 H new ATOM 0 HD13 LEU A 102 5.128 8.696 11.626 1.00 0.00 H new ATOM 0 HD21 LEU A 102 6.085 10.806 9.601 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.906 9.256 9.902 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.401 9.691 8.251 1.00 0.00 H new ATOM 1201 N SER A 103 4.283 8.365 5.640 1.00 0.00 N ATOM 1202 CA SER A 103 3.308 8.843 4.684 1.00 0.00 C ATOM 1203 C SER A 103 3.399 8.003 3.404 1.00 0.00 C ATOM 1204 O SER A 103 2.840 8.353 2.366 1.00 0.00 O ATOM 1205 CB SER A 103 3.538 10.334 4.382 1.00 0.00 C ATOM 1206 OG SER A 103 2.474 10.881 3.615 1.00 0.00 O ATOM 0 H SER A 103 5.252 8.538 5.374 1.00 0.00 H new ATOM 0 HA SER A 103 2.307 8.740 5.104 1.00 0.00 H new ATOM 0 HB2 SER A 103 3.634 10.885 5.318 1.00 0.00 H new ATOM 0 HB3 SER A 103 4.477 10.456 3.842 1.00 0.00 H new ATOM 0 HG SER A 103 2.273 10.286 2.863 1.00 0.00 H new ATOM 1212 N THR A 104 4.118 6.894 3.497 1.00 0.00 N ATOM 1213 CA THR A 104 4.279 5.971 2.387 1.00 0.00 C ATOM 1214 C THR A 104 3.931 4.561 2.849 1.00 0.00 C ATOM 1215 O THR A 104 4.226 4.189 3.989 1.00 0.00 O ATOM 1216 CB THR A 104 5.739 5.990 1.867 1.00 0.00 C ATOM 1217 OG1 THR A 104 6.118 7.332 1.546 1.00 0.00 O ATOM 1218 CG2 THR A 104 5.903 5.114 0.632 1.00 0.00 C ATOM 0 H THR A 104 4.606 6.610 4.346 1.00 0.00 H new ATOM 0 HA THR A 104 3.614 6.277 1.580 1.00 0.00 H new ATOM 0 HB THR A 104 6.380 5.595 2.655 1.00 0.00 H new ATOM 0 HG1 THR A 104 6.132 7.872 2.363 1.00 0.00 H new ATOM 0 HG21 THR A 104 6.939 5.151 0.295 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.638 4.086 0.878 1.00 0.00 H new ATOM 0 HG23 THR A 104 5.250 5.478 -0.161 1.00 0.00 H new ATOM 1225 N PHE A 105 3.290 3.781 1.990 1.00 0.00 N ATOM 1226 CA PHE A 105 2.944 2.420 2.357 1.00 0.00 C ATOM 1227 C PHE A 105 2.873 1.517 1.143 1.00 0.00 C ATOM 1228 O PHE A 105 2.829 1.991 0.001 1.00 0.00 O ATOM 1229 CB PHE A 105 1.647 2.360 3.187 1.00 0.00 C ATOM 1230 CG PHE A 105 0.397 2.801 2.477 1.00 0.00 C ATOM 1231 CD1 PHE A 105 0.140 4.143 2.255 1.00 0.00 C ATOM 1232 CD2 PHE A 105 -0.532 1.866 2.052 1.00 0.00 C ATOM 1233 CE1 PHE A 105 -1.018 4.544 1.621 1.00 0.00 C ATOM 1234 CE2 PHE A 105 -1.692 2.262 1.422 1.00 0.00 C ATOM 1235 CZ PHE A 105 -1.935 3.602 1.205 1.00 0.00 C ATOM 0 H PHE A 105 3.004 4.062 1.052 1.00 0.00 H new ATOM 0 HA PHE A 105 3.746 2.047 2.993 1.00 0.00 H new ATOM 0 HB2 PHE A 105 1.505 1.336 3.531 1.00 0.00 H new ATOM 0 HB3 PHE A 105 1.776 2.980 4.074 1.00 0.00 H new ATOM 0 HD1 PHE A 105 0.854 4.885 2.582 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -0.345 0.815 2.216 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -1.206 5.594 1.451 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -2.410 1.523 1.098 1.00 0.00 H new ATOM 0 HZ PHE A 105 -2.843 3.913 0.710 1.00 0.00 H new ATOM 1241 N ALA A 106 2.870 0.221 1.389 1.00 0.00 N ATOM 1242 CA ALA A 106 2.869 -0.753 0.326 1.00 0.00 C ATOM 1243 C ALA A 106 2.090 -1.985 0.715 1.00 0.00 C ATOM 1244 O ALA A 106 2.004 -2.339 1.891 1.00 0.00 O ATOM 1245 CB ALA A 106 4.289 -1.140 -0.021 1.00 0.00 C ATOM 0 H ALA A 106 2.868 -0.180 2.327 1.00 0.00 H new ATOM 0 HA ALA A 106 2.389 -0.303 -0.543 1.00 0.00 H new ATOM 0 HB1 ALA A 106 4.279 -1.876 -0.825 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.838 -0.256 -0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 106 4.774 -1.567 0.856 1.00 0.00 H new ATOM 1251 N TYR A 107 1.532 -2.638 -0.262 1.00 0.00 N ATOM 1252 CA TYR A 107 0.802 -3.849 -0.027 1.00 0.00 C ATOM 1253 C TYR A 107 1.276 -4.926 -0.979 1.00 0.00 C ATOM 1254 O TYR A 107 1.510 -4.672 -2.172 1.00 0.00 O ATOM 1255 CB TYR A 107 -0.715 -3.621 -0.150 1.00 0.00 C ATOM 1256 CG TYR A 107 -1.170 -3.189 -1.523 1.00 0.00 C ATOM 1257 CD1 TYR A 107 -0.931 -1.907 -1.984 1.00 0.00 C ATOM 1258 CD2 TYR A 107 -1.823 -4.074 -2.360 1.00 0.00 C ATOM 1259 CE1 TYR A 107 -1.334 -1.519 -3.240 1.00 0.00 C ATOM 1260 CE2 TYR A 107 -2.226 -3.695 -3.621 1.00 0.00 C ATOM 1261 CZ TYR A 107 -1.978 -2.418 -4.056 1.00 0.00 C ATOM 1262 OH TYR A 107 -2.372 -2.035 -5.320 1.00 0.00 O ATOM 0 H TYR A 107 1.570 -2.348 -1.239 1.00 0.00 H new ATOM 0 HA TYR A 107 0.993 -4.178 0.994 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -1.232 -4.543 0.118 1.00 0.00 H new ATOM 0 HB3 TYR A 107 -1.017 -2.864 0.574 1.00 0.00 H new ATOM 0 HD1 TYR A 107 -0.420 -1.200 -1.348 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -2.021 -5.080 -2.019 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -1.145 -0.513 -3.584 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -2.734 -4.399 -4.263 1.00 0.00 H new ATOM 0 HH TYR A 107 -3.349 -1.967 -5.351 1.00 0.00 H new ATOM 1268 N ILE A 108 1.439 -6.109 -0.457 1.00 0.00 N ATOM 1269 CA ILE A 108 1.913 -7.224 -1.229 1.00 0.00 C ATOM 1270 C ILE A 108 0.753 -8.098 -1.634 1.00 0.00 C ATOM 1271 O ILE A 108 0.006 -8.582 -0.789 1.00 0.00 O ATOM 1272 CB ILE A 108 2.933 -8.065 -0.435 1.00 0.00 C ATOM 1273 CG1 ILE A 108 4.101 -7.186 0.019 1.00 0.00 C ATOM 1274 CG2 ILE A 108 3.439 -9.235 -1.280 1.00 0.00 C ATOM 1275 CD1 ILE A 108 5.102 -7.908 0.886 1.00 0.00 C ATOM 0 H ILE A 108 1.246 -6.329 0.520 1.00 0.00 H new ATOM 0 HA ILE A 108 2.409 -6.829 -2.116 1.00 0.00 H new ATOM 0 HB ILE A 108 2.438 -8.471 0.447 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.612 -6.793 -0.860 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.708 -6.330 0.568 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.158 -9.817 -0.703 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.599 -9.871 -1.561 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.921 -8.852 -2.180 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.900 -7.222 1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.606 -8.277 1.784 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.524 -8.747 0.333 1.00 0.00 H new ATOM 1286 N THR A 109 0.607 -8.284 -2.920 1.00 0.00 N ATOM 1287 CA THR A 109 -0.461 -9.095 -3.477 1.00 0.00 C ATOM 1288 C THR A 109 0.132 -10.217 -4.294 1.00 0.00 C ATOM 1289 O THR A 109 1.333 -10.463 -4.227 1.00 0.00 O ATOM 1290 CB THR A 109 -1.374 -8.256 -4.401 1.00 0.00 C ATOM 1291 OG1 THR A 109 -0.588 -7.611 -5.417 1.00 0.00 O ATOM 1292 CG2 THR A 109 -2.132 -7.211 -3.619 1.00 0.00 C ATOM 0 H THR A 109 1.226 -7.877 -3.621 1.00 0.00 H new ATOM 0 HA THR A 109 -1.051 -9.487 -2.649 1.00 0.00 H new ATOM 0 HB THR A 109 -2.092 -8.933 -4.863 1.00 0.00 H new ATOM 0 HG1 THR A 109 -1.174 -7.083 -5.998 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.765 -6.638 -4.296 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.753 -7.698 -2.867 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.426 -6.541 -3.128 1.00 0.00 H new ATOM 1299 N LYS A 110 -0.698 -10.900 -5.046 1.00 0.00 N ATOM 1300 CA LYS A 110 -0.230 -11.911 -5.954 1.00 0.00 C ATOM 1301 C LYS A 110 -1.205 -12.073 -7.103 1.00 0.00 C ATOM 1302 O LYS A 110 -2.416 -12.140 -6.898 1.00 0.00 O ATOM 1303 CB LYS A 110 0.058 -13.254 -5.232 1.00 0.00 C ATOM 1304 CG LYS A 110 -1.128 -13.906 -4.523 1.00 0.00 C ATOM 1305 CD LYS A 110 -1.954 -14.766 -5.471 1.00 0.00 C ATOM 1306 CE LYS A 110 -2.998 -15.573 -4.722 1.00 0.00 C ATOM 1307 NZ LYS A 110 -2.377 -16.521 -3.764 1.00 0.00 N ATOM 0 H LYS A 110 -1.710 -10.769 -5.044 1.00 0.00 H new ATOM 0 HA LYS A 110 0.724 -11.583 -6.367 1.00 0.00 H new ATOM 0 HB2 LYS A 110 0.450 -13.960 -5.965 1.00 0.00 H new ATOM 0 HB3 LYS A 110 0.846 -13.086 -4.498 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.765 -14.520 -3.699 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.762 -13.132 -4.089 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -2.444 -14.130 -6.208 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -1.296 -15.440 -6.019 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -3.664 -14.897 -4.185 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -3.611 -16.125 -5.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -3.069 -17.251 -3.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -1.551 -16.971 -4.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.076 -16.006 -2.912 1.00 0.00 H new ATOM 1310 N ASP A 111 -0.683 -12.079 -8.302 1.00 0.00 N ATOM 1311 CA ASP A 111 -1.504 -12.257 -9.481 1.00 0.00 C ATOM 1312 C ASP A 111 -1.530 -13.712 -9.860 1.00 0.00 C ATOM 1313 O ASP A 111 -0.486 -14.318 -10.079 1.00 0.00 O ATOM 1314 CB ASP A 111 -0.990 -11.412 -10.646 1.00 0.00 C ATOM 1315 CG ASP A 111 -1.595 -11.826 -11.972 1.00 0.00 C ATOM 1316 OD1 ASP A 111 -2.816 -12.086 -12.024 1.00 0.00 O ATOM 1317 OD2 ASP A 111 -0.843 -11.912 -12.963 1.00 0.00 O ATOM 0 H ASP A 111 0.312 -11.962 -8.493 1.00 0.00 H new ATOM 0 HA ASP A 111 -2.516 -11.924 -9.253 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.217 -10.363 -10.458 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.095 -11.498 -10.702 1.00 0.00 H new ATOM 1320 N LEU A 112 -2.719 -14.271 -9.948 1.00 0.00 N ATOM 1321 CA LEU A 112 -2.881 -15.683 -10.243 1.00 0.00 C ATOM 1322 C LEU A 112 -2.416 -16.007 -11.668 1.00 0.00 C ATOM 1323 O LEU A 112 -2.073 -17.150 -11.975 1.00 0.00 O ATOM 1324 CB LEU A 112 -4.339 -16.105 -10.032 1.00 0.00 C ATOM 1325 CG LEU A 112 -4.585 -17.607 -9.867 1.00 0.00 C ATOM 1326 CD1 LEU A 112 -3.825 -18.144 -8.663 1.00 0.00 C ATOM 1327 CD2 LEU A 112 -6.069 -17.888 -9.720 1.00 0.00 C ATOM 0 H LEU A 112 -3.595 -13.766 -9.818 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.254 -16.251 -9.556 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -4.720 -15.595 -9.147 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -4.925 -15.752 -10.880 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.221 -18.114 -10.760 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.012 -19.213 -8.562 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.757 -17.974 -8.801 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.160 -17.630 -7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.227 -18.960 -9.604 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.453 -17.368 -8.842 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.595 -17.538 -10.608 1.00 0.00 H new ATOM 1339 N LYS A 113 -2.380 -14.989 -12.526 1.00 0.00 N ATOM 1340 CA LYS A 113 -1.934 -15.167 -13.906 1.00 0.00 C ATOM 1341 C LYS A 113 -0.409 -15.172 -13.991 1.00 0.00 C ATOM 1342 O LYS A 113 0.168 -15.543 -15.015 1.00 0.00 O ATOM 1343 CB LYS A 113 -2.516 -14.079 -14.822 1.00 0.00 C ATOM 1344 CG LYS A 113 -3.927 -14.368 -15.336 1.00 0.00 C ATOM 1345 CD LYS A 113 -4.927 -14.551 -14.205 1.00 0.00 C ATOM 1346 CE LYS A 113 -6.308 -14.885 -14.740 1.00 0.00 C ATOM 1347 NZ LYS A 113 -7.258 -15.209 -13.651 1.00 0.00 N ATOM 0 H LYS A 113 -2.654 -14.035 -12.291 1.00 0.00 H new ATOM 0 HA LYS A 113 -2.302 -16.134 -14.249 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -2.528 -13.134 -14.280 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.852 -13.948 -15.676 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -4.253 -13.549 -15.977 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -3.910 -15.267 -15.952 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -4.589 -15.348 -13.543 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -4.976 -13.640 -13.609 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -6.689 -14.041 -15.315 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -6.238 -15.731 -15.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -8.189 -15.431 -14.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -6.908 -16.030 -13.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -7.345 -14.393 -13.012 1.00 0.00 H new ATOM 1350 N SER A 114 0.240 -14.758 -12.919 1.00 0.00 N ATOM 1351 CA SER A 114 1.692 -14.739 -12.872 1.00 0.00 C ATOM 1352 C SER A 114 2.204 -15.724 -11.821 1.00 0.00 C ATOM 1353 O SER A 114 3.354 -16.162 -11.873 1.00 0.00 O ATOM 1354 CB SER A 114 2.184 -13.323 -12.568 1.00 0.00 C ATOM 1355 OG SER A 114 1.650 -12.393 -13.501 1.00 0.00 O ATOM 0 H SER A 114 -0.215 -14.430 -12.067 1.00 0.00 H new ATOM 0 HA SER A 114 2.082 -15.044 -13.843 1.00 0.00 H new ATOM 0 HB2 SER A 114 1.891 -13.040 -11.557 1.00 0.00 H new ATOM 0 HB3 SER A 114 3.273 -13.296 -12.603 1.00 0.00 H new ATOM 0 HG SER A 114 0.765 -12.099 -13.200 1.00 0.00 H new ATOM 1361 N ASN A 115 1.328 -16.055 -10.867 1.00 0.00 N ATOM 1362 CA ASN A 115 1.625 -16.991 -9.773 1.00 0.00 C ATOM 1363 C ASN A 115 2.757 -16.459 -8.887 1.00 0.00 C ATOM 1364 O ASN A 115 3.412 -17.204 -8.164 1.00 0.00 O ATOM 1365 CB ASN A 115 1.961 -18.386 -10.321 1.00 0.00 C ATOM 1366 CG ASN A 115 1.855 -19.473 -9.262 1.00 0.00 C ATOM 1367 OD1 ASN A 115 1.051 -19.378 -8.333 1.00 0.00 O ATOM 1368 ND2 ASN A 115 2.652 -20.515 -9.405 1.00 0.00 N ATOM 0 H ASN A 115 0.381 -15.677 -10.831 1.00 0.00 H new ATOM 0 HA ASN A 115 0.732 -17.080 -9.155 1.00 0.00 H new ATOM 0 HB2 ASN A 115 1.287 -18.620 -11.145 1.00 0.00 H new ATOM 0 HB3 ASN A 115 2.972 -18.378 -10.728 1.00 0.00 H new ATOM 0 HD21 ASN A 115 2.616 -21.281 -8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 115 3.304 -20.555 -10.189 1.00 0.00 H new ATOM 1375 N HIS A 116 2.963 -15.154 -8.937 1.00 0.00 N ATOM 1376 CA HIS A 116 3.994 -14.510 -8.144 1.00 0.00 C ATOM 1377 C HIS A 116 3.423 -13.317 -7.405 1.00 0.00 C ATOM 1378 O HIS A 116 2.301 -12.887 -7.686 1.00 0.00 O ATOM 1379 CB HIS A 116 5.194 -14.112 -9.009 1.00 0.00 C ATOM 1380 CG HIS A 116 6.066 -15.274 -9.382 1.00 0.00 C ATOM 1381 ND1 HIS A 116 6.448 -15.551 -10.675 1.00 0.00 N ATOM 1382 CD2 HIS A 116 6.638 -16.230 -8.612 1.00 0.00 C ATOM 1383 CE1 HIS A 116 7.212 -16.624 -10.688 1.00 0.00 C ATOM 1384 NE2 HIS A 116 7.344 -17.058 -9.448 1.00 0.00 N ATOM 0 H HIS A 116 2.425 -14.516 -9.524 1.00 0.00 H new ATOM 0 HA HIS A 116 4.354 -15.226 -7.405 1.00 0.00 H new ATOM 0 HB2 HIS A 116 4.834 -13.630 -9.918 1.00 0.00 H new ATOM 0 HB3 HIS A 116 5.792 -13.375 -8.472 1.00 0.00 H new ATOM 0 HD2 HIS A 116 6.554 -16.323 -7.539 1.00 0.00 H new ATOM 0 HE1 HIS A 116 7.655 -17.073 -11.565 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.882 -17.875 -9.159 1.00 0.00 H new ATOM 1389 N HIS A 117 4.188 -12.773 -6.476 1.00 0.00 N ATOM 1390 CA HIS A 117 3.690 -11.710 -5.618 1.00 0.00 C ATOM 1391 C HIS A 117 4.052 -10.325 -6.124 1.00 0.00 C ATOM 1392 O HIS A 117 5.202 -10.042 -6.447 1.00 0.00 O ATOM 1393 CB HIS A 117 4.172 -11.902 -4.175 1.00 0.00 C ATOM 1394 CG HIS A 117 3.578 -13.108 -3.505 1.00 0.00 C ATOM 1395 ND1 HIS A 117 2.528 -13.038 -2.610 1.00 0.00 N ATOM 1396 CD2 HIS A 117 3.889 -14.422 -3.610 1.00 0.00 C ATOM 1397 CE1 HIS A 117 2.221 -14.251 -2.194 1.00 0.00 C ATOM 1398 NE2 HIS A 117 3.030 -15.110 -2.787 1.00 0.00 N ATOM 0 H HIS A 117 5.154 -13.048 -6.296 1.00 0.00 H new ATOM 0 HA HIS A 117 2.602 -11.778 -5.639 1.00 0.00 H new ATOM 0 HB2 HIS A 117 5.258 -11.991 -4.171 1.00 0.00 H new ATOM 0 HB3 HIS A 117 3.923 -11.013 -3.595 1.00 0.00 H new ATOM 0 HD2 HIS A 117 4.667 -14.849 -4.226 1.00 0.00 H new ATOM 0 HE1 HIS A 117 1.441 -14.499 -1.489 1.00 0.00 H new ATOM 0 HE2 HIS A 117 3.019 -16.121 -2.655 1.00 0.00 H new ATOM 1403 N TYR A 118 3.049 -9.470 -6.188 1.00 0.00 N ATOM 1404 CA TYR A 118 3.221 -8.103 -6.623 1.00 0.00 C ATOM 1405 C TYR A 118 3.273 -7.164 -5.433 1.00 0.00 C ATOM 1406 O TYR A 118 2.304 -7.047 -4.676 1.00 0.00 O ATOM 1407 CB TYR A 118 2.089 -7.681 -7.562 1.00 0.00 C ATOM 1408 CG TYR A 118 2.414 -7.840 -9.026 1.00 0.00 C ATOM 1409 CD1 TYR A 118 3.134 -6.863 -9.697 1.00 0.00 C ATOM 1410 CD2 TYR A 118 2.001 -8.959 -9.740 1.00 0.00 C ATOM 1411 CE1 TYR A 118 3.438 -6.991 -11.032 1.00 0.00 C ATOM 1412 CE2 TYR A 118 2.301 -9.095 -11.084 1.00 0.00 C ATOM 1413 CZ TYR A 118 3.022 -8.104 -11.724 1.00 0.00 C ATOM 1414 OH TYR A 118 3.328 -8.231 -13.060 1.00 0.00 O ATOM 0 H TYR A 118 2.089 -9.708 -5.938 1.00 0.00 H new ATOM 0 HA TYR A 118 4.166 -8.044 -7.164 1.00 0.00 H new ATOM 0 HB2 TYR A 118 1.201 -8.270 -7.332 1.00 0.00 H new ATOM 0 HB3 TYR A 118 1.839 -6.638 -7.367 1.00 0.00 H new ATOM 0 HD1 TYR A 118 3.462 -5.985 -9.161 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.438 -9.733 -9.239 1.00 0.00 H new ATOM 0 HE1 TYR A 118 4.002 -6.220 -11.535 1.00 0.00 H new ATOM 0 HE2 TYR A 118 1.974 -9.968 -11.629 1.00 0.00 H new ATOM 0 HH TYR A 118 2.963 -9.074 -13.401 1.00 0.00 H new ATOM 1420 N CYS A 119 4.394 -6.506 -5.276 1.00 0.00 N ATOM 1421 CA CYS A 119 4.587 -5.556 -4.216 1.00 0.00 C ATOM 1422 C CYS A 119 4.322 -4.163 -4.757 1.00 0.00 C ATOM 1423 O CYS A 119 5.140 -3.601 -5.493 1.00 0.00 O ATOM 1424 CB CYS A 119 6.020 -5.659 -3.672 1.00 0.00 C ATOM 1425 SG CYS A 119 6.390 -4.552 -2.291 1.00 0.00 S ATOM 0 H CYS A 119 5.203 -6.617 -5.887 1.00 0.00 H new ATOM 0 HA CYS A 119 3.898 -5.765 -3.398 1.00 0.00 H new ATOM 0 HB2 CYS A 119 6.200 -6.686 -3.354 1.00 0.00 H new ATOM 0 HB3 CYS A 119 6.717 -5.450 -4.483 1.00 0.00 H new ATOM 0 HG CYS A 119 7.287 -5.099 -1.525 1.00 0.00 H new ATOM 1431 N HIS A 120 3.169 -3.622 -4.436 1.00 0.00 N ATOM 1432 CA HIS A 120 2.804 -2.315 -4.927 1.00 0.00 C ATOM 1433 C HIS A 120 2.969 -1.282 -3.837 1.00 0.00 C ATOM 1434 O HIS A 120 2.229 -1.277 -2.855 1.00 0.00 O ATOM 1435 CB HIS A 120 1.368 -2.318 -5.463 1.00 0.00 C ATOM 1436 CG HIS A 120 0.975 -1.048 -6.170 1.00 0.00 C ATOM 1437 ND1 HIS A 120 -0.333 -0.681 -6.385 1.00 0.00 N ATOM 1438 CD2 HIS A 120 1.728 -0.071 -6.728 1.00 0.00 C ATOM 1439 CE1 HIS A 120 -0.373 0.455 -7.042 1.00 0.00 C ATOM 1440 NE2 HIS A 120 0.866 0.850 -7.263 1.00 0.00 N ATOM 0 H HIS A 120 2.471 -4.066 -3.839 1.00 0.00 H new ATOM 0 HA HIS A 120 3.469 -2.056 -5.751 1.00 0.00 H new ATOM 0 HB2 HIS A 120 1.249 -3.156 -6.150 1.00 0.00 H new ATOM 0 HB3 HIS A 120 0.682 -2.487 -4.633 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -1.149 -1.212 -6.080 1.00 0.00 H new ATOM 0 HD2 HIS A 120 2.807 -0.026 -6.748 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -1.267 0.977 -7.349 1.00 0.00 H new ATOM 1445 N VAL A 121 3.940 -0.418 -4.017 1.00 0.00 N ATOM 1446 CA VAL A 121 4.227 0.617 -3.052 1.00 0.00 C ATOM 1447 C VAL A 121 3.938 1.989 -3.639 1.00 0.00 C ATOM 1448 O VAL A 121 4.202 2.243 -4.825 1.00 0.00 O ATOM 1449 CB VAL A 121 5.703 0.539 -2.562 1.00 0.00 C ATOM 1450 CG1 VAL A 121 6.658 0.506 -3.733 1.00 0.00 C ATOM 1451 CG2 VAL A 121 6.040 1.696 -1.625 1.00 0.00 C ATOM 0 H VAL A 121 4.551 -0.412 -4.833 1.00 0.00 H new ATOM 0 HA VAL A 121 3.577 0.459 -2.191 1.00 0.00 H new ATOM 0 HB VAL A 121 5.815 -0.389 -2.001 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.683 0.452 -3.365 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.447 -0.367 -4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.534 1.410 -4.329 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.077 1.612 -1.301 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.899 2.641 -2.149 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.385 1.662 -0.755 1.00 0.00 H new ATOM 1461 N PHE A 122 3.369 2.855 -2.830 1.00 0.00 N ATOM 1462 CA PHE A 122 3.063 4.195 -3.256 1.00 0.00 C ATOM 1463 C PHE A 122 3.062 5.169 -2.094 1.00 0.00 C ATOM 1464 O PHE A 122 3.081 4.768 -0.916 1.00 0.00 O ATOM 1465 CB PHE A 122 1.740 4.258 -4.037 1.00 0.00 C ATOM 1466 CG PHE A 122 0.636 3.401 -3.497 1.00 0.00 C ATOM 1467 CD1 PHE A 122 0.299 3.428 -2.159 1.00 0.00 C ATOM 1468 CD2 PHE A 122 -0.072 2.572 -4.343 1.00 0.00 C ATOM 1469 CE1 PHE A 122 -0.718 2.640 -1.678 1.00 0.00 C ATOM 1470 CE2 PHE A 122 -1.089 1.783 -3.868 1.00 0.00 C ATOM 1471 CZ PHE A 122 -1.414 1.816 -2.533 1.00 0.00 C ATOM 0 H PHE A 122 3.108 2.649 -1.866 1.00 0.00 H new ATOM 0 HA PHE A 122 3.859 4.499 -3.936 1.00 0.00 H new ATOM 0 HB2 PHE A 122 1.398 5.293 -4.057 1.00 0.00 H new ATOM 0 HB3 PHE A 122 1.932 3.966 -5.069 1.00 0.00 H new ATOM 0 HD1 PHE A 122 0.840 4.075 -1.484 1.00 0.00 H new ATOM 0 HD2 PHE A 122 0.178 2.544 -5.393 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -0.972 2.667 -0.629 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -1.633 1.137 -4.542 1.00 0.00 H new ATOM 0 HZ PHE A 122 -2.214 1.196 -2.156 1.00 0.00 H new ATOM 1477 N THR A 123 3.036 6.435 -2.423 1.00 0.00 N ATOM 1478 CA THR A 123 3.080 7.478 -1.430 1.00 0.00 C ATOM 1479 C THR A 123 1.678 7.997 -1.158 1.00 0.00 C ATOM 1480 O THR A 123 0.825 7.968 -2.036 1.00 0.00 O ATOM 1481 CB THR A 123 3.991 8.640 -1.896 1.00 0.00 C ATOM 1482 OG1 THR A 123 3.417 9.283 -3.044 1.00 0.00 O ATOM 1483 CG2 THR A 123 5.369 8.117 -2.265 1.00 0.00 C ATOM 0 H THR A 123 2.984 6.772 -3.384 1.00 0.00 H new ATOM 0 HA THR A 123 3.493 7.061 -0.511 1.00 0.00 H new ATOM 0 HB THR A 123 4.081 9.354 -1.077 1.00 0.00 H new ATOM 0 HG1 THR A 123 3.998 10.018 -3.332 1.00 0.00 H new ATOM 0 HG21 THR A 123 5.998 8.946 -2.591 1.00 0.00 H new ATOM 0 HG22 THR A 123 5.821 7.638 -1.396 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.278 7.391 -3.073 1.00 0.00 H new ATOM 1490 N ALA A 124 1.434 8.449 0.048 1.00 0.00 N ATOM 1491 CA ALA A 124 0.137 8.979 0.402 1.00 0.00 C ATOM 1492 C ALA A 124 0.195 10.486 0.505 1.00 0.00 C ATOM 1493 O ALA A 124 1.273 11.064 0.663 1.00 0.00 O ATOM 1494 CB ALA A 124 -0.345 8.381 1.709 1.00 0.00 C ATOM 0 H ALA A 124 2.118 8.461 0.804 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.570 8.709 -0.382 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -1.323 8.792 1.959 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -0.422 7.298 1.607 1.00 0.00 H new ATOM 0 HB3 ALA A 124 0.363 8.622 2.502 1.00 0.00 H new ATOM 1500 N PHE A 125 -0.955 11.121 0.414 1.00 0.00 N ATOM 1501 CA PHE A 125 -1.038 12.568 0.510 1.00 0.00 C ATOM 1502 C PHE A 125 -0.838 13.036 1.943 1.00 0.00 C ATOM 1503 O PHE A 125 -0.290 14.110 2.179 1.00 0.00 O ATOM 1504 CB PHE A 125 -2.377 13.070 -0.036 1.00 0.00 C ATOM 1505 CG PHE A 125 -2.433 13.136 -1.538 1.00 0.00 C ATOM 1506 CD1 PHE A 125 -2.369 11.985 -2.307 1.00 0.00 C ATOM 1507 CD2 PHE A 125 -2.551 14.359 -2.180 1.00 0.00 C ATOM 1508 CE1 PHE A 125 -2.421 12.052 -3.684 1.00 0.00 C ATOM 1509 CE2 PHE A 125 -2.604 14.431 -3.558 1.00 0.00 C ATOM 1510 CZ PHE A 125 -2.538 13.276 -4.309 1.00 0.00 C ATOM 0 H PHE A 125 -1.852 10.656 0.273 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.236 12.989 -0.097 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.172 12.415 0.320 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -2.575 14.062 0.370 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.277 11.024 -1.823 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.602 15.266 -1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.370 11.147 -4.272 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.697 15.390 -4.047 1.00 0.00 H new ATOM 0 HZ PHE A 125 -2.578 13.330 -5.387 1.00 0.00 H new ATOM 1516 N ASP A 126 -1.262 12.223 2.895 1.00 0.00 N ATOM 1517 CA ASP A 126 -1.133 12.576 4.300 1.00 0.00 C ATOM 1518 C ASP A 126 -0.790 11.352 5.134 1.00 0.00 C ATOM 1519 O ASP A 126 -1.156 10.225 4.778 1.00 0.00 O ATOM 1520 CB ASP A 126 -2.428 13.212 4.814 1.00 0.00 C ATOM 1521 CG ASP A 126 -2.259 13.849 6.178 1.00 0.00 C ATOM 1522 OD1 ASP A 126 -1.901 15.043 6.235 1.00 0.00 O ATOM 1523 OD2 ASP A 126 -2.480 13.159 7.199 1.00 0.00 O ATOM 0 H ASP A 126 -1.697 11.317 2.723 1.00 0.00 H new ATOM 0 HA ASP A 126 -0.323 13.299 4.394 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -2.766 13.966 4.103 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -3.207 12.451 4.866 1.00 0.00 H new ATOM 1526 N VAL A 127 -0.092 11.580 6.237 1.00 0.00 N ATOM 1527 CA VAL A 127 0.301 10.514 7.150 1.00 0.00 C ATOM 1528 C VAL A 127 -0.919 9.792 7.708 1.00 0.00 C ATOM 1529 O VAL A 127 -0.970 8.560 7.735 1.00 0.00 O ATOM 1530 CB VAL A 127 1.132 11.069 8.326 1.00 0.00 C ATOM 1531 CG1 VAL A 127 1.420 9.981 9.348 1.00 0.00 C ATOM 1532 CG2 VAL A 127 2.425 11.685 7.822 1.00 0.00 C ATOM 0 H VAL A 127 0.218 12.508 6.525 1.00 0.00 H new ATOM 0 HA VAL A 127 0.907 9.811 6.578 1.00 0.00 H new ATOM 0 HB VAL A 127 0.548 11.848 8.816 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.007 10.397 10.167 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.480 9.590 9.737 1.00 0.00 H new ATOM 0 HG13 VAL A 127 1.980 9.175 8.873 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.997 12.071 8.666 1.00 0.00 H new ATOM 0 HG22 VAL A 127 3.011 10.927 7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 127 2.196 12.500 7.136 1.00 0.00 H new ATOM 1542 N ASN A 128 -1.910 10.566 8.133 1.00 0.00 N ATOM 1543 CA ASN A 128 -3.123 10.004 8.706 1.00 0.00 C ATOM 1544 C ASN A 128 -3.847 9.174 7.664 1.00 0.00 C ATOM 1545 O ASN A 128 -4.349 8.093 7.956 1.00 0.00 O ATOM 1546 CB ASN A 128 -4.045 11.112 9.218 1.00 0.00 C ATOM 1547 CG ASN A 128 -5.284 10.572 9.912 1.00 0.00 C ATOM 1548 OD1 ASN A 128 -5.126 9.500 10.666 1.00 0.00 O flip ATOM 1549 ND2 ASN A 128 -6.372 11.138 9.795 1.00 0.00 N flip ATOM 0 H ASN A 128 -1.896 11.585 8.091 1.00 0.00 H new ATOM 0 HA ASN A 128 -2.845 9.369 9.547 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.493 11.746 9.911 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -4.348 11.742 8.382 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -6.456 11.964 9.203 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -7.189 10.780 10.290 1.00 0.00 H new ATOM 1556 N LEU A 129 -3.866 9.688 6.444 1.00 0.00 N ATOM 1557 CA LEU A 129 -4.506 9.021 5.323 1.00 0.00 C ATOM 1558 C LEU A 129 -3.853 7.652 5.091 1.00 0.00 C ATOM 1559 O LEU A 129 -4.540 6.640 4.940 1.00 0.00 O ATOM 1560 CB LEU A 129 -4.400 9.924 4.067 1.00 0.00 C ATOM 1561 CG LEU A 129 -5.248 9.540 2.839 1.00 0.00 C ATOM 1562 CD1 LEU A 129 -4.598 8.424 2.040 1.00 0.00 C ATOM 1563 CD2 LEU A 129 -6.660 9.148 3.259 1.00 0.00 C ATOM 0 H LEU A 129 -3.437 10.582 6.204 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.561 8.852 5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -4.671 10.939 4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -3.355 9.950 3.759 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.309 10.417 2.194 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.224 8.179 1.182 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.617 8.749 1.693 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.486 7.542 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.241 8.881 2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.615 8.295 3.936 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.135 9.988 3.766 1.00 0.00 H new ATOM 1575 N ALA A 130 -2.529 7.627 5.095 1.00 0.00 N ATOM 1576 CA ALA A 130 -1.783 6.390 4.907 1.00 0.00 C ATOM 1577 C ALA A 130 -2.083 5.396 6.027 1.00 0.00 C ATOM 1578 O ALA A 130 -2.399 4.227 5.775 1.00 0.00 O ATOM 1579 CB ALA A 130 -0.288 6.681 4.854 1.00 0.00 C ATOM 0 H ALA A 130 -1.946 8.453 5.227 1.00 0.00 H new ATOM 0 HA ALA A 130 -2.094 5.945 3.962 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.259 5.749 4.713 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -0.078 7.354 4.023 1.00 0.00 H new ATOM 0 HB3 ALA A 130 0.025 7.148 5.788 1.00 0.00 H new ATOM 1585 N ALA A 131 -2.002 5.877 7.258 1.00 0.00 N ATOM 1586 CA ALA A 131 -2.224 5.050 8.432 1.00 0.00 C ATOM 1587 C ALA A 131 -3.645 4.495 8.483 1.00 0.00 C ATOM 1588 O ALA A 131 -3.849 3.327 8.813 1.00 0.00 O ATOM 1589 CB ALA A 131 -1.919 5.838 9.693 1.00 0.00 C ATOM 0 H ALA A 131 -1.781 6.850 7.470 1.00 0.00 H new ATOM 0 HA ALA A 131 -1.546 4.199 8.366 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.089 5.208 10.566 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.878 6.162 9.677 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.570 6.711 9.743 1.00 0.00 H new ATOM 1595 N GLU A 132 -4.624 5.324 8.144 1.00 0.00 N ATOM 1596 CA GLU A 132 -6.014 4.903 8.193 1.00 0.00 C ATOM 1597 C GLU A 132 -6.305 3.877 7.124 1.00 0.00 C ATOM 1598 O GLU A 132 -7.091 2.956 7.340 1.00 0.00 O ATOM 1599 CB GLU A 132 -6.951 6.095 8.094 1.00 0.00 C ATOM 1600 CG GLU A 132 -7.083 6.718 6.722 1.00 0.00 C ATOM 1601 CD GLU A 132 -7.925 7.969 6.763 1.00 0.00 C ATOM 1602 OE1 GLU A 132 -7.573 8.900 7.517 1.00 0.00 O ATOM 1603 OE2 GLU A 132 -8.955 8.023 6.073 1.00 0.00 O ATOM 0 H GLU A 132 -4.481 6.285 7.834 1.00 0.00 H new ATOM 0 HA GLU A 132 -6.190 4.430 9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -7.941 5.783 8.427 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -6.607 6.862 8.789 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -6.093 6.957 6.333 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -7.531 5.999 6.036 1.00 0.00 H new ATOM 1606 N ILE A 133 -5.683 4.041 5.970 1.00 0.00 N ATOM 1607 CA ILE A 133 -5.805 3.038 4.908 1.00 0.00 C ATOM 1608 C ILE A 133 -5.258 1.702 5.398 1.00 0.00 C ATOM 1609 O ILE A 133 -5.889 0.657 5.217 1.00 0.00 O ATOM 1610 CB ILE A 133 -5.078 3.445 3.596 1.00 0.00 C ATOM 1611 CG1 ILE A 133 -5.767 4.650 2.954 1.00 0.00 C ATOM 1612 CG2 ILE A 133 -5.043 2.270 2.617 1.00 0.00 C ATOM 1613 CD1 ILE A 133 -5.205 5.027 1.597 1.00 0.00 C ATOM 0 H ILE A 133 -5.096 4.842 5.739 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.866 2.957 4.673 1.00 0.00 H new ATOM 0 HB ILE A 133 -4.053 3.722 3.843 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -6.830 4.435 2.849 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -5.679 5.506 3.623 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -4.530 2.572 1.704 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -4.512 1.434 3.071 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -6.062 1.966 2.377 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.745 5.890 1.207 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -4.148 5.275 1.697 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -5.317 4.188 0.911 1.00 0.00 H new ATOM 1624 N ILE A 134 -4.089 1.743 6.041 1.00 0.00 N ATOM 1625 CA ILE A 134 -3.488 0.542 6.620 1.00 0.00 C ATOM 1626 C ILE A 134 -4.442 -0.075 7.644 1.00 0.00 C ATOM 1627 O ILE A 134 -4.626 -1.294 7.684 1.00 0.00 O ATOM 1628 CB ILE A 134 -2.129 0.860 7.306 1.00 0.00 C ATOM 1629 CG1 ILE A 134 -1.097 1.331 6.270 1.00 0.00 C ATOM 1630 CG2 ILE A 134 -1.604 -0.351 8.073 1.00 0.00 C ATOM 1631 CD1 ILE A 134 -0.732 0.279 5.240 1.00 0.00 C ATOM 0 H ILE A 134 -3.542 2.593 6.173 1.00 0.00 H new ATOM 0 HA ILE A 134 -3.306 -0.164 5.810 1.00 0.00 H new ATOM 0 HB ILE A 134 -2.294 1.666 8.021 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -1.489 2.208 5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -0.192 1.644 6.790 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -0.653 -0.100 8.542 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -2.324 -0.635 8.841 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -1.460 -1.184 7.384 1.00 0.00 H new ATOM 0 HD11 ILE A 134 0.001 0.689 4.545 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -0.309 -0.591 5.742 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -1.626 -0.018 4.691 1.00 0.00 H new ATOM 1642 N LEU A 135 -5.050 0.784 8.453 1.00 0.00 N ATOM 1643 CA LEU A 135 -6.018 0.365 9.457 1.00 0.00 C ATOM 1644 C LEU A 135 -7.186 -0.366 8.794 1.00 0.00 C ATOM 1645 O LEU A 135 -7.598 -1.434 9.252 1.00 0.00 O ATOM 1646 CB LEU A 135 -6.509 1.598 10.248 1.00 0.00 C ATOM 1647 CG LEU A 135 -7.461 1.341 11.431 1.00 0.00 C ATOM 1648 CD1 LEU A 135 -7.388 2.497 12.407 1.00 0.00 C ATOM 1649 CD2 LEU A 135 -8.900 1.167 10.954 1.00 0.00 C ATOM 0 H LEU A 135 -4.885 1.790 8.431 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.543 -0.327 10.153 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -5.634 2.127 10.627 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -7.010 2.269 9.551 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.149 0.420 11.923 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -8.063 2.311 13.242 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -6.368 2.595 12.779 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -7.680 3.418 11.903 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.548 0.987 11.812 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.224 2.071 10.438 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -8.957 0.319 10.272 1.00 0.00 H new ATOM 1661 N THR A 136 -7.705 0.214 7.718 1.00 0.00 N ATOM 1662 CA THR A 136 -8.810 -0.378 6.981 1.00 0.00 C ATOM 1663 C THR A 136 -8.397 -1.718 6.352 1.00 0.00 C ATOM 1664 O THR A 136 -9.136 -2.696 6.429 1.00 0.00 O ATOM 1665 CB THR A 136 -9.328 0.593 5.895 1.00 0.00 C ATOM 1666 OG1 THR A 136 -9.690 1.839 6.513 1.00 0.00 O ATOM 1667 CG2 THR A 136 -10.545 0.022 5.174 1.00 0.00 C ATOM 0 H THR A 136 -7.374 1.100 7.336 1.00 0.00 H new ATOM 0 HA THR A 136 -9.619 -0.568 7.686 1.00 0.00 H new ATOM 0 HB THR A 136 -8.535 0.743 5.163 1.00 0.00 H new ATOM 0 HG1 THR A 136 -8.882 2.295 6.829 1.00 0.00 H new ATOM 0 HG21 THR A 136 -10.884 0.729 4.417 1.00 0.00 H new ATOM 0 HG22 THR A 136 -10.276 -0.920 4.696 1.00 0.00 H new ATOM 0 HG23 THR A 136 -11.346 -0.152 5.893 1.00 0.00 H new ATOM 1674 N LEU A 137 -7.209 -1.753 5.745 1.00 0.00 N ATOM 1675 CA LEU A 137 -6.677 -2.986 5.159 1.00 0.00 C ATOM 1676 C LEU A 137 -6.561 -4.085 6.214 1.00 0.00 C ATOM 1677 O LEU A 137 -7.031 -5.203 6.011 1.00 0.00 O ATOM 1678 CB LEU A 137 -5.306 -2.736 4.516 1.00 0.00 C ATOM 1679 CG LEU A 137 -5.304 -1.903 3.230 1.00 0.00 C ATOM 1680 CD1 LEU A 137 -3.885 -1.515 2.851 1.00 0.00 C ATOM 1681 CD2 LEU A 137 -5.956 -2.680 2.095 1.00 0.00 C ATOM 0 H LEU A 137 -6.597 -0.943 5.646 1.00 0.00 H new ATOM 0 HA LEU A 137 -7.374 -3.314 4.387 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -4.670 -2.238 5.248 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.848 -3.701 4.300 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.878 -0.994 3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.902 -0.924 1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -3.442 -0.927 3.655 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.292 -2.415 2.691 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -5.947 -2.075 1.188 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -5.403 -3.603 1.921 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -6.985 -2.919 2.362 1.00 0.00 H new ATOM 1693 N GLY A 138 -5.941 -3.752 7.345 1.00 0.00 N ATOM 1694 CA GLY A 138 -5.783 -4.714 8.425 1.00 0.00 C ATOM 1695 C GLY A 138 -7.117 -5.200 8.955 1.00 0.00 C ATOM 1696 O GLY A 138 -7.313 -6.406 9.175 1.00 0.00 O ATOM 0 H GLY A 138 -5.544 -2.831 7.533 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -5.203 -5.565 8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -5.216 -4.258 9.236 1.00 0.00 H new ATOM 1700 N GLN A 139 -8.036 -4.260 9.155 1.00 0.00 N ATOM 1701 CA GLN A 139 -9.381 -4.573 9.611 1.00 0.00 C ATOM 1702 C GLN A 139 -10.052 -5.512 8.622 1.00 0.00 C ATOM 1703 O GLN A 139 -10.680 -6.500 9.011 1.00 0.00 O ATOM 1704 CB GLN A 139 -10.200 -3.286 9.746 1.00 0.00 C ATOM 1705 CG GLN A 139 -11.657 -3.505 10.128 1.00 0.00 C ATOM 1706 CD GLN A 139 -12.463 -2.220 10.093 1.00 0.00 C ATOM 1707 OE1 GLN A 139 -12.171 -1.308 9.320 1.00 0.00 O ATOM 1708 NE2 GLN A 139 -13.484 -2.141 10.919 1.00 0.00 N ATOM 0 H GLN A 139 -7.868 -3.265 9.006 1.00 0.00 H new ATOM 0 HA GLN A 139 -9.324 -5.060 10.585 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -9.732 -2.649 10.497 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -10.162 -2.745 8.801 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -12.103 -4.230 9.447 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -11.707 -3.935 11.128 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.695 -2.918 11.545 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.065 -1.303 10.933 1.00 0.00 H new ATOM 1717 N ALA A 140 -9.893 -5.200 7.343 1.00 0.00 N ATOM 1718 CA ALA A 140 -10.456 -5.993 6.272 1.00 0.00 C ATOM 1719 C ALA A 140 -9.952 -7.428 6.327 1.00 0.00 C ATOM 1720 O ALA A 140 -10.732 -8.361 6.235 1.00 0.00 O ATOM 1721 CB ALA A 140 -10.137 -5.362 4.924 1.00 0.00 C ATOM 0 H ALA A 140 -9.367 -4.386 7.024 1.00 0.00 H new ATOM 0 HA ALA A 140 -11.538 -6.016 6.399 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -10.567 -5.969 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -10.559 -4.358 4.883 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.056 -5.306 4.795 1.00 0.00 H new ATOM 1727 N PHE A 141 -8.643 -7.596 6.495 1.00 0.00 N ATOM 1728 CA PHE A 141 -8.048 -8.930 6.566 1.00 0.00 C ATOM 1729 C PHE A 141 -8.599 -9.714 7.742 1.00 0.00 C ATOM 1730 O PHE A 141 -8.941 -10.886 7.611 1.00 0.00 O ATOM 1731 CB PHE A 141 -6.520 -8.856 6.668 1.00 0.00 C ATOM 1732 CG PHE A 141 -5.852 -8.313 5.443 1.00 0.00 C ATOM 1733 CD1 PHE A 141 -6.189 -8.787 4.187 1.00 0.00 C ATOM 1734 CD2 PHE A 141 -4.887 -7.326 5.546 1.00 0.00 C ATOM 1735 CE1 PHE A 141 -5.579 -8.288 3.059 1.00 0.00 C ATOM 1736 CE2 PHE A 141 -4.272 -6.821 4.421 1.00 0.00 C ATOM 1737 CZ PHE A 141 -4.618 -7.303 3.176 1.00 0.00 C ATOM 0 H PHE A 141 -7.976 -6.830 6.584 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.312 -9.446 5.643 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -6.253 -8.232 7.521 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.131 -9.854 6.869 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -6.940 -9.558 4.091 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.613 -6.947 6.520 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -5.851 -8.666 2.084 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -3.521 -6.050 4.514 1.00 0.00 H new ATOM 0 HZ PHE A 141 -4.137 -6.910 2.292 1.00 0.00 H new ATOM 1743 N GLU A 142 -8.703 -9.059 8.882 1.00 0.00 N ATOM 1744 CA GLU A 142 -9.183 -9.711 10.085 1.00 0.00 C ATOM 1745 C GLU A 142 -10.658 -10.116 9.946 1.00 0.00 C ATOM 1746 O GLU A 142 -11.054 -11.215 10.346 1.00 0.00 O ATOM 1747 CB GLU A 142 -8.992 -8.797 11.294 1.00 0.00 C ATOM 1748 CG GLU A 142 -9.097 -9.514 12.627 1.00 0.00 C ATOM 1749 CD GLU A 142 -8.029 -10.580 12.796 1.00 0.00 C ATOM 1750 OE1 GLU A 142 -6.887 -10.232 13.178 1.00 0.00 O ATOM 1751 OE2 GLU A 142 -8.326 -11.770 12.554 1.00 0.00 O ATOM 0 H GLU A 142 -8.461 -8.075 9.001 1.00 0.00 H new ATOM 0 HA GLU A 142 -8.599 -10.619 10.234 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.015 -8.319 11.225 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -9.738 -8.003 11.259 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.012 -8.787 13.435 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -10.082 -9.973 12.713 1.00 0.00 H new ATOM 1754 N VAL A 143 -11.464 -9.240 9.359 1.00 0.00 N ATOM 1755 CA VAL A 143 -12.885 -9.523 9.187 1.00 0.00 C ATOM 1756 C VAL A 143 -13.127 -10.429 7.967 1.00 0.00 C ATOM 1757 O VAL A 143 -14.215 -10.975 7.790 1.00 0.00 O ATOM 1758 CB VAL A 143 -13.726 -8.217 9.066 1.00 0.00 C ATOM 1759 CG1 VAL A 143 -13.504 -7.535 7.727 1.00 0.00 C ATOM 1760 CG2 VAL A 143 -15.206 -8.495 9.298 1.00 0.00 C ATOM 0 H VAL A 143 -11.163 -8.335 8.997 1.00 0.00 H new ATOM 0 HA VAL A 143 -13.214 -10.050 10.082 1.00 0.00 H new ATOM 0 HB VAL A 143 -13.385 -7.534 9.844 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -14.106 -6.628 7.677 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -12.450 -7.278 7.620 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -13.796 -8.209 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -15.769 -7.566 9.208 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -15.563 -9.209 8.556 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -15.346 -8.909 10.297 1.00 0.00 H new ATOM 1770 N ALA A 144 -12.096 -10.604 7.145 1.00 0.00 N ATOM 1771 CA ALA A 144 -12.191 -11.457 5.964 1.00 0.00 C ATOM 1772 C ALA A 144 -12.346 -12.911 6.364 1.00 0.00 C ATOM 1773 O ALA A 144 -12.861 -13.727 5.599 1.00 0.00 O ATOM 1774 CB ALA A 144 -10.969 -11.288 5.077 1.00 0.00 C ATOM 0 H ALA A 144 -11.184 -10.166 7.275 1.00 0.00 H new ATOM 0 HA ALA A 144 -13.074 -11.154 5.401 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -11.062 -11.933 4.203 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -10.894 -10.249 4.755 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.073 -11.560 5.636 1.00 0.00 H new ATOM 1780 N TYR A 145 -11.889 -13.232 7.562 1.00 0.00 N ATOM 1781 CA TYR A 145 -11.988 -14.582 8.089 1.00 0.00 C ATOM 1782 C TYR A 145 -13.224 -14.726 8.973 1.00 0.00 C ATOM 1783 O TYR A 145 -13.433 -15.759 9.607 1.00 0.00 O ATOM 1784 CB TYR A 145 -10.724 -14.951 8.874 1.00 0.00 C ATOM 1785 CG TYR A 145 -9.481 -15.082 8.013 1.00 0.00 C ATOM 1786 CD1 TYR A 145 -8.698 -13.978 7.713 1.00 0.00 C ATOM 1787 CD2 TYR A 145 -9.096 -16.316 7.501 1.00 0.00 C ATOM 1788 CE1 TYR A 145 -7.566 -14.097 6.930 1.00 0.00 C ATOM 1789 CE2 TYR A 145 -7.965 -16.443 6.717 1.00 0.00 C ATOM 1790 CZ TYR A 145 -7.204 -15.331 6.433 1.00 0.00 C ATOM 1791 OH TYR A 145 -6.072 -15.454 5.653 1.00 0.00 O ATOM 0 H TYR A 145 -11.441 -12.568 8.194 1.00 0.00 H new ATOM 0 HA TYR A 145 -12.084 -15.268 7.248 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -10.547 -14.192 9.637 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -10.894 -15.893 9.395 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -8.978 -13.008 8.098 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.691 -17.190 7.720 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -6.967 -13.226 6.708 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -7.679 -17.410 6.329 1.00 0.00 H new ATOM 0 HH TYR A 145 -5.959 -16.390 5.385 1.00 0.00 H new ATOM 1797 N GLN A 146 -14.036 -13.682 9.012 1.00 0.00 N ATOM 1798 CA GLN A 146 -15.243 -13.688 9.808 1.00 0.00 C ATOM 1799 C GLN A 146 -16.451 -13.940 8.910 1.00 0.00 C ATOM 1800 O GLN A 146 -16.918 -12.990 8.253 1.00 0.00 O ATOM 1801 CB GLN A 146 -15.400 -12.354 10.551 1.00 0.00 C ATOM 1802 CG GLN A 146 -16.449 -12.379 11.655 1.00 0.00 C ATOM 1803 CD GLN A 146 -16.046 -13.260 12.826 1.00 0.00 C ATOM 1804 OE1 GLN A 146 -14.858 -13.406 13.135 1.00 0.00 O ATOM 1805 NE2 GLN A 146 -17.024 -13.851 13.481 1.00 0.00 N ATOM 0 H GLN A 146 -13.876 -12.817 8.497 1.00 0.00 H new ATOM 0 HA GLN A 146 -15.176 -14.487 10.547 1.00 0.00 H new ATOM 0 HB2 GLN A 146 -14.439 -12.076 10.983 1.00 0.00 H new ATOM 0 HB3 GLN A 146 -15.663 -11.578 9.832 1.00 0.00 H new ATOM 0 HG2 GLN A 146 -16.620 -11.363 12.012 1.00 0.00 H new ATOM 0 HG3 GLN A 146 -17.394 -12.736 11.245 1.00 0.00 H new ATOM 0 HE21 GLN A 146 -17.992 -13.704 13.194 1.00 0.00 H new ATOM 0 HE22 GLN A 146 -16.814 -14.455 14.275 1.00 0.00 H new TER 1814 GLN A 146