USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1166 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 25 CYS SG : rot 85:sc= -3.18! USER MOD Set 1.2: A 47 ASN : amide:sc= -0.3 K(o=-3.5,f=-6!) USER MOD Set 2.1: A 15 HIS : +bothHN:sc= -0.327! C(o=0.33!,f=-9.5!) USER MOD Set 2.2: A 18 GLN : amide:sc= 0.657 K(o=0.33,f=-2.8) USER MOD Set 3.1: A 1 MET CE :methyl 158:sc= -0.18 (180deg=-0.9) USER MOD Set 3.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ 179:sc= 2.46 (180deg=2.45) USER MOD Single : A 5 THR OG1 : rot 180:sc= -3.45! USER MOD Single : A 6 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0657) USER MOD Single : A 7 LYS NZ :NH3+ 165:sc= 1.3 (180deg=1.21) USER MOD Single : A 8 GLN : amide:sc= -2.11! C(o=-2.1!,f=-7.8!) USER MOD Single : A 9 MET CE :methyl -164:sc= -0.339 (180deg=-0.731) USER MOD Single : A 12 MET CE :methyl -177:sc= -1.72 (180deg=-1.75) USER MOD Single : A 22 ASN : amide:sc= 0.214 X(o=0.21,f=0) USER MOD Single : A 43 TYR OH : rot -175:sc= 1.25 USER MOD Single : A 46 ASN : amide:sc= 0.106 K(o=0.11,f=-2.5!) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 51 SER OG : rot 91:sc= 1.25 USER MOD Single : A 54 HIS : no HD1:sc= -1.17! C(o=-1.2!,f=-5.7!) USER MOD Single : A 56 SER OG : rot 180:sc= -0.0273 USER MOD Single : A 57 MET CE :methyl -127:sc= -1.44 (180deg=-3.46!) USER MOD Single : A 62 GLN :FLIP amide:sc= -3.09 F(o=-4.4!,f=-3.1) USER MOD Single : A 64 THR OG1 : rot 69:sc= 0.021 USER MOD Single : A 67 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0818) USER MOD Single : A 69 MET CE :methyl 155:sc= 0 (180deg=-0.448) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.482 K(o=-0.48,f=-12!) USER MOD Single : A 76 MET CE :methyl -161:sc= -0.106 (180deg=-0.889) USER MOD Single : A 79 ASN :FLIP amide:sc= 1.19 F(o=0.5,f=1.2) USER MOD Single : A 81 HIS : no HE2:sc= 0.251 K(o=0.25,f=-7!) USER MOD Single : A 82 SER OG : rot 170:sc= -0.724 USER MOD Single : A 83 HIS : no HE2:sc= 1.06 K(o=1.1,f=-4.1!) USER MOD Single : A 86 THR OG1 : rot 150:sc= -1.85! USER MOD Single : A 91 SER OG : rot -91:sc= 1.3 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 5:sc= 0.584 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 57:sc= 1.24 USER MOD Single : A 109 SER OG : rot -170:sc= -2.2! USER MOD Single : A 114 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.2) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 49:sc= 0.545 USER MOD Single : A 119 LYS NZ :NH3+ 153:sc= 0.952 (180deg=0.244) USER MOD Single : A 120 SER OG : rot -115:sc= -0.81 USER MOD Single : A 124 LYS NZ :NH3+ -131:sc= 0.0397 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 163:sc= 0.257 (180deg=-0.222) USER MOD Single : A 136 LYS NZ :NH3+ -169:sc= 1.62 (180deg=1.42) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=-0.00056) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 HIS : no HD1:sc= -0.0371 X(o=-0.037,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.822 -3.149 5.624 1.00 0.00 N ATOM 2 CA MET A 1 -12.884 -2.918 4.163 1.00 0.00 C ATOM 3 C MET A 1 -11.887 -1.841 3.749 1.00 0.00 C ATOM 4 O MET A 1 -11.627 -0.898 4.498 1.00 0.00 O ATOM 5 CB MET A 1 -14.301 -2.499 3.757 1.00 0.00 C ATOM 6 CG MET A 1 -14.494 -2.353 2.256 1.00 0.00 C ATOM 7 SD MET A 1 -16.105 -1.670 1.819 1.00 0.00 S ATOM 8 CE MET A 1 -16.003 -0.049 2.579 1.00 0.00 C ATOM 0 H1 MET A 1 -13.519 -3.873 5.891 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.869 -3.474 5.884 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.034 -2.263 6.125 1.00 0.00 H new ATOM 0 HA MET A 1 -12.626 -3.847 3.655 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.010 -3.236 4.134 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.541 -1.551 4.238 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.711 -1.709 1.855 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.378 -3.328 1.783 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.711 0.625 2.096 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.244 -0.128 3.639 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.993 0.343 2.465 1.00 0.00 H new ATOM 20 N ILE A 2 -11.314 -1.992 2.565 1.00 0.00 N ATOM 21 CA ILE A 2 -10.433 -0.975 2.013 1.00 0.00 C ATOM 22 C ILE A 2 -10.930 -0.550 0.633 1.00 0.00 C ATOM 23 O ILE A 2 -11.328 -1.385 -0.183 1.00 0.00 O ATOM 24 CB ILE A 2 -8.965 -1.463 1.932 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.059 -0.351 1.386 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.853 -2.717 1.075 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.589 -0.716 1.360 1.00 0.00 C ATOM 0 H ILE A 2 -11.443 -2.809 1.968 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.452 -0.117 2.685 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.635 -1.715 2.940 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.379 -0.099 0.375 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.191 0.544 1.995 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.812 -3.038 1.035 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.461 -3.510 1.510 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.205 -2.501 0.066 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.014 0.120 0.962 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.252 -0.939 2.372 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.443 -1.591 0.727 1.00 0.00 H new ATOM 39 N THR A 3 -10.956 0.749 0.394 1.00 0.00 N ATOM 40 CA THR A 3 -11.410 1.278 -0.881 1.00 0.00 C ATOM 41 C THR A 3 -10.359 2.205 -1.489 1.00 0.00 C ATOM 42 O THR A 3 -9.811 3.067 -0.804 1.00 0.00 O ATOM 43 CB THR A 3 -12.744 2.036 -0.715 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.727 1.171 -0.129 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.257 2.552 -2.052 1.00 0.00 C ATOM 0 H THR A 3 -10.668 1.459 1.067 1.00 0.00 H new ATOM 0 HA THR A 3 -11.566 0.436 -1.555 1.00 0.00 H new ATOM 0 HB THR A 3 -12.565 2.890 -0.062 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.571 1.658 -0.025 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.198 3.081 -1.901 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.524 3.232 -2.485 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.417 1.713 -2.729 1.00 0.00 H new ATOM 53 N LEU A 4 -10.066 2.007 -2.767 1.00 0.00 N ATOM 54 CA LEU A 4 -9.162 2.887 -3.492 1.00 0.00 C ATOM 55 C LEU A 4 -9.700 3.140 -4.889 1.00 0.00 C ATOM 56 O LEU A 4 -10.577 2.420 -5.365 1.00 0.00 O ATOM 57 CB LEU A 4 -7.740 2.307 -3.539 1.00 0.00 C ATOM 58 CG LEU A 4 -7.622 0.842 -3.973 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.626 0.717 -5.488 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.368 0.215 -3.390 1.00 0.00 C ATOM 0 H LEU A 4 -10.444 1.241 -3.325 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.104 3.839 -2.964 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.144 2.915 -4.219 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.296 2.408 -2.549 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.490 0.306 -3.590 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.541 -0.333 -5.767 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.557 1.123 -5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.783 1.271 -5.901 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.300 -0.825 -3.708 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.492 0.760 -3.741 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.411 0.260 -2.302 1.00 0.00 H new ATOM 72 N THR A 5 -9.181 4.159 -5.545 1.00 0.00 N ATOM 73 CA THR A 5 -9.699 4.550 -6.846 1.00 0.00 C ATOM 74 C THR A 5 -8.893 3.922 -7.976 1.00 0.00 C ATOM 75 O THR A 5 -7.804 3.383 -7.753 1.00 0.00 O ATOM 76 CB THR A 5 -9.708 6.083 -7.018 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.373 6.595 -7.030 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.489 6.746 -5.897 1.00 0.00 C ATOM 0 H THR A 5 -8.407 4.729 -5.204 1.00 0.00 H new ATOM 0 HA THR A 5 -10.725 4.185 -6.895 1.00 0.00 H new ATOM 0 HB THR A 5 -10.189 6.308 -7.970 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.397 7.568 -7.142 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.482 7.827 -6.039 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.518 6.385 -5.907 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.029 6.503 -4.939 1.00 0.00 H new ATOM 86 N LYS A 6 -9.439 3.997 -9.186 1.00 0.00 N ATOM 87 CA LYS A 6 -8.756 3.513 -10.383 1.00 0.00 C ATOM 88 C LYS A 6 -7.387 4.161 -10.499 1.00 0.00 C ATOM 89 O LYS A 6 -6.386 3.510 -10.791 1.00 0.00 O ATOM 90 CB LYS A 6 -9.573 3.883 -11.617 1.00 0.00 C ATOM 91 CG LYS A 6 -9.023 3.322 -12.918 1.00 0.00 C ATOM 92 CD LYS A 6 -9.698 3.962 -14.120 1.00 0.00 C ATOM 93 CE LYS A 6 -9.143 3.428 -15.430 1.00 0.00 C ATOM 94 NZ LYS A 6 -9.462 1.991 -15.629 1.00 0.00 N ATOM 0 H LYS A 6 -10.362 4.392 -9.365 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.646 2.431 -10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.594 3.526 -11.483 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.622 4.969 -11.694 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.948 3.495 -12.966 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.174 2.243 -12.945 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.771 3.775 -14.077 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.561 5.043 -14.081 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.551 4.007 -16.259 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.062 3.564 -15.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -9.185 1.704 -16.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.941 1.420 -14.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.484 1.842 -15.504 1.00 0.00 H new ATOM 108 N LYS A 7 -7.372 5.456 -10.245 1.00 0.00 N ATOM 109 CA LYS A 7 -6.166 6.258 -10.336 1.00 0.00 C ATOM 110 C LYS A 7 -5.102 5.775 -9.349 1.00 0.00 C ATOM 111 O LYS A 7 -3.917 5.752 -9.674 1.00 0.00 O ATOM 112 CB LYS A 7 -6.521 7.723 -10.080 1.00 0.00 C ATOM 113 CG LYS A 7 -5.499 8.704 -10.613 1.00 0.00 C ATOM 114 CD LYS A 7 -4.814 9.460 -9.491 1.00 0.00 C ATOM 115 CE LYS A 7 -3.763 10.412 -10.027 1.00 0.00 C ATOM 116 NZ LYS A 7 -3.040 11.105 -8.933 1.00 0.00 N ATOM 0 H LYS A 7 -8.200 5.984 -9.968 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.746 6.155 -11.337 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.488 7.937 -10.535 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.633 7.877 -9.007 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.753 8.170 -11.201 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.987 9.411 -11.284 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -5.556 10.019 -8.920 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -4.350 8.753 -8.804 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -3.051 9.860 -10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -4.237 11.150 -10.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -2.176 11.544 -9.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -3.652 11.840 -8.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -2.784 10.417 -8.196 1.00 0.00 H new ATOM 130 N GLN A 8 -5.530 5.379 -8.152 1.00 0.00 N ATOM 131 CA GLN A 8 -4.610 4.842 -7.151 1.00 0.00 C ATOM 132 C GLN A 8 -4.065 3.493 -7.604 1.00 0.00 C ATOM 133 O GLN A 8 -2.878 3.211 -7.448 1.00 0.00 O ATOM 134 CB GLN A 8 -5.310 4.693 -5.798 1.00 0.00 C ATOM 135 CG GLN A 8 -5.991 5.961 -5.325 1.00 0.00 C ATOM 136 CD GLN A 8 -5.057 7.150 -5.277 1.00 0.00 C ATOM 137 OE1 GLN A 8 -3.863 7.013 -5.031 1.00 0.00 O ATOM 138 NE2 GLN A 8 -5.600 8.328 -5.521 1.00 0.00 N ATOM 0 H GLN A 8 -6.504 5.419 -7.852 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.781 5.541 -7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.051 3.897 -5.867 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.578 4.383 -5.052 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.826 6.188 -5.988 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.409 5.794 -4.332 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -6.598 8.398 -5.721 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -5.022 9.168 -5.509 1.00 0.00 H new ATOM 147 N MET A 9 -4.937 2.662 -8.169 1.00 0.00 N ATOM 148 CA MET A 9 -4.511 1.386 -8.734 1.00 0.00 C ATOM 149 C MET A 9 -3.454 1.624 -9.805 1.00 0.00 C ATOM 150 O MET A 9 -2.414 0.969 -9.823 1.00 0.00 O ATOM 151 CB MET A 9 -5.708 0.635 -9.324 1.00 0.00 C ATOM 152 CG MET A 9 -5.327 -0.641 -10.065 1.00 0.00 C ATOM 153 SD MET A 9 -6.759 -1.532 -10.708 1.00 0.00 S ATOM 154 CE MET A 9 -7.563 -2.011 -9.183 1.00 0.00 C ATOM 0 H MET A 9 -5.937 2.848 -8.247 1.00 0.00 H new ATOM 0 HA MET A 9 -4.081 0.775 -7.941 1.00 0.00 H new ATOM 0 HB2 MET A 9 -6.400 0.385 -8.520 1.00 0.00 H new ATOM 0 HB3 MET A 9 -6.239 1.297 -10.008 1.00 0.00 H new ATOM 0 HG2 MET A 9 -4.660 -0.391 -10.890 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.771 -1.294 -9.392 1.00 0.00 H new ATOM 0 HE1 MET A 9 -8.291 -2.796 -9.387 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.817 -2.382 -8.479 1.00 0.00 H new ATOM 0 HE3 MET A 9 -8.071 -1.148 -8.753 1.00 0.00 H new ATOM 164 N GLU A 10 -3.728 2.589 -10.673 1.00 0.00 N ATOM 165 CA GLU A 10 -2.809 3.000 -11.712 1.00 0.00 C ATOM 166 C GLU A 10 -1.489 3.490 -11.120 1.00 0.00 C ATOM 167 O GLU A 10 -0.417 3.164 -11.628 1.00 0.00 O ATOM 168 CB GLU A 10 -3.471 4.105 -12.532 1.00 0.00 C ATOM 169 CG GLU A 10 -4.544 3.604 -13.485 1.00 0.00 C ATOM 170 CD GLU A 10 -3.978 2.754 -14.599 1.00 0.00 C ATOM 171 OE1 GLU A 10 -3.795 1.538 -14.397 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.714 3.301 -15.692 1.00 0.00 O ATOM 0 H GLU A 10 -4.605 3.110 -10.671 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.579 2.147 -12.350 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.913 4.833 -11.852 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.705 4.628 -13.105 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.279 3.024 -12.927 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.071 4.456 -13.914 1.00 0.00 H new ATOM 179 N GLU A 11 -1.574 4.259 -10.040 1.00 0.00 N ATOM 180 CA GLU A 11 -0.393 4.771 -9.364 1.00 0.00 C ATOM 181 C GLU A 11 0.460 3.633 -8.800 1.00 0.00 C ATOM 182 O GLU A 11 1.684 3.636 -8.940 1.00 0.00 O ATOM 183 CB GLU A 11 -0.807 5.744 -8.259 1.00 0.00 C ATOM 184 CG GLU A 11 -0.948 7.182 -8.738 1.00 0.00 C ATOM 185 CD GLU A 11 -1.194 8.162 -7.608 1.00 0.00 C ATOM 186 OE1 GLU A 11 -0.384 8.195 -6.662 1.00 0.00 O ATOM 187 OE2 GLU A 11 -2.180 8.926 -7.680 1.00 0.00 O ATOM 0 H GLU A 11 -2.456 4.542 -9.613 1.00 0.00 H new ATOM 0 HA GLU A 11 0.218 5.305 -10.092 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.756 5.416 -7.834 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.069 5.707 -7.458 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.043 7.472 -9.272 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.771 7.243 -9.450 1.00 0.00 H new ATOM 194 N MET A 12 -0.191 2.654 -8.180 1.00 0.00 N ATOM 195 CA MET A 12 0.508 1.490 -7.648 1.00 0.00 C ATOM 196 C MET A 12 1.100 0.659 -8.783 1.00 0.00 C ATOM 197 O MET A 12 2.251 0.233 -8.714 1.00 0.00 O ATOM 198 CB MET A 12 -0.435 0.629 -6.804 1.00 0.00 C ATOM 199 CG MET A 12 -0.931 1.316 -5.543 1.00 0.00 C ATOM 200 SD MET A 12 -1.954 0.240 -4.519 1.00 0.00 S ATOM 201 CE MET A 12 -3.299 -0.122 -5.646 1.00 0.00 C ATOM 0 H MET A 12 -1.200 2.644 -8.034 1.00 0.00 H new ATOM 0 HA MET A 12 1.318 1.844 -7.010 1.00 0.00 H new ATOM 0 HB2 MET A 12 -1.293 0.344 -7.412 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.079 -0.291 -6.527 1.00 0.00 H new ATOM 0 HG2 MET A 12 -0.076 1.659 -4.961 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.504 2.201 -5.818 1.00 0.00 H new ATOM 0 HE1 MET A 12 -4.043 -0.736 -5.139 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.760 0.810 -5.974 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.913 -0.660 -6.512 1.00 0.00 H new ATOM 211 N LEU A 13 0.310 0.456 -9.833 1.00 0.00 N ATOM 212 CA LEU A 13 0.750 -0.298 -11.002 1.00 0.00 C ATOM 213 C LEU A 13 1.976 0.346 -11.648 1.00 0.00 C ATOM 214 O LEU A 13 2.932 -0.343 -12.015 1.00 0.00 O ATOM 215 CB LEU A 13 -0.391 -0.405 -12.020 1.00 0.00 C ATOM 216 CG LEU A 13 -1.487 -1.415 -11.668 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.534 -1.470 -12.770 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.889 -2.795 -11.429 1.00 0.00 C ATOM 0 H LEU A 13 -0.646 0.806 -9.898 1.00 0.00 H new ATOM 0 HA LEU A 13 1.031 -1.299 -10.673 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.848 0.578 -12.134 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.031 -0.674 -12.988 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.972 -1.089 -10.748 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.305 -2.193 -12.503 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.986 -0.486 -12.892 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.062 -1.771 -13.705 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.684 -3.498 -11.180 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.377 -3.131 -12.331 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.178 -2.745 -10.605 1.00 0.00 H new ATOM 230 N ALA A 14 1.949 1.667 -11.770 1.00 0.00 N ATOM 231 CA ALA A 14 3.064 2.408 -12.350 1.00 0.00 C ATOM 232 C ALA A 14 4.316 2.259 -11.495 1.00 0.00 C ATOM 233 O ALA A 14 5.418 2.072 -12.014 1.00 0.00 O ATOM 234 CB ALA A 14 2.702 3.878 -12.504 1.00 0.00 C ATOM 0 H ALA A 14 1.165 2.249 -11.475 1.00 0.00 H new ATOM 0 HA ALA A 14 3.271 1.993 -13.337 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.544 4.417 -12.938 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.835 3.973 -13.158 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.467 4.299 -11.527 1.00 0.00 H new ATOM 240 N HIS A 15 4.131 2.327 -10.181 1.00 0.00 N ATOM 241 CA HIS A 15 5.232 2.194 -9.234 1.00 0.00 C ATOM 242 C HIS A 15 5.813 0.787 -9.277 1.00 0.00 C ATOM 243 O HIS A 15 7.019 0.595 -9.115 1.00 0.00 O ATOM 244 CB HIS A 15 4.746 2.515 -7.819 1.00 0.00 C ATOM 245 CG HIS A 15 5.822 2.460 -6.774 1.00 0.00 C ATOM 246 ND1 HIS A 15 6.980 3.209 -6.831 1.00 0.00 N ATOM 247 CD2 HIS A 15 5.910 1.727 -5.640 1.00 0.00 C ATOM 248 CE1 HIS A 15 7.730 2.937 -5.779 1.00 0.00 C ATOM 249 NE2 HIS A 15 7.103 2.042 -5.039 1.00 0.00 N ATOM 0 H HIS A 15 3.221 2.475 -9.745 1.00 0.00 H new ATOM 0 HA HIS A 15 6.014 2.899 -9.514 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.302 3.511 -7.816 1.00 0.00 H new ATOM 0 HB3 HIS A 15 3.957 1.813 -7.550 1.00 0.00 H new ATOM 0 HD1 HIS A 15 7.219 3.870 -7.571 1.00 0.00 H new ATOM 0 HD2 HIS A 15 5.176 1.023 -5.275 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.694 3.373 -5.561 1.00 0.00 H new ATOM 0 HE2 HIS A 15 7.449 1.649 -4.164 1.00 0.00 H new ATOM 258 N ALA A 16 4.941 -0.186 -9.482 1.00 0.00 N ATOM 259 CA ALA A 16 5.347 -1.583 -9.552 1.00 0.00 C ATOM 260 C ALA A 16 6.335 -1.819 -10.692 1.00 0.00 C ATOM 261 O ALA A 16 7.421 -2.349 -10.475 1.00 0.00 O ATOM 262 CB ALA A 16 4.130 -2.481 -9.704 1.00 0.00 C ATOM 0 H ALA A 16 3.940 -0.034 -9.604 1.00 0.00 H new ATOM 0 HA ALA A 16 5.852 -1.833 -8.619 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.450 -3.522 -9.755 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.469 -2.346 -8.848 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.597 -2.220 -10.618 1.00 0.00 H new ATOM 268 N ARG A 17 5.970 -1.396 -11.901 1.00 0.00 N ATOM 269 CA ARG A 17 6.841 -1.580 -13.063 1.00 0.00 C ATOM 270 C ARG A 17 8.073 -0.689 -12.941 1.00 0.00 C ATOM 271 O ARG A 17 9.165 -1.045 -13.385 1.00 0.00 O ATOM 272 CB ARG A 17 6.102 -1.272 -14.370 1.00 0.00 C ATOM 273 CG ARG A 17 4.767 -1.988 -14.512 1.00 0.00 C ATOM 274 CD ARG A 17 4.270 -1.960 -15.950 1.00 0.00 C ATOM 275 NE ARG A 17 5.016 -2.886 -16.804 1.00 0.00 N ATOM 276 CZ ARG A 17 5.143 -2.760 -18.126 1.00 0.00 C ATOM 277 NH1 ARG A 17 4.607 -1.721 -18.756 1.00 0.00 N ATOM 278 NH2 ARG A 17 5.816 -3.674 -18.817 1.00 0.00 N ATOM 0 H ARG A 17 5.086 -0.928 -12.102 1.00 0.00 H new ATOM 0 HA ARG A 17 7.150 -2.625 -13.087 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.934 -0.197 -14.435 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.741 -1.547 -15.209 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.870 -3.022 -14.182 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.030 -1.518 -13.862 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.211 -2.218 -15.973 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.360 -0.948 -16.346 1.00 0.00 H new ATOM 0 HE ARG A 17 5.470 -3.683 -16.357 1.00 0.00 H new ATOM 0 HH11 ARG A 17 4.095 -1.014 -18.229 1.00 0.00 H new ATOM 0 HH12 ARG A 17 4.708 -1.630 -19.767 1.00 0.00 H new ATOM 0 HH21 ARG A 17 6.235 -4.470 -18.337 1.00 0.00 H new ATOM 0 HH22 ARG A 17 5.914 -3.579 -19.828 1.00 0.00 H new ATOM 292 N GLN A 18 7.873 0.471 -12.331 1.00 0.00 N ATOM 293 CA GLN A 18 8.939 1.433 -12.075 1.00 0.00 C ATOM 294 C GLN A 18 10.102 0.802 -11.311 1.00 0.00 C ATOM 295 O GLN A 18 11.267 1.018 -11.642 1.00 0.00 O ATOM 296 CB GLN A 18 8.358 2.591 -11.268 1.00 0.00 C ATOM 297 CG GLN A 18 9.373 3.611 -10.797 1.00 0.00 C ATOM 298 CD GLN A 18 8.736 4.668 -9.917 1.00 0.00 C ATOM 299 OE1 GLN A 18 8.649 4.511 -8.696 1.00 0.00 O ATOM 300 NE2 GLN A 18 8.277 5.745 -10.528 1.00 0.00 N ATOM 0 H GLN A 18 6.959 0.775 -11.996 1.00 0.00 H new ATOM 0 HA GLN A 18 9.331 1.784 -13.030 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.609 3.099 -11.876 1.00 0.00 H new ATOM 0 HB3 GLN A 18 7.841 2.186 -10.398 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.166 3.107 -10.245 1.00 0.00 H new ATOM 0 HG3 GLN A 18 9.838 4.087 -11.660 1.00 0.00 H new ATOM 0 HE21 GLN A 18 8.369 5.836 -11.540 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.830 6.486 -9.988 1.00 0.00 H new ATOM 309 N ALA A 19 9.771 0.021 -10.298 1.00 0.00 N ATOM 310 CA ALA A 19 10.776 -0.550 -9.410 1.00 0.00 C ATOM 311 C ALA A 19 11.500 -1.740 -10.041 1.00 0.00 C ATOM 312 O ALA A 19 12.648 -2.018 -9.695 1.00 0.00 O ATOM 313 CB ALA A 19 10.139 -0.960 -8.094 1.00 0.00 C ATOM 0 H ALA A 19 8.811 -0.235 -10.067 1.00 0.00 H new ATOM 0 HA ALA A 19 11.523 0.222 -9.227 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.899 -1.385 -7.439 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.696 -0.086 -7.616 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.364 -1.703 -8.281 1.00 0.00 H new ATOM 319 N LEU A 20 10.835 -2.423 -10.974 1.00 0.00 N ATOM 320 CA LEU A 20 11.381 -3.633 -11.593 1.00 0.00 C ATOM 321 C LEU A 20 12.801 -3.405 -12.116 1.00 0.00 C ATOM 322 O LEU A 20 13.105 -2.338 -12.653 1.00 0.00 O ATOM 323 CB LEU A 20 10.475 -4.099 -12.734 1.00 0.00 C ATOM 324 CG LEU A 20 9.032 -4.410 -12.339 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.256 -4.926 -13.539 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.992 -5.418 -11.202 1.00 0.00 C ATOM 0 H LEU A 20 9.913 -2.157 -11.319 1.00 0.00 H new ATOM 0 HA LEU A 20 11.424 -4.406 -10.826 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.465 -3.329 -13.505 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.912 -4.992 -13.181 1.00 0.00 H new ATOM 0 HG LEU A 20 8.563 -3.489 -11.993 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.230 -5.143 -13.243 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.255 -4.170 -14.324 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.726 -5.836 -13.913 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.956 -5.626 -10.936 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.478 -6.341 -11.517 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.514 -5.011 -10.336 1.00 0.00 H new ATOM 338 N PRO A 21 13.684 -4.417 -12.002 1.00 0.00 N ATOM 339 CA PRO A 21 13.330 -5.755 -11.513 1.00 0.00 C ATOM 340 C PRO A 21 13.341 -5.878 -9.987 1.00 0.00 C ATOM 341 O PRO A 21 13.259 -6.982 -9.446 1.00 0.00 O ATOM 342 CB PRO A 21 14.423 -6.621 -12.126 1.00 0.00 C ATOM 343 CG PRO A 21 15.624 -5.739 -12.132 1.00 0.00 C ATOM 344 CD PRO A 21 15.116 -4.335 -12.356 1.00 0.00 C ATOM 0 HA PRO A 21 12.312 -6.032 -11.788 1.00 0.00 H new ATOM 0 HB2 PRO A 21 14.594 -7.523 -11.538 1.00 0.00 H new ATOM 0 HB3 PRO A 21 14.159 -6.942 -13.134 1.00 0.00 H new ATOM 0 HG2 PRO A 21 16.164 -5.811 -11.188 1.00 0.00 H new ATOM 0 HG3 PRO A 21 16.318 -6.032 -12.920 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.642 -3.615 -11.730 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.255 -4.020 -13.390 1.00 0.00 H new ATOM 352 N ASN A 22 13.453 -4.754 -9.299 1.00 0.00 N ATOM 353 CA ASN A 22 13.324 -4.741 -7.849 1.00 0.00 C ATOM 354 C ASN A 22 11.853 -4.683 -7.481 1.00 0.00 C ATOM 355 O ASN A 22 11.012 -4.386 -8.329 1.00 0.00 O ATOM 356 CB ASN A 22 14.074 -3.552 -7.234 1.00 0.00 C ATOM 357 CG ASN A 22 15.575 -3.762 -7.203 1.00 0.00 C ATOM 358 OD1 ASN A 22 16.282 -3.449 -8.162 1.00 0.00 O ATOM 359 ND2 ASN A 22 16.078 -4.284 -6.092 1.00 0.00 N ATOM 0 H ASN A 22 13.632 -3.841 -9.718 1.00 0.00 H new ATOM 0 HA ASN A 22 13.768 -5.653 -7.449 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.849 -2.651 -7.804 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.713 -3.385 -6.219 1.00 0.00 H new ATOM 0 HD21 ASN A 22 17.083 -4.439 -6.011 1.00 0.00 H new ATOM 0 HD22 ASN A 22 15.460 -4.530 -5.319 1.00 0.00 H new ATOM 366 N GLU A 23 11.535 -4.978 -6.237 1.00 0.00 N ATOM 367 CA GLU A 23 10.151 -4.986 -5.812 1.00 0.00 C ATOM 368 C GLU A 23 9.726 -3.576 -5.403 1.00 0.00 C ATOM 369 O GLU A 23 10.560 -2.748 -5.025 1.00 0.00 O ATOM 370 CB GLU A 23 9.949 -6.003 -4.684 1.00 0.00 C ATOM 371 CG GLU A 23 10.329 -5.516 -3.302 1.00 0.00 C ATOM 372 CD GLU A 23 9.107 -5.236 -2.465 1.00 0.00 C ATOM 373 OE1 GLU A 23 8.460 -6.206 -2.013 1.00 0.00 O ATOM 374 OE2 GLU A 23 8.781 -4.051 -2.264 1.00 0.00 O ATOM 0 H GLU A 23 12.209 -5.213 -5.509 1.00 0.00 H new ATOM 0 HA GLU A 23 9.514 -5.294 -6.641 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.901 -6.304 -4.671 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.533 -6.895 -4.911 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.947 -6.265 -2.807 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.930 -4.611 -3.386 1.00 0.00 H new ATOM 381 N ALA A 24 8.437 -3.296 -5.503 1.00 0.00 N ATOM 382 CA ALA A 24 7.940 -1.945 -5.300 1.00 0.00 C ATOM 383 C ALA A 24 7.227 -1.794 -3.965 1.00 0.00 C ATOM 384 O ALA A 24 6.140 -2.331 -3.778 1.00 0.00 O ATOM 385 CB ALA A 24 7.006 -1.556 -6.433 1.00 0.00 C ATOM 0 H ALA A 24 7.717 -3.984 -5.723 1.00 0.00 H new ATOM 0 HA ALA A 24 8.802 -1.278 -5.291 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.640 -0.542 -6.271 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.544 -1.600 -7.380 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.163 -2.246 -6.463 1.00 0.00 H new ATOM 391 N CYS A 25 7.815 -1.022 -3.061 1.00 0.00 N ATOM 392 CA CYS A 25 7.232 -0.808 -1.744 1.00 0.00 C ATOM 393 C CYS A 25 6.827 0.654 -1.562 1.00 0.00 C ATOM 394 O CYS A 25 7.173 1.515 -2.382 1.00 0.00 O ATOM 395 CB CYS A 25 8.228 -1.212 -0.654 1.00 0.00 C ATOM 396 SG CYS A 25 9.801 -0.332 -0.738 1.00 0.00 S ATOM 0 H CYS A 25 8.697 -0.533 -3.216 1.00 0.00 H new ATOM 0 HA CYS A 25 6.339 -1.428 -1.661 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.775 -1.035 0.322 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.418 -2.283 -0.728 1.00 0.00 H new ATOM 0 HG CYS A 25 9.697 0.804 -0.114 1.00 0.00 H new ATOM 402 N GLY A 26 6.063 0.918 -0.512 1.00 0.00 N ATOM 403 CA GLY A 26 5.634 2.267 -0.204 1.00 0.00 C ATOM 404 C GLY A 26 4.494 2.269 0.791 1.00 0.00 C ATOM 405 O GLY A 26 4.199 1.238 1.397 1.00 0.00 O ATOM 0 H GLY A 26 5.728 0.210 0.141 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.473 2.834 0.200 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.321 2.769 -1.119 1.00 0.00 H new ATOM 409 N LEU A 27 3.830 3.407 0.936 1.00 0.00 N ATOM 410 CA LEU A 27 2.737 3.541 1.892 1.00 0.00 C ATOM 411 C LEU A 27 1.467 3.999 1.189 1.00 0.00 C ATOM 412 O LEU A 27 1.505 4.453 0.045 1.00 0.00 O ATOM 413 CB LEU A 27 3.096 4.554 2.990 1.00 0.00 C ATOM 414 CG LEU A 27 4.226 4.146 3.940 1.00 0.00 C ATOM 415 CD1 LEU A 27 4.534 5.272 4.915 1.00 0.00 C ATOM 416 CD2 LEU A 27 3.855 2.884 4.701 1.00 0.00 C ATOM 0 H LEU A 27 4.029 4.254 0.403 1.00 0.00 H new ATOM 0 HA LEU A 27 2.570 2.564 2.345 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.372 5.494 2.512 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.202 4.748 3.583 1.00 0.00 H new ATOM 0 HG LEU A 27 5.116 3.945 3.344 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.339 4.965 5.583 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.840 6.159 4.361 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.644 5.500 5.501 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.670 2.610 5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.951 3.063 5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.677 2.073 3.995 1.00 0.00 H new ATOM 428 N LEU A 28 0.346 3.876 1.880 1.00 0.00 N ATOM 429 CA LEU A 28 -0.931 4.350 1.367 1.00 0.00 C ATOM 430 C LEU A 28 -1.517 5.388 2.312 1.00 0.00 C ATOM 431 O LEU A 28 -1.577 5.168 3.527 1.00 0.00 O ATOM 432 CB LEU A 28 -1.907 3.185 1.191 1.00 0.00 C ATOM 433 CG LEU A 28 -1.492 2.142 0.151 1.00 0.00 C ATOM 434 CD1 LEU A 28 -2.489 1.000 0.122 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.372 2.777 -1.225 1.00 0.00 C ATOM 0 H LEU A 28 0.294 3.449 2.805 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.766 4.809 0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.031 2.687 2.153 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.881 3.586 0.912 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.517 1.745 0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.180 0.266 -0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.529 0.527 1.103 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.476 1.385 -0.135 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.076 2.019 -1.951 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.333 3.201 -1.515 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.621 3.566 -1.197 1.00 0.00 H new ATOM 447 N GLY A 29 -1.939 6.515 1.754 1.00 0.00 N ATOM 448 CA GLY A 29 -2.458 7.593 2.567 1.00 0.00 C ATOM 449 C GLY A 29 -3.866 7.987 2.176 1.00 0.00 C ATOM 450 O GLY A 29 -4.281 7.804 1.027 1.00 0.00 O ATOM 0 H GLY A 29 -1.930 6.700 0.751 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.446 7.292 3.615 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.803 8.460 2.477 1.00 0.00 H new ATOM 454 N GLY A 30 -4.599 8.523 3.134 1.00 0.00 N ATOM 455 CA GLY A 30 -5.965 8.929 2.892 1.00 0.00 C ATOM 456 C GLY A 30 -6.724 9.096 4.187 1.00 0.00 C ATOM 457 O GLY A 30 -6.209 9.676 5.143 1.00 0.00 O ATOM 0 H GLY A 30 -4.269 8.686 4.085 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.975 9.868 2.338 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.463 8.186 2.269 1.00 0.00 H new ATOM 461 N ARG A 31 -7.936 8.573 4.237 1.00 0.00 N ATOM 462 CA ARG A 31 -8.742 8.661 5.444 1.00 0.00 C ATOM 463 C ARG A 31 -9.066 7.277 5.979 1.00 0.00 C ATOM 464 O ARG A 31 -9.285 6.339 5.212 1.00 0.00 O ATOM 465 CB ARG A 31 -10.040 9.429 5.188 1.00 0.00 C ATOM 466 CG ARG A 31 -9.841 10.914 4.937 1.00 0.00 C ATOM 467 CD ARG A 31 -11.166 11.657 4.971 1.00 0.00 C ATOM 468 NE ARG A 31 -11.857 11.474 6.247 1.00 0.00 N ATOM 469 CZ ARG A 31 -13.066 11.954 6.528 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.726 12.682 5.635 1.00 0.00 N ATOM 471 NH2 ARG A 31 -13.604 11.708 7.715 1.00 0.00 N ATOM 0 H ARG A 31 -8.383 8.085 3.461 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.157 9.202 6.188 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.546 8.990 4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.701 9.301 6.046 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.170 11.327 5.690 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.363 11.061 3.969 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.992 12.719 4.801 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.802 11.304 4.159 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.378 10.941 6.973 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -13.307 12.877 4.726 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.652 13.046 5.858 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -13.092 11.156 8.403 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -14.530 12.071 7.940 1.00 0.00 H new ATOM 485 N ARG A 32 -9.075 7.153 7.295 1.00 0.00 N ATOM 486 CA ARG A 32 -9.450 5.909 7.941 1.00 0.00 C ATOM 487 C ARG A 32 -10.553 6.183 8.947 1.00 0.00 C ATOM 488 O ARG A 32 -10.385 6.998 9.856 1.00 0.00 O ATOM 489 CB ARG A 32 -8.242 5.266 8.627 1.00 0.00 C ATOM 490 CG ARG A 32 -8.518 3.882 9.195 1.00 0.00 C ATOM 491 CD ARG A 32 -7.272 3.272 9.824 1.00 0.00 C ATOM 492 NE ARG A 32 -6.885 3.957 11.058 1.00 0.00 N ATOM 493 CZ ARG A 32 -5.624 4.167 11.436 1.00 0.00 C ATOM 494 NH1 ARG A 32 -4.621 3.800 10.648 1.00 0.00 N ATOM 495 NH2 ARG A 32 -5.364 4.748 12.601 1.00 0.00 N ATOM 0 H ARG A 32 -8.825 7.903 7.939 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.813 5.210 7.188 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.424 5.197 7.910 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.905 5.918 9.433 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.309 3.947 9.943 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.882 3.229 8.402 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.453 2.218 10.037 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.448 3.317 9.112 1.00 0.00 H new ATOM 0 HE ARG A 32 -7.629 4.296 11.669 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.814 3.356 9.750 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.657 3.962 10.940 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -6.130 5.035 13.210 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -4.398 4.907 12.887 1.00 0.00 H new ATOM 509 N ASP A 33 -11.677 5.513 8.779 1.00 0.00 N ATOM 510 CA ASP A 33 -12.841 5.751 9.628 1.00 0.00 C ATOM 511 C ASP A 33 -13.648 4.477 9.776 1.00 0.00 C ATOM 512 O ASP A 33 -13.886 3.775 8.795 1.00 0.00 O ATOM 513 CB ASP A 33 -13.717 6.865 9.049 1.00 0.00 C ATOM 514 CG ASP A 33 -14.817 7.288 10.001 1.00 0.00 C ATOM 515 OD1 ASP A 33 -14.492 7.739 11.120 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.006 7.185 9.636 1.00 0.00 O ATOM 0 H ASP A 33 -11.814 4.799 8.064 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.490 6.066 10.611 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.094 7.727 8.812 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.161 6.525 8.113 1.00 0.00 H new ATOM 521 N GLY A 34 -14.058 4.174 11.004 1.00 0.00 N ATOM 522 CA GLY A 34 -14.710 2.908 11.272 1.00 0.00 C ATOM 523 C GLY A 34 -13.764 1.756 11.033 1.00 0.00 C ATOM 524 O GLY A 34 -14.188 0.644 10.703 1.00 0.00 O ATOM 0 H GLY A 34 -13.950 4.782 11.816 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -15.063 2.887 12.303 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -15.587 2.803 10.633 1.00 0.00 H new ATOM 528 N ASP A 35 -12.471 2.056 11.176 1.00 0.00 N ATOM 529 CA ASP A 35 -11.378 1.113 10.921 1.00 0.00 C ATOM 530 C ASP A 35 -11.158 0.910 9.416 1.00 0.00 C ATOM 531 O ASP A 35 -10.078 0.489 8.995 1.00 0.00 O ATOM 532 CB ASP A 35 -11.620 -0.225 11.635 1.00 0.00 C ATOM 533 CG ASP A 35 -10.516 -1.235 11.391 1.00 0.00 C ATOM 534 OD1 ASP A 35 -9.514 -1.220 12.136 1.00 0.00 O ATOM 535 OD2 ASP A 35 -10.656 -2.056 10.460 1.00 0.00 O ATOM 0 H ASP A 35 -12.148 2.976 11.477 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.466 1.546 11.332 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -11.712 -0.047 12.706 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.569 -0.644 11.299 1.00 0.00 H new ATOM 540 N ASP A 36 -12.161 1.247 8.601 1.00 0.00 N ATOM 541 CA ASP A 36 -12.031 1.139 7.149 1.00 0.00 C ATOM 542 C ASP A 36 -11.089 2.210 6.628 1.00 0.00 C ATOM 543 O ASP A 36 -10.907 3.252 7.255 1.00 0.00 O ATOM 544 CB ASP A 36 -13.375 1.275 6.430 1.00 0.00 C ATOM 545 CG ASP A 36 -14.372 0.192 6.797 1.00 0.00 C ATOM 546 OD1 ASP A 36 -14.016 -1.005 6.721 1.00 0.00 O ATOM 547 OD2 ASP A 36 -15.525 0.532 7.149 1.00 0.00 O ATOM 0 H ASP A 36 -13.065 1.594 8.921 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.634 0.145 6.943 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.806 2.248 6.664 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.206 1.252 5.353 1.00 0.00 H new ATOM 552 N ARG A 37 -10.509 1.955 5.472 1.00 0.00 N ATOM 553 CA ARG A 37 -9.475 2.826 4.922 1.00 0.00 C ATOM 554 C ARG A 37 -9.796 3.204 3.479 1.00 0.00 C ATOM 555 O ARG A 37 -10.158 2.343 2.673 1.00 0.00 O ATOM 556 CB ARG A 37 -8.094 2.153 4.982 1.00 0.00 C ATOM 557 CG ARG A 37 -7.882 1.269 6.204 1.00 0.00 C ATOM 558 CD ARG A 37 -8.275 -0.167 5.904 1.00 0.00 C ATOM 559 NE ARG A 37 -8.755 -0.882 7.085 1.00 0.00 N ATOM 560 CZ ARG A 37 -8.961 -2.196 7.113 1.00 0.00 C ATOM 561 NH1 ARG A 37 -8.581 -2.942 6.086 1.00 0.00 N ATOM 562 NH2 ARG A 37 -9.526 -2.772 8.168 1.00 0.00 N ATOM 0 H ARG A 37 -10.734 1.149 4.889 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.451 3.730 5.531 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -7.957 1.551 4.084 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.325 2.925 4.969 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -6.837 1.309 6.510 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.473 1.646 7.038 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -9.052 -0.174 5.140 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -7.416 -0.695 5.490 1.00 0.00 H new ATOM 0 HE ARG A 37 -8.942 -0.345 7.932 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -8.133 -2.508 5.279 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -8.737 -3.950 6.103 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -9.807 -2.206 8.969 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -9.679 -3.780 8.178 1.00 0.00 H new ATOM 576 N TRP A 38 -9.668 4.484 3.161 1.00 0.00 N ATOM 577 CA TRP A 38 -9.874 4.967 1.803 1.00 0.00 C ATOM 578 C TRP A 38 -8.590 5.586 1.268 1.00 0.00 C ATOM 579 O TRP A 38 -8.116 6.602 1.785 1.00 0.00 O ATOM 580 CB TRP A 38 -11.008 5.991 1.765 1.00 0.00 C ATOM 581 CG TRP A 38 -12.325 5.422 2.185 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.206 4.742 1.399 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.905 5.470 3.492 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.303 4.369 2.134 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.141 4.804 3.423 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.499 6.015 4.713 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -14.976 4.664 4.531 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.326 5.875 5.809 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.552 5.207 5.712 1.00 0.00 C ATOM 0 H TRP A 38 -9.420 5.212 3.831 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.149 4.122 1.172 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.756 6.828 2.416 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.097 6.389 0.754 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.062 4.528 0.350 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.108 3.852 1.779 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.557 6.536 4.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -15.921 4.147 4.459 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.021 6.289 6.759 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.176 5.119 6.589 1.00 0.00 H new ATOM 600 N VAL A 39 -8.024 4.960 0.245 1.00 0.00 N ATOM 601 CA VAL A 39 -6.764 5.412 -0.326 1.00 0.00 C ATOM 602 C VAL A 39 -7.007 6.520 -1.340 1.00 0.00 C ATOM 603 O VAL A 39 -7.484 6.267 -2.449 1.00 0.00 O ATOM 604 CB VAL A 39 -5.994 4.261 -1.008 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.654 4.751 -1.537 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.803 3.091 -0.051 1.00 0.00 C ATOM 0 H VAL A 39 -8.419 4.136 -0.207 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.158 5.789 0.498 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.587 3.911 -1.853 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.127 3.925 -2.014 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.819 5.545 -2.265 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.055 5.135 -0.711 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.258 2.293 -0.556 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.238 3.422 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.777 2.719 0.268 1.00 0.00 H new ATOM 616 N GLU A 40 -6.688 7.743 -0.949 1.00 0.00 N ATOM 617 CA GLU A 40 -6.864 8.889 -1.826 1.00 0.00 C ATOM 618 C GLU A 40 -5.530 9.317 -2.423 1.00 0.00 C ATOM 619 O GLU A 40 -5.479 10.136 -3.341 1.00 0.00 O ATOM 620 CB GLU A 40 -7.503 10.051 -1.069 1.00 0.00 C ATOM 621 CG GLU A 40 -8.877 9.722 -0.508 1.00 0.00 C ATOM 622 CD GLU A 40 -9.825 9.191 -1.567 1.00 0.00 C ATOM 623 OE1 GLU A 40 -9.988 9.853 -2.613 1.00 0.00 O ATOM 624 OE2 GLU A 40 -10.430 8.120 -1.348 1.00 0.00 O ATOM 0 H GLU A 40 -6.306 7.968 -0.030 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.529 8.597 -2.639 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.846 10.347 -0.251 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.587 10.908 -1.737 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.774 8.983 0.286 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.306 10.617 -0.057 1.00 0.00 H new ATOM 631 N ARG A 41 -4.447 8.777 -1.884 1.00 0.00 N ATOM 632 CA ARG A 41 -3.128 9.015 -2.447 1.00 0.00 C ATOM 633 C ARG A 41 -2.188 7.851 -2.160 1.00 0.00 C ATOM 634 O ARG A 41 -2.056 7.408 -1.015 1.00 0.00 O ATOM 635 CB ARG A 41 -2.523 10.313 -1.907 1.00 0.00 C ATOM 636 CG ARG A 41 -1.161 10.628 -2.507 1.00 0.00 C ATOM 637 CD ARG A 41 -0.577 11.916 -1.957 1.00 0.00 C ATOM 638 NE ARG A 41 0.766 12.166 -2.480 1.00 0.00 N ATOM 639 CZ ARG A 41 1.619 13.045 -1.961 1.00 0.00 C ATOM 640 NH1 ARG A 41 1.264 13.783 -0.920 1.00 0.00 N ATOM 641 NH2 ARG A 41 2.835 13.180 -2.480 1.00 0.00 N ATOM 0 H ARG A 41 -4.456 8.174 -1.061 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.250 9.108 -3.526 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.204 11.138 -2.113 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.429 10.240 -0.824 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.477 9.804 -2.303 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.252 10.706 -3.590 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.229 12.751 -2.214 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.540 11.864 -0.869 1.00 0.00 H new ATOM 0 HE ARG A 41 1.068 11.632 -3.295 1.00 0.00 H new ATOM 0 HH11 ARG A 41 0.334 13.678 -0.514 1.00 0.00 H new ATOM 0 HH12 ARG A 41 1.920 14.456 -0.524 1.00 0.00 H new ATOM 0 HH21 ARG A 41 3.115 12.609 -3.277 1.00 0.00 H new ATOM 0 HH22 ARG A 41 3.488 13.854 -2.081 1.00 0.00 H new ATOM 655 N VAL A 42 -1.549 7.354 -3.208 1.00 0.00 N ATOM 656 CA VAL A 42 -0.491 6.371 -3.066 1.00 0.00 C ATOM 657 C VAL A 42 0.819 7.086 -2.753 1.00 0.00 C ATOM 658 O VAL A 42 1.112 8.134 -3.330 1.00 0.00 O ATOM 659 CB VAL A 42 -0.334 5.521 -4.350 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.832 4.551 -4.233 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.623 4.773 -4.653 1.00 0.00 C ATOM 0 H VAL A 42 -1.748 7.619 -4.173 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.752 5.697 -2.250 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.121 6.199 -5.176 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.915 3.969 -5.151 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.755 5.109 -4.072 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.663 3.879 -3.392 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.495 4.180 -5.559 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.866 4.114 -3.819 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.433 5.488 -4.798 1.00 0.00 H new ATOM 671 N TYR A 43 1.584 6.548 -1.817 1.00 0.00 N ATOM 672 CA TYR A 43 2.866 7.132 -1.442 1.00 0.00 C ATOM 673 C TYR A 43 4.023 6.248 -1.900 1.00 0.00 C ATOM 674 O TYR A 43 4.473 5.370 -1.161 1.00 0.00 O ATOM 675 CB TYR A 43 2.948 7.353 0.073 1.00 0.00 C ATOM 676 CG TYR A 43 2.137 8.528 0.580 1.00 0.00 C ATOM 677 CD1 TYR A 43 0.749 8.496 0.585 1.00 0.00 C ATOM 678 CD2 TYR A 43 2.767 9.670 1.058 1.00 0.00 C ATOM 679 CE1 TYR A 43 0.012 9.568 1.055 1.00 0.00 C ATOM 680 CE2 TYR A 43 2.037 10.745 1.530 1.00 0.00 C ATOM 681 CZ TYR A 43 0.660 10.691 1.524 1.00 0.00 C ATOM 682 OH TYR A 43 -0.070 11.758 1.994 1.00 0.00 O ATOM 0 H TYR A 43 1.340 5.704 -1.300 1.00 0.00 H new ATOM 0 HA TYR A 43 2.945 8.098 -1.940 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.609 6.449 0.578 1.00 0.00 H new ATOM 0 HB3 TYR A 43 3.992 7.501 0.350 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.236 7.620 0.216 1.00 0.00 H new ATOM 0 HD2 TYR A 43 3.846 9.719 1.061 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -1.067 9.526 1.055 1.00 0.00 H new ATOM 0 HE2 TYR A 43 2.544 11.623 1.902 1.00 0.00 H new ATOM 0 HH TYR A 43 0.535 12.497 2.213 1.00 0.00 H new ATOM 692 N PRO A 44 4.489 6.430 -3.146 1.00 0.00 N ATOM 693 CA PRO A 44 5.633 5.695 -3.671 1.00 0.00 C ATOM 694 C PRO A 44 6.925 6.162 -3.015 1.00 0.00 C ATOM 695 O PRO A 44 7.479 7.197 -3.381 1.00 0.00 O ATOM 696 CB PRO A 44 5.639 6.021 -5.174 1.00 0.00 C ATOM 697 CG PRO A 44 4.346 6.724 -5.438 1.00 0.00 C ATOM 698 CD PRO A 44 3.951 7.366 -4.141 1.00 0.00 C ATOM 0 HA PRO A 44 5.562 4.625 -3.476 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.489 6.652 -5.435 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.721 5.113 -5.772 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.461 7.471 -6.224 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.582 6.023 -5.775 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.380 8.362 -4.034 1.00 0.00 H new ATOM 0 HD3 PRO A 44 2.870 7.473 -4.054 1.00 0.00 H new ATOM 706 N LEU A 45 7.380 5.412 -2.022 1.00 0.00 N ATOM 707 CA LEU A 45 8.571 5.783 -1.270 1.00 0.00 C ATOM 708 C LEU A 45 9.816 5.194 -1.908 1.00 0.00 C ATOM 709 O LEU A 45 10.936 5.584 -1.582 1.00 0.00 O ATOM 710 CB LEU A 45 8.447 5.307 0.179 1.00 0.00 C ATOM 711 CG LEU A 45 7.179 5.762 0.908 1.00 0.00 C ATOM 712 CD1 LEU A 45 7.150 5.193 2.317 1.00 0.00 C ATOM 713 CD2 LEU A 45 7.085 7.282 0.944 1.00 0.00 C ATOM 0 H LEU A 45 6.943 4.542 -1.718 1.00 0.00 H new ATOM 0 HA LEU A 45 8.660 6.869 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.483 4.218 0.191 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.314 5.661 0.736 1.00 0.00 H new ATOM 0 HG LEU A 45 6.316 5.385 0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.244 5.524 2.824 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.163 4.104 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.023 5.542 2.869 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.176 7.578 1.467 1.00 0.00 H new ATOM 0 HD22 LEU A 45 7.952 7.688 1.465 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.060 7.669 -0.075 1.00 0.00 H new ATOM 725 N ASN A 46 9.589 4.269 -2.834 1.00 0.00 N ATOM 726 CA ASN A 46 10.660 3.552 -3.536 1.00 0.00 C ATOM 727 C ASN A 46 11.367 2.586 -2.582 1.00 0.00 C ATOM 728 O ASN A 46 11.343 2.773 -1.373 1.00 0.00 O ATOM 729 CB ASN A 46 11.656 4.536 -4.167 1.00 0.00 C ATOM 730 CG ASN A 46 12.690 3.856 -5.045 1.00 0.00 C ATOM 731 OD1 ASN A 46 12.424 2.815 -5.646 1.00 0.00 O ATOM 732 ND2 ASN A 46 13.874 4.445 -5.127 1.00 0.00 N ATOM 0 H ASN A 46 8.652 3.990 -3.124 1.00 0.00 H new ATOM 0 HA ASN A 46 10.215 2.970 -4.343 1.00 0.00 H new ATOM 0 HB2 ASN A 46 11.108 5.267 -4.761 1.00 0.00 H new ATOM 0 HB3 ASN A 46 12.165 5.086 -3.375 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.608 4.036 -5.705 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.051 5.307 -4.612 1.00 0.00 H new ATOM 739 N ASN A 47 11.984 1.548 -3.129 1.00 0.00 N ATOM 740 CA ASN A 47 12.573 0.496 -2.307 1.00 0.00 C ATOM 741 C ASN A 47 13.854 0.983 -1.632 1.00 0.00 C ATOM 742 O ASN A 47 14.886 1.164 -2.285 1.00 0.00 O ATOM 743 CB ASN A 47 12.854 -0.746 -3.161 1.00 0.00 C ATOM 744 CG ASN A 47 13.212 -1.971 -2.334 1.00 0.00 C ATOM 745 OD1 ASN A 47 14.375 -2.196 -2.008 1.00 0.00 O ATOM 746 ND2 ASN A 47 12.217 -2.784 -2.004 1.00 0.00 N ATOM 0 H ASN A 47 12.090 1.410 -4.134 1.00 0.00 H new ATOM 0 HA ASN A 47 11.861 0.231 -1.525 1.00 0.00 H new ATOM 0 HB2 ASN A 47 11.976 -0.969 -3.768 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.671 -0.529 -3.850 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.406 -3.627 -1.462 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.263 -2.566 -2.292 1.00 0.00 H new ATOM 753 N LEU A 48 13.772 1.228 -0.324 1.00 0.00 N ATOM 754 CA LEU A 48 14.925 1.647 0.465 1.00 0.00 C ATOM 755 C LEU A 48 15.891 0.499 0.741 1.00 0.00 C ATOM 756 O LEU A 48 16.937 0.701 1.359 1.00 0.00 O ATOM 757 CB LEU A 48 14.460 2.251 1.788 1.00 0.00 C ATOM 758 CG LEU A 48 14.271 3.768 1.793 1.00 0.00 C ATOM 759 CD1 LEU A 48 15.614 4.462 1.949 1.00 0.00 C ATOM 760 CD2 LEU A 48 13.577 4.244 0.522 1.00 0.00 C ATOM 0 H LEU A 48 12.909 1.142 0.213 1.00 0.00 H new ATOM 0 HA LEU A 48 15.460 2.394 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 48 13.515 1.785 2.067 1.00 0.00 H new ATOM 0 HB3 LEU A 48 15.184 1.991 2.560 1.00 0.00 H new ATOM 0 HG LEU A 48 13.635 4.026 2.640 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.467 5.542 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 48 16.075 4.156 2.888 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.265 4.186 1.119 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.457 5.327 0.556 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.180 3.973 -0.345 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.597 3.773 0.444 1.00 0.00 H new ATOM 772 N ASP A 49 15.539 -0.705 0.321 1.00 0.00 N ATOM 773 CA ASP A 49 16.428 -1.847 0.496 1.00 0.00 C ATOM 774 C ASP A 49 17.216 -2.079 -0.794 1.00 0.00 C ATOM 775 O ASP A 49 17.293 -1.196 -1.650 1.00 0.00 O ATOM 776 CB ASP A 49 15.636 -3.108 0.877 1.00 0.00 C ATOM 777 CG ASP A 49 16.494 -4.125 1.600 1.00 0.00 C ATOM 778 OD1 ASP A 49 16.677 -3.996 2.829 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.004 -5.049 0.939 1.00 0.00 O ATOM 0 H ASP A 49 14.654 -0.918 -0.139 1.00 0.00 H new ATOM 0 HA ASP A 49 17.121 -1.633 1.309 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.794 -2.829 1.511 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.221 -3.560 -0.024 1.00 0.00 H new ATOM 784 N GLN A 50 17.817 -3.250 -0.922 1.00 0.00 N ATOM 785 CA GLN A 50 18.540 -3.616 -2.130 1.00 0.00 C ATOM 786 C GLN A 50 18.059 -4.980 -2.609 1.00 0.00 C ATOM 787 O GLN A 50 18.603 -5.565 -3.546 1.00 0.00 O ATOM 788 CB GLN A 50 20.047 -3.640 -1.861 1.00 0.00 C ATOM 789 CG GLN A 50 20.590 -2.320 -1.333 1.00 0.00 C ATOM 790 CD GLN A 50 22.078 -2.359 -1.062 1.00 0.00 C ATOM 791 OE1 GLN A 50 22.641 -3.410 -0.753 1.00 0.00 O ATOM 792 NE2 GLN A 50 22.725 -1.208 -1.160 1.00 0.00 N ATOM 0 H GLN A 50 17.818 -3.969 -0.198 1.00 0.00 H new ATOM 0 HA GLN A 50 18.347 -2.876 -2.907 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.267 -4.428 -1.141 1.00 0.00 H new ATOM 0 HB3 GLN A 50 20.569 -3.896 -2.783 1.00 0.00 H new ATOM 0 HG2 GLN A 50 20.378 -1.532 -2.055 1.00 0.00 H new ATOM 0 HG3 GLN A 50 20.066 -2.059 -0.414 1.00 0.00 H new ATOM 0 HE21 GLN A 50 22.221 -0.360 -1.419 1.00 0.00 H new ATOM 0 HE22 GLN A 50 23.728 -1.169 -0.977 1.00 0.00 H new ATOM 801 N SER A 51 17.024 -5.472 -1.946 1.00 0.00 N ATOM 802 CA SER A 51 16.459 -6.775 -2.243 1.00 0.00 C ATOM 803 C SER A 51 15.494 -6.703 -3.429 1.00 0.00 C ATOM 804 O SER A 51 14.822 -5.691 -3.635 1.00 0.00 O ATOM 805 CB SER A 51 15.744 -7.306 -1.001 1.00 0.00 C ATOM 806 OG SER A 51 16.651 -7.452 0.079 1.00 0.00 O ATOM 0 H SER A 51 16.554 -4.978 -1.188 1.00 0.00 H new ATOM 0 HA SER A 51 17.265 -7.455 -2.519 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.942 -6.624 -0.718 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.281 -8.267 -1.225 1.00 0.00 H new ATOM 0 HG SER A 51 16.671 -6.624 0.603 1.00 0.00 H new ATOM 812 N PRO A 52 15.437 -7.767 -4.247 1.00 0.00 N ATOM 813 CA PRO A 52 14.534 -7.842 -5.386 1.00 0.00 C ATOM 814 C PRO A 52 13.148 -8.367 -5.012 1.00 0.00 C ATOM 815 O PRO A 52 12.159 -8.008 -5.641 1.00 0.00 O ATOM 816 CB PRO A 52 15.233 -8.819 -6.343 1.00 0.00 C ATOM 817 CG PRO A 52 16.398 -9.395 -5.593 1.00 0.00 C ATOM 818 CD PRO A 52 16.271 -8.965 -4.156 1.00 0.00 C ATOM 0 HA PRO A 52 14.355 -6.856 -5.815 1.00 0.00 H new ATOM 0 HB2 PRO A 52 14.549 -9.606 -6.660 1.00 0.00 H new ATOM 0 HB3 PRO A 52 15.568 -8.305 -7.244 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.402 -10.482 -5.668 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.338 -9.042 -6.017 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.805 -9.736 -3.543 1.00 0.00 H new ATOM 0 HD3 PRO A 52 17.242 -8.748 -3.712 1.00 0.00 H new ATOM 826 N GLU A 53 13.076 -9.218 -3.995 1.00 0.00 N ATOM 827 CA GLU A 53 11.805 -9.818 -3.606 1.00 0.00 C ATOM 828 C GLU A 53 11.378 -9.371 -2.215 1.00 0.00 C ATOM 829 O GLU A 53 10.186 -9.282 -1.925 1.00 0.00 O ATOM 830 CB GLU A 53 11.895 -11.339 -3.658 1.00 0.00 C ATOM 831 CG GLU A 53 12.187 -11.879 -5.050 1.00 0.00 C ATOM 832 CD GLU A 53 12.268 -13.387 -5.081 1.00 0.00 C ATOM 833 OE1 GLU A 53 11.211 -14.040 -5.177 1.00 0.00 O ATOM 834 OE2 GLU A 53 13.392 -13.927 -5.002 1.00 0.00 O ATOM 0 H GLU A 53 13.874 -9.506 -3.429 1.00 0.00 H new ATOM 0 HA GLU A 53 11.051 -9.479 -4.317 1.00 0.00 H new ATOM 0 HB2 GLU A 53 12.676 -11.673 -2.975 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.957 -11.764 -3.301 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.408 -11.546 -5.736 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.127 -11.461 -5.408 1.00 0.00 H new ATOM 841 N HIS A 54 12.350 -9.120 -1.348 1.00 0.00 N ATOM 842 CA HIS A 54 12.057 -8.602 -0.018 1.00 0.00 C ATOM 843 C HIS A 54 12.022 -7.084 -0.044 1.00 0.00 C ATOM 844 O HIS A 54 12.711 -6.451 -0.845 1.00 0.00 O ATOM 845 CB HIS A 54 13.082 -9.088 1.011 1.00 0.00 C ATOM 846 CG HIS A 54 12.882 -10.506 1.439 1.00 0.00 C ATOM 847 ND1 HIS A 54 13.375 -11.009 2.625 1.00 0.00 N ATOM 848 CD2 HIS A 54 12.224 -11.529 0.844 1.00 0.00 C ATOM 849 CE1 HIS A 54 13.034 -12.276 2.737 1.00 0.00 C ATOM 850 NE2 HIS A 54 12.334 -12.616 1.675 1.00 0.00 N ATOM 0 H HIS A 54 13.341 -9.265 -1.539 1.00 0.00 H new ATOM 0 HA HIS A 54 11.079 -8.979 0.280 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.082 -8.983 0.591 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.035 -8.443 1.889 1.00 0.00 H new ATOM 0 HD2 HIS A 54 11.710 -11.496 -0.105 1.00 0.00 H new ATOM 0 HE1 HIS A 54 13.286 -12.927 3.561 1.00 0.00 H new ATOM 0 HE2 HIS A 54 11.937 -13.539 1.498 1.00 0.00 H new ATOM 859 N PHE A 55 11.225 -6.508 0.836 1.00 0.00 N ATOM 860 CA PHE A 55 11.010 -5.072 0.851 1.00 0.00 C ATOM 861 C PHE A 55 11.640 -4.441 2.080 1.00 0.00 C ATOM 862 O PHE A 55 12.048 -5.134 3.014 1.00 0.00 O ATOM 863 CB PHE A 55 9.506 -4.763 0.831 1.00 0.00 C ATOM 864 CG PHE A 55 8.770 -5.165 2.084 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.593 -6.502 2.412 1.00 0.00 C ATOM 866 CD2 PHE A 55 8.243 -4.201 2.928 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.910 -6.866 3.557 1.00 0.00 C ATOM 868 CE2 PHE A 55 7.562 -4.559 4.075 1.00 0.00 C ATOM 869 CZ PHE A 55 7.395 -5.893 4.389 1.00 0.00 C ATOM 0 H PHE A 55 10.712 -7.017 1.556 1.00 0.00 H new ATOM 0 HA PHE A 55 11.481 -4.651 -0.038 1.00 0.00 H new ATOM 0 HB2 PHE A 55 9.369 -3.693 0.672 1.00 0.00 H new ATOM 0 HB3 PHE A 55 9.054 -5.272 -0.020 1.00 0.00 H new ATOM 0 HD1 PHE A 55 8.994 -7.268 1.764 1.00 0.00 H new ATOM 0 HD2 PHE A 55 8.366 -3.156 2.686 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.780 -7.910 3.800 1.00 0.00 H new ATOM 0 HE2 PHE A 55 7.161 -3.796 4.726 1.00 0.00 H new ATOM 0 HZ PHE A 55 6.862 -6.175 5.285 1.00 0.00 H new ATOM 879 N SER A 56 11.722 -3.126 2.062 1.00 0.00 N ATOM 880 CA SER A 56 12.105 -2.373 3.230 1.00 0.00 C ATOM 881 C SER A 56 10.874 -1.639 3.729 1.00 0.00 C ATOM 882 O SER A 56 9.867 -1.571 3.028 1.00 0.00 O ATOM 883 CB SER A 56 13.227 -1.380 2.902 1.00 0.00 C ATOM 884 OG SER A 56 13.677 -0.708 4.069 1.00 0.00 O ATOM 0 H SER A 56 11.525 -2.555 1.240 1.00 0.00 H new ATOM 0 HA SER A 56 12.487 -3.046 3.998 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.060 -1.909 2.440 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.870 -0.651 2.175 1.00 0.00 H new ATOM 0 HG SER A 56 14.393 -0.083 3.831 1.00 0.00 H new ATOM 890 N MET A 57 10.939 -1.099 4.929 1.00 0.00 N ATOM 891 CA MET A 57 9.818 -0.349 5.457 1.00 0.00 C ATOM 892 C MET A 57 10.077 1.137 5.238 1.00 0.00 C ATOM 893 O MET A 57 9.349 1.994 5.743 1.00 0.00 O ATOM 894 CB MET A 57 9.600 -0.668 6.936 1.00 0.00 C ATOM 895 CG MET A 57 8.247 -0.217 7.481 1.00 0.00 C ATOM 896 SD MET A 57 6.836 -1.011 6.676 1.00 0.00 S ATOM 897 CE MET A 57 6.538 0.072 5.275 1.00 0.00 C ATOM 0 H MET A 57 11.745 -1.164 5.550 1.00 0.00 H new ATOM 0 HA MET A 57 8.905 -0.632 4.934 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.698 -1.744 7.082 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.390 -0.194 7.519 1.00 0.00 H new ATOM 0 HG2 MET A 57 8.208 -0.426 8.550 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.160 0.863 7.364 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.493 0.382 5.271 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.177 0.952 5.353 1.00 0.00 H new ATOM 0 HE3 MET A 57 6.763 -0.459 4.350 1.00 0.00 H new ATOM 907 N ASP A 58 11.138 1.404 4.468 1.00 0.00 N ATOM 908 CA ASP A 58 11.534 2.747 4.055 1.00 0.00 C ATOM 909 C ASP A 58 11.541 3.721 5.237 1.00 0.00 C ATOM 910 O ASP A 58 10.704 4.617 5.327 1.00 0.00 O ATOM 911 CB ASP A 58 10.624 3.234 2.923 1.00 0.00 C ATOM 912 CG ASP A 58 10.517 2.220 1.788 1.00 0.00 C ATOM 913 OD1 ASP A 58 11.527 1.536 1.493 1.00 0.00 O ATOM 914 OD2 ASP A 58 9.417 2.082 1.207 1.00 0.00 O ATOM 0 H ASP A 58 11.755 0.675 4.110 1.00 0.00 H new ATOM 0 HA ASP A 58 12.557 2.707 3.680 1.00 0.00 H new ATOM 0 HB2 ASP A 58 9.630 3.437 3.321 1.00 0.00 H new ATOM 0 HB3 ASP A 58 11.008 4.176 2.531 1.00 0.00 H new ATOM 919 N PRO A 59 12.517 3.555 6.153 1.00 0.00 N ATOM 920 CA PRO A 59 12.549 4.265 7.443 1.00 0.00 C ATOM 921 C PRO A 59 12.517 5.789 7.317 1.00 0.00 C ATOM 922 O PRO A 59 11.699 6.453 7.959 1.00 0.00 O ATOM 923 CB PRO A 59 13.872 3.814 8.069 1.00 0.00 C ATOM 924 CG PRO A 59 14.197 2.527 7.398 1.00 0.00 C ATOM 925 CD PRO A 59 13.676 2.658 5.996 1.00 0.00 C ATOM 0 HA PRO A 59 11.665 4.028 8.035 1.00 0.00 H new ATOM 0 HB2 PRO A 59 14.657 4.553 7.907 1.00 0.00 H new ATOM 0 HB3 PRO A 59 13.774 3.683 9.147 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.272 2.344 7.401 1.00 0.00 H new ATOM 0 HG3 PRO A 59 13.729 1.688 7.913 1.00 0.00 H new ATOM 0 HD2 PRO A 59 14.425 3.080 5.325 1.00 0.00 H new ATOM 0 HD3 PRO A 59 13.385 1.692 5.582 1.00 0.00 H new ATOM 933 N ARG A 60 13.406 6.343 6.500 1.00 0.00 N ATOM 934 CA ARG A 60 13.491 7.794 6.344 1.00 0.00 C ATOM 935 C ARG A 60 12.238 8.313 5.649 1.00 0.00 C ATOM 936 O ARG A 60 11.695 9.362 5.999 1.00 0.00 O ATOM 937 CB ARG A 60 14.727 8.180 5.523 1.00 0.00 C ATOM 938 CG ARG A 60 16.015 7.489 5.953 1.00 0.00 C ATOM 939 CD ARG A 60 17.184 7.931 5.085 1.00 0.00 C ATOM 940 NE ARG A 60 18.390 7.130 5.307 1.00 0.00 N ATOM 941 CZ ARG A 60 19.615 7.533 4.970 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.809 8.763 4.506 1.00 0.00 N ATOM 943 NH2 ARG A 60 20.651 6.720 5.125 1.00 0.00 N ATOM 0 H ARG A 60 14.074 5.816 5.938 1.00 0.00 H new ATOM 0 HA ARG A 60 13.574 8.242 7.334 1.00 0.00 H new ATOM 0 HB2 ARG A 60 14.538 7.948 4.475 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.869 9.259 5.590 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.225 7.719 6.997 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.893 6.408 5.883 1.00 0.00 H new ATOM 0 HD2 ARG A 60 16.897 7.864 4.036 1.00 0.00 H new ATOM 0 HD3 ARG A 60 17.406 8.978 5.289 1.00 0.00 H new ATOM 0 HE ARG A 60 18.287 6.214 5.743 1.00 0.00 H new ATOM 0 HH11 ARG A 60 19.019 9.401 4.407 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.747 9.069 4.249 1.00 0.00 H new ATOM 0 HH21 ARG A 60 20.512 5.783 5.503 1.00 0.00 H new ATOM 0 HH22 ARG A 60 21.587 7.032 4.866 1.00 0.00 H new ATOM 957 N GLU A 61 11.787 7.546 4.672 1.00 0.00 N ATOM 958 CA GLU A 61 10.610 7.873 3.885 1.00 0.00 C ATOM 959 C GLU A 61 9.349 7.897 4.745 1.00 0.00 C ATOM 960 O GLU A 61 8.423 8.660 4.469 1.00 0.00 O ATOM 961 CB GLU A 61 10.476 6.888 2.726 1.00 0.00 C ATOM 962 CG GLU A 61 11.337 7.244 1.518 1.00 0.00 C ATOM 963 CD GLU A 61 12.743 7.693 1.884 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.478 6.927 2.534 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.118 8.826 1.512 1.00 0.00 O ATOM 0 H GLU A 61 12.232 6.670 4.400 1.00 0.00 H new ATOM 0 HA GLU A 61 10.732 8.877 3.479 1.00 0.00 H new ATOM 0 HB2 GLU A 61 10.748 5.891 3.074 1.00 0.00 H new ATOM 0 HB3 GLU A 61 9.432 6.844 2.417 1.00 0.00 H new ATOM 0 HG2 GLU A 61 11.401 6.377 0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 61 10.847 8.037 0.954 1.00 0.00 H new ATOM 972 N GLN A 62 9.314 7.059 5.781 1.00 0.00 N ATOM 973 CA GLN A 62 8.206 7.065 6.737 1.00 0.00 C ATOM 974 C GLN A 62 8.018 8.462 7.306 1.00 0.00 C ATOM 975 O GLN A 62 6.908 8.998 7.327 1.00 0.00 O ATOM 976 CB GLN A 62 8.482 6.121 7.910 1.00 0.00 C ATOM 977 CG GLN A 62 8.673 4.667 7.534 1.00 0.00 C ATOM 978 CD GLN A 62 9.139 3.835 8.714 1.00 0.00 C ATOM 979 OE1 GLN A 62 8.768 2.570 8.723 1.00 0.00 O flip ATOM 980 NE2 GLN A 62 9.833 4.328 9.606 1.00 0.00 N flip ATOM 0 H GLN A 62 10.038 6.369 5.980 1.00 0.00 H new ATOM 0 HA GLN A 62 7.314 6.738 6.203 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.375 6.466 8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.654 6.192 8.616 1.00 0.00 H new ATOM 0 HG2 GLN A 62 7.734 4.264 7.153 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.402 4.593 6.727 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.098 5.312 9.561 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.142 3.752 10.389 1.00 0.00 H new ATOM 989 N LEU A 63 9.123 9.052 7.742 1.00 0.00 N ATOM 990 CA LEU A 63 9.096 10.360 8.374 1.00 0.00 C ATOM 991 C LEU A 63 8.638 11.417 7.374 1.00 0.00 C ATOM 992 O LEU A 63 7.940 12.367 7.733 1.00 0.00 O ATOM 993 CB LEU A 63 10.489 10.693 8.917 1.00 0.00 C ATOM 994 CG LEU A 63 10.586 11.937 9.801 1.00 0.00 C ATOM 995 CD1 LEU A 63 9.803 11.744 11.090 1.00 0.00 C ATOM 996 CD2 LEU A 63 12.040 12.255 10.106 1.00 0.00 C ATOM 0 H LEU A 63 10.053 8.641 7.668 1.00 0.00 H new ATOM 0 HA LEU A 63 8.389 10.349 9.203 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.848 9.837 9.488 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.166 10.819 8.072 1.00 0.00 H new ATOM 0 HG LEU A 63 10.151 12.777 9.260 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.886 12.641 11.704 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.755 11.561 10.855 1.00 0.00 H new ATOM 0 HD13 LEU A 63 10.207 10.892 11.637 1.00 0.00 H new ATOM 0 HD21 LEU A 63 12.094 13.143 10.736 1.00 0.00 H new ATOM 0 HD22 LEU A 63 12.495 11.412 10.627 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.576 12.438 9.174 1.00 0.00 H new ATOM 1008 N THR A 64 9.020 11.229 6.118 1.00 0.00 N ATOM 1009 CA THR A 64 8.602 12.116 5.044 1.00 0.00 C ATOM 1010 C THR A 64 7.103 11.973 4.780 1.00 0.00 C ATOM 1011 O THR A 64 6.386 12.966 4.658 1.00 0.00 O ATOM 1012 CB THR A 64 9.386 11.811 3.750 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.794 11.840 4.019 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.055 12.818 2.658 1.00 0.00 C ATOM 0 H THR A 64 9.623 10.463 5.818 1.00 0.00 H new ATOM 0 HA THR A 64 8.812 13.140 5.354 1.00 0.00 H new ATOM 0 HB THR A 64 9.097 10.819 3.402 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.035 11.076 4.584 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.622 12.578 1.758 1.00 0.00 H new ATOM 0 HG22 THR A 64 7.988 12.777 2.437 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.317 13.821 2.996 1.00 0.00 H new ATOM 1022 N ALA A 65 6.636 10.732 4.719 1.00 0.00 N ATOM 1023 CA ALA A 65 5.239 10.449 4.420 1.00 0.00 C ATOM 1024 C ALA A 65 4.312 10.981 5.507 1.00 0.00 C ATOM 1025 O ALA A 65 3.297 11.605 5.210 1.00 0.00 O ATOM 1026 CB ALA A 65 5.035 8.957 4.230 1.00 0.00 C ATOM 0 H ALA A 65 7.208 9.902 4.874 1.00 0.00 H new ATOM 0 HA ALA A 65 4.986 10.963 3.493 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.987 8.759 4.007 1.00 0.00 H new ATOM 0 HB2 ALA A 65 5.654 8.607 3.404 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.318 8.432 5.143 1.00 0.00 H new ATOM 1032 N VAL A 66 4.667 10.744 6.765 1.00 0.00 N ATOM 1033 CA VAL A 66 3.858 11.221 7.881 1.00 0.00 C ATOM 1034 C VAL A 66 3.844 12.749 7.910 1.00 0.00 C ATOM 1035 O VAL A 66 2.840 13.374 8.261 1.00 0.00 O ATOM 1036 CB VAL A 66 4.372 10.679 9.233 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.510 11.182 10.384 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.401 9.159 9.221 1.00 0.00 C ATOM 0 H VAL A 66 5.504 10.228 7.037 1.00 0.00 H new ATOM 0 HA VAL A 66 2.844 10.849 7.732 1.00 0.00 H new ATOM 0 HB VAL A 66 5.387 11.047 9.380 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.892 10.786 11.325 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.538 12.271 10.410 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.482 10.849 10.241 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.766 8.794 10.181 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.395 8.777 9.046 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.063 8.814 8.427 1.00 0.00 H new ATOM 1048 N LYS A 67 4.966 13.341 7.520 1.00 0.00 N ATOM 1049 CA LYS A 67 5.097 14.791 7.459 1.00 0.00 C ATOM 1050 C LYS A 67 4.156 15.361 6.398 1.00 0.00 C ATOM 1051 O LYS A 67 3.603 16.450 6.557 1.00 0.00 O ATOM 1052 CB LYS A 67 6.544 15.161 7.136 1.00 0.00 C ATOM 1053 CG LYS A 67 6.892 16.616 7.408 1.00 0.00 C ATOM 1054 CD LYS A 67 8.355 16.901 7.100 1.00 0.00 C ATOM 1055 CE LYS A 67 9.293 16.056 7.954 1.00 0.00 C ATOM 1056 NZ LYS A 67 9.155 16.353 9.404 1.00 0.00 N ATOM 0 H LYS A 67 5.805 12.834 7.239 1.00 0.00 H new ATOM 0 HA LYS A 67 4.827 15.216 8.426 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.209 14.525 7.720 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.737 14.943 6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.258 17.263 6.802 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.685 16.853 8.452 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.549 16.704 6.046 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.562 17.957 7.270 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.087 15.000 7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.323 16.235 7.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.891 15.844 9.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.260 17.376 9.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.217 16.047 9.733 1.00 0.00 H new ATOM 1070 N ASP A 68 3.977 14.601 5.323 1.00 0.00 N ATOM 1071 CA ASP A 68 3.089 14.991 4.231 1.00 0.00 C ATOM 1072 C ASP A 68 1.638 14.915 4.682 1.00 0.00 C ATOM 1073 O ASP A 68 0.857 15.848 4.486 1.00 0.00 O ATOM 1074 CB ASP A 68 3.308 14.066 3.034 1.00 0.00 C ATOM 1075 CG ASP A 68 2.443 14.418 1.839 1.00 0.00 C ATOM 1076 OD1 ASP A 68 1.270 13.988 1.799 1.00 0.00 O ATOM 1077 OD2 ASP A 68 2.944 15.100 0.918 1.00 0.00 O ATOM 0 H ASP A 68 4.440 13.703 5.183 1.00 0.00 H new ATOM 0 HA ASP A 68 3.314 16.017 3.941 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.357 14.106 2.739 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.100 13.039 3.334 1.00 0.00 H new ATOM 1082 N MET A 69 1.303 13.797 5.309 1.00 0.00 N ATOM 1083 CA MET A 69 -0.047 13.548 5.817 1.00 0.00 C ATOM 1084 C MET A 69 -0.477 14.631 6.803 1.00 0.00 C ATOM 1085 O MET A 69 -1.652 14.976 6.893 1.00 0.00 O ATOM 1086 CB MET A 69 -0.106 12.176 6.489 1.00 0.00 C ATOM 1087 CG MET A 69 0.262 11.039 5.557 1.00 0.00 C ATOM 1088 SD MET A 69 0.443 9.462 6.410 1.00 0.00 S ATOM 1089 CE MET A 69 1.059 8.447 5.071 1.00 0.00 C ATOM 0 H MET A 69 1.957 13.033 5.482 1.00 0.00 H new ATOM 0 HA MET A 69 -0.736 13.568 4.972 1.00 0.00 H new ATOM 0 HB2 MET A 69 0.569 12.168 7.345 1.00 0.00 H new ATOM 0 HB3 MET A 69 -1.112 12.010 6.875 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.504 10.944 4.788 1.00 0.00 H new ATOM 0 HG3 MET A 69 1.196 11.280 5.049 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.629 7.613 5.479 1.00 0.00 H new ATOM 0 HE2 MET A 69 0.221 8.064 4.490 1.00 0.00 H new ATOM 0 HE3 MET A 69 1.703 9.046 4.427 1.00 0.00 H new ATOM 1099 N ARG A 70 0.477 15.173 7.543 1.00 0.00 N ATOM 1100 CA ARG A 70 0.180 16.227 8.504 1.00 0.00 C ATOM 1101 C ARG A 70 -0.088 17.556 7.803 1.00 0.00 C ATOM 1102 O ARG A 70 -0.772 18.426 8.345 1.00 0.00 O ATOM 1103 CB ARG A 70 1.318 16.367 9.517 1.00 0.00 C ATOM 1104 CG ARG A 70 0.997 15.732 10.859 1.00 0.00 C ATOM 1105 CD ARG A 70 0.557 14.284 10.705 1.00 0.00 C ATOM 1106 NE ARG A 70 -0.071 13.780 11.922 1.00 0.00 N ATOM 1107 CZ ARG A 70 -1.335 13.354 11.983 1.00 0.00 C ATOM 1108 NH1 ARG A 70 -2.085 13.310 10.884 1.00 0.00 N ATOM 1109 NH2 ARG A 70 -1.847 12.961 13.140 1.00 0.00 N ATOM 0 H ARG A 70 1.460 14.903 7.498 1.00 0.00 H new ATOM 0 HA ARG A 70 -0.727 15.947 9.040 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.219 15.908 9.110 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.538 17.424 9.665 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.875 15.779 11.503 1.00 0.00 H new ATOM 0 HG3 ARG A 70 0.209 16.301 11.352 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.143 14.203 9.873 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.420 13.666 10.457 1.00 0.00 H new ATOM 0 HE ARG A 70 0.488 13.752 12.775 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -1.695 13.603 9.988 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -3.050 12.983 10.938 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.276 12.984 13.985 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -2.813 12.636 13.186 1.00 0.00 H new ATOM 1123 N LYS A 71 0.452 17.709 6.602 1.00 0.00 N ATOM 1124 CA LYS A 71 0.251 18.926 5.827 1.00 0.00 C ATOM 1125 C LYS A 71 -1.165 18.959 5.247 1.00 0.00 C ATOM 1126 O LYS A 71 -1.825 19.999 5.256 1.00 0.00 O ATOM 1127 CB LYS A 71 1.303 19.004 4.702 1.00 0.00 C ATOM 1128 CG LYS A 71 1.437 20.368 4.020 1.00 0.00 C ATOM 1129 CD LYS A 71 0.265 20.678 3.097 1.00 0.00 C ATOM 1130 CE LYS A 71 0.444 22.010 2.389 1.00 0.00 C ATOM 1131 NZ LYS A 71 -0.793 22.430 1.679 1.00 0.00 N ATOM 0 H LYS A 71 1.032 17.007 6.143 1.00 0.00 H new ATOM 0 HA LYS A 71 0.370 19.791 6.480 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.273 18.727 5.115 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.055 18.261 3.944 1.00 0.00 H new ATOM 0 HG2 LYS A 71 1.511 21.145 4.781 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.363 20.394 3.446 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.164 19.884 2.358 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -0.659 20.694 3.675 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.723 22.773 3.116 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.265 21.935 1.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.630 23.343 1.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -1.045 21.714 0.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -1.570 22.527 2.363 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.634 17.813 4.765 1.00 0.00 N ATOM 1146 CA ASN A 72 -2.923 17.749 4.074 1.00 0.00 C ATOM 1147 C ASN A 72 -4.059 17.327 5.005 1.00 0.00 C ATOM 1148 O ASN A 72 -5.230 17.581 4.716 1.00 0.00 O ATOM 1149 CB ASN A 72 -2.833 16.813 2.858 1.00 0.00 C ATOM 1150 CG ASN A 72 -2.261 15.443 3.187 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -2.484 14.899 4.263 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -1.494 14.889 2.262 1.00 0.00 N ATOM 0 H ASN A 72 -1.147 16.920 4.838 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.157 18.755 3.727 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -3.828 16.689 2.431 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.214 17.282 2.094 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -1.066 13.979 2.433 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -1.331 15.372 1.378 1.00 0.00 H new ATOM 1159 N GLY A 73 -3.715 16.701 6.123 1.00 0.00 N ATOM 1160 CA GLY A 73 -4.719 16.327 7.102 1.00 0.00 C ATOM 1161 C GLY A 73 -5.182 14.888 6.956 1.00 0.00 C ATOM 1162 O GLY A 73 -6.259 14.524 7.434 1.00 0.00 O ATOM 0 H GLY A 73 -2.759 16.445 6.370 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.314 16.473 8.103 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.578 16.991 7.005 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.368 14.069 6.303 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.698 12.663 6.107 1.00 0.00 C ATOM 1168 C TRP A 74 -3.953 11.783 7.110 1.00 0.00 C ATOM 1169 O TRP A 74 -3.140 12.271 7.900 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.379 12.225 4.672 1.00 0.00 C ATOM 1171 CG TRP A 74 -5.238 12.895 3.637 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.452 13.489 3.834 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.953 13.027 2.239 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.934 13.988 2.648 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -6.031 13.719 1.655 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.887 12.634 1.426 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -6.075 14.020 0.297 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.933 12.934 0.078 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -5.018 13.623 -0.474 1.00 0.00 C ATOM 0 H TRP A 74 -3.475 14.353 5.900 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.768 12.543 6.275 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.332 12.440 4.459 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -4.505 11.145 4.594 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.960 13.557 4.785 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.820 14.479 2.527 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -3.043 12.106 1.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.914 14.548 -0.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -3.117 12.631 -0.561 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -5.021 13.846 -1.531 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.244 10.488 7.082 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.640 9.541 8.013 1.00 0.00 C ATOM 1192 C VAL A 75 -3.033 8.350 7.277 1.00 0.00 C ATOM 1193 O VAL A 75 -3.243 8.171 6.072 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.666 9.026 9.051 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -5.174 10.157 9.930 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.829 8.338 8.364 1.00 0.00 C ATOM 0 H VAL A 75 -4.898 10.068 6.421 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.850 10.081 8.536 1.00 0.00 H new ATOM 0 HB VAL A 75 -4.156 8.301 9.686 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.893 9.764 10.649 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.337 10.608 10.463 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.657 10.912 9.309 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.537 7.984 9.114 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.327 9.043 7.698 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.460 7.491 7.785 1.00 0.00 H new ATOM 1206 N MET A 76 -2.280 7.540 8.012 1.00 0.00 N ATOM 1207 CA MET A 76 -1.624 6.373 7.441 1.00 0.00 C ATOM 1208 C MET A 76 -2.576 5.183 7.439 1.00 0.00 C ATOM 1209 O MET A 76 -3.085 4.784 8.484 1.00 0.00 O ATOM 1210 CB MET A 76 -0.355 6.024 8.231 1.00 0.00 C ATOM 1211 CG MET A 76 0.380 4.805 7.689 1.00 0.00 C ATOM 1212 SD MET A 76 1.814 4.345 8.687 1.00 0.00 S ATOM 1213 CE MET A 76 2.805 5.830 8.559 1.00 0.00 C ATOM 0 H MET A 76 -2.109 7.672 9.009 1.00 0.00 H new ATOM 0 HA MET A 76 -1.342 6.607 6.414 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.319 6.881 8.218 1.00 0.00 H new ATOM 0 HB3 MET A 76 -0.622 5.844 9.272 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.310 3.962 7.643 1.00 0.00 H new ATOM 0 HG3 MET A 76 0.704 5.007 6.668 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.838 5.602 8.820 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.764 6.208 7.537 1.00 0.00 H new ATOM 0 HE3 MET A 76 2.417 6.586 9.241 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.822 4.624 6.265 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.738 3.496 6.140 1.00 0.00 C ATOM 1225 C LEU A 77 -2.983 2.179 6.226 1.00 0.00 C ATOM 1226 O LEU A 77 -3.460 1.208 6.813 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.483 3.575 4.810 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.140 4.922 4.513 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.828 4.882 3.164 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -6.130 5.290 5.606 1.00 0.00 C ATOM 0 H LEU A 77 -2.403 4.930 5.387 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.454 3.542 6.960 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.784 3.344 4.006 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.252 2.802 4.796 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.364 5.687 4.487 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.292 5.848 2.964 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.094 4.664 2.388 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.593 4.105 3.169 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.586 6.253 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.905 4.526 5.667 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.609 5.356 6.561 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.801 2.157 5.636 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.995 0.956 5.621 1.00 0.00 C ATOM 1244 C GLY A 78 0.112 1.053 4.600 1.00 0.00 C ATOM 1245 O GLY A 78 0.495 2.157 4.205 1.00 0.00 O ATOM 0 H GLY A 78 -1.381 2.957 5.163 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.567 0.790 6.610 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.625 0.095 5.397 1.00 0.00 H new ATOM 1249 N ASN A 79 0.618 -0.085 4.160 1.00 0.00 N ATOM 1250 CA ASN A 79 1.693 -0.102 3.185 1.00 0.00 C ATOM 1251 C ASN A 79 1.424 -1.136 2.113 1.00 0.00 C ATOM 1252 O ASN A 79 0.502 -1.945 2.225 1.00 0.00 O ATOM 1253 CB ASN A 79 3.040 -0.399 3.847 1.00 0.00 C ATOM 1254 CG ASN A 79 3.101 -1.783 4.467 1.00 0.00 C ATOM 1255 OD1 ASN A 79 2.800 -1.874 5.754 1.00 0.00 O flip ATOM 1256 ND2 ASN A 79 3.429 -2.759 3.796 1.00 0.00 N flip ATOM 0 H ASN A 79 0.303 -1.007 4.461 1.00 0.00 H new ATOM 0 HA ASN A 79 1.736 0.888 2.732 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.833 -0.304 3.105 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.233 0.348 4.617 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.653 -2.646 2.807 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.477 -3.682 4.228 1.00 0.00 H new ATOM 1263 N PHE A 80 2.237 -1.101 1.078 1.00 0.00 N ATOM 1264 CA PHE A 80 2.116 -2.041 -0.019 1.00 0.00 C ATOM 1265 C PHE A 80 3.492 -2.376 -0.570 1.00 0.00 C ATOM 1266 O PHE A 80 4.398 -1.542 -0.541 1.00 0.00 O ATOM 1267 CB PHE A 80 1.221 -1.471 -1.132 1.00 0.00 C ATOM 1268 CG PHE A 80 1.837 -0.337 -1.910 1.00 0.00 C ATOM 1269 CD1 PHE A 80 1.848 0.951 -1.400 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.401 -0.564 -3.157 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.411 1.990 -2.119 1.00 0.00 C ATOM 1272 CE2 PHE A 80 2.965 0.470 -3.877 1.00 0.00 C ATOM 1273 CZ PHE A 80 2.969 1.748 -3.358 1.00 0.00 C ATOM 0 H PHE A 80 2.995 -0.426 0.972 1.00 0.00 H new ATOM 0 HA PHE A 80 1.652 -2.952 0.357 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.968 -2.274 -1.824 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.287 -1.126 -0.689 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.413 1.146 -0.431 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.399 -1.562 -3.570 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.414 2.990 -1.711 1.00 0.00 H new ATOM 0 HE2 PHE A 80 3.403 0.279 -4.846 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.408 2.558 -3.921 1.00 0.00 H new ATOM 1283 N HIS A 81 3.650 -3.597 -1.052 1.00 0.00 N ATOM 1284 CA HIS A 81 4.871 -3.991 -1.728 1.00 0.00 C ATOM 1285 C HIS A 81 4.561 -5.066 -2.762 1.00 0.00 C ATOM 1286 O HIS A 81 3.823 -6.016 -2.493 1.00 0.00 O ATOM 1287 CB HIS A 81 5.958 -4.438 -0.736 1.00 0.00 C ATOM 1288 CG HIS A 81 5.776 -5.795 -0.120 1.00 0.00 C ATOM 1289 ND1 HIS A 81 6.578 -6.859 -0.445 1.00 0.00 N ATOM 1290 CD2 HIS A 81 4.926 -6.246 0.833 1.00 0.00 C ATOM 1291 CE1 HIS A 81 6.229 -7.910 0.266 1.00 0.00 C ATOM 1292 NE2 HIS A 81 5.230 -7.570 1.058 1.00 0.00 N ATOM 0 H HIS A 81 2.946 -4.332 -0.987 1.00 0.00 H new ATOM 0 HA HIS A 81 5.277 -3.122 -2.246 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.919 -4.421 -1.250 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.013 -3.702 0.066 1.00 0.00 H new ATOM 0 HD1 HIS A 81 7.331 -6.839 -1.133 1.00 0.00 H new ATOM 0 HD2 HIS A 81 4.153 -5.674 1.325 1.00 0.00 H new ATOM 0 HE1 HIS A 81 6.684 -8.888 0.210 1.00 0.00 H new ATOM 1301 N SER A 82 5.105 -4.891 -3.949 1.00 0.00 N ATOM 1302 CA SER A 82 4.751 -5.727 -5.084 1.00 0.00 C ATOM 1303 C SER A 82 5.941 -6.556 -5.540 1.00 0.00 C ATOM 1304 O SER A 82 7.054 -6.048 -5.633 1.00 0.00 O ATOM 1305 CB SER A 82 4.268 -4.837 -6.229 1.00 0.00 C ATOM 1306 OG SER A 82 3.360 -3.856 -5.754 1.00 0.00 O ATOM 0 H SER A 82 5.799 -4.173 -4.156 1.00 0.00 H new ATOM 0 HA SER A 82 3.957 -6.411 -4.784 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.121 -4.351 -6.703 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.785 -5.448 -6.992 1.00 0.00 H new ATOM 0 HG SER A 82 3.187 -3.200 -6.461 1.00 0.00 H new ATOM 1312 N HIS A 83 5.695 -7.824 -5.844 1.00 0.00 N ATOM 1313 CA HIS A 83 6.754 -8.716 -6.296 1.00 0.00 C ATOM 1314 C HIS A 83 6.966 -8.551 -7.797 1.00 0.00 C ATOM 1315 O HIS A 83 6.004 -8.337 -8.533 1.00 0.00 O ATOM 1316 CB HIS A 83 6.415 -10.172 -5.955 1.00 0.00 C ATOM 1317 CG HIS A 83 6.437 -10.471 -4.485 1.00 0.00 C ATOM 1318 ND1 HIS A 83 5.521 -11.299 -3.873 1.00 0.00 N ATOM 1319 CD2 HIS A 83 7.279 -10.055 -3.504 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.797 -11.381 -2.583 1.00 0.00 C ATOM 1321 NE2 HIS A 83 6.858 -10.634 -2.332 1.00 0.00 N ATOM 0 H HIS A 83 4.773 -8.257 -5.786 1.00 0.00 H new ATOM 0 HA HIS A 83 7.678 -8.455 -5.780 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.426 -10.407 -6.349 1.00 0.00 H new ATOM 0 HB3 HIS A 83 7.124 -10.828 -6.460 1.00 0.00 H new ATOM 0 HD1 HIS A 83 4.750 -11.774 -4.342 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.123 -9.392 -3.623 1.00 0.00 H new ATOM 0 HE1 HIS A 83 5.248 -11.961 -1.856 1.00 0.00 H new ATOM 1330 N PRO A 84 8.226 -8.654 -8.262 1.00 0.00 N ATOM 1331 CA PRO A 84 8.593 -8.381 -9.664 1.00 0.00 C ATOM 1332 C PRO A 84 7.806 -9.209 -10.679 1.00 0.00 C ATOM 1333 O PRO A 84 7.173 -8.661 -11.577 1.00 0.00 O ATOM 1334 CB PRO A 84 10.078 -8.746 -9.724 1.00 0.00 C ATOM 1335 CG PRO A 84 10.560 -8.628 -8.320 1.00 0.00 C ATOM 1336 CD PRO A 84 9.402 -9.026 -7.451 1.00 0.00 C ATOM 0 HA PRO A 84 8.372 -7.347 -9.929 1.00 0.00 H new ATOM 0 HB2 PRO A 84 10.221 -9.756 -10.107 1.00 0.00 H new ATOM 0 HB3 PRO A 84 10.623 -8.074 -10.386 1.00 0.00 H new ATOM 0 HG2 PRO A 84 11.419 -9.276 -8.146 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.880 -7.609 -8.101 1.00 0.00 H new ATOM 0 HD2 PRO A 84 9.415 -10.093 -7.227 1.00 0.00 H new ATOM 0 HD3 PRO A 84 9.415 -8.500 -6.497 1.00 0.00 H new ATOM 1344 N ALA A 85 7.858 -10.524 -10.543 1.00 0.00 N ATOM 1345 CA ALA A 85 7.123 -11.409 -11.436 1.00 0.00 C ATOM 1346 C ALA A 85 6.607 -12.614 -10.667 1.00 0.00 C ATOM 1347 O ALA A 85 6.232 -13.634 -11.246 1.00 0.00 O ATOM 1348 CB ALA A 85 8.005 -11.848 -12.596 1.00 0.00 C ATOM 0 H ALA A 85 8.400 -11.003 -9.824 1.00 0.00 H new ATOM 0 HA ALA A 85 6.270 -10.867 -11.845 1.00 0.00 H new ATOM 0 HB1 ALA A 85 7.440 -12.509 -13.253 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.332 -10.972 -13.156 1.00 0.00 H new ATOM 0 HB3 ALA A 85 8.876 -12.378 -12.211 1.00 0.00 H new ATOM 1354 N THR A 86 6.585 -12.474 -9.356 1.00 0.00 N ATOM 1355 CA THR A 86 6.144 -13.534 -8.473 1.00 0.00 C ATOM 1356 C THR A 86 4.768 -13.208 -7.887 1.00 0.00 C ATOM 1357 O THR A 86 4.351 -12.046 -7.892 1.00 0.00 O ATOM 1358 CB THR A 86 7.178 -13.754 -7.355 1.00 0.00 C ATOM 1359 OG1 THR A 86 7.993 -12.581 -7.214 1.00 0.00 O ATOM 1360 CG2 THR A 86 8.061 -14.954 -7.663 1.00 0.00 C ATOM 0 H THR A 86 6.872 -11.622 -8.874 1.00 0.00 H new ATOM 0 HA THR A 86 6.055 -14.456 -9.048 1.00 0.00 H new ATOM 0 HB THR A 86 6.644 -13.946 -6.424 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.288 -12.498 -6.283 1.00 0.00 H new ATOM 0 HG21 THR A 86 8.784 -15.090 -6.859 1.00 0.00 H new ATOM 0 HG22 THR A 86 7.443 -15.848 -7.750 1.00 0.00 H new ATOM 0 HG23 THR A 86 8.589 -14.786 -8.601 1.00 0.00 H new ATOM 1368 N PRO A 87 4.044 -14.226 -7.380 1.00 0.00 N ATOM 1369 CA PRO A 87 2.657 -14.065 -6.924 1.00 0.00 C ATOM 1370 C PRO A 87 2.518 -13.239 -5.643 1.00 0.00 C ATOM 1371 O PRO A 87 3.502 -12.734 -5.089 1.00 0.00 O ATOM 1372 CB PRO A 87 2.196 -15.504 -6.683 1.00 0.00 C ATOM 1373 CG PRO A 87 3.444 -16.256 -6.383 1.00 0.00 C ATOM 1374 CD PRO A 87 4.520 -15.612 -7.208 1.00 0.00 C ATOM 0 HA PRO A 87 2.065 -13.518 -7.657 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.491 -15.560 -5.854 1.00 0.00 H new ATOM 0 HB3 PRO A 87 1.690 -15.910 -7.559 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.684 -16.207 -5.321 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.335 -17.310 -6.637 1.00 0.00 H new ATOM 0 HD2 PRO A 87 5.485 -15.644 -6.703 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.645 -16.115 -8.167 1.00 0.00 H new ATOM 1382 N ALA A 88 1.278 -13.111 -5.185 1.00 0.00 N ATOM 1383 CA ALA A 88 0.960 -12.330 -3.998 1.00 0.00 C ATOM 1384 C ALA A 88 1.115 -13.166 -2.729 1.00 0.00 C ATOM 1385 O ALA A 88 1.737 -14.231 -2.757 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.455 -11.777 -4.103 1.00 0.00 C ATOM 0 H ALA A 88 0.467 -13.545 -5.626 1.00 0.00 H new ATOM 0 HA ALA A 88 1.663 -11.499 -3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -0.685 -11.194 -3.211 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.532 -11.139 -4.983 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.162 -12.602 -4.190 1.00 0.00 H new ATOM 1392 N ARG A 89 0.537 -12.668 -1.627 1.00 0.00 N ATOM 1393 CA ARG A 89 0.636 -13.298 -0.308 1.00 0.00 C ATOM 1394 C ARG A 89 2.028 -13.104 0.293 1.00 0.00 C ATOM 1395 O ARG A 89 3.031 -13.090 -0.421 1.00 0.00 O ATOM 1396 CB ARG A 89 0.287 -14.789 -0.381 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.190 -15.073 -0.610 1.00 0.00 C ATOM 1398 CD ARG A 89 -1.944 -15.220 0.706 1.00 0.00 C ATOM 1399 NE ARG A 89 -1.489 -16.383 1.470 1.00 0.00 N ATOM 1400 CZ ARG A 89 -2.303 -17.236 2.095 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -3.616 -17.018 2.117 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -1.794 -18.300 2.710 1.00 0.00 N ATOM 0 H ARG A 89 -0.016 -11.811 -1.629 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.088 -12.809 0.344 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.863 -15.246 -1.186 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.598 -15.269 0.547 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -1.630 -14.265 -1.194 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.299 -15.985 -1.196 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.810 -14.318 1.304 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -3.011 -15.313 0.504 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.485 -16.552 1.528 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.004 -16.196 1.655 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -4.234 -17.673 2.596 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -0.787 -18.460 2.702 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.411 -18.956 3.189 1.00 0.00 H new ATOM 1416 N PRO A 90 2.104 -12.923 1.620 1.00 0.00 N ATOM 1417 CA PRO A 90 3.378 -12.780 2.314 1.00 0.00 C ATOM 1418 C PRO A 90 4.069 -14.126 2.508 1.00 0.00 C ATOM 1419 O PRO A 90 3.442 -15.105 2.923 1.00 0.00 O ATOM 1420 CB PRO A 90 2.980 -12.170 3.659 1.00 0.00 C ATOM 1421 CG PRO A 90 1.587 -12.643 3.900 1.00 0.00 C ATOM 1422 CD PRO A 90 0.955 -12.829 2.542 1.00 0.00 C ATOM 0 HA PRO A 90 4.091 -12.171 1.759 1.00 0.00 H new ATOM 0 HB2 PRO A 90 3.651 -12.496 4.454 1.00 0.00 H new ATOM 0 HB3 PRO A 90 3.027 -11.081 3.628 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.587 -13.579 4.459 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.028 -11.918 4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.342 -13.729 2.508 1.00 0.00 H new ATOM 0 HD3 PRO A 90 0.306 -11.991 2.286 1.00 0.00 H new ATOM 1430 N SER A 91 5.354 -14.178 2.197 1.00 0.00 N ATOM 1431 CA SER A 91 6.121 -15.404 2.348 1.00 0.00 C ATOM 1432 C SER A 91 6.619 -15.520 3.788 1.00 0.00 C ATOM 1433 O SER A 91 6.478 -14.577 4.565 1.00 0.00 O ATOM 1434 CB SER A 91 7.288 -15.420 1.357 1.00 0.00 C ATOM 1435 OG SER A 91 7.901 -16.696 1.299 1.00 0.00 O ATOM 0 H SER A 91 5.888 -13.386 1.839 1.00 0.00 H new ATOM 0 HA SER A 91 5.485 -16.262 2.131 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.929 -15.142 0.366 1.00 0.00 H new ATOM 0 HB3 SER A 91 8.026 -14.673 1.650 1.00 0.00 H new ATOM 0 HG SER A 91 8.627 -16.740 1.956 1.00 0.00 H new ATOM 1441 N ALA A 92 7.201 -16.663 4.141 1.00 0.00 N ATOM 1442 CA ALA A 92 7.600 -16.921 5.521 1.00 0.00 C ATOM 1443 C ALA A 92 8.622 -15.901 6.018 1.00 0.00 C ATOM 1444 O ALA A 92 8.445 -15.314 7.084 1.00 0.00 O ATOM 1445 CB ALA A 92 8.154 -18.332 5.655 1.00 0.00 C ATOM 0 H ALA A 92 7.406 -17.423 3.493 1.00 0.00 H new ATOM 0 HA ALA A 92 6.711 -16.824 6.144 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.448 -18.511 6.689 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.389 -19.052 5.365 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.023 -18.445 5.006 1.00 0.00 H new ATOM 1451 N GLU A 93 9.673 -15.674 5.238 1.00 0.00 N ATOM 1452 CA GLU A 93 10.691 -14.694 5.607 1.00 0.00 C ATOM 1453 C GLU A 93 10.169 -13.280 5.391 1.00 0.00 C ATOM 1454 O GLU A 93 10.500 -12.364 6.140 1.00 0.00 O ATOM 1455 CB GLU A 93 12.004 -14.892 4.831 1.00 0.00 C ATOM 1456 CG GLU A 93 12.038 -16.097 3.899 1.00 0.00 C ATOM 1457 CD GLU A 93 11.193 -15.902 2.659 1.00 0.00 C ATOM 1458 OE1 GLU A 93 11.622 -15.159 1.754 1.00 0.00 O ATOM 1459 OE2 GLU A 93 10.098 -16.492 2.592 1.00 0.00 O ATOM 0 H GLU A 93 9.843 -16.151 4.352 1.00 0.00 H new ATOM 0 HA GLU A 93 10.910 -14.845 6.664 1.00 0.00 H new ATOM 0 HB2 GLU A 93 12.198 -13.994 4.244 1.00 0.00 H new ATOM 0 HB3 GLU A 93 12.819 -14.986 5.548 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.069 -16.293 3.604 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.687 -16.977 4.438 1.00 0.00 H new ATOM 1466 N ASP A 94 9.347 -13.121 4.360 1.00 0.00 N ATOM 1467 CA ASP A 94 8.766 -11.823 4.008 1.00 0.00 C ATOM 1468 C ASP A 94 7.897 -11.296 5.149 1.00 0.00 C ATOM 1469 O ASP A 94 7.933 -10.113 5.482 1.00 0.00 O ATOM 1470 CB ASP A 94 7.932 -11.966 2.728 1.00 0.00 C ATOM 1471 CG ASP A 94 7.378 -10.648 2.217 1.00 0.00 C ATOM 1472 OD1 ASP A 94 8.134 -9.903 1.563 1.00 0.00 O ATOM 1473 OD2 ASP A 94 6.175 -10.378 2.427 1.00 0.00 O ATOM 0 H ASP A 94 9.063 -13.883 3.744 1.00 0.00 H new ATOM 0 HA ASP A 94 9.572 -11.109 3.836 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.548 -12.418 1.951 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.105 -12.650 2.917 1.00 0.00 H new ATOM 1478 N LYS A 95 7.140 -12.199 5.761 1.00 0.00 N ATOM 1479 CA LYS A 95 6.243 -11.851 6.854 1.00 0.00 C ATOM 1480 C LYS A 95 7.031 -11.485 8.116 1.00 0.00 C ATOM 1481 O LYS A 95 6.576 -10.688 8.931 1.00 0.00 O ATOM 1482 CB LYS A 95 5.283 -13.018 7.124 1.00 0.00 C ATOM 1483 CG LYS A 95 4.030 -12.632 7.899 1.00 0.00 C ATOM 1484 CD LYS A 95 4.199 -12.822 9.398 1.00 0.00 C ATOM 1485 CE LYS A 95 4.414 -14.284 9.752 1.00 0.00 C ATOM 1486 NZ LYS A 95 4.404 -14.509 11.219 1.00 0.00 N ATOM 0 H LYS A 95 7.131 -13.189 5.514 1.00 0.00 H new ATOM 0 HA LYS A 95 5.661 -10.975 6.567 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.986 -13.457 6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.816 -13.791 7.679 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.784 -11.591 7.692 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.190 -13.233 7.551 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.047 -12.233 9.747 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.316 -12.447 9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 95 3.634 -14.888 9.287 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.366 -14.620 9.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 4.554 -15.519 11.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.164 -13.953 11.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.487 -14.212 11.609 1.00 0.00 H new ATOM 1500 N ARG A 96 8.216 -12.070 8.270 1.00 0.00 N ATOM 1501 CA ARG A 96 9.061 -11.810 9.440 1.00 0.00 C ATOM 1502 C ARG A 96 9.535 -10.354 9.469 1.00 0.00 C ATOM 1503 O ARG A 96 9.979 -9.856 10.503 1.00 0.00 O ATOM 1504 CB ARG A 96 10.266 -12.756 9.457 1.00 0.00 C ATOM 1505 CG ARG A 96 9.887 -14.227 9.548 1.00 0.00 C ATOM 1506 CD ARG A 96 9.189 -14.555 10.860 1.00 0.00 C ATOM 1507 NE ARG A 96 10.128 -14.673 11.976 1.00 0.00 N ATOM 1508 CZ ARG A 96 9.771 -14.615 13.262 1.00 0.00 C ATOM 1509 NH1 ARG A 96 8.510 -14.364 13.593 1.00 0.00 N ATOM 1510 NH2 ARG A 96 10.678 -14.786 14.214 1.00 0.00 N ATOM 0 H ARG A 96 8.616 -12.728 7.601 1.00 0.00 H new ATOM 0 HA ARG A 96 8.458 -11.991 10.330 1.00 0.00 H new ATOM 0 HB2 ARG A 96 10.855 -12.597 8.554 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.905 -12.501 10.303 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.233 -14.485 8.715 1.00 0.00 H new ATOM 0 HG3 ARG A 96 10.784 -14.839 9.451 1.00 0.00 H new ATOM 0 HD2 ARG A 96 8.458 -13.778 11.084 1.00 0.00 H new ATOM 0 HD3 ARG A 96 8.638 -15.489 10.752 1.00 0.00 H new ATOM 0 HE ARG A 96 11.115 -14.808 11.759 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.812 -14.215 12.865 1.00 0.00 H new ATOM 0 HH12 ARG A 96 8.240 -14.320 14.576 1.00 0.00 H new ATOM 0 HH21 ARG A 96 11.651 -14.962 13.965 1.00 0.00 H new ATOM 0 HH22 ARG A 96 10.402 -14.741 15.195 1.00 0.00 H new ATOM 1524 N LEU A 97 9.441 -9.679 8.329 1.00 0.00 N ATOM 1525 CA LEU A 97 9.843 -8.283 8.223 1.00 0.00 C ATOM 1526 C LEU A 97 8.776 -7.357 8.811 1.00 0.00 C ATOM 1527 O LEU A 97 8.978 -6.146 8.915 1.00 0.00 O ATOM 1528 CB LEU A 97 10.102 -7.924 6.759 1.00 0.00 C ATOM 1529 CG LEU A 97 11.227 -8.712 6.082 1.00 0.00 C ATOM 1530 CD1 LEU A 97 11.344 -8.319 4.619 1.00 0.00 C ATOM 1531 CD2 LEU A 97 12.548 -8.477 6.800 1.00 0.00 C ATOM 0 H LEU A 97 9.087 -10.080 7.460 1.00 0.00 H new ATOM 0 HA LEU A 97 10.761 -8.148 8.794 1.00 0.00 H new ATOM 0 HB2 LEU A 97 9.182 -8.079 6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 97 10.337 -6.861 6.699 1.00 0.00 H new ATOM 0 HG LEU A 97 10.986 -9.774 6.138 1.00 0.00 H new ATOM 0 HD11 LEU A 97 12.148 -8.888 4.153 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.405 -8.533 4.109 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.563 -7.254 4.545 1.00 0.00 H new ATOM 0 HD21 LEU A 97 13.337 -9.044 6.306 1.00 0.00 H new ATOM 0 HD22 LEU A 97 12.793 -7.415 6.773 1.00 0.00 H new ATOM 0 HD23 LEU A 97 12.462 -8.803 7.837 1.00 0.00 H new ATOM 1543 N ALA A 98 7.643 -7.928 9.198 1.00 0.00 N ATOM 1544 CA ALA A 98 6.563 -7.160 9.792 1.00 0.00 C ATOM 1545 C ALA A 98 6.824 -6.926 11.274 1.00 0.00 C ATOM 1546 O ALA A 98 6.599 -7.802 12.111 1.00 0.00 O ATOM 1547 CB ALA A 98 5.232 -7.868 9.583 1.00 0.00 C ATOM 0 H ALA A 98 7.450 -8.926 9.109 1.00 0.00 H new ATOM 0 HA ALA A 98 6.516 -6.189 9.299 1.00 0.00 H new ATOM 0 HB1 ALA A 98 4.432 -7.280 10.034 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.043 -7.979 8.515 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.266 -8.852 10.050 1.00 0.00 H new ATOM 1553 N PHE A 99 7.338 -5.748 11.582 1.00 0.00 N ATOM 1554 CA PHE A 99 7.604 -5.357 12.963 1.00 0.00 C ATOM 1555 C PHE A 99 6.451 -4.515 13.506 1.00 0.00 C ATOM 1556 O PHE A 99 6.632 -3.671 14.388 1.00 0.00 O ATOM 1557 CB PHE A 99 8.917 -4.577 13.047 1.00 0.00 C ATOM 1558 CG PHE A 99 10.109 -5.348 12.554 1.00 0.00 C ATOM 1559 CD1 PHE A 99 10.600 -6.427 13.274 1.00 0.00 C ATOM 1560 CD2 PHE A 99 10.733 -4.999 11.367 1.00 0.00 C ATOM 1561 CE1 PHE A 99 11.692 -7.140 12.820 1.00 0.00 C ATOM 1562 CE2 PHE A 99 11.825 -5.711 10.908 1.00 0.00 C ATOM 1563 CZ PHE A 99 12.305 -6.783 11.635 1.00 0.00 C ATOM 0 H PHE A 99 7.582 -5.038 10.891 1.00 0.00 H new ATOM 0 HA PHE A 99 7.693 -6.257 13.571 1.00 0.00 H new ATOM 0 HB2 PHE A 99 8.823 -3.660 12.466 1.00 0.00 H new ATOM 0 HB3 PHE A 99 9.089 -4.282 14.082 1.00 0.00 H new ATOM 0 HD1 PHE A 99 10.123 -6.713 14.200 1.00 0.00 H new ATOM 0 HD2 PHE A 99 10.362 -4.162 10.794 1.00 0.00 H new ATOM 0 HE1 PHE A 99 12.067 -7.976 13.391 1.00 0.00 H new ATOM 0 HE2 PHE A 99 12.303 -5.429 9.981 1.00 0.00 H new ATOM 0 HZ PHE A 99 13.158 -7.341 11.277 1.00 0.00 H new ATOM 1573 N ASP A 100 5.268 -4.767 12.980 1.00 0.00 N ATOM 1574 CA ASP A 100 4.068 -4.044 13.362 1.00 0.00 C ATOM 1575 C ASP A 100 3.097 -4.995 14.058 1.00 0.00 C ATOM 1576 O ASP A 100 3.295 -6.208 14.031 1.00 0.00 O ATOM 1577 CB ASP A 100 3.410 -3.442 12.123 1.00 0.00 C ATOM 1578 CG ASP A 100 2.855 -4.511 11.210 1.00 0.00 C ATOM 1579 OD1 ASP A 100 3.660 -5.220 10.575 1.00 0.00 O ATOM 1580 OD2 ASP A 100 1.618 -4.647 11.140 1.00 0.00 O ATOM 0 H ASP A 100 5.110 -5.483 12.271 1.00 0.00 H new ATOM 0 HA ASP A 100 4.334 -3.239 14.047 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.607 -2.770 12.427 1.00 0.00 H new ATOM 0 HB3 ASP A 100 4.139 -2.841 11.579 1.00 0.00 H new ATOM 1585 N PRO A 101 2.058 -4.465 14.725 1.00 0.00 N ATOM 1586 CA PRO A 101 1.063 -5.294 15.403 1.00 0.00 C ATOM 1587 C PRO A 101 0.104 -5.997 14.439 1.00 0.00 C ATOM 1588 O PRO A 101 -0.010 -7.224 14.469 1.00 0.00 O ATOM 1589 CB PRO A 101 0.296 -4.299 16.291 1.00 0.00 C ATOM 1590 CG PRO A 101 1.051 -3.012 16.213 1.00 0.00 C ATOM 1591 CD PRO A 101 1.781 -3.036 14.903 1.00 0.00 C ATOM 0 HA PRO A 101 1.539 -6.103 15.957 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -0.728 -4.172 15.941 1.00 0.00 H new ATOM 0 HB3 PRO A 101 0.239 -4.657 17.319 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.374 -2.159 16.266 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.748 -2.918 17.046 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.173 -2.636 14.092 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.697 -2.446 14.937 1.00 0.00 H new ATOM 1599 N SER A 102 -0.572 -5.226 13.588 1.00 0.00 N ATOM 1600 CA SER A 102 -1.572 -5.765 12.673 1.00 0.00 C ATOM 1601 C SER A 102 -1.954 -4.727 11.622 1.00 0.00 C ATOM 1602 O SER A 102 -3.132 -4.409 11.448 1.00 0.00 O ATOM 1603 CB SER A 102 -2.829 -6.199 13.436 1.00 0.00 C ATOM 1604 OG SER A 102 -2.573 -7.320 14.264 1.00 0.00 O ATOM 0 H SER A 102 -0.442 -4.217 13.515 1.00 0.00 H new ATOM 0 HA SER A 102 -1.136 -6.633 12.179 1.00 0.00 H new ATOM 0 HB2 SER A 102 -3.190 -5.370 14.045 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.620 -6.442 12.727 1.00 0.00 H new ATOM 0 HG SER A 102 -1.617 -7.533 14.240 1.00 0.00 H new ATOM 1610 N LEU A 103 -0.962 -4.195 10.931 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.208 -3.197 9.897 1.00 0.00 C ATOM 1612 C LEU A 103 -1.651 -3.849 8.589 1.00 0.00 C ATOM 1613 O LEU A 103 -1.707 -5.075 8.470 1.00 0.00 O ATOM 1614 CB LEU A 103 0.041 -2.345 9.662 1.00 0.00 C ATOM 1615 CG LEU A 103 0.345 -1.312 10.750 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.629 -0.563 10.427 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.817 -0.337 10.899 1.00 0.00 C ATOM 0 H LEU A 103 0.021 -4.434 11.064 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.015 -2.553 10.246 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.900 -3.009 9.565 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.069 -1.824 8.711 1.00 0.00 H new ATOM 0 HG LEU A 103 0.479 -1.836 11.696 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.831 0.168 11.210 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.457 -1.269 10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.520 -0.050 9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.584 0.390 11.677 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.980 0.181 9.954 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.719 -0.885 11.173 1.00 0.00 H new ATOM 1629 N SER A 104 -1.970 -3.013 7.609 1.00 0.00 N ATOM 1630 CA SER A 104 -2.420 -3.488 6.311 1.00 0.00 C ATOM 1631 C SER A 104 -1.253 -3.566 5.332 1.00 0.00 C ATOM 1632 O SER A 104 -0.627 -2.553 5.012 1.00 0.00 O ATOM 1633 CB SER A 104 -3.504 -2.557 5.763 1.00 0.00 C ATOM 1634 OG SER A 104 -4.572 -2.420 6.688 1.00 0.00 O ATOM 0 H SER A 104 -1.924 -1.997 7.692 1.00 0.00 H new ATOM 0 HA SER A 104 -2.835 -4.489 6.432 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.074 -1.578 5.551 1.00 0.00 H new ATOM 0 HB3 SER A 104 -3.883 -2.950 4.820 1.00 0.00 H new ATOM 0 HG SER A 104 -5.251 -1.819 6.317 1.00 0.00 H new ATOM 1640 N TYR A 105 -0.958 -4.775 4.882 1.00 0.00 N ATOM 1641 CA TYR A 105 0.096 -5.002 3.906 1.00 0.00 C ATOM 1642 C TYR A 105 -0.501 -5.445 2.581 1.00 0.00 C ATOM 1643 O TYR A 105 -1.014 -6.556 2.461 1.00 0.00 O ATOM 1644 CB TYR A 105 1.081 -6.064 4.408 1.00 0.00 C ATOM 1645 CG TYR A 105 2.031 -5.574 5.478 1.00 0.00 C ATOM 1646 CD1 TYR A 105 1.566 -5.169 6.722 1.00 0.00 C ATOM 1647 CD2 TYR A 105 3.401 -5.524 5.242 1.00 0.00 C ATOM 1648 CE1 TYR A 105 2.434 -4.726 7.697 1.00 0.00 C ATOM 1649 CE2 TYR A 105 4.276 -5.083 6.216 1.00 0.00 C ATOM 1650 CZ TYR A 105 3.786 -4.685 7.440 1.00 0.00 C ATOM 1651 OH TYR A 105 4.648 -4.239 8.411 1.00 0.00 O ATOM 0 H TYR A 105 -1.440 -5.623 5.181 1.00 0.00 H new ATOM 0 HA TYR A 105 0.634 -4.065 3.763 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.517 -6.910 4.799 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.663 -6.432 3.563 1.00 0.00 H new ATOM 0 HD1 TYR A 105 0.507 -5.202 6.929 1.00 0.00 H new ATOM 0 HD2 TYR A 105 3.787 -5.835 4.282 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.055 -4.412 8.658 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.337 -5.051 6.019 1.00 0.00 H new ATOM 0 HH TYR A 105 4.535 -4.778 9.222 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.454 -4.573 1.593 1.00 0.00 N ATOM 1662 CA LEU A 106 -0.932 -4.920 0.267 1.00 0.00 C ATOM 1663 C LEU A 106 0.197 -5.520 -0.555 1.00 0.00 C ATOM 1664 O LEU A 106 1.239 -4.896 -0.746 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.514 -3.703 -0.462 1.00 0.00 C ATOM 1666 CG LEU A 106 -2.884 -3.222 0.032 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -2.782 -2.542 1.389 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.511 -2.285 -0.987 1.00 0.00 C ATOM 0 H LEU A 106 -0.092 -3.624 1.681 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.729 -5.654 0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -0.807 -2.878 -0.374 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.595 -3.942 -1.522 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.523 -4.097 0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.772 -2.214 1.707 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.380 -3.245 2.119 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.121 -1.679 1.315 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.483 -1.951 -0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.862 -1.422 -1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.638 -2.810 -1.934 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.001 -6.740 -1.022 1.00 0.00 N ATOM 1681 CA ILE A 107 0.980 -7.387 -1.874 1.00 0.00 C ATOM 1682 C ILE A 107 0.402 -7.548 -3.270 1.00 0.00 C ATOM 1683 O ILE A 107 -0.653 -8.162 -3.446 1.00 0.00 O ATOM 1684 CB ILE A 107 1.432 -8.776 -1.342 1.00 0.00 C ATOM 1685 CG1 ILE A 107 2.215 -8.654 -0.027 1.00 0.00 C ATOM 1686 CG2 ILE A 107 2.292 -9.489 -2.378 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.361 -8.385 1.188 1.00 0.00 C ATOM 0 H ILE A 107 -0.830 -7.301 -0.826 1.00 0.00 H new ATOM 0 HA ILE A 107 1.863 -6.748 -1.886 1.00 0.00 H new ATOM 0 HB ILE A 107 0.530 -9.357 -1.151 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.774 -9.575 0.135 1.00 0.00 H new ATOM 0 HG13 ILE A 107 2.945 -7.851 -0.127 1.00 0.00 H new ATOM 0 HG21 ILE A 107 2.600 -10.460 -1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.717 -9.630 -3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 107 3.175 -8.888 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.996 -8.314 2.071 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.821 -7.448 1.053 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.648 -9.199 1.319 1.00 0.00 H new ATOM 1699 N ILE A 108 1.082 -6.981 -4.250 1.00 0.00 N ATOM 1700 CA ILE A 108 0.627 -7.041 -5.628 1.00 0.00 C ATOM 1701 C ILE A 108 1.455 -8.046 -6.417 1.00 0.00 C ATOM 1702 O ILE A 108 2.687 -8.070 -6.322 1.00 0.00 O ATOM 1703 CB ILE A 108 0.713 -5.653 -6.305 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -0.103 -4.626 -5.512 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.228 -5.719 -7.751 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.012 -3.216 -6.059 1.00 0.00 C ATOM 0 H ILE A 108 1.955 -6.471 -4.116 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.415 -7.359 -5.620 1.00 0.00 H new ATOM 0 HB ILE A 108 1.757 -5.341 -6.314 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.148 -4.935 -5.503 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.238 -4.626 -4.477 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.299 -4.730 -8.204 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.847 -6.420 -8.311 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.809 -6.054 -7.772 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.616 -2.548 -5.445 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.027 -2.885 -6.042 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.381 -3.199 -7.084 1.00 0.00 H new ATOM 1718 N SER A 109 0.770 -8.883 -7.176 1.00 0.00 N ATOM 1719 CA SER A 109 1.426 -9.870 -8.012 1.00 0.00 C ATOM 1720 C SER A 109 1.615 -9.317 -9.418 1.00 0.00 C ATOM 1721 O SER A 109 0.645 -9.116 -10.152 1.00 0.00 O ATOM 1722 CB SER A 109 0.596 -11.156 -8.056 1.00 0.00 C ATOM 1723 OG SER A 109 1.193 -12.129 -8.895 1.00 0.00 O ATOM 0 H SER A 109 -0.248 -8.897 -7.230 1.00 0.00 H new ATOM 0 HA SER A 109 2.404 -10.099 -7.590 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.491 -11.558 -7.048 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.408 -10.931 -8.415 1.00 0.00 H new ATOM 0 HG SER A 109 0.569 -12.873 -9.029 1.00 0.00 H new ATOM 1729 N LEU A 110 2.862 -9.060 -9.789 1.00 0.00 N ATOM 1730 CA LEU A 110 3.171 -8.521 -11.106 1.00 0.00 C ATOM 1731 C LEU A 110 3.652 -9.634 -12.033 1.00 0.00 C ATOM 1732 O LEU A 110 4.364 -9.387 -13.006 1.00 0.00 O ATOM 1733 CB LEU A 110 4.225 -7.414 -10.994 1.00 0.00 C ATOM 1734 CG LEU A 110 3.848 -6.079 -11.648 1.00 0.00 C ATOM 1735 CD1 LEU A 110 3.675 -6.238 -13.152 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.578 -5.520 -11.023 1.00 0.00 C ATOM 0 H LEU A 110 3.677 -9.216 -9.196 1.00 0.00 H new ATOM 0 HA LEU A 110 2.265 -8.089 -11.530 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.431 -7.237 -9.938 1.00 0.00 H new ATOM 0 HB3 LEU A 110 5.152 -7.771 -11.444 1.00 0.00 H new ATOM 0 HG LEU A 110 4.662 -5.375 -11.473 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.408 -5.277 -13.591 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.609 -6.590 -13.590 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.884 -6.961 -13.353 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.325 -4.573 -11.499 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.761 -6.227 -11.165 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.737 -5.359 -9.957 1.00 0.00 H new ATOM 1748 N ALA A 111 3.237 -10.864 -11.727 1.00 0.00 N ATOM 1749 CA ALA A 111 3.552 -12.014 -12.564 1.00 0.00 C ATOM 1750 C ALA A 111 3.090 -11.768 -13.996 1.00 0.00 C ATOM 1751 O ALA A 111 3.751 -12.169 -14.958 1.00 0.00 O ATOM 1752 CB ALA A 111 2.905 -13.272 -12.001 1.00 0.00 C ATOM 0 H ALA A 111 2.680 -11.086 -10.902 1.00 0.00 H new ATOM 0 HA ALA A 111 4.633 -12.156 -12.570 1.00 0.00 H new ATOM 0 HB1 ALA A 111 3.149 -14.123 -12.637 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.278 -13.453 -10.993 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.823 -13.142 -11.969 1.00 0.00 H new ATOM 1758 N GLU A 112 1.950 -11.103 -14.126 1.00 0.00 N ATOM 1759 CA GLU A 112 1.456 -10.670 -15.420 1.00 0.00 C ATOM 1760 C GLU A 112 0.777 -9.308 -15.265 1.00 0.00 C ATOM 1761 O GLU A 112 0.079 -9.075 -14.278 1.00 0.00 O ATOM 1762 CB GLU A 112 0.446 -11.690 -15.954 1.00 0.00 C ATOM 1763 CG GLU A 112 0.272 -11.660 -17.460 1.00 0.00 C ATOM 1764 CD GLU A 112 1.492 -12.183 -18.188 1.00 0.00 C ATOM 1765 OE1 GLU A 112 2.411 -11.390 -18.468 1.00 0.00 O ATOM 1766 OE2 GLU A 112 1.538 -13.396 -18.481 1.00 0.00 O ATOM 0 H GLU A 112 1.348 -10.851 -13.342 1.00 0.00 H new ATOM 0 HA GLU A 112 2.286 -10.589 -16.121 1.00 0.00 H new ATOM 0 HB2 GLU A 112 0.763 -12.689 -15.656 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -0.520 -11.508 -15.484 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -0.597 -12.258 -17.735 1.00 0.00 H new ATOM 0 HG3 GLU A 112 0.071 -10.638 -17.780 1.00 0.00 H new ATOM 1773 N PRO A 113 0.954 -8.394 -16.231 1.00 0.00 N ATOM 1774 CA PRO A 113 0.296 -7.088 -16.203 1.00 0.00 C ATOM 1775 C PRO A 113 -1.152 -7.176 -16.656 1.00 0.00 C ATOM 1776 O PRO A 113 -1.948 -6.264 -16.438 1.00 0.00 O ATOM 1777 CB PRO A 113 1.121 -6.234 -17.181 1.00 0.00 C ATOM 1778 CG PRO A 113 2.273 -7.093 -17.605 1.00 0.00 C ATOM 1779 CD PRO A 113 1.846 -8.514 -17.385 1.00 0.00 C ATOM 0 HA PRO A 113 0.261 -6.670 -15.197 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.521 -5.934 -18.040 1.00 0.00 H new ATOM 0 HB3 PRO A 113 1.471 -5.320 -16.702 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.522 -6.920 -18.652 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.165 -6.861 -17.023 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.333 -8.924 -18.255 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.694 -9.167 -17.178 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.484 -8.294 -17.275 1.00 0.00 N ATOM 1788 CA GLN A 114 -2.833 -8.535 -17.756 1.00 0.00 C ATOM 1789 C GLN A 114 -3.748 -8.891 -16.595 1.00 0.00 C ATOM 1790 O GLN A 114 -4.949 -8.619 -16.628 1.00 0.00 O ATOM 1791 CB GLN A 114 -2.836 -9.658 -18.791 1.00 0.00 C ATOM 1792 CG GLN A 114 -1.963 -9.370 -20.001 1.00 0.00 C ATOM 1793 CD GLN A 114 -2.315 -8.057 -20.672 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -1.753 -7.011 -20.352 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -3.261 -8.100 -21.593 1.00 0.00 N ATOM 0 H GLN A 114 -0.831 -9.056 -17.458 1.00 0.00 H new ATOM 0 HA GLN A 114 -3.201 -7.624 -18.229 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -2.495 -10.579 -18.318 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -3.859 -9.831 -19.124 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -0.917 -9.348 -19.694 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.067 -10.182 -20.721 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -3.702 -8.989 -21.830 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.550 -7.245 -22.068 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.164 -9.488 -15.565 1.00 0.00 N ATOM 1805 CA LYS A 115 -3.902 -9.850 -14.366 1.00 0.00 C ATOM 1806 C LYS A 115 -3.012 -9.752 -13.133 1.00 0.00 C ATOM 1807 O LYS A 115 -2.497 -10.760 -12.644 1.00 0.00 O ATOM 1808 CB LYS A 115 -4.503 -11.258 -14.478 1.00 0.00 C ATOM 1809 CG LYS A 115 -5.870 -11.281 -15.144 1.00 0.00 C ATOM 1810 CD LYS A 115 -6.857 -10.412 -14.384 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.175 -10.271 -15.124 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.048 -9.249 -14.486 1.00 0.00 N ATOM 0 H LYS A 115 -2.174 -9.733 -15.538 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.724 -9.141 -14.262 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.821 -11.892 -15.044 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.586 -11.690 -13.481 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.784 -10.928 -16.172 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.240 -12.305 -15.189 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.038 -10.844 -13.400 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.423 -9.425 -14.224 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.984 -9.993 -16.161 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.689 -11.232 -15.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.941 -9.176 -15.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.249 -9.528 -13.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.566 -8.328 -14.492 1.00 0.00 H new ATOM 1826 N PRO A 116 -2.783 -8.527 -12.646 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.022 -8.279 -11.433 1.00 0.00 C ATOM 1828 C PRO A 116 -2.901 -8.420 -10.200 1.00 0.00 C ATOM 1829 O PRO A 116 -3.790 -7.596 -9.962 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.540 -6.826 -11.592 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.119 -6.334 -12.885 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.239 -7.270 -13.236 1.00 0.00 C ATOM 0 HA PRO A 116 -1.203 -8.986 -11.301 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -1.874 -6.211 -10.756 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.451 -6.776 -11.609 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -2.485 -5.313 -12.782 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -1.362 -6.324 -13.669 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.190 -6.944 -12.815 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.379 -7.353 -14.314 1.00 0.00 H new ATOM 1840 N VAL A 117 -2.675 -9.474 -9.429 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.501 -9.727 -8.260 1.00 0.00 C ATOM 1842 C VAL A 117 -3.208 -8.695 -7.183 1.00 0.00 C ATOM 1843 O VAL A 117 -2.074 -8.573 -6.720 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.266 -11.142 -7.687 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.158 -11.396 -6.480 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.502 -12.194 -8.757 1.00 0.00 C ATOM 0 H VAL A 117 -1.936 -10.159 -9.589 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.542 -9.655 -8.574 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.229 -11.208 -7.359 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -3.973 -12.399 -6.096 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -3.937 -10.663 -5.704 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.204 -11.308 -6.775 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -3.332 -13.185 -8.336 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.529 -12.123 -9.116 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.815 -12.029 -9.587 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.235 -7.949 -6.805 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.114 -6.953 -5.758 1.00 0.00 C ATOM 1858 C CYS A 118 -5.003 -7.319 -4.575 1.00 0.00 C ATOM 1859 O CYS A 118 -6.227 -7.383 -4.709 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.501 -5.576 -6.301 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.627 -5.108 -7.815 1.00 0.00 S ATOM 0 H CYS A 118 -5.167 -8.018 -7.213 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.078 -6.923 -5.419 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -5.574 -5.562 -6.494 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.305 -4.826 -5.534 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.684 -6.086 -8.669 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.393 -7.556 -3.422 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.141 -7.833 -2.203 1.00 0.00 C ATOM 1869 C LYS A 119 -4.516 -7.091 -1.035 1.00 0.00 C ATOM 1870 O LYS A 119 -3.378 -6.627 -1.118 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.173 -9.334 -1.882 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.878 -10.196 -2.922 1.00 0.00 C ATOM 1873 CD LYS A 119 -7.361 -9.870 -3.021 1.00 0.00 C ATOM 1874 CE LYS A 119 -8.073 -10.807 -3.982 1.00 0.00 C ATOM 1875 NZ LYS A 119 -9.487 -10.407 -4.212 1.00 0.00 N ATOM 0 H LYS A 119 -3.380 -7.562 -3.305 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.165 -7.495 -2.363 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.149 -9.689 -1.771 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.666 -9.475 -0.920 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.408 -10.048 -3.894 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.754 -11.248 -2.665 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.818 -9.943 -2.034 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.487 -8.840 -3.355 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.542 -10.821 -4.934 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -8.044 -11.822 -3.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.793 -10.737 -5.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -10.092 -10.833 -3.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.566 -9.371 -4.167 1.00 0.00 H new ATOM 1889 N SER A 120 -5.261 -6.986 0.043 1.00 0.00 N ATOM 1890 CA SER A 120 -4.771 -6.363 1.254 1.00 0.00 C ATOM 1891 C SER A 120 -4.704 -7.400 2.363 1.00 0.00 C ATOM 1892 O SER A 120 -5.712 -8.006 2.714 1.00 0.00 O ATOM 1893 CB SER A 120 -5.688 -5.209 1.656 1.00 0.00 C ATOM 1894 OG SER A 120 -5.825 -4.279 0.594 1.00 0.00 O ATOM 0 H SER A 120 -6.220 -7.328 0.106 1.00 0.00 H new ATOM 0 HA SER A 120 -3.772 -5.964 1.080 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.668 -5.597 1.934 1.00 0.00 H new ATOM 0 HB3 SER A 120 -5.284 -4.707 2.535 1.00 0.00 H new ATOM 0 HG SER A 120 -5.433 -3.421 0.858 1.00 0.00 H new ATOM 1900 N PHE A 121 -3.520 -7.630 2.894 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.352 -8.641 3.919 1.00 0.00 C ATOM 1902 C PHE A 121 -3.089 -7.999 5.271 1.00 0.00 C ATOM 1903 O PHE A 121 -2.237 -7.124 5.403 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.209 -9.589 3.551 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.408 -10.278 2.230 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.216 -11.398 2.137 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -1.791 -9.802 1.082 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.404 -12.032 0.926 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -1.975 -10.434 -0.131 1.00 0.00 C ATOM 1910 CZ PHE A 121 -2.783 -11.550 -0.209 1.00 0.00 C ATOM 0 H PHE A 121 -2.666 -7.135 2.636 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.276 -9.216 3.986 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.275 -9.027 3.522 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.104 -10.341 4.333 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -3.704 -11.780 3.021 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.160 -8.927 1.138 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.037 -12.905 0.866 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.488 -10.056 -1.017 1.00 0.00 H new ATOM 0 HZ PHE A 121 -2.929 -12.046 -1.157 1.00 0.00 H new ATOM 1920 N LEU A 122 -3.836 -8.432 6.265 1.00 0.00 N ATOM 1921 CA LEU A 122 -3.645 -7.970 7.624 1.00 0.00 C ATOM 1922 C LEU A 122 -2.761 -8.955 8.366 1.00 0.00 C ATOM 1923 O LEU A 122 -3.173 -10.087 8.634 1.00 0.00 O ATOM 1924 CB LEU A 122 -4.994 -7.835 8.336 1.00 0.00 C ATOM 1925 CG LEU A 122 -5.956 -6.814 7.726 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.296 -6.847 8.446 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.355 -5.419 7.786 1.00 0.00 C ATOM 0 H LEU A 122 -4.589 -9.111 6.155 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.166 -6.991 7.607 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.482 -8.810 8.343 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.812 -7.562 9.375 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.121 -7.076 6.681 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.968 -6.114 7.999 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.733 -7.842 8.357 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.149 -6.609 9.499 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.051 -4.704 7.348 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.163 -5.150 8.825 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.419 -5.402 7.228 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.547 -8.536 8.675 1.00 0.00 N ATOM 1940 CA ILE A 123 -0.615 -9.397 9.378 1.00 0.00 C ATOM 1941 C ILE A 123 -0.843 -9.274 10.872 1.00 0.00 C ATOM 1942 O ILE A 123 -0.536 -8.255 11.479 1.00 0.00 O ATOM 1943 CB ILE A 123 0.855 -9.059 9.043 1.00 0.00 C ATOM 1944 CG1 ILE A 123 1.106 -9.229 7.540 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.802 -9.944 9.848 1.00 0.00 C ATOM 1946 CD1 ILE A 123 2.527 -8.924 7.120 1.00 0.00 C ATOM 0 H ILE A 123 -1.185 -7.609 8.451 1.00 0.00 H new ATOM 0 HA ILE A 123 -0.797 -10.421 9.053 1.00 0.00 H new ATOM 0 HB ILE A 123 1.046 -8.020 9.312 1.00 0.00 H new ATOM 0 HG12 ILE A 123 0.864 -10.253 7.254 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.427 -8.576 6.992 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.833 -9.693 9.600 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.635 -9.782 10.913 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.615 -10.990 9.607 1.00 0.00 H new ATOM 0 HD11 ILE A 123 2.627 -9.067 6.044 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.768 -7.891 7.373 1.00 0.00 H new ATOM 0 HD13 ILE A 123 3.212 -9.594 7.640 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.411 -10.313 11.451 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.727 -10.320 12.865 1.00 0.00 C ATOM 1960 C LYS A 124 -0.846 -11.330 13.582 1.00 0.00 C ATOM 1961 O LYS A 124 -0.137 -12.113 12.945 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.203 -10.680 13.078 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.169 -9.824 12.274 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.595 -10.333 12.401 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.561 -9.526 11.549 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.949 -10.061 11.631 1.00 0.00 N ATOM 0 H LYS A 124 -1.665 -11.170 10.959 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.544 -9.325 13.271 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.353 -11.727 12.813 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.441 -10.582 14.137 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.117 -8.791 12.619 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -3.872 -9.825 11.225 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.635 -11.381 12.102 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.906 -10.287 13.445 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.552 -8.486 11.875 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.228 -9.537 10.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.336 -10.170 10.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.937 -10.986 12.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -8.544 -9.401 12.172 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.903 -11.316 14.903 1.00 0.00 N ATOM 1981 CA LYS A 125 -0.176 -12.281 15.719 1.00 0.00 C ATOM 1982 C LYS A 125 -0.649 -13.687 15.388 1.00 0.00 C ATOM 1983 O LYS A 125 0.142 -14.582 15.094 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.406 -11.979 17.205 1.00 0.00 C ATOM 1985 CG LYS A 125 0.464 -12.788 18.160 1.00 0.00 C ATOM 1986 CD LYS A 125 -0.148 -14.146 18.497 1.00 0.00 C ATOM 1987 CE LYS A 125 -1.101 -14.074 19.688 1.00 0.00 C ATOM 1988 NZ LYS A 125 -2.287 -13.206 19.441 1.00 0.00 N ATOM 0 H LYS A 125 -1.449 -10.642 15.439 1.00 0.00 H new ATOM 0 HA LYS A 125 0.891 -12.207 15.506 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.224 -10.918 17.379 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.453 -12.166 17.442 1.00 0.00 H new ATOM 0 HG2 LYS A 125 1.447 -12.936 17.714 1.00 0.00 H new ATOM 0 HG3 LYS A 125 0.613 -12.222 19.079 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.685 -14.526 17.628 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.649 -14.857 18.715 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.440 -15.080 19.934 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -0.559 -13.699 20.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -3.024 -13.416 20.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -2.008 -12.207 19.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -2.658 -13.388 18.487 1.00 0.00 H new ATOM 2002 N ASP A 126 -1.956 -13.856 15.457 1.00 0.00 N ATOM 2003 CA ASP A 126 -2.600 -15.153 15.253 1.00 0.00 C ATOM 2004 C ASP A 126 -2.473 -15.652 13.813 1.00 0.00 C ATOM 2005 O ASP A 126 -2.685 -16.836 13.547 1.00 0.00 O ATOM 2006 CB ASP A 126 -4.077 -15.066 15.636 1.00 0.00 C ATOM 2007 CG ASP A 126 -4.274 -14.673 17.084 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -4.021 -13.496 17.424 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -4.657 -15.537 17.891 1.00 0.00 O ATOM 0 H ASP A 126 -2.609 -13.098 15.657 1.00 0.00 H new ATOM 0 HA ASP A 126 -2.086 -15.870 15.893 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.574 -14.339 14.994 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.554 -16.029 15.455 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.144 -14.759 12.887 1.00 0.00 N ATOM 2015 CA GLY A 127 -1.978 -15.159 11.503 1.00 0.00 C ATOM 2016 C GLY A 127 -2.245 -14.025 10.540 1.00 0.00 C ATOM 2017 O GLY A 127 -2.317 -12.868 10.946 1.00 0.00 O ATOM 0 H GLY A 127 -1.990 -13.767 13.069 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -0.963 -15.528 11.353 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.653 -15.986 11.283 1.00 0.00 H new ATOM 2021 N VAL A 128 -2.399 -14.354 9.267 1.00 0.00 N ATOM 2022 CA VAL A 128 -2.658 -13.347 8.248 1.00 0.00 C ATOM 2023 C VAL A 128 -4.114 -13.414 7.790 1.00 0.00 C ATOM 2024 O VAL A 128 -4.650 -14.495 7.532 1.00 0.00 O ATOM 2025 CB VAL A 128 -1.701 -13.491 7.035 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -1.857 -14.845 6.357 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -1.924 -12.365 6.034 1.00 0.00 C ATOM 0 H VAL A 128 -2.349 -15.310 8.914 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.471 -12.372 8.697 1.00 0.00 H new ATOM 0 HB VAL A 128 -0.681 -13.423 7.413 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.171 -14.910 5.512 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -1.630 -15.637 7.070 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -2.881 -14.958 6.002 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.242 -12.486 5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.953 -12.396 5.675 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.737 -11.406 6.517 1.00 0.00 H new ATOM 2037 N ASP A 129 -4.750 -12.258 7.709 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.158 -12.175 7.343 1.00 0.00 C ATOM 2039 C ASP A 129 -6.314 -11.365 6.060 1.00 0.00 C ATOM 2040 O ASP A 129 -5.551 -10.430 5.821 1.00 0.00 O ATOM 2041 CB ASP A 129 -6.939 -11.530 8.487 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.426 -11.457 8.229 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.007 -12.465 7.779 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.018 -10.394 8.493 1.00 0.00 O ATOM 0 H ASP A 129 -4.311 -11.356 7.893 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.552 -13.176 7.166 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.763 -12.096 9.402 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.557 -10.523 8.656 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.285 -11.723 5.230 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.454 -11.063 3.953 1.00 0.00 C ATOM 2051 C GLU A 130 -8.515 -9.968 4.013 1.00 0.00 C ATOM 2052 O GLU A 130 -9.636 -10.180 4.484 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.808 -12.078 2.867 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.065 -12.887 3.139 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.502 -13.695 1.934 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -8.906 -14.762 1.683 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -10.449 -13.272 1.233 1.00 0.00 O ATOM 0 H GLU A 130 -7.961 -12.463 5.421 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.503 -10.591 3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.930 -11.550 1.921 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.970 -12.764 2.743 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.887 -13.559 3.979 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.870 -12.214 3.434 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.137 -8.799 3.536 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.051 -7.685 3.381 1.00 0.00 C ATOM 2066 C GLU A 131 -9.320 -7.482 1.895 1.00 0.00 C ATOM 2067 O GLU A 131 -8.386 -7.480 1.088 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.441 -6.422 3.992 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.302 -5.182 3.832 1.00 0.00 C ATOM 2070 CD GLU A 131 -10.594 -5.254 4.621 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.579 -5.827 4.115 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -10.633 -4.706 5.744 1.00 0.00 O ATOM 0 H GLU A 131 -7.182 -8.594 3.243 1.00 0.00 H new ATOM 0 HA GLU A 131 -9.988 -7.894 3.896 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.263 -6.594 5.054 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.470 -6.240 3.531 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.735 -4.308 4.153 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.534 -5.041 2.776 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.582 -7.328 1.529 1.00 0.00 N ATOM 2080 CA GLU A 132 -10.942 -7.218 0.130 1.00 0.00 C ATOM 2081 C GLU A 132 -10.954 -5.761 -0.312 1.00 0.00 C ATOM 2082 O GLU A 132 -11.312 -4.864 0.460 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.297 -7.874 -0.120 1.00 0.00 C ATOM 2084 CG GLU A 132 -12.567 -8.152 -1.587 1.00 0.00 C ATOM 2085 CD GLU A 132 -11.416 -8.884 -2.252 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -11.394 -10.137 -2.221 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -10.514 -8.210 -2.799 1.00 0.00 O ATOM 0 H GLU A 132 -11.367 -7.277 2.178 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.192 -7.741 -0.463 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.348 -8.810 0.436 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.083 -7.228 0.271 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.476 -8.746 -1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.746 -7.211 -2.107 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.565 -5.536 -1.559 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.422 -4.188 -2.087 1.00 0.00 C ATOM 2096 C ILE A 133 -11.625 -3.789 -2.933 1.00 0.00 C ATOM 2097 O ILE A 133 -11.968 -4.462 -3.907 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.141 -4.046 -2.940 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -7.904 -4.429 -2.120 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.009 -2.623 -3.468 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.609 -4.364 -2.905 1.00 0.00 C ATOM 0 H ILE A 133 -10.342 -6.274 -2.226 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.354 -3.524 -1.225 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.215 -4.725 -3.789 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.830 -3.765 -1.259 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.034 -5.440 -1.733 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.102 -2.540 -4.067 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.875 -2.382 -4.085 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.956 -1.928 -2.630 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.778 -4.648 -2.260 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.662 -5.049 -3.751 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.455 -3.348 -3.269 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.259 -2.694 -2.542 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.362 -2.125 -3.301 1.00 0.00 C ATOM 2115 C ILE A 134 -12.865 -0.897 -4.066 1.00 0.00 C ATOM 2116 O ILE A 134 -12.087 -0.102 -3.534 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.559 -1.743 -2.381 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.319 -2.996 -1.911 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.515 -0.786 -3.085 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -14.550 -3.874 -0.944 1.00 0.00 C ATOM 0 H ILE A 134 -12.025 -2.177 -1.694 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.722 -2.877 -4.003 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.147 -1.238 -1.507 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -16.250 -2.684 -1.437 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.590 -3.590 -2.784 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.340 -0.538 -2.417 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.983 0.125 -3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.907 -1.260 -3.985 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.162 -4.732 -0.667 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -13.632 -4.221 -1.419 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.302 -3.301 -0.050 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.282 -0.759 -5.318 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.808 0.334 -6.155 1.00 0.00 C ATOM 2134 C LEU A 135 -13.760 1.526 -6.124 1.00 0.00 C ATOM 2135 O LEU A 135 -14.974 1.371 -5.970 1.00 0.00 O ATOM 2136 CB LEU A 135 -12.619 -0.141 -7.597 1.00 0.00 C ATOM 2137 CG LEU A 135 -11.616 -1.283 -7.783 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -11.401 -1.564 -9.261 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -10.296 -0.951 -7.106 1.00 0.00 C ATOM 0 H LEU A 135 -13.944 -1.387 -5.774 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.849 0.659 -5.752 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.585 -0.461 -7.986 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -12.296 0.706 -8.202 1.00 0.00 H new ATOM 0 HG LEU A 135 -12.024 -2.179 -7.316 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.686 -2.378 -9.376 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -12.349 -1.846 -9.719 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -11.014 -0.669 -9.749 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.596 -1.774 -7.249 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.881 -0.042 -7.543 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.462 -0.798 -6.040 1.00 0.00 H new ATOM 2151 N LYS A 136 -13.191 2.716 -6.253 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.968 3.940 -6.345 1.00 0.00 C ATOM 2153 C LYS A 136 -13.647 4.649 -7.657 1.00 0.00 C ATOM 2154 O LYS A 136 -12.485 4.764 -8.049 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.678 4.843 -5.142 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.588 6.055 -5.030 1.00 0.00 C ATOM 2157 CD LYS A 136 -14.469 6.723 -3.662 1.00 0.00 C ATOM 2158 CE LYS A 136 -13.037 7.134 -3.347 1.00 0.00 C ATOM 2159 NZ LYS A 136 -12.925 7.797 -2.022 1.00 0.00 N ATOM 0 H LYS A 136 -12.182 2.858 -6.297 1.00 0.00 H new ATOM 0 HA LYS A 136 -15.031 3.699 -6.332 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.767 4.252 -4.230 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.645 5.185 -5.201 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.335 6.774 -5.810 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.621 5.752 -5.199 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -15.113 7.602 -3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -14.827 6.039 -2.893 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.395 6.254 -3.367 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.675 7.810 -4.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -11.982 8.224 -1.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.650 8.538 -1.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -13.064 7.093 -1.269 1.00 0.00 H new ATOM 2173 N GLU A 137 -14.687 5.106 -8.333 1.00 0.00 N ATOM 2174 CA GLU A 137 -14.556 5.695 -9.662 1.00 0.00 C ATOM 2175 C GLU A 137 -13.949 7.085 -9.596 1.00 0.00 C ATOM 2176 O GLU A 137 -13.344 7.573 -10.555 1.00 0.00 O ATOM 2177 CB GLU A 137 -15.933 5.797 -10.296 1.00 0.00 C ATOM 2178 CG GLU A 137 -15.905 6.008 -11.798 1.00 0.00 C ATOM 2179 CD GLU A 137 -17.238 6.474 -12.330 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -17.546 7.678 -12.181 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -17.991 5.646 -12.880 1.00 0.00 O ATOM 0 H GLU A 137 -15.644 5.081 -7.981 1.00 0.00 H new ATOM 0 HA GLU A 137 -13.899 5.057 -10.253 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -16.491 4.887 -10.077 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.475 6.622 -9.833 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.139 6.743 -12.046 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -15.624 5.076 -12.289 1.00 0.00 H new ATOM 2188 N GLU A 138 -14.126 7.709 -8.458 1.00 0.00 N ATOM 2189 CA GLU A 138 -13.738 9.105 -8.279 1.00 0.00 C ATOM 2190 C GLU A 138 -13.005 9.286 -6.958 1.00 0.00 C ATOM 2191 O GLU A 138 -13.163 8.480 -6.049 1.00 0.00 O ATOM 2192 CB GLU A 138 -14.990 9.998 -8.324 1.00 0.00 C ATOM 2193 CG GLU A 138 -14.715 11.487 -8.147 1.00 0.00 C ATOM 2194 CD GLU A 138 -13.906 12.084 -9.281 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -12.684 11.836 -9.340 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -14.486 12.813 -10.117 1.00 0.00 O ATOM 0 H GLU A 138 -14.538 7.278 -7.631 1.00 0.00 H new ATOM 0 HA GLU A 138 -13.065 9.394 -9.086 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -15.494 9.846 -9.278 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -15.679 9.674 -7.544 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -15.664 12.018 -8.067 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -14.183 11.642 -7.209 1.00 0.00 H new ATOM 2203 N LEU A 139 -12.191 10.329 -6.864 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.518 10.658 -5.614 1.00 0.00 C ATOM 2205 C LEU A 139 -12.533 11.158 -4.593 1.00 0.00 C ATOM 2206 O LEU A 139 -13.677 11.462 -4.945 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.443 11.721 -5.841 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.283 11.297 -6.744 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.301 12.444 -6.921 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.579 10.076 -6.171 1.00 0.00 C ATOM 0 H LEU A 139 -11.981 10.961 -7.637 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.038 9.756 -5.234 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.914 12.604 -6.273 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.039 12.017 -4.873 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.686 11.034 -7.722 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.482 12.126 -7.566 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.811 13.293 -7.375 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.904 12.737 -5.949 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.757 9.789 -6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.188 10.312 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.287 9.251 -6.094 1.00 0.00 H new ATOM 2222 N GLU A 140 -12.122 11.251 -3.337 1.00 0.00 N ATOM 2223 CA GLU A 140 -13.013 11.701 -2.273 1.00 0.00 C ATOM 2224 C GLU A 140 -13.200 13.222 -2.318 1.00 0.00 C ATOM 2225 O GLU A 140 -12.915 13.930 -1.351 1.00 0.00 O ATOM 2226 CB GLU A 140 -12.481 11.255 -0.907 1.00 0.00 C ATOM 2227 CG GLU A 140 -13.506 11.350 0.214 1.00 0.00 C ATOM 2228 CD GLU A 140 -14.784 10.601 -0.104 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -14.705 9.444 -0.569 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -15.876 11.171 0.096 1.00 0.00 O ATOM 0 H GLU A 140 -11.178 11.021 -3.028 1.00 0.00 H new ATOM 0 HA GLU A 140 -13.990 11.242 -2.428 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.133 10.225 -0.982 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -11.616 11.865 -0.648 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.074 10.952 1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -13.740 12.398 0.401 1.00 0.00 H new ATOM 2237 N HIS A 141 -13.676 13.704 -3.464 1.00 0.00 N ATOM 2238 CA HIS A 141 -14.039 15.109 -3.652 1.00 0.00 C ATOM 2239 C HIS A 141 -12.843 16.030 -3.437 1.00 0.00 C ATOM 2240 O HIS A 141 -12.953 17.075 -2.787 1.00 0.00 O ATOM 2241 CB HIS A 141 -15.201 15.484 -2.727 1.00 0.00 C ATOM 2242 CG HIS A 141 -16.386 14.586 -2.899 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -16.850 13.755 -1.905 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -17.176 14.360 -3.973 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -17.868 13.053 -2.361 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -18.089 13.401 -3.615 1.00 0.00 N ATOM 0 H HIS A 141 -13.822 13.129 -4.293 1.00 0.00 H new ATOM 0 HA HIS A 141 -14.363 15.241 -4.684 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -14.864 15.441 -1.691 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -15.499 16.514 -2.923 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -17.102 14.845 -4.935 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -18.427 12.317 -1.803 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -18.818 13.020 -4.218 1.00 0.00 H new ATOM 2255 N HIS A 142 -11.705 15.629 -4.010 1.00 0.00 N ATOM 2256 CA HIS A 142 -10.474 16.422 -3.986 1.00 0.00 C ATOM 2257 C HIS A 142 -9.906 16.492 -2.568 1.00 0.00 C ATOM 2258 O HIS A 142 -10.313 15.722 -1.699 1.00 0.00 O ATOM 2259 CB HIS A 142 -10.723 17.828 -4.554 1.00 0.00 C ATOM 2260 CG HIS A 142 -11.274 17.818 -5.953 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -12.596 18.085 -6.247 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -10.676 17.554 -7.141 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -12.785 17.981 -7.550 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -11.638 17.660 -8.114 1.00 0.00 N ATOM 0 H HIS A 142 -11.612 14.742 -4.505 1.00 0.00 H new ATOM 0 HA HIS A 142 -9.735 15.931 -4.620 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -11.417 18.358 -3.902 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -9.787 18.387 -4.544 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -9.636 17.306 -7.293 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -13.721 18.133 -8.066 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -11.489 17.514 -9.112 1.00 0.00 H new ATOM 2273 N HIS A 143 -8.957 17.400 -2.338 1.00 0.00 N ATOM 2274 CA HIS A 143 -8.309 17.502 -1.027 1.00 0.00 C ATOM 2275 C HIS A 143 -9.322 17.882 0.056 1.00 0.00 C ATOM 2276 O HIS A 143 -9.158 17.512 1.217 1.00 0.00 O ATOM 2277 CB HIS A 143 -7.133 18.498 -1.055 1.00 0.00 C ATOM 2278 CG HIS A 143 -7.514 19.937 -1.252 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -7.635 20.523 -2.492 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -7.780 20.913 -0.351 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -7.953 21.795 -2.348 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -8.048 22.059 -1.057 1.00 0.00 N ATOM 0 H HIS A 143 -8.622 18.068 -3.032 1.00 0.00 H new ATOM 0 HA HIS A 143 -7.903 16.520 -0.783 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -6.582 18.410 -0.119 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -6.451 18.207 -1.854 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -7.781 20.809 0.724 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -8.109 22.501 -3.150 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -8.282 22.965 -0.652 1.00 0.00 H new ATOM 2291 N HIS A 144 -10.354 18.625 -0.346 1.00 0.00 N ATOM 2292 CA HIS A 144 -11.476 18.975 0.531 1.00 0.00 C ATOM 2293 C HIS A 144 -11.036 19.790 1.751 1.00 0.00 C ATOM 2294 O HIS A 144 -10.562 19.243 2.747 1.00 0.00 O ATOM 2295 CB HIS A 144 -12.228 17.713 0.976 1.00 0.00 C ATOM 2296 CG HIS A 144 -13.395 17.995 1.873 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -14.625 18.399 1.404 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -13.507 17.949 3.222 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -15.440 18.594 2.423 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -14.786 18.328 3.539 1.00 0.00 N ATOM 0 H HIS A 144 -10.437 19.002 -1.290 1.00 0.00 H new ATOM 0 HA HIS A 144 -12.147 19.606 -0.052 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -12.580 17.179 0.093 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -11.534 17.050 1.494 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -12.732 17.666 3.919 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -16.468 18.917 2.356 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -15.169 18.394 4.482 1.00 0.00 H new ATOM 2309 N HIS A 145 -11.220 21.100 1.676 1.00 0.00 N ATOM 2310 CA HIS A 145 -10.893 21.982 2.792 1.00 0.00 C ATOM 2311 C HIS A 145 -11.477 23.368 2.552 1.00 0.00 C ATOM 2312 O HIS A 145 -11.150 24.022 1.560 1.00 0.00 O ATOM 2313 CB HIS A 145 -9.373 22.077 2.979 1.00 0.00 C ATOM 2314 CG HIS A 145 -8.963 22.634 4.310 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -8.529 23.931 4.487 1.00 0.00 N ATOM 2316 CD2 HIS A 145 -8.920 22.056 5.535 1.00 0.00 C ATOM 2317 CE1 HIS A 145 -8.236 24.126 5.761 1.00 0.00 C ATOM 2318 NE2 HIS A 145 -8.466 23.007 6.416 1.00 0.00 N ATOM 0 H HIS A 145 -11.594 21.578 0.856 1.00 0.00 H new ATOM 0 HA HIS A 145 -11.328 21.565 3.700 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -8.939 21.084 2.861 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -8.957 22.703 2.189 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -9.192 21.038 5.774 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -7.870 25.046 6.192 1.00 0.00 H new ATOM 0 HE2 HIS A 145 -8.329 22.869 7.417 1.00 0.00 H new ATOM 2327 N HIS A 146 -12.344 23.810 3.451 1.00 0.00 N ATOM 2328 CA HIS A 146 -12.957 25.125 3.321 1.00 0.00 C ATOM 2329 C HIS A 146 -12.204 26.138 4.168 1.00 0.00 C ATOM 2330 O HIS A 146 -11.826 27.194 3.628 1.00 0.00 O ATOM 2331 CB HIS A 146 -14.454 25.109 3.691 1.00 0.00 C ATOM 2332 CG HIS A 146 -14.759 24.823 5.135 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -14.810 25.801 6.108 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -15.053 23.662 5.762 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -15.124 25.253 7.264 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -15.277 23.956 7.082 1.00 0.00 N ATOM 2337 OXT HIS A 146 -11.960 25.856 5.356 1.00 0.00 O ATOM 0 H HIS A 146 -12.638 23.282 4.273 1.00 0.00 H new ATOM 0 HA HIS A 146 -12.893 25.417 2.273 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -14.885 26.076 3.431 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -14.955 24.361 3.077 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -15.102 22.684 5.307 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -15.237 25.777 8.202 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -15.522 23.281 7.806 1.00 0.00 H new TER 2346 HIS A 146