USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1056 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 27 THR OG1 : rot -179:sc= -0.42 USER MOD Set 1.2: B 5 GLN : amide:sc= -3.86 K(o=-4.3,f=-5.8!) USER MOD Set 2.1: A 8 SER OG : rot 98:sc= 1.09 USER MOD Set 2.2: B 8 SER OG : rot 26:sc= 0.647 USER MOD Set 3.1: A 5 GLN : amide:sc= -1.38! X(o=-1.8!,f=-1.8) USER MOD Set 3.2: B 27 THR OG1 : rot -150:sc= -0.461 USER MOD Single : A 1 MET CE :methyl -131:sc= -0.0705 (180deg=-0.749) USER MOD Single : A 1 MET N :NH3+ -165:sc= -0.0119 (180deg=-0.241) USER MOD Single : A 3 ASN : amide:sc= -4.51 K(o=-4.5,f=-1.2) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.235 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.316 X(o=-0.32,f=-0.18) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -119:sc= -0.287 (180deg=-1.16) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 33 SER OG : rot 160:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -169:sc= 0.607 (180deg=0.281) USER MOD Single : A 38 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.105) USER MOD Single : A 47 LYS NZ :NH3+ -158:sc= -0.101 (180deg=-0.627) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 30:sc= -0.453 USER MOD Single : A 66 HIS : no HD1:sc= -1.26 K(o=-1.3,f=-2.1) USER MOD Single : A 67 HIS : no HD1:sc= -0.965 K(o=-0.96,f=-4.8!) USER MOD Single : A 68 HIS : no HD1:sc= 0.0612 K(o=0.061,f=-2.9!) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 HIS : no HD1:sc=-0.00779 X(o=-0.0078,f=0) USER MOD Single : A 71 HIS : no HD1:sc= -0.252 X(o=-0.25,f=-0.16) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -100:sc= 0.501 (180deg=-1.45!) USER MOD Single : B 3 ASN : amide:sc= -1.97! C(o=-2!,f=-7.7!) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.166 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.14) USER MOD Single : B 17 SER OG : rot 180:sc= -0.139 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 GLN : amide:sc=-0.00621 K(o=-0.0062,f=-1.7!) USER MOD Single : B 33 SER OG : rot 180:sc= -2.18! USER MOD Single : B 35 LYS NZ :NH3+ -175:sc= -4.01! (180deg=-4.19!) USER MOD Single : B 38 LYS NZ :NH3+ -163:sc= -0.0301 (180deg=-0.312) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 TYR OH : rot -47:sc= -0.565 USER MOD Single : B 66 HIS : no HE2:sc= -4.37! C(o=-4.4!,f=-9.2!) USER MOD Single : B 67 HIS : no HD1:sc= -0.604 K(o=-0.6,f=-1.6!) USER MOD Single : B 68 HIS : no HD1:sc= -3.37! C(o=-3.4!,f=-11!) USER MOD Single : B 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 70 HIS : no HD1:sc= -5.35! C(o=-5.3!,f=-8.7!) USER MOD Single : B 71 HIS : no HD1:sc= -0.135 X(o=-0.14,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.678 8.845 -15.125 1.00 0.00 N ATOM 2 CA MET A 1 -10.131 8.644 -14.863 1.00 0.00 C ATOM 3 C MET A 1 -10.365 8.454 -13.359 1.00 0.00 C ATOM 4 O MET A 1 -9.738 7.631 -12.723 1.00 0.00 O ATOM 5 CB MET A 1 -10.621 7.407 -15.619 1.00 0.00 C ATOM 6 CG MET A 1 -10.588 7.683 -17.124 1.00 0.00 C ATOM 7 SD MET A 1 -11.245 6.252 -18.020 1.00 0.00 S ATOM 8 CE MET A 1 -9.872 5.112 -17.705 1.00 0.00 C ATOM 0 H1 MET A 1 -8.547 9.221 -16.086 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.291 9.518 -14.434 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.181 7.936 -15.039 1.00 0.00 H new ATOM 0 HA MET A 1 -10.683 9.520 -15.204 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.991 6.549 -15.382 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.634 7.154 -15.307 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.177 8.571 -17.354 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.566 7.887 -17.444 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.562 4.648 -18.641 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.033 5.662 -17.278 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.193 4.340 -17.006 1.00 0.00 H new ATOM 20 N ASP A 2 -11.266 9.210 -12.794 1.00 0.00 N ATOM 21 CA ASP A 2 -11.555 9.085 -11.333 1.00 0.00 C ATOM 22 C ASP A 2 -10.243 9.000 -10.541 1.00 0.00 C ATOM 23 O ASP A 2 -9.170 9.220 -11.068 1.00 0.00 O ATOM 24 CB ASP A 2 -12.396 7.820 -11.087 1.00 0.00 C ATOM 25 CG ASP A 2 -13.171 7.958 -9.771 1.00 0.00 C ATOM 26 OD1 ASP A 2 -14.169 8.660 -9.767 1.00 0.00 O ATOM 27 OD2 ASP A 2 -12.753 7.362 -8.794 1.00 0.00 O ATOM 0 H ASP A 2 -11.819 9.914 -13.283 1.00 0.00 H new ATOM 0 HA ASP A 2 -12.109 9.962 -11.000 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -13.090 7.667 -11.914 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -11.749 6.944 -11.048 1.00 0.00 H new ATOM 32 N ASN A 3 -10.324 8.686 -9.275 1.00 0.00 N ATOM 33 CA ASN A 3 -9.088 8.589 -8.437 1.00 0.00 C ATOM 34 C ASN A 3 -9.297 7.550 -7.331 1.00 0.00 C ATOM 35 O ASN A 3 -8.364 6.927 -6.866 1.00 0.00 O ATOM 36 CB ASN A 3 -8.807 9.949 -7.799 1.00 0.00 C ATOM 37 CG ASN A 3 -10.050 10.410 -7.045 1.00 0.00 C ATOM 38 OD1 ASN A 3 -10.771 11.273 -7.504 1.00 0.00 O ATOM 39 ND2 ASN A 3 -10.336 9.864 -5.897 1.00 0.00 N ATOM 0 H ASN A 3 -11.195 8.491 -8.782 1.00 0.00 H new ATOM 0 HA ASN A 3 -8.247 8.290 -9.063 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -7.959 9.877 -7.118 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -8.540 10.677 -8.566 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -11.166 10.161 -5.383 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -9.730 9.139 -5.512 1.00 0.00 H new ATOM 46 N ARG A 4 -10.517 7.364 -6.903 1.00 0.00 N ATOM 47 CA ARG A 4 -10.788 6.374 -5.825 1.00 0.00 C ATOM 48 C ARG A 4 -10.203 5.018 -6.220 1.00 0.00 C ATOM 49 O ARG A 4 -10.265 4.610 -7.364 1.00 0.00 O ATOM 50 CB ARG A 4 -12.304 6.247 -5.637 1.00 0.00 C ATOM 51 CG ARG A 4 -12.878 7.551 -5.048 1.00 0.00 C ATOM 52 CD ARG A 4 -12.812 7.515 -3.515 1.00 0.00 C ATOM 53 NE ARG A 4 -13.809 6.530 -3.007 1.00 0.00 N ATOM 54 CZ ARG A 4 -15.059 6.881 -2.875 1.00 0.00 C ATOM 55 NH1 ARG A 4 -15.430 8.089 -3.198 1.00 0.00 N ATOM 56 NH2 ARG A 4 -15.939 6.027 -2.427 1.00 0.00 N ATOM 0 H ARG A 4 -11.338 7.857 -7.255 1.00 0.00 H new ATOM 0 HA ARG A 4 -10.328 6.704 -4.893 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -12.780 6.031 -6.594 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -12.527 5.411 -4.974 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -12.316 8.406 -5.423 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -13.911 7.681 -5.372 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -11.810 7.238 -3.188 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -13.019 8.504 -3.106 1.00 0.00 H new ATOM 0 HE ARG A 4 -13.515 5.584 -2.763 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -14.744 8.756 -3.552 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -16.406 8.367 -3.096 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -15.651 5.081 -2.178 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -16.915 6.306 -2.326 1.00 0.00 H new ATOM 70 N GLN A 5 -9.628 4.316 -5.278 1.00 0.00 N ATOM 71 CA GLN A 5 -9.028 2.984 -5.588 1.00 0.00 C ATOM 72 C GLN A 5 -9.178 2.061 -4.377 1.00 0.00 C ATOM 73 O GLN A 5 -9.389 2.509 -3.267 1.00 0.00 O ATOM 74 CB GLN A 5 -7.544 3.162 -5.919 1.00 0.00 C ATOM 75 CG GLN A 5 -6.840 3.896 -4.775 1.00 0.00 C ATOM 76 CD GLN A 5 -5.426 4.281 -5.214 1.00 0.00 C ATOM 77 OE1 GLN A 5 -4.732 4.990 -4.512 1.00 0.00 O ATOM 78 NE2 GLN A 5 -4.968 3.844 -6.354 1.00 0.00 N ATOM 0 H GLN A 5 -9.548 4.609 -4.304 1.00 0.00 H new ATOM 0 HA GLN A 5 -9.541 2.542 -6.442 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -7.079 2.189 -6.079 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -7.434 3.725 -6.846 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -7.403 4.788 -4.499 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -6.798 3.260 -3.891 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.550 3.249 -6.943 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -4.027 4.097 -6.656 1.00 0.00 H new ATOM 87 N PHE A 6 -9.067 0.772 -4.587 1.00 0.00 N ATOM 88 CA PHE A 6 -9.199 -0.205 -3.460 1.00 0.00 C ATOM 89 C PHE A 6 -7.827 -0.841 -3.211 1.00 0.00 C ATOM 90 O PHE A 6 -7.168 -1.275 -4.134 1.00 0.00 O ATOM 91 CB PHE A 6 -10.198 -1.298 -3.859 1.00 0.00 C ATOM 92 CG PHE A 6 -11.407 -0.654 -4.492 1.00 0.00 C ATOM 93 CD1 PHE A 6 -12.467 -0.201 -3.697 1.00 0.00 C ATOM 94 CD2 PHE A 6 -11.461 -0.500 -5.881 1.00 0.00 C ATOM 95 CE1 PHE A 6 -13.581 0.405 -4.295 1.00 0.00 C ATOM 96 CE2 PHE A 6 -12.568 0.108 -6.479 1.00 0.00 C ATOM 97 CZ PHE A 6 -13.630 0.561 -5.687 1.00 0.00 C ATOM 0 H PHE A 6 -8.889 0.351 -5.499 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.551 0.298 -2.559 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -9.734 -1.995 -4.557 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -10.494 -1.875 -2.983 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -12.426 -0.318 -2.624 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -10.644 -0.852 -6.494 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -14.401 0.751 -3.683 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -12.604 0.228 -7.552 1.00 0.00 H new ATOM 0 HZ PHE A 6 -14.486 1.030 -6.148 1.00 0.00 H new ATOM 107 N LEU A 7 -7.389 -0.897 -1.975 1.00 0.00 N ATOM 108 CA LEU A 7 -6.052 -1.503 -1.661 1.00 0.00 C ATOM 109 C LEU A 7 -6.267 -2.712 -0.750 1.00 0.00 C ATOM 110 O LEU A 7 -7.094 -2.688 0.143 1.00 0.00 O ATOM 111 CB LEU A 7 -5.164 -0.454 -0.959 1.00 0.00 C ATOM 112 CG LEU A 7 -3.688 -0.943 -0.862 1.00 0.00 C ATOM 113 CD1 LEU A 7 -2.725 0.246 -0.987 1.00 0.00 C ATOM 114 CD2 LEU A 7 -3.437 -1.620 0.496 1.00 0.00 C ATOM 0 H LEU A 7 -7.902 -0.548 -1.165 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.555 -1.822 -2.577 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.203 0.487 -1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.551 -0.256 0.040 1.00 0.00 H new ATOM 0 HG LEU A 7 -3.516 -1.653 -1.671 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.697 -0.110 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.875 0.736 -1.949 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.918 0.957 -0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.402 -1.956 0.549 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -3.629 -0.908 1.299 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.103 -2.476 0.604 1.00 0.00 H new ATOM 126 N SER A 8 -5.533 -3.775 -0.976 1.00 0.00 N ATOM 127 CA SER A 8 -5.681 -5.009 -0.140 1.00 0.00 C ATOM 128 C SER A 8 -4.339 -5.343 0.507 1.00 0.00 C ATOM 129 O SER A 8 -3.290 -5.105 -0.059 1.00 0.00 O ATOM 130 CB SER A 8 -6.120 -6.169 -1.036 1.00 0.00 C ATOM 131 OG SER A 8 -7.180 -5.736 -1.879 1.00 0.00 O ATOM 0 H SER A 8 -4.830 -3.841 -1.712 1.00 0.00 H new ATOM 0 HA SER A 8 -6.427 -4.844 0.637 1.00 0.00 H new ATOM 0 HB2 SER A 8 -5.280 -6.517 -1.638 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.446 -7.012 -0.426 1.00 0.00 H new ATOM 0 HG SER A 8 -6.821 -5.497 -2.759 1.00 0.00 H new ATOM 137 N LEU A 9 -4.357 -5.888 1.696 1.00 0.00 N ATOM 138 CA LEU A 9 -3.073 -6.226 2.376 1.00 0.00 C ATOM 139 C LEU A 9 -3.306 -7.337 3.407 1.00 0.00 C ATOM 140 O LEU A 9 -4.367 -7.446 3.996 1.00 0.00 O ATOM 141 CB LEU A 9 -2.522 -4.974 3.077 1.00 0.00 C ATOM 142 CG LEU A 9 -1.022 -5.157 3.397 1.00 0.00 C ATOM 143 CD1 LEU A 9 -0.168 -4.744 2.187 1.00 0.00 C ATOM 144 CD2 LEU A 9 -0.637 -4.290 4.602 1.00 0.00 C ATOM 0 H LEU A 9 -5.201 -6.112 2.223 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.353 -6.575 1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.661 -4.101 2.440 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.077 -4.789 3.997 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.841 -6.207 3.627 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.888 -4.877 2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.428 -5.364 1.329 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.357 -3.697 1.949 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.422 -4.423 4.823 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.831 -3.242 4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -1.228 -4.587 5.468 1.00 0.00 H new ATOM 156 N THR A 10 -2.312 -8.160 3.627 1.00 0.00 N ATOM 157 CA THR A 10 -2.440 -9.273 4.618 1.00 0.00 C ATOM 158 C THR A 10 -1.087 -9.516 5.294 1.00 0.00 C ATOM 159 O THR A 10 -0.057 -9.077 4.820 1.00 0.00 O ATOM 160 CB THR A 10 -2.889 -10.552 3.903 1.00 0.00 C ATOM 161 OG1 THR A 10 -2.638 -11.674 4.738 1.00 0.00 O ATOM 162 CG2 THR A 10 -2.137 -10.703 2.584 1.00 0.00 C ATOM 0 H THR A 10 -1.408 -8.108 3.158 1.00 0.00 H new ATOM 0 HA THR A 10 -3.180 -9.000 5.371 1.00 0.00 H new ATOM 0 HB THR A 10 -3.957 -10.492 3.693 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.926 -12.492 4.282 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.462 -11.614 2.082 1.00 0.00 H new ATOM 0 HG22 THR A 10 -2.345 -9.844 1.946 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.066 -10.759 2.780 1.00 0.00 H new ATOM 170 N GLY A 11 -1.081 -10.214 6.400 1.00 0.00 N ATOM 171 CA GLY A 11 0.204 -10.491 7.109 1.00 0.00 C ATOM 172 C GLY A 11 0.523 -9.340 8.068 1.00 0.00 C ATOM 173 O GLY A 11 1.650 -9.168 8.491 1.00 0.00 O ATOM 0 H GLY A 11 -1.912 -10.605 6.844 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.131 -11.428 7.661 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.011 -10.609 6.386 1.00 0.00 H new ATOM 177 N VAL A 12 -0.457 -8.550 8.415 1.00 0.00 N ATOM 178 CA VAL A 12 -0.203 -7.412 9.346 1.00 0.00 C ATOM 179 C VAL A 12 0.133 -7.948 10.741 1.00 0.00 C ATOM 180 O VAL A 12 -0.458 -8.901 11.210 1.00 0.00 O ATOM 181 CB VAL A 12 -1.449 -6.525 9.428 1.00 0.00 C ATOM 182 CG1 VAL A 12 -2.581 -7.283 10.128 1.00 0.00 C ATOM 183 CG2 VAL A 12 -1.112 -5.261 10.222 1.00 0.00 C ATOM 0 H VAL A 12 -1.421 -8.643 8.095 1.00 0.00 H new ATOM 0 HA VAL A 12 0.637 -6.826 8.972 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.770 -6.255 8.422 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.465 -6.647 10.184 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -2.818 -8.185 9.564 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.267 -7.557 11.135 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -1.995 -4.624 10.285 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -0.792 -5.537 11.227 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.309 -4.720 9.721 1.00 0.00 H new ATOM 193 N SER A 13 1.075 -7.341 11.412 1.00 0.00 N ATOM 194 CA SER A 13 1.441 -7.817 12.775 1.00 0.00 C ATOM 195 C SER A 13 0.341 -7.425 13.769 1.00 0.00 C ATOM 196 O SER A 13 -0.165 -8.251 14.504 1.00 0.00 O ATOM 197 CB SER A 13 2.768 -7.179 13.195 1.00 0.00 C ATOM 198 OG SER A 13 3.351 -7.948 14.238 1.00 0.00 O ATOM 0 H SER A 13 1.605 -6.538 11.075 1.00 0.00 H new ATOM 0 HA SER A 13 1.546 -8.902 12.767 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.446 -7.128 12.343 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.602 -6.156 13.532 1.00 0.00 H new ATOM 0 HG SER A 13 4.202 -7.542 14.507 1.00 0.00 H new ATOM 204 N LYS A 14 -0.041 -6.175 13.796 1.00 0.00 N ATOM 205 CA LYS A 14 -1.115 -5.743 14.744 1.00 0.00 C ATOM 206 C LYS A 14 -1.798 -4.475 14.217 1.00 0.00 C ATOM 207 O LYS A 14 -1.259 -3.749 13.400 1.00 0.00 O ATOM 208 CB LYS A 14 -0.509 -5.451 16.127 1.00 0.00 C ATOM 209 CG LYS A 14 0.886 -4.818 15.962 1.00 0.00 C ATOM 210 CD LYS A 14 1.160 -3.819 17.094 1.00 0.00 C ATOM 211 CE LYS A 14 0.968 -4.488 18.457 1.00 0.00 C ATOM 212 NZ LYS A 14 1.687 -3.702 19.499 1.00 0.00 N ATOM 0 H LYS A 14 0.341 -5.436 13.206 1.00 0.00 H new ATOM 0 HA LYS A 14 -1.849 -6.544 14.830 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.160 -4.778 16.685 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.434 -6.373 16.704 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.648 -5.597 15.964 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.951 -4.312 14.999 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.177 -3.436 17.010 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.489 -2.965 17.004 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -0.093 -4.548 18.699 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.347 -5.510 18.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 1.558 -4.155 20.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.701 -3.666 19.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.305 -2.735 19.530 1.00 0.00 H new ATOM 226 N VAL A 15 -2.982 -4.202 14.701 1.00 0.00 N ATOM 227 CA VAL A 15 -3.723 -2.981 14.268 1.00 0.00 C ATOM 228 C VAL A 15 -3.407 -1.838 15.235 1.00 0.00 C ATOM 229 O VAL A 15 -3.925 -1.778 16.333 1.00 0.00 O ATOM 230 CB VAL A 15 -5.224 -3.283 14.288 1.00 0.00 C ATOM 231 CG1 VAL A 15 -6.018 -2.016 13.962 1.00 0.00 C ATOM 232 CG2 VAL A 15 -5.532 -4.359 13.243 1.00 0.00 C ATOM 0 H VAL A 15 -3.471 -4.779 15.385 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.424 -2.692 13.260 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.508 -3.635 15.280 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.084 -2.241 13.979 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.797 -1.248 14.703 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.738 -1.656 12.972 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.599 -4.579 13.251 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.243 -4.000 12.255 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.973 -5.265 13.478 1.00 0.00 H new ATOM 242 N GLN A 16 -2.552 -0.934 14.840 1.00 0.00 N ATOM 243 CA GLN A 16 -2.193 0.199 15.739 1.00 0.00 C ATOM 244 C GLN A 16 -3.421 1.086 15.956 1.00 0.00 C ATOM 245 O GLN A 16 -3.662 1.578 17.042 1.00 0.00 O ATOM 246 CB GLN A 16 -1.073 1.023 15.095 1.00 0.00 C ATOM 247 CG GLN A 16 -0.583 2.092 16.075 1.00 0.00 C ATOM 248 CD GLN A 16 0.122 1.419 17.256 1.00 0.00 C ATOM 249 OE1 GLN A 16 -0.214 1.664 18.397 1.00 0.00 O ATOM 250 NE2 GLN A 16 1.092 0.576 17.028 1.00 0.00 N ATOM 0 H GLN A 16 -2.086 -0.932 13.933 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.853 -0.190 16.699 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -0.247 0.371 14.812 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.435 1.494 14.181 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.101 2.776 15.572 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.424 2.687 16.431 1.00 0.00 H new ATOM 0 HE21 GLN A 16 1.374 0.370 16.070 1.00 0.00 H new ATOM 0 HE22 GLN A 16 1.568 0.123 17.808 1.00 0.00 H new ATOM 259 N SER A 17 -4.200 1.298 14.931 1.00 0.00 N ATOM 260 CA SER A 17 -5.410 2.158 15.076 1.00 0.00 C ATOM 261 C SER A 17 -6.300 2.000 13.842 1.00 0.00 C ATOM 262 O SER A 17 -5.880 1.497 12.817 1.00 0.00 O ATOM 263 CB SER A 17 -4.985 3.622 15.214 1.00 0.00 C ATOM 264 OG SER A 17 -6.093 4.393 15.662 1.00 0.00 O ATOM 0 H SER A 17 -4.051 0.913 13.998 1.00 0.00 H new ATOM 0 HA SER A 17 -5.964 1.856 15.965 1.00 0.00 H new ATOM 0 HB2 SER A 17 -4.159 3.708 15.920 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.627 4.001 14.257 1.00 0.00 H new ATOM 0 HG SER A 17 -5.824 5.331 15.753 1.00 0.00 H new ATOM 270 N PHE A 18 -7.531 2.426 13.931 1.00 0.00 N ATOM 271 CA PHE A 18 -8.465 2.308 12.772 1.00 0.00 C ATOM 272 C PHE A 18 -9.431 3.500 12.790 1.00 0.00 C ATOM 273 O PHE A 18 -10.320 3.574 13.614 1.00 0.00 O ATOM 274 CB PHE A 18 -9.241 0.980 12.894 1.00 0.00 C ATOM 275 CG PHE A 18 -10.545 1.041 12.120 1.00 0.00 C ATOM 276 CD1 PHE A 18 -10.565 1.540 10.811 1.00 0.00 C ATOM 277 CD2 PHE A 18 -11.735 0.609 12.720 1.00 0.00 C ATOM 278 CE1 PHE A 18 -11.773 1.609 10.107 1.00 0.00 C ATOM 279 CE2 PHE A 18 -12.941 0.675 12.014 1.00 0.00 C ATOM 280 CZ PHE A 18 -12.961 1.176 10.708 1.00 0.00 C ATOM 0 H PHE A 18 -7.934 2.855 14.764 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.915 2.313 11.831 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -8.628 0.161 12.518 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -9.446 0.769 13.944 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -9.649 1.871 10.345 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -11.721 0.224 13.729 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -11.789 1.997 9.099 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -13.857 0.339 12.477 1.00 0.00 H new ATOM 0 HZ PHE A 18 -13.892 1.229 10.164 1.00 0.00 H new ATOM 290 N ASP A 19 -9.267 4.422 11.873 1.00 0.00 N ATOM 291 CA ASP A 19 -10.176 5.610 11.807 1.00 0.00 C ATOM 292 C ASP A 19 -10.627 5.788 10.352 1.00 0.00 C ATOM 293 O ASP A 19 -9.882 5.496 9.439 1.00 0.00 O ATOM 294 CB ASP A 19 -9.417 6.863 12.260 1.00 0.00 C ATOM 295 CG ASP A 19 -8.921 6.673 13.693 1.00 0.00 C ATOM 296 OD1 ASP A 19 -9.622 6.036 14.463 1.00 0.00 O ATOM 297 OD2 ASP A 19 -7.848 7.165 13.997 1.00 0.00 O ATOM 0 H ASP A 19 -8.536 4.403 11.161 1.00 0.00 H new ATOM 0 HA ASP A 19 -11.038 5.461 12.457 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.574 7.050 11.595 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -10.068 7.735 12.203 1.00 0.00 H new ATOM 302 N PRO A 20 -11.828 6.258 10.119 1.00 0.00 N ATOM 303 CA PRO A 20 -12.339 6.456 8.733 1.00 0.00 C ATOM 304 C PRO A 20 -11.583 7.580 8.014 1.00 0.00 C ATOM 305 O PRO A 20 -11.607 7.681 6.805 1.00 0.00 O ATOM 306 CB PRO A 20 -13.823 6.810 8.933 1.00 0.00 C ATOM 307 CG PRO A 20 -13.903 7.375 10.317 1.00 0.00 C ATOM 308 CD PRO A 20 -12.823 6.659 11.131 1.00 0.00 C ATOM 0 HA PRO A 20 -12.202 5.575 8.106 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -14.160 7.534 8.191 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -14.456 5.929 8.829 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -13.735 8.452 10.309 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.890 7.210 10.749 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -12.386 7.317 11.883 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -13.227 5.795 11.659 1.00 0.00 H new ATOM 316 N LYS A 21 -10.910 8.425 8.757 1.00 0.00 N ATOM 317 CA LYS A 21 -10.145 9.548 8.136 1.00 0.00 C ATOM 318 C LYS A 21 -8.657 9.175 8.061 1.00 0.00 C ATOM 319 O LYS A 21 -7.847 9.911 7.533 1.00 0.00 O ATOM 320 CB LYS A 21 -10.323 10.799 9.003 1.00 0.00 C ATOM 321 CG LYS A 21 -10.020 12.055 8.181 1.00 0.00 C ATOM 322 CD LYS A 21 -9.841 13.252 9.121 1.00 0.00 C ATOM 323 CE LYS A 21 -11.105 13.463 9.974 1.00 0.00 C ATOM 324 NZ LYS A 21 -10.944 12.759 11.279 1.00 0.00 N ATOM 0 H LYS A 21 -10.859 8.383 9.775 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.513 9.741 7.128 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.342 10.843 9.387 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.659 10.751 9.866 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.117 11.906 7.589 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.832 12.248 7.480 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.981 13.087 9.770 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.634 14.150 8.540 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.272 14.527 10.140 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.980 13.082 9.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -11.685 12.036 11.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.009 12.304 11.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -11.025 13.445 12.056 1.00 0.00 H new ATOM 338 N GLU A 22 -8.294 8.034 8.588 1.00 0.00 N ATOM 339 CA GLU A 22 -6.863 7.604 8.553 1.00 0.00 C ATOM 340 C GLU A 22 -6.745 6.185 9.105 1.00 0.00 C ATOM 341 O GLU A 22 -7.526 5.764 9.936 1.00 0.00 O ATOM 342 CB GLU A 22 -6.010 8.555 9.405 1.00 0.00 C ATOM 343 CG GLU A 22 -4.568 8.033 9.487 1.00 0.00 C ATOM 344 CD GLU A 22 -3.678 9.079 10.162 1.00 0.00 C ATOM 345 OE1 GLU A 22 -3.558 10.165 9.618 1.00 0.00 O ATOM 346 OE2 GLU A 22 -3.124 8.773 11.205 1.00 0.00 O ATOM 0 H GLU A 22 -8.930 7.379 9.043 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.507 7.628 7.523 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.020 9.554 8.970 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.433 8.639 10.406 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.540 7.100 10.050 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.193 7.813 8.487 1.00 0.00 H new ATOM 353 N ILE A 23 -5.768 5.439 8.650 1.00 0.00 N ATOM 354 CA ILE A 23 -5.582 4.037 9.149 1.00 0.00 C ATOM 355 C ILE A 23 -4.106 3.796 9.475 1.00 0.00 C ATOM 356 O ILE A 23 -3.231 4.071 8.676 1.00 0.00 O ATOM 357 CB ILE A 23 -6.054 3.049 8.076 1.00 0.00 C ATOM 358 CG1 ILE A 23 -7.574 3.171 7.918 1.00 0.00 C ATOM 359 CG2 ILE A 23 -5.682 1.619 8.479 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.030 2.378 6.692 1.00 0.00 C ATOM 0 H ILE A 23 -5.088 5.740 7.952 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.170 3.890 10.055 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.568 3.280 7.128 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.073 2.797 8.812 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.855 4.219 7.811 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.021 0.924 7.711 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -4.600 1.541 8.586 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -6.159 1.372 9.427 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.111 2.467 6.583 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.541 2.773 5.801 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.763 1.329 6.817 1.00 0.00 H new ATOM 372 N LEU A 24 -3.825 3.282 10.652 1.00 0.00 N ATOM 373 CA LEU A 24 -2.408 3.008 11.055 1.00 0.00 C ATOM 374 C LEU A 24 -2.248 1.504 11.289 1.00 0.00 C ATOM 375 O LEU A 24 -2.918 0.924 12.122 1.00 0.00 O ATOM 376 CB LEU A 24 -2.101 3.754 12.357 1.00 0.00 C ATOM 377 CG LEU A 24 -2.453 5.239 12.204 1.00 0.00 C ATOM 378 CD1 LEU A 24 -2.150 5.969 13.516 1.00 0.00 C ATOM 379 CD2 LEU A 24 -1.635 5.856 11.060 1.00 0.00 C ATOM 0 H LEU A 24 -4.523 3.039 11.355 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.726 3.341 10.273 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.671 3.319 13.178 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -1.046 3.646 12.608 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.513 5.338 11.971 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -2.399 7.025 13.411 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.744 5.534 14.320 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.091 5.868 13.752 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.891 6.911 10.958 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.572 5.760 11.280 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.861 5.336 10.129 1.00 0.00 H new ATOM 391 N LEU A 25 -1.367 0.864 10.559 1.00 0.00 N ATOM 392 CA LEU A 25 -1.157 -0.612 10.730 1.00 0.00 C ATOM 393 C LEU A 25 0.341 -0.909 10.784 1.00 0.00 C ATOM 394 O LEU A 25 1.104 -0.425 9.971 1.00 0.00 O ATOM 395 CB LEU A 25 -1.773 -1.356 9.541 1.00 0.00 C ATOM 396 CG LEU A 25 -3.290 -1.139 9.512 1.00 0.00 C ATOM 397 CD1 LEU A 25 -3.864 -1.725 8.217 1.00 0.00 C ATOM 398 CD2 LEU A 25 -3.952 -1.820 10.722 1.00 0.00 C ATOM 0 H LEU A 25 -0.780 1.301 9.848 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.631 -0.940 11.655 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.329 -1.001 8.611 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.552 -2.421 9.614 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.495 -0.069 9.555 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.943 -1.571 8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.409 -1.228 7.360 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.649 -2.793 8.174 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.029 -1.657 10.687 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.746 -2.890 10.695 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.551 -1.396 11.643 1.00 0.00 H new ATOM 410 N GLU A 26 0.773 -1.707 11.732 1.00 0.00 N ATOM 411 CA GLU A 26 2.230 -2.042 11.830 1.00 0.00 C ATOM 412 C GLU A 26 2.456 -3.443 11.268 1.00 0.00 C ATOM 413 O GLU A 26 1.914 -4.418 11.757 1.00 0.00 O ATOM 414 CB GLU A 26 2.668 -1.987 13.293 1.00 0.00 C ATOM 415 CG GLU A 26 4.183 -2.181 13.389 1.00 0.00 C ATOM 416 CD GLU A 26 4.614 -2.092 14.854 1.00 0.00 C ATOM 417 OE1 GLU A 26 3.745 -2.129 15.709 1.00 0.00 O ATOM 418 OE2 GLU A 26 5.806 -1.989 15.095 1.00 0.00 O ATOM 0 H GLU A 26 0.181 -2.140 12.441 1.00 0.00 H new ATOM 0 HA GLU A 26 2.817 -1.323 11.258 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.387 -1.029 13.730 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.156 -2.761 13.865 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.464 -3.149 12.974 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.696 -1.421 12.800 1.00 0.00 H new ATOM 425 N THR A 27 3.247 -3.542 10.223 1.00 0.00 N ATOM 426 CA THR A 27 3.518 -4.869 9.584 1.00 0.00 C ATOM 427 C THR A 27 5.025 -5.123 9.516 1.00 0.00 C ATOM 428 O THR A 27 5.826 -4.208 9.473 1.00 0.00 O ATOM 429 CB THR A 27 2.942 -4.865 8.164 1.00 0.00 C ATOM 430 OG1 THR A 27 3.278 -6.083 7.515 1.00 0.00 O ATOM 431 CG2 THR A 27 3.524 -3.687 7.377 1.00 0.00 C ATOM 0 H THR A 27 3.720 -2.752 9.783 1.00 0.00 H new ATOM 0 HA THR A 27 3.052 -5.656 10.177 1.00 0.00 H new ATOM 0 HB THR A 27 1.858 -4.766 8.212 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.920 -6.077 6.603 1.00 0.00 H new ATOM 0 HG21 THR A 27 3.113 -3.686 6.367 1.00 0.00 H new ATOM 0 HG22 THR A 27 3.265 -2.753 7.875 1.00 0.00 H new ATOM 0 HG23 THR A 27 4.609 -3.783 7.327 1.00 0.00 H new ATOM 439 N ILE A 28 5.409 -6.371 9.496 1.00 0.00 N ATOM 440 CA ILE A 28 6.855 -6.727 9.422 1.00 0.00 C ATOM 441 C ILE A 28 7.623 -6.025 10.548 1.00 0.00 C ATOM 442 O ILE A 28 7.888 -6.606 11.580 1.00 0.00 O ATOM 443 CB ILE A 28 7.427 -6.316 8.058 1.00 0.00 C ATOM 444 CG1 ILE A 28 6.442 -6.699 6.944 1.00 0.00 C ATOM 445 CG2 ILE A 28 8.762 -7.031 7.820 1.00 0.00 C ATOM 446 CD1 ILE A 28 6.011 -8.163 7.097 1.00 0.00 C ATOM 0 H ILE A 28 4.774 -7.169 9.528 1.00 0.00 H new ATOM 0 HA ILE A 28 6.963 -7.805 9.539 1.00 0.00 H new ATOM 0 HB ILE A 28 7.584 -5.237 8.049 1.00 0.00 H new ATOM 0 HG12 ILE A 28 5.568 -6.049 6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.908 -6.549 5.970 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.165 -6.737 6.851 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.467 -6.756 8.605 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.605 -8.110 7.835 1.00 0.00 H new ATOM 0 HD11 ILE A 28 5.313 -8.422 6.301 1.00 0.00 H new ATOM 0 HD12 ILE A 28 6.887 -8.809 7.035 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.526 -8.301 8.064 1.00 0.00 H new ATOM 458 N GLN A 29 7.988 -4.786 10.362 1.00 0.00 N ATOM 459 CA GLN A 29 8.738 -4.071 11.430 1.00 0.00 C ATOM 460 C GLN A 29 8.705 -2.565 11.165 1.00 0.00 C ATOM 461 O GLN A 29 9.722 -1.900 11.167 1.00 0.00 O ATOM 462 CB GLN A 29 10.186 -4.566 11.451 1.00 0.00 C ATOM 463 CG GLN A 29 10.802 -4.432 10.056 1.00 0.00 C ATOM 464 CD GLN A 29 12.169 -5.118 10.043 1.00 0.00 C ATOM 465 OE1 GLN A 29 12.688 -5.478 11.082 1.00 0.00 O ATOM 466 NE2 GLN A 29 12.776 -5.321 8.908 1.00 0.00 N ATOM 0 H GLN A 29 7.800 -4.241 9.521 1.00 0.00 H new ATOM 0 HA GLN A 29 8.275 -4.270 12.396 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.766 -3.989 12.171 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.219 -5.606 11.775 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.147 -4.885 9.311 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.907 -3.380 9.791 1.00 0.00 H new ATOM 0 HE21 GLN A 29 12.341 -5.019 8.036 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.686 -5.782 8.892 1.00 0.00 H new ATOM 475 N GLY A 30 7.541 -2.017 10.945 1.00 0.00 N ATOM 476 CA GLY A 30 7.445 -0.551 10.690 1.00 0.00 C ATOM 477 C GLY A 30 5.975 -0.133 10.677 1.00 0.00 C ATOM 478 O GLY A 30 5.093 -0.932 10.421 1.00 0.00 O ATOM 0 H GLY A 30 6.654 -2.520 10.931 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.984 -0.001 11.461 1.00 0.00 H new ATOM 0 HA3 GLY A 30 7.913 -0.305 9.737 1.00 0.00 H new ATOM 482 N VAL A 31 5.701 1.114 10.965 1.00 0.00 N ATOM 483 CA VAL A 31 4.285 1.591 10.988 1.00 0.00 C ATOM 484 C VAL A 31 3.930 2.235 9.648 1.00 0.00 C ATOM 485 O VAL A 31 4.641 3.085 9.148 1.00 0.00 O ATOM 486 CB VAL A 31 4.109 2.621 12.106 1.00 0.00 C ATOM 487 CG1 VAL A 31 2.672 3.150 12.088 1.00 0.00 C ATOM 488 CG2 VAL A 31 4.390 1.959 13.459 1.00 0.00 C ATOM 0 H VAL A 31 6.399 1.824 11.186 1.00 0.00 H new ATOM 0 HA VAL A 31 3.626 0.741 11.165 1.00 0.00 H new ATOM 0 HB VAL A 31 4.804 3.446 11.953 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.544 3.884 12.884 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.469 3.619 11.125 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.978 2.324 12.242 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.265 2.692 14.256 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.694 1.134 13.612 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.411 1.579 13.473 1.00 0.00 H new ATOM 498 N LEU A 32 2.823 1.840 9.069 1.00 0.00 N ATOM 499 CA LEU A 32 2.388 2.425 7.762 1.00 0.00 C ATOM 500 C LEU A 32 1.200 3.345 8.010 1.00 0.00 C ATOM 501 O LEU A 32 0.181 2.928 8.524 1.00 0.00 O ATOM 502 CB LEU A 32 1.966 1.295 6.811 1.00 0.00 C ATOM 503 CG LEU A 32 1.598 1.858 5.425 1.00 0.00 C ATOM 504 CD1 LEU A 32 2.826 2.492 4.752 1.00 0.00 C ATOM 505 CD2 LEU A 32 1.066 0.717 4.553 1.00 0.00 C ATOM 0 H LEU A 32 2.196 1.131 9.449 1.00 0.00 H new ATOM 0 HA LEU A 32 3.208 2.986 7.314 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.778 0.574 6.712 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.114 0.760 7.230 1.00 0.00 H new ATOM 0 HG LEU A 32 0.836 2.628 5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.544 2.883 3.775 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.202 3.305 5.373 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.604 1.738 4.630 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.802 1.104 3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.834 -0.049 4.448 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.182 0.283 5.021 1.00 0.00 H new ATOM 517 N SER A 33 1.324 4.597 7.645 1.00 0.00 N ATOM 518 CA SER A 33 0.200 5.558 7.855 1.00 0.00 C ATOM 519 C SER A 33 -0.435 5.889 6.509 1.00 0.00 C ATOM 520 O SER A 33 0.201 6.437 5.624 1.00 0.00 O ATOM 521 CB SER A 33 0.737 6.835 8.498 1.00 0.00 C ATOM 522 OG SER A 33 -0.200 7.887 8.309 1.00 0.00 O ATOM 0 H SER A 33 2.157 4.995 7.210 1.00 0.00 H new ATOM 0 HA SER A 33 -0.548 5.112 8.510 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.911 6.675 9.562 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.696 7.103 8.055 1.00 0.00 H new ATOM 0 HG SER A 33 -0.034 8.595 8.966 1.00 0.00 H new ATOM 528 N ILE A 34 -1.694 5.559 6.356 1.00 0.00 N ATOM 529 CA ILE A 34 -2.411 5.842 5.078 1.00 0.00 C ATOM 530 C ILE A 34 -3.322 7.047 5.289 1.00 0.00 C ATOM 531 O ILE A 34 -4.118 7.084 6.213 1.00 0.00 O ATOM 532 CB ILE A 34 -3.262 4.628 4.687 1.00 0.00 C ATOM 533 CG1 ILE A 34 -2.362 3.404 4.507 1.00 0.00 C ATOM 534 CG2 ILE A 34 -3.991 4.915 3.370 1.00 0.00 C ATOM 535 CD1 ILE A 34 -3.228 2.148 4.370 1.00 0.00 C ATOM 0 H ILE A 34 -2.260 5.101 7.071 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.691 6.047 4.286 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.990 4.433 5.474 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -1.737 3.526 3.622 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -1.691 3.304 5.360 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.596 4.051 3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.636 5.785 3.493 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.261 5.113 2.586 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -2.587 1.276 4.242 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -3.834 2.024 5.268 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.881 2.249 3.503 1.00 0.00 H new ATOM 547 N LYS A 35 -3.202 8.038 4.439 1.00 0.00 N ATOM 548 CA LYS A 35 -4.039 9.270 4.565 1.00 0.00 C ATOM 549 C LYS A 35 -4.846 9.462 3.280 1.00 0.00 C ATOM 550 O LYS A 35 -4.316 9.431 2.184 1.00 0.00 O ATOM 551 CB LYS A 35 -3.117 10.473 4.768 1.00 0.00 C ATOM 552 CG LYS A 35 -2.404 10.348 6.117 1.00 0.00 C ATOM 553 CD LYS A 35 -1.442 11.524 6.299 1.00 0.00 C ATOM 554 CE LYS A 35 -0.687 11.359 7.619 1.00 0.00 C ATOM 555 NZ LYS A 35 -1.640 11.495 8.755 1.00 0.00 N ATOM 0 H LYS A 35 -2.551 8.044 3.654 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.719 9.176 5.412 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.386 10.524 3.961 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.694 11.397 4.734 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.134 10.334 6.926 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.857 9.406 6.165 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -0.739 11.566 5.467 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.994 12.464 6.297 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.201 10.384 7.653 1.00 0.00 H new ATOM 0 HE3 LYS A 35 0.099 12.110 7.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.109 11.570 9.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.218 12.350 8.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -2.260 10.660 8.790 1.00 0.00 H new ATOM 569 N GLY A 36 -6.129 9.661 3.414 1.00 0.00 N ATOM 570 CA GLY A 36 -6.997 9.854 2.218 1.00 0.00 C ATOM 571 C GLY A 36 -8.406 10.220 2.691 1.00 0.00 C ATOM 572 O GLY A 36 -8.574 10.948 3.651 1.00 0.00 O ATOM 0 H GLY A 36 -6.617 9.698 4.309 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.595 10.643 1.582 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.024 8.944 1.619 1.00 0.00 H new ATOM 576 N GLU A 37 -9.426 9.719 2.037 1.00 0.00 N ATOM 577 CA GLU A 37 -10.822 10.042 2.471 1.00 0.00 C ATOM 578 C GLU A 37 -11.733 8.832 2.260 1.00 0.00 C ATOM 579 O GLU A 37 -11.509 8.013 1.389 1.00 0.00 O ATOM 580 CB GLU A 37 -11.357 11.227 1.666 1.00 0.00 C ATOM 581 CG GLU A 37 -10.581 12.488 2.044 1.00 0.00 C ATOM 582 CD GLU A 37 -11.223 13.705 1.377 1.00 0.00 C ATOM 583 OE1 GLU A 37 -12.174 13.517 0.637 1.00 0.00 O ATOM 584 OE2 GLU A 37 -10.758 14.806 1.623 1.00 0.00 O ATOM 0 H GLU A 37 -9.354 9.104 1.226 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.807 10.300 3.530 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.256 11.031 0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.419 11.367 1.866 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -10.577 12.614 3.127 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -9.541 12.395 1.730 1.00 0.00 H new ATOM 591 N LYS A 38 -12.764 8.719 3.058 1.00 0.00 N ATOM 592 CA LYS A 38 -13.707 7.572 2.929 1.00 0.00 C ATOM 593 C LYS A 38 -12.939 6.256 3.054 1.00 0.00 C ATOM 594 O LYS A 38 -13.171 5.324 2.316 1.00 0.00 O ATOM 595 CB LYS A 38 -14.410 7.621 1.569 1.00 0.00 C ATOM 596 CG LYS A 38 -15.084 8.985 1.372 1.00 0.00 C ATOM 597 CD LYS A 38 -16.212 9.172 2.394 1.00 0.00 C ATOM 598 CE LYS A 38 -17.139 10.299 1.934 1.00 0.00 C ATOM 599 NZ LYS A 38 -16.381 11.581 1.903 1.00 0.00 N ATOM 0 H LYS A 38 -12.993 9.380 3.800 1.00 0.00 H new ATOM 0 HA LYS A 38 -14.452 7.637 3.722 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.688 7.445 0.771 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -15.154 6.827 1.507 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.348 9.782 1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.484 9.058 0.361 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.776 8.245 2.503 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.794 9.408 3.373 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.538 10.076 0.945 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.990 10.383 2.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -17.046 12.375 1.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -15.840 11.686 2.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -15.727 11.578 1.094 1.00 0.00 H new ATOM 613 N LEU A 39 -12.037 6.173 3.995 1.00 0.00 N ATOM 614 CA LEU A 39 -11.260 4.912 4.180 1.00 0.00 C ATOM 615 C LEU A 39 -12.173 3.861 4.819 1.00 0.00 C ATOM 616 O LEU A 39 -12.041 3.531 5.981 1.00 0.00 O ATOM 617 CB LEU A 39 -10.059 5.186 5.099 1.00 0.00 C ATOM 618 CG LEU A 39 -8.926 5.826 4.293 1.00 0.00 C ATOM 619 CD1 LEU A 39 -9.436 7.096 3.613 1.00 0.00 C ATOM 620 CD2 LEU A 39 -7.769 6.183 5.231 1.00 0.00 C ATOM 0 H LEU A 39 -11.804 6.924 4.644 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.898 4.548 3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.356 5.846 5.914 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.716 4.256 5.551 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.579 5.122 3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.628 7.551 3.039 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.259 6.845 2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.784 7.799 4.370 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.962 6.639 4.657 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.118 6.886 5.988 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.402 5.279 5.717 1.00 0.00 H new ATOM 632 N GLY A 40 -13.113 3.346 4.070 1.00 0.00 N ATOM 633 CA GLY A 40 -14.052 2.329 4.639 1.00 0.00 C ATOM 634 C GLY A 40 -13.444 0.928 4.536 1.00 0.00 C ATOM 635 O GLY A 40 -12.877 0.558 3.528 1.00 0.00 O ATOM 0 H GLY A 40 -13.272 3.584 3.091 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -14.265 2.564 5.682 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -15.001 2.361 4.104 1.00 0.00 H new ATOM 639 N LEU A 46 -13.623 -12.358 7.964 1.00 0.00 N ATOM 640 CA LEU A 46 -12.422 -12.604 8.814 1.00 0.00 C ATOM 641 C LEU A 46 -11.502 -13.621 8.130 1.00 0.00 C ATOM 642 O LEU A 46 -10.292 -13.509 8.185 1.00 0.00 O ATOM 643 CB LEU A 46 -12.871 -13.140 10.177 1.00 0.00 C ATOM 644 CG LEU A 46 -11.657 -13.445 11.068 1.00 0.00 C ATOM 645 CD1 LEU A 46 -10.787 -12.189 11.239 1.00 0.00 C ATOM 646 CD2 LEU A 46 -12.159 -13.914 12.437 1.00 0.00 C ATOM 0 HA LEU A 46 -11.875 -11.672 8.953 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -13.513 -12.408 10.667 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -13.464 -14.044 10.040 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.052 -14.223 10.602 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.932 -12.423 11.873 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.435 -11.855 10.263 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -11.377 -11.398 11.703 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.308 -14.134 13.081 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -12.764 -13.129 12.891 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -12.763 -14.813 12.315 1.00 0.00 H new ATOM 658 N LYS A 47 -12.075 -14.621 7.508 1.00 0.00 N ATOM 659 CA LYS A 47 -11.266 -15.681 6.825 1.00 0.00 C ATOM 660 C LYS A 47 -10.025 -15.080 6.159 1.00 0.00 C ATOM 661 O LYS A 47 -10.025 -13.945 5.727 1.00 0.00 O ATOM 662 CB LYS A 47 -12.126 -16.364 5.760 1.00 0.00 C ATOM 663 CG LYS A 47 -11.349 -17.528 5.144 1.00 0.00 C ATOM 664 CD LYS A 47 -12.239 -18.266 4.144 1.00 0.00 C ATOM 665 CE LYS A 47 -11.468 -19.447 3.554 1.00 0.00 C ATOM 666 NZ LYS A 47 -10.259 -18.942 2.843 1.00 0.00 N ATOM 0 H LYS A 47 -13.085 -14.751 7.443 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.943 -16.405 7.573 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -13.053 -16.727 6.204 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -12.402 -15.648 4.986 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -10.454 -17.157 4.645 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -11.018 -18.212 5.926 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.145 -18.619 4.637 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.552 -17.588 3.350 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.176 -20.137 4.346 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -12.104 -20.003 2.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -9.945 -19.649 2.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -10.490 -18.054 2.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -9.498 -18.771 3.531 1.00 0.00 H new ATOM 680 N ALA A 48 -8.964 -15.841 6.091 1.00 0.00 N ATOM 681 CA ALA A 48 -7.703 -15.340 5.470 1.00 0.00 C ATOM 682 C ALA A 48 -7.163 -14.157 6.276 1.00 0.00 C ATOM 683 O ALA A 48 -6.063 -13.696 6.052 1.00 0.00 O ATOM 684 CB ALA A 48 -7.963 -14.900 4.024 1.00 0.00 C ATOM 0 H ALA A 48 -8.917 -16.797 6.443 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.968 -16.145 5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -7.035 -14.537 3.582 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -8.332 -15.748 3.447 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -8.706 -14.103 4.014 1.00 0.00 H new ATOM 690 N GLY A 49 -7.922 -13.660 7.216 1.00 0.00 N ATOM 691 CA GLY A 49 -7.431 -12.510 8.023 1.00 0.00 C ATOM 692 C GLY A 49 -6.964 -11.397 7.083 1.00 0.00 C ATOM 693 O GLY A 49 -6.103 -10.610 7.418 1.00 0.00 O ATOM 0 H GLY A 49 -8.853 -13.999 7.457 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.224 -12.143 8.675 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.610 -12.826 8.667 1.00 0.00 H new ATOM 697 N GLN A 50 -7.525 -11.331 5.904 1.00 0.00 N ATOM 698 CA GLN A 50 -7.116 -10.272 4.934 1.00 0.00 C ATOM 699 C GLN A 50 -8.045 -9.072 5.094 1.00 0.00 C ATOM 700 O GLN A 50 -9.172 -9.206 5.529 1.00 0.00 O ATOM 701 CB GLN A 50 -7.237 -10.820 3.509 1.00 0.00 C ATOM 702 CG GLN A 50 -6.773 -9.769 2.498 1.00 0.00 C ATOM 703 CD GLN A 50 -6.856 -10.356 1.089 1.00 0.00 C ATOM 704 OE1 GLN A 50 -7.931 -10.639 0.595 1.00 0.00 O ATOM 705 NE2 GLN A 50 -5.755 -10.580 0.425 1.00 0.00 N ATOM 0 H GLN A 50 -8.250 -11.966 5.570 1.00 0.00 H new ATOM 0 HA GLN A 50 -6.085 -9.971 5.123 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.636 -11.724 3.407 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -8.271 -11.100 3.306 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.396 -8.877 2.571 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.750 -9.462 2.718 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.853 -10.343 0.838 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.796 -10.992 -0.507 1.00 0.00 H new ATOM 714 N VAL A 51 -7.584 -7.896 4.751 1.00 0.00 N ATOM 715 CA VAL A 51 -8.441 -6.677 4.885 1.00 0.00 C ATOM 716 C VAL A 51 -8.323 -5.838 3.614 1.00 0.00 C ATOM 717 O VAL A 51 -7.375 -5.962 2.865 1.00 0.00 O ATOM 718 CB VAL A 51 -7.963 -5.851 6.082 1.00 0.00 C ATOM 719 CG1 VAL A 51 -8.164 -6.649 7.372 1.00 0.00 C ATOM 720 CG2 VAL A 51 -6.476 -5.526 5.915 1.00 0.00 C ATOM 0 H VAL A 51 -6.648 -7.726 4.383 1.00 0.00 H new ATOM 0 HA VAL A 51 -9.479 -6.973 5.036 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.538 -4.926 6.134 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.823 -6.058 8.222 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -9.222 -6.883 7.494 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.591 -7.575 7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.134 -4.938 6.767 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.905 -6.453 5.861 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.329 -4.956 4.998 1.00 0.00 H new ATOM 730 N GLU A 52 -9.277 -4.977 3.372 1.00 0.00 N ATOM 731 CA GLU A 52 -9.224 -4.113 2.155 1.00 0.00 C ATOM 732 C GLU A 52 -9.659 -2.700 2.534 1.00 0.00 C ATOM 733 O GLU A 52 -10.492 -2.506 3.396 1.00 0.00 O ATOM 734 CB GLU A 52 -10.152 -4.671 1.072 1.00 0.00 C ATOM 735 CG GLU A 52 -9.646 -6.047 0.625 1.00 0.00 C ATOM 736 CD GLU A 52 -10.486 -6.541 -0.554 1.00 0.00 C ATOM 737 OE1 GLU A 52 -10.399 -5.939 -1.612 1.00 0.00 O ATOM 738 OE2 GLU A 52 -11.201 -7.515 -0.382 1.00 0.00 O ATOM 0 H GLU A 52 -10.093 -4.835 3.967 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.207 -4.094 1.764 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -11.169 -4.753 1.456 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.186 -3.990 0.221 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.597 -5.984 0.337 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.708 -6.755 1.451 1.00 0.00 H new ATOM 745 N VAL A 53 -9.084 -1.711 1.898 1.00 0.00 N ATOM 746 CA VAL A 53 -9.432 -0.290 2.210 1.00 0.00 C ATOM 747 C VAL A 53 -9.909 0.402 0.933 1.00 0.00 C ATOM 748 O VAL A 53 -9.313 0.267 -0.117 1.00 0.00 O ATOM 749 CB VAL A 53 -8.186 0.425 2.746 1.00 0.00 C ATOM 750 CG1 VAL A 53 -8.455 1.929 2.861 1.00 0.00 C ATOM 751 CG2 VAL A 53 -7.831 -0.139 4.124 1.00 0.00 C ATOM 0 H VAL A 53 -8.381 -1.828 1.168 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.223 -0.257 2.959 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.355 0.264 2.059 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.565 2.430 3.242 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.704 2.330 1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.287 2.099 3.544 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.945 0.368 4.507 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.665 0.020 4.808 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.630 -1.207 4.039 1.00 0.00 H new ATOM 761 N GLU A 54 -10.980 1.148 1.025 1.00 0.00 N ATOM 762 CA GLU A 54 -11.523 1.868 -0.167 1.00 0.00 C ATOM 763 C GLU A 54 -11.431 3.370 0.097 1.00 0.00 C ATOM 764 O GLU A 54 -11.812 3.847 1.147 1.00 0.00 O ATOM 765 CB GLU A 54 -12.991 1.455 -0.378 1.00 0.00 C ATOM 766 CG GLU A 54 -13.885 2.080 0.703 1.00 0.00 C ATOM 767 CD GLU A 54 -15.279 1.455 0.641 1.00 0.00 C ATOM 768 OE1 GLU A 54 -15.535 0.712 -0.293 1.00 0.00 O ATOM 769 OE2 GLU A 54 -16.068 1.728 1.529 1.00 0.00 O ATOM 0 H GLU A 54 -11.508 1.291 1.886 1.00 0.00 H new ATOM 0 HA GLU A 54 -10.954 1.618 -1.062 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -13.327 1.774 -1.365 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.078 0.369 -0.347 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -13.447 1.920 1.688 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.952 3.158 0.555 1.00 0.00 H new ATOM 776 N GLY A 55 -10.923 4.120 -0.842 1.00 0.00 N ATOM 777 CA GLY A 55 -10.802 5.592 -0.638 1.00 0.00 C ATOM 778 C GLY A 55 -9.718 6.144 -1.563 1.00 0.00 C ATOM 779 O GLY A 55 -9.022 5.403 -2.230 1.00 0.00 O ATOM 0 H GLY A 55 -10.586 3.778 -1.742 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.755 6.079 -0.845 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.553 5.807 0.401 1.00 0.00 H new ATOM 783 N LEU A 56 -9.569 7.442 -1.613 1.00 0.00 N ATOM 784 CA LEU A 56 -8.529 8.052 -2.496 1.00 0.00 C ATOM 785 C LEU A 56 -7.269 8.352 -1.680 1.00 0.00 C ATOM 786 O LEU A 56 -7.311 9.042 -0.683 1.00 0.00 O ATOM 787 CB LEU A 56 -9.081 9.349 -3.107 1.00 0.00 C ATOM 788 CG LEU A 56 -9.379 10.403 -2.003 1.00 0.00 C ATOM 789 CD1 LEU A 56 -8.242 11.437 -1.929 1.00 0.00 C ATOM 790 CD2 LEU A 56 -10.695 11.134 -2.317 1.00 0.00 C ATOM 0 H LEU A 56 -10.125 8.109 -1.078 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.273 7.356 -3.295 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.361 9.755 -3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.993 9.133 -3.664 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.462 9.885 -1.048 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.465 12.168 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.305 10.932 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.149 11.945 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -10.897 11.870 -1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -10.611 11.637 -3.280 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.512 10.413 -2.355 1.00 0.00 H new ATOM 802 N ILE A 57 -6.145 7.838 -2.101 1.00 0.00 N ATOM 803 CA ILE A 57 -4.877 8.096 -1.358 1.00 0.00 C ATOM 804 C ILE A 57 -4.348 9.482 -1.730 1.00 0.00 C ATOM 805 O ILE A 57 -4.218 9.816 -2.891 1.00 0.00 O ATOM 806 CB ILE A 57 -3.846 7.015 -1.719 1.00 0.00 C ATOM 807 CG1 ILE A 57 -4.215 5.717 -0.991 1.00 0.00 C ATOM 808 CG2 ILE A 57 -2.435 7.458 -1.310 1.00 0.00 C ATOM 809 CD1 ILE A 57 -3.359 4.560 -1.511 1.00 0.00 C ATOM 0 H ILE A 57 -6.050 7.250 -2.929 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.061 8.063 -0.284 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.855 6.854 -2.797 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -4.064 5.837 0.082 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.271 5.494 -1.142 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.719 6.680 -1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.178 8.380 -1.832 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.405 7.629 -0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.629 3.643 -0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.531 4.432 -2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.306 4.780 -1.337 1.00 0.00 H new ATOM 821 N ASP A 58 -4.042 10.290 -0.741 1.00 0.00 N ATOM 822 CA ASP A 58 -3.514 11.663 -1.006 1.00 0.00 C ATOM 823 C ASP A 58 -2.109 11.785 -0.405 1.00 0.00 C ATOM 824 O ASP A 58 -1.290 12.553 -0.874 1.00 0.00 O ATOM 825 CB ASP A 58 -4.453 12.700 -0.364 1.00 0.00 C ATOM 826 CG ASP A 58 -4.330 14.043 -1.093 1.00 0.00 C ATOM 827 OD1 ASP A 58 -3.411 14.185 -1.884 1.00 0.00 O ATOM 828 OD2 ASP A 58 -5.163 14.902 -0.854 1.00 0.00 O ATOM 0 H ASP A 58 -4.137 10.052 0.246 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.463 11.843 -2.080 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.483 12.346 -0.408 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -4.204 12.825 0.690 1.00 0.00 H new ATOM 833 N ALA A 59 -1.817 11.035 0.631 1.00 0.00 N ATOM 834 CA ALA A 59 -0.456 11.125 1.247 1.00 0.00 C ATOM 835 C ALA A 59 -0.084 9.799 1.928 1.00 0.00 C ATOM 836 O ALA A 59 -0.921 9.100 2.467 1.00 0.00 O ATOM 837 CB ALA A 59 -0.440 12.262 2.276 1.00 0.00 C ATOM 0 H ALA A 59 -2.454 10.372 1.072 1.00 0.00 H new ATOM 0 HA ALA A 59 0.275 11.327 0.465 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.550 12.331 2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.680 13.203 1.782 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.179 12.061 3.052 1.00 0.00 H new ATOM 843 N LEU A 60 1.185 9.463 1.911 1.00 0.00 N ATOM 844 CA LEU A 60 1.667 8.198 2.555 1.00 0.00 C ATOM 845 C LEU A 60 2.918 8.533 3.382 1.00 0.00 C ATOM 846 O LEU A 60 3.802 9.228 2.922 1.00 0.00 O ATOM 847 CB LEU A 60 2.021 7.165 1.451 1.00 0.00 C ATOM 848 CG LEU A 60 1.016 5.990 1.433 1.00 0.00 C ATOM 849 CD1 LEU A 60 1.123 5.171 2.737 1.00 0.00 C ATOM 850 CD2 LEU A 60 -0.419 6.522 1.246 1.00 0.00 C ATOM 0 H LEU A 60 1.918 10.020 1.472 1.00 0.00 H new ATOM 0 HA LEU A 60 0.897 7.774 3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.025 7.657 0.478 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.028 6.782 1.619 1.00 0.00 H new ATOM 0 HG LEU A 60 1.257 5.336 0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.409 4.348 2.709 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.133 4.773 2.835 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.902 5.814 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.118 5.686 1.235 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.668 7.193 2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.486 7.064 0.303 1.00 0.00 H new ATOM 862 N VAL A 61 2.997 8.048 4.599 1.00 0.00 N ATOM 863 CA VAL A 61 4.192 8.344 5.457 1.00 0.00 C ATOM 864 C VAL A 61 4.735 7.045 6.063 1.00 0.00 C ATOM 865 O VAL A 61 4.032 6.324 6.748 1.00 0.00 O ATOM 866 CB VAL A 61 3.769 9.290 6.584 1.00 0.00 C ATOM 867 CG1 VAL A 61 4.963 9.578 7.500 1.00 0.00 C ATOM 868 CG2 VAL A 61 3.263 10.601 5.973 1.00 0.00 C ATOM 0 H VAL A 61 2.287 7.460 5.036 1.00 0.00 H new ATOM 0 HA VAL A 61 4.971 8.807 4.850 1.00 0.00 H new ATOM 0 HB VAL A 61 2.977 8.825 7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.654 10.252 8.299 1.00 0.00 H new ATOM 0 HG12 VAL A 61 5.324 8.644 7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.761 10.043 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.960 11.280 6.770 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.059 11.061 5.388 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.410 10.396 5.327 1.00 0.00 H new ATOM 878 N TYR A 62 5.990 6.749 5.827 1.00 0.00 N ATOM 879 CA TYR A 62 6.603 5.512 6.402 1.00 0.00 C ATOM 880 C TYR A 62 8.083 5.800 6.708 1.00 0.00 C ATOM 881 O TYR A 62 8.759 6.418 5.909 1.00 0.00 O ATOM 882 CB TYR A 62 6.511 4.370 5.384 1.00 0.00 C ATOM 883 CG TYR A 62 7.137 3.124 5.968 1.00 0.00 C ATOM 884 CD1 TYR A 62 8.519 2.920 5.878 1.00 0.00 C ATOM 885 CD2 TYR A 62 6.332 2.172 6.602 1.00 0.00 C ATOM 886 CE1 TYR A 62 9.092 1.762 6.422 1.00 0.00 C ATOM 887 CE2 TYR A 62 6.904 1.017 7.144 1.00 0.00 C ATOM 888 CZ TYR A 62 8.283 0.812 7.055 1.00 0.00 C ATOM 889 OH TYR A 62 8.846 -0.330 7.587 1.00 0.00 O ATOM 0 H TYR A 62 6.619 7.315 5.257 1.00 0.00 H new ATOM 0 HA TYR A 62 6.076 5.224 7.312 1.00 0.00 H new ATOM 0 HB2 TYR A 62 5.469 4.180 5.127 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.021 4.648 4.462 1.00 0.00 H new ATOM 0 HD1 TYR A 62 9.143 3.654 5.390 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.266 2.329 6.673 1.00 0.00 H new ATOM 0 HE1 TYR A 62 10.158 1.603 6.352 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.280 0.283 7.632 1.00 0.00 H new ATOM 0 HH TYR A 62 9.763 -0.139 7.875 1.00 0.00 H new ATOM 899 N PRO A 63 8.607 5.358 7.830 1.00 0.00 N ATOM 900 CA PRO A 63 10.040 5.599 8.168 1.00 0.00 C ATOM 901 C PRO A 63 10.968 4.693 7.352 1.00 0.00 C ATOM 902 O PRO A 63 10.938 3.486 7.479 1.00 0.00 O ATOM 903 CB PRO A 63 10.120 5.263 9.664 1.00 0.00 C ATOM 904 CG PRO A 63 9.031 4.263 9.893 1.00 0.00 C ATOM 905 CD PRO A 63 7.916 4.600 8.894 1.00 0.00 C ATOM 0 HA PRO A 63 10.357 6.617 7.942 1.00 0.00 H new ATOM 0 HB2 PRO A 63 11.095 4.852 9.925 1.00 0.00 H new ATOM 0 HB3 PRO A 63 9.975 6.153 10.277 1.00 0.00 H new ATOM 0 HG2 PRO A 63 9.397 3.248 9.739 1.00 0.00 H new ATOM 0 HG3 PRO A 63 8.664 4.317 10.918 1.00 0.00 H new ATOM 0 HD2 PRO A 63 7.446 3.698 8.501 1.00 0.00 H new ATOM 0 HD3 PRO A 63 7.129 5.193 9.360 1.00 0.00 H new ATOM 913 N LEU A 64 11.798 5.266 6.520 1.00 0.00 N ATOM 914 CA LEU A 64 12.729 4.433 5.704 1.00 0.00 C ATOM 915 C LEU A 64 14.005 4.217 6.500 1.00 0.00 C ATOM 916 O LEU A 64 15.093 4.228 5.961 1.00 0.00 O ATOM 917 CB LEU A 64 13.065 5.113 4.356 1.00 0.00 C ATOM 918 CG LEU A 64 13.029 6.650 4.464 1.00 0.00 C ATOM 919 CD1 LEU A 64 11.580 7.172 4.637 1.00 0.00 C ATOM 920 CD2 LEU A 64 13.937 7.103 5.628 1.00 0.00 C ATOM 0 H LEU A 64 11.871 6.272 6.371 1.00 0.00 H new ATOM 0 HA LEU A 64 12.247 3.481 5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.054 4.795 4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.355 4.785 3.597 1.00 0.00 H new ATOM 0 HG LEU A 64 13.407 7.079 3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.591 8.259 4.710 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.980 6.872 3.778 1.00 0.00 H new ATOM 0 HD13 LEU A 64 11.148 6.752 5.545 1.00 0.00 H new ATOM 0 HD21 LEU A 64 13.913 8.190 5.706 1.00 0.00 H new ATOM 0 HD22 LEU A 64 13.580 6.664 6.560 1.00 0.00 H new ATOM 0 HD23 LEU A 64 14.959 6.775 5.441 1.00 0.00 H new ATOM 932 N GLU A 65 13.887 3.996 7.777 1.00 0.00 N ATOM 933 CA GLU A 65 15.102 3.754 8.595 1.00 0.00 C ATOM 934 C GLU A 65 16.018 4.989 8.505 1.00 0.00 C ATOM 935 O GLU A 65 16.248 5.544 7.448 1.00 0.00 O ATOM 936 CB GLU A 65 15.771 2.432 8.079 1.00 0.00 C ATOM 937 CG GLU A 65 17.326 2.452 8.106 1.00 0.00 C ATOM 938 CD GLU A 65 17.870 1.789 9.392 1.00 0.00 C ATOM 939 OE1 GLU A 65 17.134 1.048 10.027 1.00 0.00 O ATOM 940 OE2 GLU A 65 19.024 2.023 9.710 1.00 0.00 O ATOM 0 H GLU A 65 13.004 3.973 8.288 1.00 0.00 H new ATOM 0 HA GLU A 65 14.874 3.616 9.652 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.419 1.599 8.687 1.00 0.00 H new ATOM 0 HB3 GLU A 65 15.439 2.244 7.058 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.714 1.930 7.232 1.00 0.00 H new ATOM 0 HG3 GLU A 65 17.680 3.481 8.046 1.00 0.00 H new ATOM 947 N HIS A 66 16.560 5.409 9.614 1.00 0.00 N ATOM 948 CA HIS A 66 17.485 6.582 9.613 1.00 0.00 C ATOM 949 C HIS A 66 18.249 6.579 10.936 1.00 0.00 C ATOM 950 O HIS A 66 18.190 5.627 11.688 1.00 0.00 O ATOM 951 CB HIS A 66 16.702 7.901 9.453 1.00 0.00 C ATOM 952 CG HIS A 66 17.631 8.966 8.916 1.00 0.00 C ATOM 953 ND1 HIS A 66 17.918 10.135 9.611 1.00 0.00 N ATOM 954 CD2 HIS A 66 18.374 9.027 7.760 1.00 0.00 C ATOM 955 CE1 HIS A 66 18.802 10.839 8.874 1.00 0.00 C ATOM 956 NE2 HIS A 66 19.111 10.204 7.742 1.00 0.00 N ATOM 0 H HIS A 66 16.402 4.988 10.529 1.00 0.00 H new ATOM 0 HA HIS A 66 18.175 6.507 8.773 1.00 0.00 H new ATOM 0 HB2 HIS A 66 15.861 7.759 8.775 1.00 0.00 H new ATOM 0 HB3 HIS A 66 16.289 8.212 10.413 1.00 0.00 H new ATOM 0 HD2 HIS A 66 18.383 8.275 6.985 1.00 0.00 H new ATOM 0 HE1 HIS A 66 19.209 11.797 9.164 1.00 0.00 H new ATOM 0 HE2 HIS A 66 19.754 10.518 7.015 1.00 0.00 H new ATOM 964 N HIS A 67 18.968 7.625 11.234 1.00 0.00 N ATOM 965 CA HIS A 67 19.732 7.655 12.518 1.00 0.00 C ATOM 966 C HIS A 67 19.791 9.085 13.049 1.00 0.00 C ATOM 967 O HIS A 67 19.927 10.032 12.302 1.00 0.00 O ATOM 968 CB HIS A 67 21.152 7.146 12.269 1.00 0.00 C ATOM 969 CG HIS A 67 21.870 7.013 13.583 1.00 0.00 C ATOM 970 ND1 HIS A 67 21.198 7.023 14.796 1.00 0.00 N ATOM 971 CD2 HIS A 67 23.202 6.870 13.891 1.00 0.00 C ATOM 972 CE1 HIS A 67 22.117 6.891 15.772 1.00 0.00 C ATOM 973 NE2 HIS A 67 23.351 6.794 15.273 1.00 0.00 N ATOM 0 H HIS A 67 19.061 8.456 10.650 1.00 0.00 H new ATOM 0 HA HIS A 67 19.236 7.020 13.252 1.00 0.00 H new ATOM 0 HB2 HIS A 67 21.121 6.183 11.759 1.00 0.00 H new ATOM 0 HB3 HIS A 67 21.688 7.835 11.617 1.00 0.00 H new ATOM 0 HD2 HIS A 67 24.007 6.824 13.173 1.00 0.00 H new ATOM 0 HE1 HIS A 67 21.884 6.867 16.826 1.00 0.00 H new ATOM 0 HE2 HIS A 67 24.221 6.687 15.795 1.00 0.00 H new ATOM 981 N HIS A 68 19.693 9.248 14.337 1.00 0.00 N ATOM 982 CA HIS A 68 19.749 10.616 14.917 1.00 0.00 C ATOM 983 C HIS A 68 21.209 11.076 14.936 1.00 0.00 C ATOM 984 O HIS A 68 22.098 10.326 15.287 1.00 0.00 O ATOM 985 CB HIS A 68 19.190 10.576 16.339 1.00 0.00 C ATOM 986 CG HIS A 68 17.851 9.890 16.311 1.00 0.00 C ATOM 987 ND1 HIS A 68 17.731 8.511 16.202 1.00 0.00 N ATOM 988 CD2 HIS A 68 16.565 10.374 16.356 1.00 0.00 C ATOM 989 CE1 HIS A 68 16.418 8.216 16.182 1.00 0.00 C ATOM 990 NE2 HIS A 68 15.668 9.315 16.273 1.00 0.00 N ATOM 0 H HIS A 68 19.577 8.493 15.013 1.00 0.00 H new ATOM 0 HA HIS A 68 19.157 11.311 14.322 1.00 0.00 H new ATOM 0 HB2 HIS A 68 19.874 10.043 16.999 1.00 0.00 H new ATOM 0 HB3 HIS A 68 19.089 11.587 16.734 1.00 0.00 H new ATOM 0 HD2 HIS A 68 16.294 11.416 16.442 1.00 0.00 H new ATOM 0 HE1 HIS A 68 16.021 7.215 16.102 1.00 0.00 H new ATOM 0 HE2 HIS A 68 14.649 9.368 16.280 1.00 0.00 H new ATOM 998 N HIS A 69 21.473 12.297 14.546 1.00 0.00 N ATOM 999 CA HIS A 69 22.887 12.791 14.526 1.00 0.00 C ATOM 1000 C HIS A 69 23.199 13.527 15.836 1.00 0.00 C ATOM 1001 O HIS A 69 22.505 14.443 16.233 1.00 0.00 O ATOM 1002 CB HIS A 69 23.075 13.740 13.327 1.00 0.00 C ATOM 1003 CG HIS A 69 23.365 12.938 12.084 1.00 0.00 C ATOM 1004 ND1 HIS A 69 24.651 12.792 11.581 1.00 0.00 N ATOM 1005 CD2 HIS A 69 22.551 12.214 11.245 1.00 0.00 C ATOM 1006 CE1 HIS A 69 24.575 12.008 10.490 1.00 0.00 C ATOM 1007 NE2 HIS A 69 23.320 11.629 10.244 1.00 0.00 N ATOM 0 H HIS A 69 20.773 12.974 14.241 1.00 0.00 H new ATOM 0 HA HIS A 69 23.569 11.947 14.428 1.00 0.00 H new ATOM 0 HB2 HIS A 69 22.177 14.341 13.182 1.00 0.00 H new ATOM 0 HB3 HIS A 69 23.894 14.432 13.524 1.00 0.00 H new ATOM 0 HD2 HIS A 69 21.480 12.115 11.347 1.00 0.00 H new ATOM 0 HE1 HIS A 69 25.425 11.721 9.888 1.00 0.00 H new ATOM 0 HE2 HIS A 69 22.993 11.035 9.482 1.00 0.00 H new ATOM 1015 N HIS A 70 24.251 13.124 16.501 1.00 0.00 N ATOM 1016 CA HIS A 70 24.642 13.778 17.786 1.00 0.00 C ATOM 1017 C HIS A 70 25.569 14.961 17.497 1.00 0.00 C ATOM 1018 O HIS A 70 25.938 15.215 16.367 1.00 0.00 O ATOM 1019 CB HIS A 70 25.387 12.767 18.663 1.00 0.00 C ATOM 1020 CG HIS A 70 24.423 11.754 19.215 1.00 0.00 C ATOM 1021 ND1 HIS A 70 24.108 11.692 20.566 1.00 0.00 N ATOM 1022 CD2 HIS A 70 23.703 10.749 18.615 1.00 0.00 C ATOM 1023 CE1 HIS A 70 23.237 10.681 20.735 1.00 0.00 C ATOM 1024 NE2 HIS A 70 22.958 10.078 19.579 1.00 0.00 N ATOM 0 H HIS A 70 24.862 12.362 16.206 1.00 0.00 H new ATOM 0 HA HIS A 70 23.747 14.128 18.300 1.00 0.00 H new ATOM 0 HB2 HIS A 70 26.159 12.266 18.079 1.00 0.00 H new ATOM 0 HB3 HIS A 70 25.891 13.284 19.480 1.00 0.00 H new ATOM 0 HD2 HIS A 70 23.714 10.517 17.560 1.00 0.00 H new ATOM 0 HE1 HIS A 70 22.816 10.394 21.687 1.00 0.00 H new ATOM 0 HE2 HIS A 70 22.329 9.289 19.432 1.00 0.00 H new ATOM 1032 N HIS A 71 25.953 15.683 18.514 1.00 0.00 N ATOM 1033 CA HIS A 71 26.864 16.843 18.304 1.00 0.00 C ATOM 1034 C HIS A 71 26.269 17.773 17.242 1.00 0.00 C ATOM 1035 O HIS A 71 27.032 18.316 16.462 1.00 0.00 O ATOM 1036 CB HIS A 71 28.235 16.329 17.841 1.00 0.00 C ATOM 1037 CG HIS A 71 29.294 17.380 18.060 1.00 0.00 C ATOM 1038 ND1 HIS A 71 30.274 17.645 17.114 1.00 0.00 N ATOM 1039 CD2 HIS A 71 29.546 18.232 19.109 1.00 0.00 C ATOM 1040 CE1 HIS A 71 31.066 18.616 17.608 1.00 0.00 C ATOM 1041 NE2 HIS A 71 30.664 19.006 18.818 1.00 0.00 N ATOM 1042 OXT HIS A 71 25.059 17.922 17.227 1.00 0.00 O ATOM 0 H HIS A 71 25.675 15.519 19.482 1.00 0.00 H new ATOM 0 HA HIS A 71 26.981 17.396 19.236 1.00 0.00 H new ATOM 0 HB2 HIS A 71 28.494 15.423 18.389 1.00 0.00 H new ATOM 0 HB3 HIS A 71 28.192 16.062 16.785 1.00 0.00 H new ATOM 0 HD2 HIS A 71 28.966 18.291 20.018 1.00 0.00 H new ATOM 0 HE1 HIS A 71 31.919 19.027 17.089 1.00 0.00 H new ATOM 0 HE2 HIS A 71 31.088 19.723 19.407 1.00 0.00 H new TER 1050 HIS A 71 ATOM 1051 N MET B 1 7.931 -15.126 11.508 1.00 0.00 N ATOM 1052 CA MET B 1 6.876 -15.871 10.765 1.00 0.00 C ATOM 1053 C MET B 1 6.944 -15.497 9.281 1.00 0.00 C ATOM 1054 O MET B 1 7.945 -15.002 8.802 1.00 0.00 O ATOM 1055 CB MET B 1 5.497 -15.505 11.330 1.00 0.00 C ATOM 1056 CG MET B 1 5.357 -13.981 11.416 1.00 0.00 C ATOM 1057 SD MET B 1 6.237 -13.372 12.879 1.00 0.00 S ATOM 1058 CE MET B 1 4.832 -13.388 14.023 1.00 0.00 C ATOM 0 H1 MET B 1 8.747 -15.750 11.672 1.00 0.00 H new ATOM 0 H2 MET B 1 8.232 -14.302 10.950 1.00 0.00 H new ATOM 0 H3 MET B 1 7.551 -14.805 12.422 1.00 0.00 H new ATOM 0 HA MET B 1 7.036 -16.944 10.876 1.00 0.00 H new ATOM 0 HB2 MET B 1 4.713 -15.916 10.694 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.370 -15.947 12.318 1.00 0.00 H new ATOM 0 HG2 MET B 1 5.761 -13.517 10.516 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.304 -13.705 11.471 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.158 -13.042 15.004 1.00 0.00 H new ATOM 0 HE2 MET B 1 4.049 -12.729 13.647 1.00 0.00 H new ATOM 0 HE3 MET B 1 4.443 -14.403 14.107 1.00 0.00 H new ATOM 1070 N ASP B 2 5.888 -15.728 8.547 1.00 0.00 N ATOM 1071 CA ASP B 2 5.898 -15.381 7.098 1.00 0.00 C ATOM 1072 C ASP B 2 5.731 -13.867 6.930 1.00 0.00 C ATOM 1073 O ASP B 2 4.726 -13.298 7.308 1.00 0.00 O ATOM 1074 CB ASP B 2 4.740 -16.094 6.398 1.00 0.00 C ATOM 1075 CG ASP B 2 4.717 -15.708 4.918 1.00 0.00 C ATOM 1076 OD1 ASP B 2 4.077 -14.719 4.596 1.00 0.00 O ATOM 1077 OD2 ASP B 2 5.340 -16.402 4.133 1.00 0.00 O ATOM 0 H ASP B 2 5.020 -16.142 8.889 1.00 0.00 H new ATOM 0 HA ASP B 2 6.845 -15.694 6.658 1.00 0.00 H new ATOM 0 HB2 ASP B 2 4.850 -17.174 6.501 1.00 0.00 H new ATOM 0 HB3 ASP B 2 3.795 -15.823 6.869 1.00 0.00 H new ATOM 1082 N ASN B 3 6.707 -13.213 6.357 1.00 0.00 N ATOM 1083 CA ASN B 3 6.614 -11.734 6.150 1.00 0.00 C ATOM 1084 C ASN B 3 6.137 -11.458 4.727 1.00 0.00 C ATOM 1085 O ASN B 3 6.099 -10.329 4.278 1.00 0.00 O ATOM 1086 CB ASN B 3 7.997 -11.112 6.343 1.00 0.00 C ATOM 1087 CG ASN B 3 9.030 -11.921 5.563 1.00 0.00 C ATOM 1088 OD1 ASN B 3 8.980 -13.134 5.535 1.00 0.00 O ATOM 1089 ND2 ASN B 3 9.972 -11.294 4.922 1.00 0.00 N ATOM 0 H ASN B 3 7.570 -13.641 6.021 1.00 0.00 H new ATOM 0 HA ASN B 3 5.913 -11.305 6.866 1.00 0.00 H new ATOM 0 HB2 ASN B 3 7.994 -10.078 5.999 1.00 0.00 H new ATOM 0 HB3 ASN B 3 8.256 -11.095 7.402 1.00 0.00 H new ATOM 0 HD21 ASN B 3 10.669 -11.821 4.396 1.00 0.00 H new ATOM 0 HD22 ASN B 3 10.014 -10.275 4.946 1.00 0.00 H new ATOM 1096 N ARG B 4 5.781 -12.486 4.009 1.00 0.00 N ATOM 1097 CA ARG B 4 5.316 -12.294 2.611 1.00 0.00 C ATOM 1098 C ARG B 4 3.852 -11.851 2.621 1.00 0.00 C ATOM 1099 O ARG B 4 3.051 -12.338 3.394 1.00 0.00 O ATOM 1100 CB ARG B 4 5.438 -13.614 1.840 1.00 0.00 C ATOM 1101 CG ARG B 4 6.788 -14.280 2.136 1.00 0.00 C ATOM 1102 CD ARG B 4 7.930 -13.418 1.590 1.00 0.00 C ATOM 1103 NE ARG B 4 7.656 -13.072 0.170 1.00 0.00 N ATOM 1104 CZ ARG B 4 7.841 -13.966 -0.758 1.00 0.00 C ATOM 1105 NH1 ARG B 4 8.206 -15.174 -0.428 1.00 0.00 N ATOM 1106 NH2 ARG B 4 7.647 -13.659 -2.011 1.00 0.00 N ATOM 0 H ARG B 4 5.793 -13.453 4.333 1.00 0.00 H new ATOM 0 HA ARG B 4 5.929 -11.533 2.128 1.00 0.00 H new ATOM 0 HB2 ARG B 4 4.625 -14.284 2.121 1.00 0.00 H new ATOM 0 HB3 ARG B 4 5.343 -13.428 0.770 1.00 0.00 H new ATOM 0 HG2 ARG B 4 6.907 -14.417 3.211 1.00 0.00 H new ATOM 0 HG3 ARG B 4 6.821 -15.271 1.683 1.00 0.00 H new ATOM 0 HD2 ARG B 4 8.030 -12.509 2.184 1.00 0.00 H new ATOM 0 HD3 ARG B 4 8.875 -13.956 1.668 1.00 0.00 H new ATOM 0 HE ARG B 4 7.325 -12.139 -0.076 1.00 0.00 H new ATOM 0 HH11 ARG B 4 8.345 -15.415 0.553 1.00 0.00 H new ATOM 0 HH12 ARG B 4 8.352 -15.878 -1.151 1.00 0.00 H new ATOM 0 HH21 ARG B 4 7.350 -12.717 -2.265 1.00 0.00 H new ATOM 0 HH22 ARG B 4 7.793 -14.361 -2.737 1.00 0.00 H new ATOM 1120 N GLN B 5 3.493 -10.938 1.760 1.00 0.00 N ATOM 1121 CA GLN B 5 2.077 -10.470 1.710 1.00 0.00 C ATOM 1122 C GLN B 5 1.749 -9.995 0.293 1.00 0.00 C ATOM 1123 O GLN B 5 2.630 -9.733 -0.507 1.00 0.00 O ATOM 1124 CB GLN B 5 1.872 -9.327 2.708 1.00 0.00 C ATOM 1125 CG GLN B 5 2.916 -8.237 2.467 1.00 0.00 C ATOM 1126 CD GLN B 5 2.817 -7.190 3.578 1.00 0.00 C ATOM 1127 OE1 GLN B 5 2.681 -7.527 4.736 1.00 0.00 O ATOM 1128 NE2 GLN B 5 2.878 -5.924 3.272 1.00 0.00 N ATOM 0 H GLN B 5 4.119 -10.495 1.088 1.00 0.00 H new ATOM 0 HA GLN B 5 1.413 -11.292 1.976 1.00 0.00 H new ATOM 0 HB2 GLN B 5 0.869 -8.913 2.600 1.00 0.00 H new ATOM 0 HB3 GLN B 5 1.954 -9.703 3.728 1.00 0.00 H new ATOM 0 HG2 GLN B 5 3.915 -8.672 2.449 1.00 0.00 H new ATOM 0 HG3 GLN B 5 2.754 -7.770 1.496 1.00 0.00 H new ATOM 0 HE21 GLN B 5 2.992 -5.639 2.299 1.00 0.00 H new ATOM 0 HE22 GLN B 5 2.811 -5.218 4.005 1.00 0.00 H new ATOM 1137 N PHE B 6 0.482 -9.900 -0.025 1.00 0.00 N ATOM 1138 CA PHE B 6 0.065 -9.461 -1.393 1.00 0.00 C ATOM 1139 C PHE B 6 -0.425 -8.012 -1.335 1.00 0.00 C ATOM 1140 O PHE B 6 -1.024 -7.589 -0.367 1.00 0.00 O ATOM 1141 CB PHE B 6 -1.090 -10.346 -1.865 1.00 0.00 C ATOM 1142 CG PHE B 6 -0.686 -11.797 -1.780 1.00 0.00 C ATOM 1143 CD1 PHE B 6 -0.624 -12.424 -0.531 1.00 0.00 C ATOM 1144 CD2 PHE B 6 -0.384 -12.522 -2.940 1.00 0.00 C ATOM 1145 CE1 PHE B 6 -0.263 -13.770 -0.437 1.00 0.00 C ATOM 1146 CE2 PHE B 6 -0.021 -13.872 -2.847 1.00 0.00 C ATOM 1147 CZ PHE B 6 0.040 -14.496 -1.595 1.00 0.00 C ATOM 0 H PHE B 6 -0.288 -10.110 0.610 1.00 0.00 H new ATOM 0 HA PHE B 6 0.910 -9.540 -2.076 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -1.972 -10.168 -1.250 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -1.359 -10.093 -2.890 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -0.856 -11.865 0.364 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -0.431 -12.040 -3.906 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -0.218 -14.251 0.529 1.00 0.00 H new ATOM 0 HE2 PHE B 6 0.212 -14.431 -3.741 1.00 0.00 H new ATOM 0 HZ PHE B 6 0.321 -15.536 -1.523 1.00 0.00 H new ATOM 1157 N LEU B 7 -0.190 -7.255 -2.377 1.00 0.00 N ATOM 1158 CA LEU B 7 -0.653 -5.831 -2.410 1.00 0.00 C ATOM 1159 C LEU B 7 -1.339 -5.585 -3.756 1.00 0.00 C ATOM 1160 O LEU B 7 -0.748 -5.779 -4.802 1.00 0.00 O ATOM 1161 CB LEU B 7 0.560 -4.904 -2.262 1.00 0.00 C ATOM 1162 CG LEU B 7 0.105 -3.463 -1.966 1.00 0.00 C ATOM 1163 CD1 LEU B 7 1.320 -2.638 -1.528 1.00 0.00 C ATOM 1164 CD2 LEU B 7 -0.542 -2.823 -3.213 1.00 0.00 C ATOM 0 H LEU B 7 0.306 -7.563 -3.213 1.00 0.00 H new ATOM 0 HA LEU B 7 -1.350 -5.632 -1.596 1.00 0.00 H new ATOM 0 HB2 LEU B 7 1.202 -5.261 -1.457 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.154 -4.924 -3.176 1.00 0.00 H new ATOM 0 HG LEU B 7 -0.640 -3.482 -1.171 1.00 0.00 H new ATOM 0 HD11 LEU B 7 1.008 -1.615 -1.316 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.754 -3.078 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.063 -2.633 -2.326 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -0.855 -1.806 -2.979 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.182 -2.801 -4.028 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -1.410 -3.410 -3.514 1.00 0.00 H new ATOM 1176 N SER B 8 -2.583 -5.170 -3.742 1.00 0.00 N ATOM 1177 CA SER B 8 -3.325 -4.919 -5.022 1.00 0.00 C ATOM 1178 C SER B 8 -3.654 -3.435 -5.147 1.00 0.00 C ATOM 1179 O SER B 8 -3.933 -2.763 -4.174 1.00 0.00 O ATOM 1180 CB SER B 8 -4.626 -5.726 -5.016 1.00 0.00 C ATOM 1181 OG SER B 8 -5.424 -5.323 -3.912 1.00 0.00 O ATOM 0 H SER B 8 -3.121 -4.993 -2.894 1.00 0.00 H new ATOM 0 HA SER B 8 -2.704 -5.222 -5.865 1.00 0.00 H new ATOM 0 HB2 SER B 8 -5.169 -5.569 -5.948 1.00 0.00 H new ATOM 0 HB3 SER B 8 -4.406 -6.792 -4.951 1.00 0.00 H new ATOM 0 HG SER B 8 -5.196 -4.403 -3.662 1.00 0.00 H new ATOM 1187 N LEU B 9 -3.626 -2.915 -6.346 1.00 0.00 N ATOM 1188 CA LEU B 9 -3.939 -1.470 -6.548 1.00 0.00 C ATOM 1189 C LEU B 9 -4.545 -1.272 -7.944 1.00 0.00 C ATOM 1190 O LEU B 9 -4.253 -2.008 -8.872 1.00 0.00 O ATOM 1191 CB LEU B 9 -2.649 -0.643 -6.417 1.00 0.00 C ATOM 1192 CG LEU B 9 -2.995 0.836 -6.125 1.00 0.00 C ATOM 1193 CD1 LEU B 9 -3.153 1.054 -4.610 1.00 0.00 C ATOM 1194 CD2 LEU B 9 -1.876 1.747 -6.655 1.00 0.00 C ATOM 0 H LEU B 9 -3.399 -3.431 -7.196 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.654 -1.140 -5.794 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -2.030 -1.045 -5.615 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -2.067 -0.714 -7.336 1.00 0.00 H new ATOM 0 HG LEU B 9 -3.933 1.081 -6.623 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -3.396 2.099 -4.416 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -3.954 0.419 -4.233 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -2.220 0.799 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -2.125 2.788 -6.447 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -0.937 1.493 -6.164 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -1.772 1.607 -7.731 1.00 0.00 H new ATOM 1206 N THR B 10 -5.387 -0.282 -8.096 1.00 0.00 N ATOM 1207 CA THR B 10 -6.025 -0.014 -9.422 1.00 0.00 C ATOM 1208 C THR B 10 -6.237 1.492 -9.591 1.00 0.00 C ATOM 1209 O THR B 10 -6.238 2.240 -8.632 1.00 0.00 O ATOM 1210 CB THR B 10 -7.373 -0.735 -9.498 1.00 0.00 C ATOM 1211 OG1 THR B 10 -8.157 -0.165 -10.536 1.00 0.00 O ATOM 1212 CG2 THR B 10 -8.104 -0.616 -8.159 1.00 0.00 C ATOM 0 H THR B 10 -5.663 0.358 -7.352 1.00 0.00 H new ATOM 0 HA THR B 10 -5.376 -0.380 -10.218 1.00 0.00 H new ATOM 0 HB THR B 10 -7.207 -1.791 -9.713 1.00 0.00 H new ATOM 0 HG1 THR B 10 -9.020 -0.628 -10.586 1.00 0.00 H new ATOM 0 HG21 THR B 10 -9.062 -1.131 -8.221 1.00 0.00 H new ATOM 0 HG22 THR B 10 -7.499 -1.068 -7.373 1.00 0.00 H new ATOM 0 HG23 THR B 10 -8.272 0.436 -7.928 1.00 0.00 H new ATOM 1220 N GLY B 11 -6.417 1.947 -10.804 1.00 0.00 N ATOM 1221 CA GLY B 11 -6.626 3.407 -11.040 1.00 0.00 C ATOM 1222 C GLY B 11 -5.272 4.091 -11.249 1.00 0.00 C ATOM 1223 O GLY B 11 -5.165 5.300 -11.204 1.00 0.00 O ATOM 0 H GLY B 11 -6.428 1.368 -11.644 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -7.260 3.558 -11.914 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -7.143 3.853 -10.190 1.00 0.00 H new ATOM 1227 N VAL B 12 -4.238 3.328 -11.479 1.00 0.00 N ATOM 1228 CA VAL B 12 -2.895 3.941 -11.692 1.00 0.00 C ATOM 1229 C VAL B 12 -2.859 4.645 -13.051 1.00 0.00 C ATOM 1230 O VAL B 12 -3.311 4.118 -14.048 1.00 0.00 O ATOM 1231 CB VAL B 12 -1.822 2.847 -11.660 1.00 0.00 C ATOM 1232 CG1 VAL B 12 -2.011 1.905 -12.851 1.00 0.00 C ATOM 1233 CG2 VAL B 12 -0.436 3.494 -11.735 1.00 0.00 C ATOM 0 H VAL B 12 -4.264 2.310 -11.529 1.00 0.00 H new ATOM 0 HA VAL B 12 -2.702 4.667 -10.902 1.00 0.00 H new ATOM 0 HB VAL B 12 -1.911 2.279 -10.734 1.00 0.00 H new ATOM 0 HG11 VAL B 12 -1.247 1.128 -12.825 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -2.998 1.445 -12.798 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -1.923 2.470 -13.779 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.329 2.718 -11.712 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.349 4.062 -12.661 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.300 4.163 -10.885 1.00 0.00 H new ATOM 1243 N SER B 13 -2.326 5.837 -13.097 1.00 0.00 N ATOM 1244 CA SER B 13 -2.261 6.575 -14.390 1.00 0.00 C ATOM 1245 C SER B 13 -1.192 5.951 -15.292 1.00 0.00 C ATOM 1246 O SER B 13 -1.401 5.764 -16.475 1.00 0.00 O ATOM 1247 CB SER B 13 -1.913 8.039 -14.120 1.00 0.00 C ATOM 1248 OG SER B 13 -2.257 8.820 -15.255 1.00 0.00 O ATOM 0 H SER B 13 -1.933 6.330 -12.295 1.00 0.00 H new ATOM 0 HA SER B 13 -3.228 6.515 -14.889 1.00 0.00 H new ATOM 0 HB2 SER B 13 -2.451 8.397 -13.242 1.00 0.00 H new ATOM 0 HB3 SER B 13 -0.849 8.138 -13.905 1.00 0.00 H new ATOM 0 HG SER B 13 -2.037 9.760 -15.085 1.00 0.00 H new ATOM 1254 N LYS B 14 -0.047 5.625 -14.752 1.00 0.00 N ATOM 1255 CA LYS B 14 1.020 5.015 -15.599 1.00 0.00 C ATOM 1256 C LYS B 14 2.151 4.487 -14.709 1.00 0.00 C ATOM 1257 O LYS B 14 2.237 4.808 -13.541 1.00 0.00 O ATOM 1258 CB LYS B 14 1.567 6.062 -16.582 1.00 0.00 C ATOM 1259 CG LYS B 14 2.105 7.303 -15.820 1.00 0.00 C ATOM 1260 CD LYS B 14 3.638 7.243 -15.702 1.00 0.00 C ATOM 1261 CE LYS B 14 4.286 7.748 -16.999 1.00 0.00 C ATOM 1262 NZ LYS B 14 5.769 7.729 -16.854 1.00 0.00 N ATOM 0 H LYS B 14 0.194 5.753 -13.769 1.00 0.00 H new ATOM 0 HA LYS B 14 0.598 4.185 -16.165 1.00 0.00 H new ATOM 0 HB2 LYS B 14 2.365 5.623 -17.181 1.00 0.00 H new ATOM 0 HB3 LYS B 14 0.780 6.366 -17.272 1.00 0.00 H new ATOM 0 HG2 LYS B 14 1.810 8.213 -16.342 1.00 0.00 H new ATOM 0 HG3 LYS B 14 1.660 7.348 -14.826 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.970 7.850 -14.860 1.00 0.00 H new ATOM 0 HD3 LYS B 14 3.956 6.220 -15.502 1.00 0.00 H new ATOM 0 HE2 LYS B 14 3.984 7.120 -17.837 1.00 0.00 H new ATOM 0 HE3 LYS B 14 3.944 8.759 -17.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 6.208 8.071 -17.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 6.049 8.345 -16.064 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 6.087 6.757 -16.664 1.00 0.00 H new ATOM 1276 N VAL B 15 3.013 3.665 -15.252 1.00 0.00 N ATOM 1277 CA VAL B 15 4.136 3.094 -14.441 1.00 0.00 C ATOM 1278 C VAL B 15 5.419 3.895 -14.689 1.00 0.00 C ATOM 1279 O VAL B 15 5.812 4.127 -15.815 1.00 0.00 O ATOM 1280 CB VAL B 15 4.356 1.635 -14.856 1.00 0.00 C ATOM 1281 CG1 VAL B 15 5.625 1.088 -14.191 1.00 0.00 C ATOM 1282 CG2 VAL B 15 3.151 0.798 -14.422 1.00 0.00 C ATOM 0 H VAL B 15 2.989 3.362 -16.226 1.00 0.00 H new ATOM 0 HA VAL B 15 3.885 3.146 -13.382 1.00 0.00 H new ATOM 0 HB VAL B 15 4.470 1.582 -15.939 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.775 0.051 -14.491 1.00 0.00 H new ATOM 0 HG12 VAL B 15 6.484 1.683 -14.502 1.00 0.00 H new ATOM 0 HG13 VAL B 15 5.520 1.141 -13.107 1.00 0.00 H new ATOM 0 HG21 VAL B 15 3.304 -0.240 -14.716 1.00 0.00 H new ATOM 0 HG22 VAL B 15 3.039 0.856 -13.339 1.00 0.00 H new ATOM 0 HG23 VAL B 15 2.250 1.181 -14.901 1.00 0.00 H new ATOM 1292 N GLN B 16 6.078 4.314 -13.641 1.00 0.00 N ATOM 1293 CA GLN B 16 7.339 5.092 -13.811 1.00 0.00 C ATOM 1294 C GLN B 16 8.507 4.123 -14.016 1.00 0.00 C ATOM 1295 O GLN B 16 9.486 4.439 -14.663 1.00 0.00 O ATOM 1296 CB GLN B 16 7.588 5.930 -12.553 1.00 0.00 C ATOM 1297 CG GLN B 16 8.774 6.874 -12.783 1.00 0.00 C ATOM 1298 CD GLN B 16 8.380 7.950 -13.796 1.00 0.00 C ATOM 1299 OE1 GLN B 16 8.935 8.019 -14.874 1.00 0.00 O ATOM 1300 NE2 GLN B 16 7.438 8.802 -13.492 1.00 0.00 N ATOM 0 H GLN B 16 5.797 4.151 -12.674 1.00 0.00 H new ATOM 0 HA GLN B 16 7.253 5.748 -14.677 1.00 0.00 H new ATOM 0 HB2 GLN B 16 6.696 6.506 -12.306 1.00 0.00 H new ATOM 0 HB3 GLN B 16 7.791 5.277 -11.704 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.072 7.337 -11.842 1.00 0.00 H new ATOM 0 HG3 GLN B 16 9.634 6.313 -13.149 1.00 0.00 H new ATOM 0 HE21 GLN B 16 6.971 8.745 -12.587 1.00 0.00 H new ATOM 0 HE22 GLN B 16 7.169 9.525 -14.160 1.00 0.00 H new ATOM 1309 N SER B 17 8.411 2.943 -13.465 1.00 0.00 N ATOM 1310 CA SER B 17 9.514 1.949 -13.619 1.00 0.00 C ATOM 1311 C SER B 17 9.056 0.603 -13.051 1.00 0.00 C ATOM 1312 O SER B 17 8.038 0.514 -12.395 1.00 0.00 O ATOM 1313 CB SER B 17 10.745 2.431 -12.853 1.00 0.00 C ATOM 1314 OG SER B 17 11.816 1.518 -13.058 1.00 0.00 O ATOM 0 H SER B 17 7.615 2.623 -12.914 1.00 0.00 H new ATOM 0 HA SER B 17 9.765 1.838 -14.674 1.00 0.00 H new ATOM 0 HB2 SER B 17 11.031 3.427 -13.192 1.00 0.00 H new ATOM 0 HB3 SER B 17 10.518 2.509 -11.790 1.00 0.00 H new ATOM 0 HG SER B 17 12.607 1.827 -12.569 1.00 0.00 H new ATOM 1320 N PHE B 18 9.796 -0.447 -13.297 1.00 0.00 N ATOM 1321 CA PHE B 18 9.391 -1.785 -12.768 1.00 0.00 C ATOM 1322 C PHE B 18 10.638 -2.643 -12.517 1.00 0.00 C ATOM 1323 O PHE B 18 11.261 -3.135 -13.439 1.00 0.00 O ATOM 1324 CB PHE B 18 8.480 -2.480 -13.793 1.00 0.00 C ATOM 1325 CG PHE B 18 8.300 -3.939 -13.426 1.00 0.00 C ATOM 1326 CD1 PHE B 18 7.390 -4.309 -12.426 1.00 0.00 C ATOM 1327 CD2 PHE B 18 9.052 -4.921 -14.085 1.00 0.00 C ATOM 1328 CE1 PHE B 18 7.234 -5.659 -12.089 1.00 0.00 C ATOM 1329 CE2 PHE B 18 8.895 -6.270 -13.747 1.00 0.00 C ATOM 1330 CZ PHE B 18 7.986 -6.639 -12.749 1.00 0.00 C ATOM 0 H PHE B 18 10.660 -0.437 -13.839 1.00 0.00 H new ATOM 0 HA PHE B 18 8.853 -1.658 -11.829 1.00 0.00 H new ATOM 0 HB2 PHE B 18 7.510 -1.983 -13.825 1.00 0.00 H new ATOM 0 HB3 PHE B 18 8.913 -2.399 -14.790 1.00 0.00 H new ATOM 0 HD1 PHE B 18 6.810 -3.554 -11.916 1.00 0.00 H new ATOM 0 HD2 PHE B 18 9.754 -4.636 -14.855 1.00 0.00 H new ATOM 0 HE1 PHE B 18 6.533 -5.945 -11.319 1.00 0.00 H new ATOM 0 HE2 PHE B 18 9.475 -7.026 -14.256 1.00 0.00 H new ATOM 0 HZ PHE B 18 7.864 -7.680 -12.488 1.00 0.00 H new ATOM 1340 N ASP B 19 10.981 -2.851 -11.270 1.00 0.00 N ATOM 1341 CA ASP B 19 12.162 -3.705 -10.926 1.00 0.00 C ATOM 1342 C ASP B 19 11.722 -4.688 -9.836 1.00 0.00 C ATOM 1343 O ASP B 19 10.855 -4.377 -9.042 1.00 0.00 O ATOM 1344 CB ASP B 19 13.305 -2.831 -10.394 1.00 0.00 C ATOM 1345 CG ASP B 19 13.830 -1.934 -11.514 1.00 0.00 C ATOM 1346 OD1 ASP B 19 13.359 -2.074 -12.630 1.00 0.00 O ATOM 1347 OD2 ASP B 19 14.696 -1.120 -11.237 1.00 0.00 O ATOM 0 H ASP B 19 10.488 -2.462 -10.466 1.00 0.00 H new ATOM 0 HA ASP B 19 12.515 -4.237 -11.810 1.00 0.00 H new ATOM 0 HB2 ASP B 19 12.953 -2.222 -9.562 1.00 0.00 H new ATOM 0 HB3 ASP B 19 14.109 -3.460 -10.011 1.00 0.00 H new ATOM 1352 N PRO B 20 12.295 -5.863 -9.784 1.00 0.00 N ATOM 1353 CA PRO B 20 11.915 -6.874 -8.759 1.00 0.00 C ATOM 1354 C PRO B 20 12.379 -6.458 -7.355 1.00 0.00 C ATOM 1355 O PRO B 20 12.107 -7.130 -6.381 1.00 0.00 O ATOM 1356 CB PRO B 20 12.618 -8.156 -9.230 1.00 0.00 C ATOM 1357 CG PRO B 20 13.790 -7.680 -10.031 1.00 0.00 C ATOM 1358 CD PRO B 20 13.353 -6.366 -10.682 1.00 0.00 C ATOM 0 HA PRO B 20 10.835 -6.997 -8.673 1.00 0.00 H new ATOM 0 HB2 PRO B 20 12.938 -8.765 -8.384 1.00 0.00 H new ATOM 0 HB3 PRO B 20 11.952 -8.773 -9.833 1.00 0.00 H new ATOM 0 HG2 PRO B 20 14.662 -7.529 -9.394 1.00 0.00 H new ATOM 0 HG3 PRO B 20 14.070 -8.415 -10.786 1.00 0.00 H new ATOM 0 HD2 PRO B 20 14.182 -5.662 -10.758 1.00 0.00 H new ATOM 0 HD3 PRO B 20 12.977 -6.526 -11.693 1.00 0.00 H new ATOM 1366 N LYS B 21 13.079 -5.349 -7.252 1.00 0.00 N ATOM 1367 CA LYS B 21 13.571 -4.870 -5.916 1.00 0.00 C ATOM 1368 C LYS B 21 13.039 -3.456 -5.637 1.00 0.00 C ATOM 1369 O LYS B 21 13.116 -2.964 -4.529 1.00 0.00 O ATOM 1370 CB LYS B 21 15.102 -4.855 -5.923 1.00 0.00 C ATOM 1371 CG LYS B 21 15.608 -3.792 -6.902 1.00 0.00 C ATOM 1372 CD LYS B 21 17.119 -3.954 -7.106 1.00 0.00 C ATOM 1373 CE LYS B 21 17.863 -3.629 -5.807 1.00 0.00 C ATOM 1374 NZ LYS B 21 19.310 -3.427 -6.105 1.00 0.00 N ATOM 0 H LYS B 21 13.332 -4.752 -8.040 1.00 0.00 H new ATOM 0 HA LYS B 21 13.213 -5.541 -5.135 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.477 -4.647 -4.921 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.483 -5.836 -6.209 1.00 0.00 H new ATOM 0 HG2 LYS B 21 15.090 -3.887 -7.856 1.00 0.00 H new ATOM 0 HG3 LYS B 21 15.388 -2.796 -6.518 1.00 0.00 H new ATOM 0 HD2 LYS B 21 17.344 -4.974 -7.418 1.00 0.00 H new ATOM 0 HD3 LYS B 21 17.459 -3.294 -7.904 1.00 0.00 H new ATOM 0 HE2 LYS B 21 17.445 -2.732 -5.350 1.00 0.00 H new ATOM 0 HE3 LYS B 21 17.737 -4.440 -5.090 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 19.818 -3.206 -5.225 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 19.703 -4.294 -6.523 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 19.420 -2.639 -6.775 1.00 0.00 H new ATOM 1388 N GLU B 22 12.496 -2.801 -6.631 1.00 0.00 N ATOM 1389 CA GLU B 22 11.957 -1.422 -6.413 1.00 0.00 C ATOM 1390 C GLU B 22 10.945 -1.097 -7.512 1.00 0.00 C ATOM 1391 O GLU B 22 11.304 -0.904 -8.655 1.00 0.00 O ATOM 1392 CB GLU B 22 13.104 -0.406 -6.457 1.00 0.00 C ATOM 1393 CG GLU B 22 12.556 1.007 -6.227 1.00 0.00 C ATOM 1394 CD GLU B 22 13.719 2.003 -6.175 1.00 0.00 C ATOM 1395 OE1 GLU B 22 14.845 1.560 -6.025 1.00 0.00 O ATOM 1396 OE2 GLU B 22 13.462 3.190 -6.288 1.00 0.00 O ATOM 0 H GLU B 22 12.402 -3.159 -7.582 1.00 0.00 H new ATOM 0 HA GLU B 22 11.470 -1.372 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU B 22 13.845 -0.647 -5.695 1.00 0.00 H new ATOM 0 HB3 GLU B 22 13.610 -0.457 -7.421 1.00 0.00 H new ATOM 0 HG2 GLU B 22 11.868 1.277 -7.028 1.00 0.00 H new ATOM 0 HG3 GLU B 22 11.991 1.042 -5.296 1.00 0.00 H new ATOM 1403 N ILE B 23 9.681 -1.028 -7.177 1.00 0.00 N ATOM 1404 CA ILE B 23 8.638 -0.713 -8.208 1.00 0.00 C ATOM 1405 C ILE B 23 8.045 0.667 -7.928 1.00 0.00 C ATOM 1406 O ILE B 23 7.627 0.965 -6.827 1.00 0.00 O ATOM 1407 CB ILE B 23 7.529 -1.766 -8.150 1.00 0.00 C ATOM 1408 CG1 ILE B 23 8.117 -3.140 -8.483 1.00 0.00 C ATOM 1409 CG2 ILE B 23 6.442 -1.419 -9.169 1.00 0.00 C ATOM 1410 CD1 ILE B 23 7.078 -4.226 -8.198 1.00 0.00 C ATOM 0 H ILE B 23 9.323 -1.176 -6.233 1.00 0.00 H new ATOM 0 HA ILE B 23 9.093 -0.719 -9.198 1.00 0.00 H new ATOM 0 HB ILE B 23 7.097 -1.785 -7.150 1.00 0.00 H new ATOM 0 HG12 ILE B 23 8.416 -3.175 -9.531 1.00 0.00 H new ATOM 0 HG13 ILE B 23 9.014 -3.316 -7.890 1.00 0.00 H new ATOM 0 HG21 ILE B 23 5.652 -2.169 -9.128 1.00 0.00 H new ATOM 0 HG22 ILE B 23 6.025 -0.439 -8.937 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.874 -1.401 -10.170 1.00 0.00 H new ATOM 0 HD11 ILE B 23 7.498 -5.203 -8.436 1.00 0.00 H new ATOM 0 HD12 ILE B 23 6.801 -4.197 -7.144 1.00 0.00 H new ATOM 0 HD13 ILE B 23 6.193 -4.053 -8.811 1.00 0.00 H new ATOM 1422 N LEU B 24 8.014 1.511 -8.928 1.00 0.00 N ATOM 1423 CA LEU B 24 7.455 2.889 -8.759 1.00 0.00 C ATOM 1424 C LEU B 24 6.156 2.994 -9.560 1.00 0.00 C ATOM 1425 O LEU B 24 6.126 2.721 -10.744 1.00 0.00 O ATOM 1426 CB LEU B 24 8.474 3.902 -9.299 1.00 0.00 C ATOM 1427 CG LEU B 24 9.739 3.916 -8.408 1.00 0.00 C ATOM 1428 CD1 LEU B 24 10.955 4.364 -9.231 1.00 0.00 C ATOM 1429 CD2 LEU B 24 9.544 4.889 -7.231 1.00 0.00 C ATOM 0 H LEU B 24 8.356 1.302 -9.866 1.00 0.00 H new ATOM 0 HA LEU B 24 7.255 3.093 -7.707 1.00 0.00 H new ATOM 0 HB2 LEU B 24 8.745 3.645 -10.323 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.029 4.897 -9.327 1.00 0.00 H new ATOM 0 HG LEU B 24 9.906 2.909 -8.026 1.00 0.00 H new ATOM 0 HD11 LEU B 24 11.841 4.371 -8.596 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.108 3.673 -10.060 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.781 5.366 -9.622 1.00 0.00 H new ATOM 0 HD21 LEU B 24 10.439 4.892 -6.609 1.00 0.00 H new ATOM 0 HD22 LEU B 24 9.365 5.893 -7.615 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.689 4.571 -6.634 1.00 0.00 H new ATOM 1441 N LEU B 25 5.081 3.376 -8.917 1.00 0.00 N ATOM 1442 CA LEU B 25 3.763 3.494 -9.623 1.00 0.00 C ATOM 1443 C LEU B 25 3.232 4.922 -9.496 1.00 0.00 C ATOM 1444 O LEU B 25 3.141 5.468 -8.413 1.00 0.00 O ATOM 1445 CB LEU B 25 2.761 2.536 -8.976 1.00 0.00 C ATOM 1446 CG LEU B 25 3.312 1.106 -9.006 1.00 0.00 C ATOM 1447 CD1 LEU B 25 2.325 0.171 -8.301 1.00 0.00 C ATOM 1448 CD2 LEU B 25 3.507 0.651 -10.463 1.00 0.00 C ATOM 0 H LEU B 25 5.058 3.614 -7.925 1.00 0.00 H new ATOM 0 HA LEU B 25 3.896 3.247 -10.676 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.567 2.839 -7.947 1.00 0.00 H new ATOM 0 HB3 LEU B 25 1.809 2.579 -9.505 1.00 0.00 H new ATOM 0 HG LEU B 25 4.274 1.077 -8.494 1.00 0.00 H new ATOM 0 HD11 LEU B 25 2.712 -0.848 -8.320 1.00 0.00 H new ATOM 0 HD12 LEU B 25 2.196 0.491 -7.267 1.00 0.00 H new ATOM 0 HD13 LEU B 25 1.364 0.203 -8.814 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.899 -0.366 -10.477 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.550 0.678 -10.984 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.211 1.318 -10.961 1.00 0.00 H new ATOM 1460 N GLU B 26 2.860 5.528 -10.593 1.00 0.00 N ATOM 1461 CA GLU B 26 2.309 6.917 -10.544 1.00 0.00 C ATOM 1462 C GLU B 26 0.782 6.839 -10.541 1.00 0.00 C ATOM 1463 O GLU B 26 0.170 6.397 -11.499 1.00 0.00 O ATOM 1464 CB GLU B 26 2.799 7.702 -11.761 1.00 0.00 C ATOM 1465 CG GLU B 26 2.204 9.111 -11.736 1.00 0.00 C ATOM 1466 CD GLU B 26 2.891 9.972 -12.797 1.00 0.00 C ATOM 1467 OE1 GLU B 26 4.097 10.136 -12.706 1.00 0.00 O ATOM 1468 OE2 GLU B 26 2.200 10.461 -13.675 1.00 0.00 O ATOM 0 H GLU B 26 2.914 5.119 -11.526 1.00 0.00 H new ATOM 0 HA GLU B 26 2.647 7.426 -9.642 1.00 0.00 H new ATOM 0 HB2 GLU B 26 3.888 7.756 -11.757 1.00 0.00 H new ATOM 0 HB3 GLU B 26 2.508 7.190 -12.678 1.00 0.00 H new ATOM 0 HG2 GLU B 26 1.131 9.068 -11.925 1.00 0.00 H new ATOM 0 HG3 GLU B 26 2.336 9.556 -10.750 1.00 0.00 H new ATOM 1475 N THR B 27 0.166 7.243 -9.453 1.00 0.00 N ATOM 1476 CA THR B 27 -1.327 7.178 -9.338 1.00 0.00 C ATOM 1477 C THR B 27 -1.900 8.558 -9.008 1.00 0.00 C ATOM 1478 O THR B 27 -1.228 9.406 -8.458 1.00 0.00 O ATOM 1479 CB THR B 27 -1.691 6.211 -8.208 1.00 0.00 C ATOM 1480 OG1 THR B 27 -3.100 6.207 -8.028 1.00 0.00 O ATOM 1481 CG2 THR B 27 -1.011 6.658 -6.910 1.00 0.00 C ATOM 0 H THR B 27 0.640 7.619 -8.632 1.00 0.00 H new ATOM 0 HA THR B 27 -1.742 6.839 -10.287 1.00 0.00 H new ATOM 0 HB THR B 27 -1.353 5.207 -8.465 1.00 0.00 H new ATOM 0 HG1 THR B 27 -3.309 6.013 -7.090 1.00 0.00 H new ATOM 0 HG21 THR B 27 -1.271 5.969 -6.107 1.00 0.00 H new ATOM 0 HG22 THR B 27 0.070 6.662 -7.048 1.00 0.00 H new ATOM 0 HG23 THR B 27 -1.347 7.662 -6.650 1.00 0.00 H new ATOM 1489 N ILE B 28 -3.153 8.763 -9.340 1.00 0.00 N ATOM 1490 CA ILE B 28 -3.846 10.066 -9.069 1.00 0.00 C ATOM 1491 C ILE B 28 -2.866 11.242 -9.216 1.00 0.00 C ATOM 1492 O ILE B 28 -2.740 11.826 -10.274 1.00 0.00 O ATOM 1493 CB ILE B 28 -4.441 10.057 -7.654 1.00 0.00 C ATOM 1494 CG1 ILE B 28 -5.278 8.790 -7.456 1.00 0.00 C ATOM 1495 CG2 ILE B 28 -5.350 11.282 -7.480 1.00 0.00 C ATOM 1496 CD1 ILE B 28 -5.719 8.684 -5.993 1.00 0.00 C ATOM 0 H ILE B 28 -3.739 8.065 -9.799 1.00 0.00 H new ATOM 0 HA ILE B 28 -4.648 10.189 -9.797 1.00 0.00 H new ATOM 0 HB ILE B 28 -3.633 10.082 -6.923 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -6.151 8.814 -8.108 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -4.696 7.911 -7.735 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.775 11.280 -6.476 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -4.767 12.191 -7.625 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -6.154 11.246 -8.215 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -6.314 7.781 -5.857 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -4.840 8.639 -5.350 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -6.317 9.556 -5.729 1.00 0.00 H new ATOM 1508 N GLN B 29 -2.171 11.596 -8.162 1.00 0.00 N ATOM 1509 CA GLN B 29 -1.204 12.730 -8.244 1.00 0.00 C ATOM 1510 C GLN B 29 -0.063 12.508 -7.247 1.00 0.00 C ATOM 1511 O GLN B 29 0.338 13.405 -6.534 1.00 0.00 O ATOM 1512 CB GLN B 29 -1.931 14.039 -7.914 1.00 0.00 C ATOM 1513 CG GLN B 29 -2.579 13.939 -6.532 1.00 0.00 C ATOM 1514 CD GLN B 29 -3.445 15.176 -6.291 1.00 0.00 C ATOM 1515 OE1 GLN B 29 -3.646 15.974 -7.184 1.00 0.00 O ATOM 1516 NE2 GLN B 29 -3.973 15.370 -5.113 1.00 0.00 N ATOM 0 H GLN B 29 -2.233 11.147 -7.248 1.00 0.00 H new ATOM 0 HA GLN B 29 -0.792 12.786 -9.251 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -1.228 14.872 -7.936 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -2.691 14.243 -8.668 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -3.187 13.037 -6.467 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -1.811 13.862 -5.762 1.00 0.00 H new ATOM 0 HE21 GLN B 29 -3.805 14.700 -4.362 1.00 0.00 H new ATOM 0 HE22 GLN B 29 -4.554 16.191 -4.943 1.00 0.00 H new ATOM 1525 N GLY B 30 0.467 11.315 -7.193 1.00 0.00 N ATOM 1526 CA GLY B 30 1.581 11.041 -6.241 1.00 0.00 C ATOM 1527 C GLY B 30 2.253 9.717 -6.611 1.00 0.00 C ATOM 1528 O GLY B 30 1.597 8.742 -6.921 1.00 0.00 O ATOM 0 H GLY B 30 0.178 10.522 -7.765 1.00 0.00 H new ATOM 0 HA2 GLY B 30 2.309 11.852 -6.273 1.00 0.00 H new ATOM 0 HA3 GLY B 30 1.199 10.995 -5.221 1.00 0.00 H new ATOM 1532 N VAL B 31 3.560 9.680 -6.590 1.00 0.00 N ATOM 1533 CA VAL B 31 4.285 8.425 -6.954 1.00 0.00 C ATOM 1534 C VAL B 31 4.536 7.589 -5.696 1.00 0.00 C ATOM 1535 O VAL B 31 4.986 8.088 -4.684 1.00 0.00 O ATOM 1536 CB VAL B 31 5.624 8.781 -7.610 1.00 0.00 C ATOM 1537 CG1 VAL B 31 6.446 7.508 -7.825 1.00 0.00 C ATOM 1538 CG2 VAL B 31 5.366 9.450 -8.963 1.00 0.00 C ATOM 0 H VAL B 31 4.158 10.466 -6.336 1.00 0.00 H new ATOM 0 HA VAL B 31 3.679 7.848 -7.653 1.00 0.00 H new ATOM 0 HB VAL B 31 6.173 9.463 -6.961 1.00 0.00 H new ATOM 0 HG11 VAL B 31 7.397 7.764 -8.291 1.00 0.00 H new ATOM 0 HG12 VAL B 31 6.630 7.027 -6.864 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.896 6.825 -8.473 1.00 0.00 H new ATOM 0 HG21 VAL B 31 6.317 9.704 -9.431 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.816 8.765 -9.608 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.781 10.358 -8.814 1.00 0.00 H new ATOM 1548 N LEU B 32 4.245 6.312 -5.762 1.00 0.00 N ATOM 1549 CA LEU B 32 4.458 5.411 -4.586 1.00 0.00 C ATOM 1550 C LEU B 32 5.662 4.516 -4.856 1.00 0.00 C ATOM 1551 O LEU B 32 5.727 3.830 -5.858 1.00 0.00 O ATOM 1552 CB LEU B 32 3.210 4.543 -4.387 1.00 0.00 C ATOM 1553 CG LEU B 32 3.353 3.673 -3.128 1.00 0.00 C ATOM 1554 CD1 LEU B 32 3.470 4.556 -1.871 1.00 0.00 C ATOM 1555 CD2 LEU B 32 2.121 2.766 -3.011 1.00 0.00 C ATOM 0 H LEU B 32 3.865 5.851 -6.589 1.00 0.00 H new ATOM 0 HA LEU B 32 4.637 6.004 -3.689 1.00 0.00 H new ATOM 0 HB2 LEU B 32 2.329 5.178 -4.299 1.00 0.00 H new ATOM 0 HB3 LEU B 32 3.059 3.908 -5.260 1.00 0.00 H new ATOM 0 HG LEU B 32 4.257 3.069 -3.209 1.00 0.00 H new ATOM 0 HD11 LEU B 32 3.570 3.923 -0.990 1.00 0.00 H new ATOM 0 HD12 LEU B 32 4.346 5.199 -1.958 1.00 0.00 H new ATOM 0 HD13 LEU B 32 2.576 5.172 -1.775 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.211 2.143 -2.121 1.00 0.00 H new ATOM 0 HD22 LEU B 32 1.223 3.380 -2.936 1.00 0.00 H new ATOM 0 HD23 LEU B 32 2.052 2.130 -3.893 1.00 0.00 H new ATOM 1567 N SER B 33 6.624 4.522 -3.968 1.00 0.00 N ATOM 1568 CA SER B 33 7.844 3.681 -4.159 1.00 0.00 C ATOM 1569 C SER B 33 7.811 2.508 -3.180 1.00 0.00 C ATOM 1570 O SER B 33 7.781 2.687 -1.974 1.00 0.00 O ATOM 1571 CB SER B 33 9.085 4.528 -3.887 1.00 0.00 C ATOM 1572 OG SER B 33 9.049 5.691 -4.705 1.00 0.00 O ATOM 0 H SER B 33 6.616 5.078 -3.113 1.00 0.00 H new ATOM 0 HA SER B 33 7.871 3.303 -5.181 1.00 0.00 H new ATOM 0 HB2 SER B 33 9.123 4.810 -2.835 1.00 0.00 H new ATOM 0 HB3 SER B 33 9.986 3.951 -4.095 1.00 0.00 H new ATOM 0 HG SER B 33 9.844 6.238 -4.531 1.00 0.00 H new ATOM 1578 N ILE B 34 7.825 1.304 -3.699 1.00 0.00 N ATOM 1579 CA ILE B 34 7.802 0.089 -2.829 1.00 0.00 C ATOM 1580 C ILE B 34 9.187 -0.555 -2.844 1.00 0.00 C ATOM 1581 O ILE B 34 9.744 -0.824 -3.893 1.00 0.00 O ATOM 1582 CB ILE B 34 6.775 -0.908 -3.374 1.00 0.00 C ATOM 1583 CG1 ILE B 34 5.385 -0.264 -3.373 1.00 0.00 C ATOM 1584 CG2 ILE B 34 6.756 -2.160 -2.494 1.00 0.00 C ATOM 1585 CD1 ILE B 34 4.406 -1.155 -4.142 1.00 0.00 C ATOM 0 H ILE B 34 7.852 1.111 -4.700 1.00 0.00 H new ATOM 0 HA ILE B 34 7.532 0.368 -1.811 1.00 0.00 H new ATOM 0 HB ILE B 34 7.047 -1.185 -4.392 1.00 0.00 H new ATOM 0 HG12 ILE B 34 5.038 -0.125 -2.349 1.00 0.00 H new ATOM 0 HG13 ILE B 34 5.430 0.724 -3.831 1.00 0.00 H new ATOM 0 HG21 ILE B 34 6.024 -2.868 -2.884 1.00 0.00 H new ATOM 0 HG22 ILE B 34 7.744 -2.621 -2.496 1.00 0.00 H new ATOM 0 HG23 ILE B 34 6.486 -1.884 -1.475 1.00 0.00 H new ATOM 0 HD11 ILE B 34 3.418 -0.696 -4.140 1.00 0.00 H new ATOM 0 HD12 ILE B 34 4.750 -1.272 -5.170 1.00 0.00 H new ATOM 0 HD13 ILE B 34 4.352 -2.133 -3.664 1.00 0.00 H new ATOM 1597 N LYS B 35 9.746 -0.799 -1.683 1.00 0.00 N ATOM 1598 CA LYS B 35 11.102 -1.425 -1.597 1.00 0.00 C ATOM 1599 C LYS B 35 11.025 -2.684 -0.733 1.00 0.00 C ATOM 1600 O LYS B 35 10.348 -2.723 0.278 1.00 0.00 O ATOM 1601 CB LYS B 35 12.075 -0.429 -0.961 1.00 0.00 C ATOM 1602 CG LYS B 35 12.293 0.750 -1.912 1.00 0.00 C ATOM 1603 CD LYS B 35 13.235 1.766 -1.264 1.00 0.00 C ATOM 1604 CE LYS B 35 13.412 2.964 -2.199 1.00 0.00 C ATOM 1605 NZ LYS B 35 14.024 2.509 -3.478 1.00 0.00 N ATOM 0 H LYS B 35 9.315 -0.589 -0.783 1.00 0.00 H new ATOM 0 HA LYS B 35 11.449 -1.691 -2.595 1.00 0.00 H new ATOM 0 HB2 LYS B 35 11.679 -0.074 -0.010 1.00 0.00 H new ATOM 0 HB3 LYS B 35 13.025 -0.918 -0.748 1.00 0.00 H new ATOM 0 HG2 LYS B 35 12.714 0.398 -2.853 1.00 0.00 H new ATOM 0 HG3 LYS B 35 11.339 1.222 -2.147 1.00 0.00 H new ATOM 0 HD2 LYS B 35 12.830 2.095 -0.307 1.00 0.00 H new ATOM 0 HD3 LYS B 35 14.201 1.304 -1.060 1.00 0.00 H new ATOM 0 HE2 LYS B 35 12.448 3.434 -2.392 1.00 0.00 H new ATOM 0 HE3 LYS B 35 14.045 3.716 -1.728 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 14.223 3.333 -4.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 14.911 2.004 -3.278 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 13.366 1.871 -3.970 1.00 0.00 H new ATOM 1619 N GLY B 36 11.715 -3.716 -1.131 1.00 0.00 N ATOM 1620 CA GLY B 36 11.695 -4.989 -0.357 1.00 0.00 C ATOM 1621 C GLY B 36 12.443 -6.056 -1.156 1.00 0.00 C ATOM 1622 O GLY B 36 13.460 -5.784 -1.762 1.00 0.00 O ATOM 0 H GLY B 36 12.298 -3.732 -1.968 1.00 0.00 H new ATOM 0 HA2 GLY B 36 12.164 -4.847 0.617 1.00 0.00 H new ATOM 0 HA3 GLY B 36 10.668 -5.304 -0.173 1.00 0.00 H new ATOM 1626 N GLU B 37 11.952 -7.270 -1.173 1.00 0.00 N ATOM 1627 CA GLU B 37 12.645 -8.345 -1.951 1.00 0.00 C ATOM 1628 C GLU B 37 11.605 -9.275 -2.575 1.00 0.00 C ATOM 1629 O GLU B 37 10.512 -9.428 -2.072 1.00 0.00 O ATOM 1630 CB GLU B 37 13.560 -9.148 -1.026 1.00 0.00 C ATOM 1631 CG GLU B 37 14.647 -8.226 -0.470 1.00 0.00 C ATOM 1632 CD GLU B 37 15.692 -9.056 0.277 1.00 0.00 C ATOM 1633 OE1 GLU B 37 15.381 -10.176 0.643 1.00 0.00 O ATOM 1634 OE2 GLU B 37 16.787 -8.554 0.470 1.00 0.00 O ATOM 0 H GLU B 37 11.106 -7.563 -0.685 1.00 0.00 H new ATOM 0 HA GLU B 37 13.244 -7.888 -2.739 1.00 0.00 H new ATOM 0 HB2 GLU B 37 12.982 -9.582 -0.210 1.00 0.00 H new ATOM 0 HB3 GLU B 37 14.013 -9.976 -1.572 1.00 0.00 H new ATOM 0 HG2 GLU B 37 15.120 -7.674 -1.282 1.00 0.00 H new ATOM 0 HG3 GLU B 37 14.205 -7.490 0.201 1.00 0.00 H new ATOM 1641 N LYS B 38 11.950 -9.892 -3.674 1.00 0.00 N ATOM 1642 CA LYS B 38 11.000 -10.813 -4.360 1.00 0.00 C ATOM 1643 C LYS B 38 9.696 -10.082 -4.683 1.00 0.00 C ATOM 1644 O LYS B 38 8.616 -10.556 -4.387 1.00 0.00 O ATOM 1645 CB LYS B 38 10.705 -12.026 -3.475 1.00 0.00 C ATOM 1646 CG LYS B 38 11.965 -12.880 -3.365 1.00 0.00 C ATOM 1647 CD LYS B 38 11.695 -14.069 -2.448 1.00 0.00 C ATOM 1648 CE LYS B 38 12.976 -14.884 -2.297 1.00 0.00 C ATOM 1649 NZ LYS B 38 13.304 -15.538 -3.595 1.00 0.00 N ATOM 0 H LYS B 38 12.858 -9.796 -4.129 1.00 0.00 H new ATOM 0 HA LYS B 38 11.458 -11.153 -5.289 1.00 0.00 H new ATOM 0 HB2 LYS B 38 10.383 -11.701 -2.486 1.00 0.00 H new ATOM 0 HB3 LYS B 38 9.889 -12.612 -3.899 1.00 0.00 H new ATOM 0 HG2 LYS B 38 12.268 -13.230 -4.352 1.00 0.00 H new ATOM 0 HG3 LYS B 38 12.788 -12.284 -2.972 1.00 0.00 H new ATOM 0 HD2 LYS B 38 11.353 -13.722 -1.473 1.00 0.00 H new ATOM 0 HD3 LYS B 38 10.901 -14.690 -2.862 1.00 0.00 H new ATOM 0 HE2 LYS B 38 13.797 -14.238 -1.986 1.00 0.00 H new ATOM 0 HE3 LYS B 38 12.851 -15.637 -1.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 13.988 -16.305 -3.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 12.437 -15.929 -4.015 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 13.717 -14.837 -4.243 1.00 0.00 H new ATOM 1663 N LEU B 39 9.783 -8.939 -5.312 1.00 0.00 N ATOM 1664 CA LEU B 39 8.545 -8.189 -5.681 1.00 0.00 C ATOM 1665 C LEU B 39 8.053 -8.733 -7.022 1.00 0.00 C ATOM 1666 O LEU B 39 8.167 -8.091 -8.047 1.00 0.00 O ATOM 1667 CB LEU B 39 8.860 -6.690 -5.810 1.00 0.00 C ATOM 1668 CG LEU B 39 8.888 -6.042 -4.422 1.00 0.00 C ATOM 1669 CD1 LEU B 39 9.902 -6.767 -3.541 1.00 0.00 C ATOM 1670 CD2 LEU B 39 9.287 -4.569 -4.551 1.00 0.00 C ATOM 0 H LEU B 39 10.658 -8.492 -5.586 1.00 0.00 H new ATOM 0 HA LEU B 39 7.781 -8.315 -4.914 1.00 0.00 H new ATOM 0 HB2 LEU B 39 9.822 -6.553 -6.304 1.00 0.00 H new ATOM 0 HB3 LEU B 39 8.109 -6.204 -6.433 1.00 0.00 H new ATOM 0 HG LEU B 39 7.898 -6.112 -3.971 1.00 0.00 H new ATOM 0 HD11 LEU B 39 9.922 -6.306 -2.554 1.00 0.00 H new ATOM 0 HD12 LEU B 39 9.618 -7.815 -3.446 1.00 0.00 H new ATOM 0 HD13 LEU B 39 10.891 -6.699 -3.993 1.00 0.00 H new ATOM 0 HD21 LEU B 39 9.306 -4.109 -3.563 1.00 0.00 H new ATOM 0 HD22 LEU B 39 10.276 -4.498 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU B 39 8.563 -4.049 -5.179 1.00 0.00 H new ATOM 1682 N GLY B 40 7.530 -9.929 -7.025 1.00 0.00 N ATOM 1683 CA GLY B 40 7.055 -10.536 -8.302 1.00 0.00 C ATOM 1684 C GLY B 40 5.696 -9.956 -8.699 1.00 0.00 C ATOM 1685 O GLY B 40 4.999 -9.365 -7.895 1.00 0.00 O ATOM 0 H GLY B 40 7.411 -10.513 -6.197 1.00 0.00 H new ATOM 0 HA2 GLY B 40 7.782 -10.349 -9.093 1.00 0.00 H new ATOM 0 HA3 GLY B 40 6.977 -11.617 -8.190 1.00 0.00 H new ATOM 1689 N LEU B 46 -5.281 -8.360 -18.014 1.00 0.00 N ATOM 1690 CA LEU B 46 -5.919 -7.830 -16.776 1.00 0.00 C ATOM 1691 C LEU B 46 -7.425 -7.674 -17.012 1.00 0.00 C ATOM 1692 O LEU B 46 -7.858 -6.966 -17.902 1.00 0.00 O ATOM 1693 CB LEU B 46 -5.301 -6.471 -16.434 1.00 0.00 C ATOM 1694 CG LEU B 46 -3.935 -6.675 -15.774 1.00 0.00 C ATOM 1695 CD1 LEU B 46 -3.040 -7.523 -16.685 1.00 0.00 C ATOM 1696 CD2 LEU B 46 -3.278 -5.313 -15.541 1.00 0.00 C ATOM 0 HA LEU B 46 -5.755 -8.519 -15.948 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.193 -5.872 -17.338 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.960 -5.919 -15.764 1.00 0.00 H new ATOM 0 HG LEU B 46 -4.067 -7.188 -14.821 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.069 -7.665 -16.211 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -3.507 -8.493 -16.853 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -2.906 -7.014 -17.640 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -2.305 -5.454 -15.071 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.149 -4.803 -16.496 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -3.911 -4.710 -14.890 1.00 0.00 H new ATOM 1708 N LYS B 47 -8.225 -8.336 -16.221 1.00 0.00 N ATOM 1709 CA LYS B 47 -9.703 -8.240 -16.391 1.00 0.00 C ATOM 1710 C LYS B 47 -10.179 -6.823 -16.062 1.00 0.00 C ATOM 1711 O LYS B 47 -10.990 -6.251 -16.765 1.00 0.00 O ATOM 1712 CB LYS B 47 -10.382 -9.246 -15.448 1.00 0.00 C ATOM 1713 CG LYS B 47 -9.583 -10.576 -15.419 1.00 0.00 C ATOM 1714 CD LYS B 47 -8.749 -10.673 -14.133 1.00 0.00 C ATOM 1715 CE LYS B 47 -7.773 -11.843 -14.255 1.00 0.00 C ATOM 1716 NZ LYS B 47 -6.932 -11.925 -13.027 1.00 0.00 N ATOM 0 H LYS B 47 -7.917 -8.942 -15.461 1.00 0.00 H new ATOM 0 HA LYS B 47 -9.965 -8.467 -17.425 1.00 0.00 H new ATOM 0 HB2 LYS B 47 -10.444 -8.829 -14.443 1.00 0.00 H new ATOM 0 HB3 LYS B 47 -11.403 -9.434 -15.779 1.00 0.00 H new ATOM 0 HG2 LYS B 47 -10.269 -11.421 -15.479 1.00 0.00 H new ATOM 0 HG3 LYS B 47 -8.929 -10.634 -16.289 1.00 0.00 H new ATOM 0 HD2 LYS B 47 -8.203 -9.744 -13.968 1.00 0.00 H new ATOM 0 HD3 LYS B 47 -9.402 -10.816 -13.272 1.00 0.00 H new ATOM 0 HE2 LYS B 47 -8.322 -12.774 -14.394 1.00 0.00 H new ATOM 0 HE3 LYS B 47 -7.140 -11.712 -15.133 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 -6.269 -12.722 -13.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 -6.397 -11.040 -12.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 -7.542 -12.070 -12.197 1.00 0.00 H new ATOM 1730 N ALA B 48 -9.684 -6.259 -14.986 1.00 0.00 N ATOM 1731 CA ALA B 48 -10.103 -4.878 -14.576 1.00 0.00 C ATOM 1732 C ALA B 48 -8.882 -3.956 -14.539 1.00 0.00 C ATOM 1733 O ALA B 48 -8.763 -3.106 -13.677 1.00 0.00 O ATOM 1734 CB ALA B 48 -10.737 -4.937 -13.181 1.00 0.00 C ATOM 0 H ALA B 48 -9.002 -6.699 -14.368 1.00 0.00 H new ATOM 0 HA ALA B 48 -10.825 -4.490 -15.295 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -11.043 -3.936 -12.878 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -11.608 -5.592 -13.205 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -10.011 -5.326 -12.467 1.00 0.00 H new ATOM 1740 N GLY B 49 -7.973 -4.110 -15.463 1.00 0.00 N ATOM 1741 CA GLY B 49 -6.767 -3.233 -15.468 1.00 0.00 C ATOM 1742 C GLY B 49 -6.171 -3.171 -14.057 1.00 0.00 C ATOM 1743 O GLY B 49 -5.483 -2.232 -13.706 1.00 0.00 O ATOM 0 H GLY B 49 -8.012 -4.802 -16.212 1.00 0.00 H new ATOM 0 HA2 GLY B 49 -6.027 -3.619 -16.170 1.00 0.00 H new ATOM 0 HA3 GLY B 49 -7.034 -2.232 -15.805 1.00 0.00 H new ATOM 1747 N GLN B 50 -6.433 -4.162 -13.243 1.00 0.00 N ATOM 1748 CA GLN B 50 -5.885 -4.161 -11.852 1.00 0.00 C ATOM 1749 C GLN B 50 -4.562 -4.921 -11.835 1.00 0.00 C ATOM 1750 O GLN B 50 -4.324 -5.781 -12.662 1.00 0.00 O ATOM 1751 CB GLN B 50 -6.876 -4.858 -10.918 1.00 0.00 C ATOM 1752 CG GLN B 50 -6.360 -4.805 -9.477 1.00 0.00 C ATOM 1753 CD GLN B 50 -7.407 -5.409 -8.542 1.00 0.00 C ATOM 1754 OE1 GLN B 50 -7.685 -6.591 -8.602 1.00 0.00 O ATOM 1755 NE2 GLN B 50 -8.020 -4.637 -7.690 1.00 0.00 N ATOM 0 H GLN B 50 -7.004 -4.973 -13.482 1.00 0.00 H new ATOM 0 HA GLN B 50 -5.727 -3.135 -11.520 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -7.851 -4.375 -10.982 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -7.013 -5.894 -11.227 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -5.422 -5.354 -9.394 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -6.152 -3.774 -9.191 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -7.786 -3.645 -7.640 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -8.734 -5.024 -7.073 1.00 0.00 H new ATOM 1764 N VAL B 51 -3.701 -4.618 -10.896 1.00 0.00 N ATOM 1765 CA VAL B 51 -2.383 -5.326 -10.814 1.00 0.00 C ATOM 1766 C VAL B 51 -2.155 -5.793 -9.380 1.00 0.00 C ATOM 1767 O VAL B 51 -2.754 -5.286 -8.449 1.00 0.00 O ATOM 1768 CB VAL B 51 -1.261 -4.364 -11.214 1.00 0.00 C ATOM 1769 CG1 VAL B 51 -1.419 -3.969 -12.685 1.00 0.00 C ATOM 1770 CG2 VAL B 51 -1.330 -3.108 -10.344 1.00 0.00 C ATOM 0 H VAL B 51 -3.853 -3.908 -10.179 1.00 0.00 H new ATOM 0 HA VAL B 51 -2.386 -6.183 -11.487 1.00 0.00 H new ATOM 0 HB VAL B 51 -0.299 -4.856 -11.071 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -0.619 -3.284 -12.966 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -1.369 -4.861 -13.309 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -2.382 -3.480 -12.829 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -0.531 -2.424 -10.629 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -2.294 -2.620 -10.486 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -1.214 -3.384 -9.296 1.00 0.00 H new ATOM 1780 N GLU B 52 -1.288 -6.754 -9.189 1.00 0.00 N ATOM 1781 CA GLU B 52 -1.015 -7.260 -7.811 1.00 0.00 C ATOM 1782 C GLU B 52 0.481 -7.494 -7.642 1.00 0.00 C ATOM 1783 O GLU B 52 1.198 -7.727 -8.596 1.00 0.00 O ATOM 1784 CB GLU B 52 -1.770 -8.570 -7.580 1.00 0.00 C ATOM 1785 CG GLU B 52 -3.234 -8.400 -8.003 1.00 0.00 C ATOM 1786 CD GLU B 52 -3.347 -8.484 -9.529 1.00 0.00 C ATOM 1787 OE1 GLU B 52 -2.525 -9.154 -10.133 1.00 0.00 O ATOM 1788 OE2 GLU B 52 -4.252 -7.870 -10.071 1.00 0.00 O ATOM 0 H GLU B 52 -0.756 -7.211 -9.930 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.351 -6.521 -7.083 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -1.307 -9.374 -8.151 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -1.715 -8.853 -6.529 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -3.848 -9.173 -7.541 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -3.614 -7.440 -7.653 1.00 0.00 H new ATOM 1795 N VAL B 53 0.955 -7.421 -6.427 1.00 0.00 N ATOM 1796 CA VAL B 53 2.412 -7.626 -6.161 1.00 0.00 C ATOM 1797 C VAL B 53 2.570 -8.616 -5.007 1.00 0.00 C ATOM 1798 O VAL B 53 1.689 -8.776 -4.186 1.00 0.00 O ATOM 1799 CB VAL B 53 3.049 -6.286 -5.771 1.00 0.00 C ATOM 1800 CG1 VAL B 53 4.479 -6.516 -5.273 1.00 0.00 C ATOM 1801 CG2 VAL B 53 3.074 -5.354 -6.986 1.00 0.00 C ATOM 0 H VAL B 53 0.392 -7.227 -5.599 1.00 0.00 H new ATOM 0 HA VAL B 53 2.901 -8.016 -7.054 1.00 0.00 H new ATOM 0 HB VAL B 53 2.460 -5.829 -4.976 1.00 0.00 H new ATOM 0 HG11 VAL B 53 4.926 -5.561 -4.998 1.00 0.00 H new ATOM 0 HG12 VAL B 53 4.460 -7.172 -4.403 1.00 0.00 H new ATOM 0 HG13 VAL B 53 5.070 -6.979 -6.064 1.00 0.00 H new ATOM 0 HG21 VAL B 53 3.527 -4.403 -6.706 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.657 -5.813 -7.784 1.00 0.00 H new ATOM 0 HG23 VAL B 53 2.055 -5.182 -7.334 1.00 0.00 H new ATOM 1811 N GLU B 54 3.695 -9.275 -4.937 1.00 0.00 N ATOM 1812 CA GLU B 54 3.939 -10.254 -3.835 1.00 0.00 C ATOM 1813 C GLU B 54 5.377 -10.095 -3.345 1.00 0.00 C ATOM 1814 O GLU B 54 6.304 -9.999 -4.128 1.00 0.00 O ATOM 1815 CB GLU B 54 3.718 -11.678 -4.359 1.00 0.00 C ATOM 1816 CG GLU B 54 4.077 -12.696 -3.272 1.00 0.00 C ATOM 1817 CD GLU B 54 3.713 -14.103 -3.752 1.00 0.00 C ATOM 1818 OE1 GLU B 54 2.544 -14.442 -3.695 1.00 0.00 O ATOM 1819 OE2 GLU B 54 4.611 -14.818 -4.167 1.00 0.00 O ATOM 0 H GLU B 54 4.463 -9.177 -5.601 1.00 0.00 H new ATOM 0 HA GLU B 54 3.250 -10.070 -3.011 1.00 0.00 H new ATOM 0 HB2 GLU B 54 2.678 -11.806 -4.660 1.00 0.00 H new ATOM 0 HB3 GLU B 54 4.330 -11.848 -5.245 1.00 0.00 H new ATOM 0 HG2 GLU B 54 5.142 -12.642 -3.045 1.00 0.00 H new ATOM 0 HG3 GLU B 54 3.542 -12.465 -2.351 1.00 0.00 H new ATOM 1826 N GLY B 55 5.571 -10.064 -2.054 1.00 0.00 N ATOM 1827 CA GLY B 55 6.950 -9.905 -1.516 1.00 0.00 C ATOM 1828 C GLY B 55 6.881 -9.371 -0.086 1.00 0.00 C ATOM 1829 O GLY B 55 5.816 -9.126 0.446 1.00 0.00 O ATOM 0 H GLY B 55 4.836 -10.142 -1.351 1.00 0.00 H new ATOM 0 HA2 GLY B 55 7.471 -10.862 -1.533 1.00 0.00 H new ATOM 0 HA3 GLY B 55 7.520 -9.220 -2.144 1.00 0.00 H new ATOM 1833 N LEU B 56 8.012 -9.194 0.544 1.00 0.00 N ATOM 1834 CA LEU B 56 8.026 -8.678 1.944 1.00 0.00 C ATOM 1835 C LEU B 56 8.249 -7.162 1.918 1.00 0.00 C ATOM 1836 O LEU B 56 9.044 -6.656 1.152 1.00 0.00 O ATOM 1837 CB LEU B 56 9.160 -9.357 2.730 1.00 0.00 C ATOM 1838 CG LEU B 56 10.411 -9.535 1.833 1.00 0.00 C ATOM 1839 CD1 LEU B 56 11.684 -9.448 2.687 1.00 0.00 C ATOM 1840 CD2 LEU B 56 10.375 -10.906 1.133 1.00 0.00 C ATOM 0 H LEU B 56 8.932 -9.386 0.147 1.00 0.00 H new ATOM 0 HA LEU B 56 7.074 -8.898 2.428 1.00 0.00 H new ATOM 0 HB2 LEU B 56 9.414 -8.757 3.604 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.826 -10.328 3.096 1.00 0.00 H new ATOM 0 HG LEU B 56 10.413 -8.743 1.084 1.00 0.00 H new ATOM 0 HD11 LEU B 56 12.559 -9.574 2.050 1.00 0.00 H new ATOM 0 HD12 LEU B 56 11.728 -8.475 3.176 1.00 0.00 H new ATOM 0 HD13 LEU B 56 11.670 -10.233 3.443 1.00 0.00 H new ATOM 0 HD21 LEU B 56 11.260 -11.018 0.506 1.00 0.00 H new ATOM 0 HD22 LEU B 56 10.359 -11.697 1.883 1.00 0.00 H new ATOM 0 HD23 LEU B 56 9.481 -10.975 0.514 1.00 0.00 H new ATOM 1852 N ILE B 57 7.554 -6.436 2.751 1.00 0.00 N ATOM 1853 CA ILE B 57 7.729 -4.955 2.778 1.00 0.00 C ATOM 1854 C ILE B 57 8.889 -4.601 3.710 1.00 0.00 C ATOM 1855 O ILE B 57 8.854 -4.876 4.893 1.00 0.00 O ATOM 1856 CB ILE B 57 6.439 -4.309 3.299 1.00 0.00 C ATOM 1857 CG1 ILE B 57 5.264 -4.641 2.359 1.00 0.00 C ATOM 1858 CG2 ILE B 57 6.615 -2.794 3.407 1.00 0.00 C ATOM 1859 CD1 ILE B 57 5.565 -4.199 0.918 1.00 0.00 C ATOM 0 H ILE B 57 6.872 -6.804 3.414 1.00 0.00 H new ATOM 0 HA ILE B 57 7.945 -4.588 1.774 1.00 0.00 H new ATOM 0 HB ILE B 57 6.221 -4.708 4.290 1.00 0.00 H new ATOM 0 HG12 ILE B 57 5.069 -5.713 2.380 1.00 0.00 H new ATOM 0 HG13 ILE B 57 4.360 -4.146 2.713 1.00 0.00 H new ATOM 0 HG21 ILE B 57 5.693 -2.346 3.778 1.00 0.00 H new ATOM 0 HG22 ILE B 57 7.430 -2.571 4.096 1.00 0.00 H new ATOM 0 HG23 ILE B 57 6.848 -2.384 2.424 1.00 0.00 H new ATOM 0 HD11 ILE B 57 4.718 -4.446 0.277 1.00 0.00 H new ATOM 0 HD12 ILE B 57 5.735 -3.123 0.896 1.00 0.00 H new ATOM 0 HD13 ILE B 57 6.455 -4.715 0.558 1.00 0.00 H new ATOM 1871 N ASP B 58 9.923 -3.992 3.179 1.00 0.00 N ATOM 1872 CA ASP B 58 11.104 -3.613 4.017 1.00 0.00 C ATOM 1873 C ASP B 58 11.127 -2.098 4.219 1.00 0.00 C ATOM 1874 O ASP B 58 11.573 -1.604 5.236 1.00 0.00 O ATOM 1875 CB ASP B 58 12.387 -4.043 3.303 1.00 0.00 C ATOM 1876 CG ASP B 58 13.575 -3.893 4.252 1.00 0.00 C ATOM 1877 OD1 ASP B 58 13.348 -3.812 5.448 1.00 0.00 O ATOM 1878 OD2 ASP B 58 14.695 -3.863 3.768 1.00 0.00 O ATOM 0 H ASP B 58 9.999 -3.740 2.194 1.00 0.00 H new ATOM 0 HA ASP B 58 11.034 -4.108 4.986 1.00 0.00 H new ATOM 0 HB2 ASP B 58 12.302 -5.078 2.971 1.00 0.00 H new ATOM 0 HB3 ASP B 58 12.541 -3.434 2.412 1.00 0.00 H new ATOM 1883 N ALA B 59 10.654 -1.352 3.256 1.00 0.00 N ATOM 1884 CA ALA B 59 10.660 0.130 3.405 1.00 0.00 C ATOM 1885 C ALA B 59 9.665 0.765 2.430 1.00 0.00 C ATOM 1886 O ALA B 59 9.451 0.277 1.336 1.00 0.00 O ATOM 1887 CB ALA B 59 12.069 0.661 3.126 1.00 0.00 C ATOM 0 H ALA B 59 10.267 -1.702 2.380 1.00 0.00 H new ATOM 0 HA ALA B 59 10.365 0.388 4.422 1.00 0.00 H new ATOM 0 HB1 ALA B 59 12.077 1.746 3.234 1.00 0.00 H new ATOM 0 HB2 ALA B 59 12.771 0.220 3.834 1.00 0.00 H new ATOM 0 HB3 ALA B 59 12.363 0.395 2.111 1.00 0.00 H new ATOM 1893 N LEU B 60 9.062 1.862 2.824 1.00 0.00 N ATOM 1894 CA LEU B 60 8.074 2.566 1.941 1.00 0.00 C ATOM 1895 C LEU B 60 8.450 4.051 1.876 1.00 0.00 C ATOM 1896 O LEU B 60 8.759 4.665 2.879 1.00 0.00 O ATOM 1897 CB LEU B 60 6.652 2.409 2.539 1.00 0.00 C ATOM 1898 CG LEU B 60 5.798 1.422 1.713 1.00 0.00 C ATOM 1899 CD1 LEU B 60 5.511 2.001 0.310 1.00 0.00 C ATOM 1900 CD2 LEU B 60 6.522 0.064 1.595 1.00 0.00 C ATOM 0 H LEU B 60 9.213 2.305 3.730 1.00 0.00 H new ATOM 0 HA LEU B 60 8.088 2.138 0.939 1.00 0.00 H new ATOM 0 HB2 LEU B 60 6.725 2.056 3.568 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.159 3.381 2.570 1.00 0.00 H new ATOM 0 HG LEU B 60 4.848 1.270 2.224 1.00 0.00 H new ATOM 0 HD11 LEU B 60 4.908 1.293 -0.259 1.00 0.00 H new ATOM 0 HD12 LEU B 60 4.970 2.942 0.408 1.00 0.00 H new ATOM 0 HD13 LEU B 60 6.452 2.177 -0.211 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.911 -0.624 1.011 1.00 0.00 H new ATOM 0 HD22 LEU B 60 7.483 0.206 1.100 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.684 -0.350 2.590 1.00 0.00 H new ATOM 1912 N VAL B 61 8.421 4.634 0.703 1.00 0.00 N ATOM 1913 CA VAL B 61 8.769 6.085 0.571 1.00 0.00 C ATOM 1914 C VAL B 61 7.747 6.776 -0.339 1.00 0.00 C ATOM 1915 O VAL B 61 7.471 6.326 -1.434 1.00 0.00 O ATOM 1916 CB VAL B 61 10.166 6.214 -0.035 1.00 0.00 C ATOM 1917 CG1 VAL B 61 10.511 7.693 -0.215 1.00 0.00 C ATOM 1918 CG2 VAL B 61 11.183 5.568 0.907 1.00 0.00 C ATOM 0 H VAL B 61 8.171 4.169 -0.170 1.00 0.00 H new ATOM 0 HA VAL B 61 8.753 6.557 1.553 1.00 0.00 H new ATOM 0 HB VAL B 61 10.192 5.716 -1.004 1.00 0.00 H new ATOM 0 HG11 VAL B 61 11.507 7.784 -0.647 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.783 8.158 -0.880 1.00 0.00 H new ATOM 0 HG13 VAL B 61 10.489 8.192 0.754 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.182 5.657 0.480 1.00 0.00 H new ATOM 0 HG22 VAL B 61 11.155 6.072 1.873 1.00 0.00 H new ATOM 0 HG23 VAL B 61 10.938 4.514 1.040 1.00 0.00 H new ATOM 1928 N TYR B 62 7.191 7.873 0.103 1.00 0.00 N ATOM 1929 CA TYR B 62 6.196 8.619 -0.730 1.00 0.00 C ATOM 1930 C TYR B 62 6.389 10.123 -0.461 1.00 0.00 C ATOM 1931 O TYR B 62 6.307 10.542 0.676 1.00 0.00 O ATOM 1932 CB TYR B 62 4.776 8.209 -0.316 1.00 0.00 C ATOM 1933 CG TYR B 62 3.771 9.089 -1.026 1.00 0.00 C ATOM 1934 CD1 TYR B 62 3.393 10.312 -0.462 1.00 0.00 C ATOM 1935 CD2 TYR B 62 3.222 8.684 -2.249 1.00 0.00 C ATOM 1936 CE1 TYR B 62 2.467 11.130 -1.119 1.00 0.00 C ATOM 1937 CE2 TYR B 62 2.293 9.501 -2.906 1.00 0.00 C ATOM 1938 CZ TYR B 62 1.916 10.726 -2.339 1.00 0.00 C ATOM 1939 OH TYR B 62 1.004 11.536 -2.984 1.00 0.00 O ATOM 0 H TYR B 62 7.384 8.290 1.014 1.00 0.00 H new ATOM 0 HA TYR B 62 6.339 8.396 -1.787 1.00 0.00 H new ATOM 0 HB2 TYR B 62 4.600 7.163 -0.566 1.00 0.00 H new ATOM 0 HB3 TYR B 62 4.659 8.303 0.764 1.00 0.00 H new ATOM 0 HD1 TYR B 62 3.816 10.625 0.481 1.00 0.00 H new ATOM 0 HD2 TYR B 62 3.515 7.741 -2.686 1.00 0.00 H new ATOM 0 HE1 TYR B 62 2.177 12.075 -0.683 1.00 0.00 H new ATOM 0 HE2 TYR B 62 1.868 9.187 -3.848 1.00 0.00 H new ATOM 0 HH TYR B 62 0.331 11.847 -2.343 1.00 0.00 H new ATOM 1949 N PRO B 63 6.643 10.943 -1.462 1.00 0.00 N ATOM 1950 CA PRO B 63 6.842 12.404 -1.240 1.00 0.00 C ATOM 1951 C PRO B 63 5.831 12.982 -0.243 1.00 0.00 C ATOM 1952 O PRO B 63 4.794 13.496 -0.612 1.00 0.00 O ATOM 1953 CB PRO B 63 6.655 13.016 -2.631 1.00 0.00 C ATOM 1954 CG PRO B 63 7.066 11.936 -3.587 1.00 0.00 C ATOM 1955 CD PRO B 63 6.773 10.593 -2.891 1.00 0.00 C ATOM 0 HA PRO B 63 7.818 12.621 -0.806 1.00 0.00 H new ATOM 0 HB2 PRO B 63 5.620 13.315 -2.795 1.00 0.00 H new ATOM 0 HB3 PRO B 63 7.269 13.908 -2.756 1.00 0.00 H new ATOM 0 HG2 PRO B 63 6.512 12.016 -4.522 1.00 0.00 H new ATOM 0 HG3 PRO B 63 8.124 12.021 -3.835 1.00 0.00 H new ATOM 0 HD2 PRO B 63 5.860 10.138 -3.274 1.00 0.00 H new ATOM 0 HD3 PRO B 63 7.578 9.877 -3.053 1.00 0.00 H new ATOM 1963 N LEU B 64 6.138 12.904 1.022 1.00 0.00 N ATOM 1964 CA LEU B 64 5.223 13.449 2.061 1.00 0.00 C ATOM 1965 C LEU B 64 5.675 14.867 2.410 1.00 0.00 C ATOM 1966 O LEU B 64 5.374 15.394 3.463 1.00 0.00 O ATOM 1967 CB LEU B 64 5.248 12.544 3.305 1.00 0.00 C ATOM 1968 CG LEU B 64 6.543 12.727 4.118 1.00 0.00 C ATOM 1969 CD1 LEU B 64 6.600 11.669 5.224 1.00 0.00 C ATOM 1970 CD2 LEU B 64 7.774 12.571 3.220 1.00 0.00 C ATOM 0 H LEU B 64 6.993 12.481 1.383 1.00 0.00 H new ATOM 0 HA LEU B 64 4.200 13.479 1.687 1.00 0.00 H new ATOM 0 HB2 LEU B 64 4.388 12.769 3.936 1.00 0.00 H new ATOM 0 HB3 LEU B 64 5.155 11.502 2.999 1.00 0.00 H new ATOM 0 HG LEU B 64 6.543 13.728 4.549 1.00 0.00 H new ATOM 0 HD11 LEU B 64 7.516 11.796 5.802 1.00 0.00 H new ATOM 0 HD12 LEU B 64 5.738 11.783 5.881 1.00 0.00 H new ATOM 0 HD13 LEU B 64 6.587 10.675 4.777 1.00 0.00 H new ATOM 0 HD21 LEU B 64 8.678 12.704 3.815 1.00 0.00 H new ATOM 0 HD22 LEU B 64 7.776 11.576 2.775 1.00 0.00 H new ATOM 0 HD23 LEU B 64 7.746 13.322 2.430 1.00 0.00 H new ATOM 1982 N GLU B 65 6.405 15.478 1.513 1.00 0.00 N ATOM 1983 CA GLU B 65 6.910 16.870 1.750 1.00 0.00 C ATOM 1984 C GLU B 65 5.817 17.733 2.408 1.00 0.00 C ATOM 1985 O GLU B 65 4.638 17.469 2.286 1.00 0.00 O ATOM 1986 CB GLU B 65 7.350 17.518 0.406 1.00 0.00 C ATOM 1987 CG GLU B 65 6.728 16.791 -0.799 1.00 0.00 C ATOM 1988 CD GLU B 65 5.198 16.866 -0.747 1.00 0.00 C ATOM 1989 OE1 GLU B 65 4.627 16.391 0.216 1.00 0.00 O ATOM 1990 OE2 GLU B 65 4.621 17.388 -1.687 1.00 0.00 O ATOM 0 H GLU B 65 6.677 15.071 0.618 1.00 0.00 H new ATOM 0 HA GLU B 65 7.769 16.815 2.419 1.00 0.00 H new ATOM 0 HB2 GLU B 65 7.054 18.567 0.392 1.00 0.00 H new ATOM 0 HB3 GLU B 65 8.437 17.492 0.327 1.00 0.00 H new ATOM 0 HG2 GLU B 65 7.088 17.239 -1.725 1.00 0.00 H new ATOM 0 HG3 GLU B 65 7.046 15.748 -0.805 1.00 0.00 H new ATOM 1997 N HIS B 66 6.217 18.774 3.107 1.00 0.00 N ATOM 1998 CA HIS B 66 5.230 19.684 3.777 1.00 0.00 C ATOM 1999 C HIS B 66 5.488 21.128 3.331 1.00 0.00 C ATOM 2000 O HIS B 66 4.676 22.005 3.547 1.00 0.00 O ATOM 2001 CB HIS B 66 5.393 19.586 5.299 1.00 0.00 C ATOM 2002 CG HIS B 66 4.771 18.308 5.790 1.00 0.00 C ATOM 2003 ND1 HIS B 66 5.018 17.084 5.185 1.00 0.00 N ATOM 2004 CD2 HIS B 66 3.905 18.047 6.825 1.00 0.00 C ATOM 2005 CE1 HIS B 66 4.313 16.152 5.850 1.00 0.00 C ATOM 2006 NE2 HIS B 66 3.619 16.687 6.857 1.00 0.00 N ATOM 0 H HIS B 66 7.194 19.033 3.242 1.00 0.00 H new ATOM 0 HA HIS B 66 4.218 19.389 3.500 1.00 0.00 H new ATOM 0 HB2 HIS B 66 6.450 19.614 5.565 1.00 0.00 H new ATOM 0 HB3 HIS B 66 4.920 20.442 5.782 1.00 0.00 H new ATOM 0 HD1 HIS B 66 5.625 16.921 4.381 1.00 0.00 H new ATOM 0 HD2 HIS B 66 3.508 18.784 7.507 1.00 0.00 H new ATOM 0 HE1 HIS B 66 4.309 15.101 5.600 1.00 0.00 H new ATOM 2014 N HIS B 67 6.613 21.385 2.712 1.00 0.00 N ATOM 2015 CA HIS B 67 6.910 22.779 2.257 1.00 0.00 C ATOM 2016 C HIS B 67 7.807 22.733 1.017 1.00 0.00 C ATOM 2017 O HIS B 67 8.454 21.743 0.742 1.00 0.00 O ATOM 2018 CB HIS B 67 7.638 23.539 3.374 1.00 0.00 C ATOM 2019 CG HIS B 67 8.990 22.922 3.617 1.00 0.00 C ATOM 2020 ND1 HIS B 67 9.149 21.583 3.943 1.00 0.00 N ATOM 2021 CD2 HIS B 67 10.258 23.453 3.585 1.00 0.00 C ATOM 2022 CE1 HIS B 67 10.469 21.354 4.092 1.00 0.00 C ATOM 2023 NE2 HIS B 67 11.183 22.461 3.886 1.00 0.00 N ATOM 0 H HIS B 67 7.335 20.695 2.503 1.00 0.00 H new ATOM 0 HA HIS B 67 5.975 23.285 2.016 1.00 0.00 H new ATOM 0 HB2 HIS B 67 7.751 24.587 3.098 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.047 23.512 4.289 1.00 0.00 H new ATOM 0 HD2 HIS B 67 10.498 24.482 3.361 1.00 0.00 H new ATOM 0 HE1 HIS B 67 10.895 20.395 4.346 1.00 0.00 H new ATOM 0 HE2 HIS B 67 12.197 22.559 3.938 1.00 0.00 H new ATOM 2031 N HIS B 68 7.859 23.805 0.273 1.00 0.00 N ATOM 2032 CA HIS B 68 8.724 23.829 -0.939 1.00 0.00 C ATOM 2033 C HIS B 68 8.915 25.281 -1.388 1.00 0.00 C ATOM 2034 O HIS B 68 9.982 25.674 -1.819 1.00 0.00 O ATOM 2035 CB HIS B 68 8.069 23.018 -2.064 1.00 0.00 C ATOM 2036 CG HIS B 68 6.621 23.409 -2.207 1.00 0.00 C ATOM 2037 ND1 HIS B 68 6.227 24.715 -2.464 1.00 0.00 N ATOM 2038 CD2 HIS B 68 5.461 22.676 -2.139 1.00 0.00 C ATOM 2039 CE1 HIS B 68 4.884 24.728 -2.540 1.00 0.00 C ATOM 2040 NE2 HIS B 68 4.370 23.513 -2.349 1.00 0.00 N ATOM 0 H HIS B 68 7.340 24.664 0.453 1.00 0.00 H new ATOM 0 HA HIS B 68 9.693 23.387 -0.706 1.00 0.00 H new ATOM 0 HB2 HIS B 68 8.595 23.192 -3.003 1.00 0.00 H new ATOM 0 HB3 HIS B 68 8.147 21.952 -1.848 1.00 0.00 H new ATOM 0 HD2 HIS B 68 5.405 21.614 -1.951 1.00 0.00 H new ATOM 0 HE1 HIS B 68 4.295 25.613 -2.732 1.00 0.00 H new ATOM 0 HE2 HIS B 68 3.384 23.252 -2.355 1.00 0.00 H new ATOM 2048 N HIS B 69 7.880 26.075 -1.291 1.00 0.00 N ATOM 2049 CA HIS B 69 7.966 27.510 -1.709 1.00 0.00 C ATOM 2050 C HIS B 69 8.010 28.406 -0.469 1.00 0.00 C ATOM 2051 O HIS B 69 7.123 28.376 0.364 1.00 0.00 O ATOM 2052 CB HIS B 69 6.731 27.858 -2.541 1.00 0.00 C ATOM 2053 CG HIS B 69 6.745 29.325 -2.874 1.00 0.00 C ATOM 2054 ND1 HIS B 69 5.878 30.227 -2.275 1.00 0.00 N ATOM 2055 CD2 HIS B 69 7.517 30.064 -3.736 1.00 0.00 C ATOM 2056 CE1 HIS B 69 6.145 31.445 -2.778 1.00 0.00 C ATOM 2057 NE2 HIS B 69 7.134 31.398 -3.674 1.00 0.00 N ATOM 0 H HIS B 69 6.968 25.788 -0.936 1.00 0.00 H new ATOM 0 HA HIS B 69 8.869 27.667 -2.298 1.00 0.00 H new ATOM 0 HB2 HIS B 69 6.718 27.267 -3.457 1.00 0.00 H new ATOM 0 HB3 HIS B 69 5.825 27.609 -1.988 1.00 0.00 H new ATOM 0 HD2 HIS B 69 8.301 29.669 -4.365 1.00 0.00 H new ATOM 0 HE1 HIS B 69 5.625 32.348 -2.493 1.00 0.00 H new ATOM 0 HE2 HIS B 69 7.526 32.178 -4.202 1.00 0.00 H new ATOM 2065 N HIS B 70 9.029 29.209 -0.340 1.00 0.00 N ATOM 2066 CA HIS B 70 9.121 30.111 0.842 1.00 0.00 C ATOM 2067 C HIS B 70 10.349 31.014 0.697 1.00 0.00 C ATOM 2068 O HIS B 70 11.310 30.678 0.034 1.00 0.00 O ATOM 2069 CB HIS B 70 9.221 29.262 2.124 1.00 0.00 C ATOM 2070 CG HIS B 70 9.756 30.082 3.278 1.00 0.00 C ATOM 2071 ND1 HIS B 70 11.015 30.665 3.248 1.00 0.00 N ATOM 2072 CD2 HIS B 70 9.223 30.408 4.502 1.00 0.00 C ATOM 2073 CE1 HIS B 70 11.198 31.304 4.418 1.00 0.00 C ATOM 2074 NE2 HIS B 70 10.138 31.177 5.215 1.00 0.00 N ATOM 0 H HIS B 70 9.802 29.280 -1.002 1.00 0.00 H new ATOM 0 HA HIS B 70 8.231 30.737 0.904 1.00 0.00 H new ATOM 0 HB2 HIS B 70 8.238 28.866 2.380 1.00 0.00 H new ATOM 0 HB3 HIS B 70 9.873 28.407 1.948 1.00 0.00 H new ATOM 0 HD2 HIS B 70 8.246 30.113 4.856 1.00 0.00 H new ATOM 0 HE1 HIS B 70 12.092 31.851 4.678 1.00 0.00 H new ATOM 0 HE2 HIS B 70 10.021 31.563 6.152 1.00 0.00 H new ATOM 2082 N HIS B 71 10.325 32.149 1.338 1.00 0.00 N ATOM 2083 CA HIS B 71 11.489 33.078 1.272 1.00 0.00 C ATOM 2084 C HIS B 71 11.250 34.255 2.220 1.00 0.00 C ATOM 2085 O HIS B 71 10.464 35.121 1.871 1.00 0.00 O ATOM 2086 CB HIS B 71 11.668 33.607 -0.153 1.00 0.00 C ATOM 2087 CG HIS B 71 12.812 34.583 -0.165 1.00 0.00 C ATOM 2088 ND1 HIS B 71 13.903 34.442 0.680 1.00 0.00 N ATOM 2089 CD2 HIS B 71 13.050 35.721 -0.898 1.00 0.00 C ATOM 2090 CE1 HIS B 71 14.740 35.468 0.442 1.00 0.00 C ATOM 2091 NE2 HIS B 71 14.266 36.275 -0.510 1.00 0.00 N ATOM 2092 OXT HIS B 71 11.856 34.270 3.278 1.00 0.00 O ATOM 0 H HIS B 71 9.545 32.475 1.908 1.00 0.00 H new ATOM 0 HA HIS B 71 12.389 32.538 1.565 1.00 0.00 H new ATOM 0 HB2 HIS B 71 11.866 32.784 -0.839 1.00 0.00 H new ATOM 0 HB3 HIS B 71 10.753 34.093 -0.493 1.00 0.00 H new ATOM 0 HD2 HIS B 71 12.395 36.123 -1.657 1.00 0.00 H new ATOM 0 HE1 HIS B 71 15.677 35.620 0.956 1.00 0.00 H new ATOM 0 HE2 HIS B 71 14.704 37.120 -0.876 1.00 0.00 H new TER 2100 HIS B 71