USER MOD reduce.3.24.130724 H: found=0, std=0, add=1131, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1118 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 113 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.603) USER MOD Set 1.2: A 122 GLN : amide:sc= -0.0257 K(o=-0.026,f=-1) USER MOD Set 2.1: A 94 SER OG : rot 78:sc= 0.00742 USER MOD Set 2.2: A 97 HIS : no HE2:sc= -4.73! C(o=-4.7!,f=-5!) USER MOD Set 3.1: A 73 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 56 THR OG1 : rot -160:sc= -0.424 USER MOD Set 4.2: A 58 GLN : amide:sc= -2.04! K(o=-2.5!,f=-3) USER MOD Set 5.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 89 TYR OH : rot 180:sc= -1.28 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 166:sc= 0 (180deg=-0.137) USER MOD Single : A 2 ASN : amide:sc=-0.00451 X(o=-0.0045,f=-0.21) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 160:sc= -2.63 USER MOD Single : A 13 ASN : amide:sc= -2.02 K(o=-2,f=-4.9!) USER MOD Single : A 16 HIS : no HD1:sc= -5.23! C(o=-5.2!,f=-5.4!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 HIS : no HD1:sc= -2.84! C(o=-2.8!,f=-4.7!) USER MOD Single : A 38 GLN : amide:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : A 40 GLN : amide:sc= -0.225 K(o=-0.22,f=-3.9!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 120:sc= -0.594! USER MOD Single : A 50 TYR OH : rot 15:sc= -0.757 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot -84:sc= 0.00628 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.102 USER MOD Single : A 62 MET CE :methyl -152:sc= -0.481 (180deg=-2.2!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0149 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -110:sc= 0.461 USER MOD Single : A 72 GLN : amide:sc= -0.0255 X(o=-0.025,f=-0.17) USER MOD Single : A 78 CYS SG : rot 70:sc= -5.23! USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 HIS : no HD1:sc= -0.233 X(o=-0.23,f=-0.3) USER MOD Single : A 90 ASN : amide:sc= -0.582 K(o=-0.58,f=-4.9!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -1.41 K(o=-1.4,f=-3.7!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -0.0841 K(o=-0.084,f=-1.6!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot 21:sc= 0.481 USER MOD Single : A 118 THR OG1 : rot -76:sc= 0.845 USER MOD Single : A 119 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.23) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.163) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 HIS : no HD1:sc= -0.12 X(o=-0.12,f=-0.38) USER MOD Single : A 139 HIS : no HD1:sc= -0.647 K(o=-0.65,f=-0.1) USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 142 HIS : no HD1:sc= -0.395 X(o=-0.4,f=-0.02) USER MOD Single : A 143 HIS : no HD1:sc= -0.0451 X(o=-0.045,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.087 -14.157 11.865 1.00 0.00 N ATOM 2 CA MET A 1 -0.144 -14.107 10.431 1.00 0.00 C ATOM 3 C MET A 1 0.391 -12.803 9.836 1.00 0.00 C ATOM 4 O MET A 1 -0.327 -12.098 9.129 1.00 0.00 O ATOM 5 CB MET A 1 -1.643 -14.219 10.150 1.00 0.00 C ATOM 6 CG MET A 1 -2.415 -13.085 10.830 1.00 0.00 C ATOM 7 SD MET A 1 -3.733 -12.521 9.768 1.00 0.00 S ATOM 8 CE MET A 1 -3.575 -10.757 9.987 1.00 0.00 C ATOM 0 H1 MET A 1 -0.482 -14.921 12.282 1.00 0.00 H new ATOM 0 H2 MET A 1 1.095 -14.336 12.048 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.186 -13.249 12.293 1.00 0.00 H new ATOM 0 HA MET A 1 0.384 -14.941 9.968 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.818 -14.189 9.075 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.013 -15.180 10.507 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.824 -13.431 11.779 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.740 -12.259 11.056 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.330 -10.247 9.388 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.716 -10.507 11.038 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.583 -10.438 9.668 1.00 0.00 H new ATOM 18 N ASN A 2 1.649 -12.521 10.143 1.00 0.00 N ATOM 19 CA ASN A 2 2.289 -11.315 9.647 1.00 0.00 C ATOM 20 C ASN A 2 3.246 -11.680 8.511 1.00 0.00 C ATOM 21 O ASN A 2 4.206 -12.421 8.718 1.00 0.00 O ATOM 22 CB ASN A 2 3.101 -10.630 10.748 1.00 0.00 C ATOM 23 CG ASN A 2 3.042 -9.107 10.607 1.00 0.00 C ATOM 24 OD1 ASN A 2 1.983 -8.507 10.518 1.00 0.00 O ATOM 25 ND2 ASN A 2 4.234 -8.519 10.590 1.00 0.00 N ATOM 0 H ASN A 2 2.242 -13.108 10.730 1.00 0.00 H new ATOM 0 HA ASN A 2 1.509 -10.638 9.300 1.00 0.00 H new ATOM 0 HB2 ASN A 2 2.716 -10.923 11.725 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.138 -10.963 10.701 1.00 0.00 H new ATOM 0 HD21 ASN A 2 4.301 -7.505 10.498 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.081 -9.081 10.669 1.00 0.00 H new ATOM 32 N TYR A 3 2.952 -11.143 7.336 1.00 0.00 N ATOM 33 CA TYR A 3 3.775 -11.403 6.167 1.00 0.00 C ATOM 34 C TYR A 3 4.830 -10.310 5.985 1.00 0.00 C ATOM 35 O TYR A 3 4.582 -9.308 5.316 1.00 0.00 O ATOM 36 CB TYR A 3 2.824 -11.382 4.969 1.00 0.00 C ATOM 37 CG TYR A 3 2.625 -12.747 4.308 1.00 0.00 C ATOM 38 CD1 TYR A 3 3.661 -13.333 3.608 1.00 0.00 C ATOM 39 CD2 TYR A 3 1.410 -13.394 4.411 1.00 0.00 C ATOM 40 CE1 TYR A 3 3.474 -14.618 2.986 1.00 0.00 C ATOM 41 CE2 TYR A 3 1.223 -14.679 3.789 1.00 0.00 C ATOM 42 CZ TYR A 3 2.264 -15.227 3.107 1.00 0.00 C ATOM 43 OH TYR A 3 2.088 -16.441 2.520 1.00 0.00 O ATOM 0 H TYR A 3 2.155 -10.529 7.168 1.00 0.00 H new ATOM 0 HA TYR A 3 4.298 -12.354 6.269 1.00 0.00 H new ATOM 0 HB2 TYR A 3 1.855 -11.003 5.294 1.00 0.00 H new ATOM 0 HB3 TYR A 3 3.207 -10.683 4.226 1.00 0.00 H new ATOM 0 HD1 TYR A 3 4.612 -12.827 3.527 1.00 0.00 H new ATOM 0 HD2 TYR A 3 0.599 -12.936 4.958 1.00 0.00 H new ATOM 0 HE1 TYR A 3 4.276 -15.087 2.436 1.00 0.00 H new ATOM 0 HE2 TYR A 3 0.278 -15.196 3.862 1.00 0.00 H new ATOM 0 HH TYR A 3 1.176 -16.757 2.689 1.00 0.00 H new ATOM 53 N LYS A 4 5.985 -10.541 6.592 1.00 0.00 N ATOM 54 CA LYS A 4 7.079 -9.588 6.505 1.00 0.00 C ATOM 55 C LYS A 4 7.912 -9.887 5.256 1.00 0.00 C ATOM 56 O LYS A 4 8.858 -10.671 5.310 1.00 0.00 O ATOM 57 CB LYS A 4 7.892 -9.587 7.801 1.00 0.00 C ATOM 58 CG LYS A 4 7.420 -8.478 8.743 1.00 0.00 C ATOM 59 CD LYS A 4 8.511 -7.423 8.939 1.00 0.00 C ATOM 60 CE LYS A 4 8.462 -6.839 10.352 1.00 0.00 C ATOM 61 NZ LYS A 4 7.379 -5.836 10.461 1.00 0.00 N ATOM 0 H LYS A 4 6.187 -11.373 7.146 1.00 0.00 H new ATOM 0 HA LYS A 4 6.694 -8.574 6.396 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.797 -10.554 8.295 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.949 -9.449 7.572 1.00 0.00 H new ATOM 0 HG2 LYS A 4 6.524 -8.008 8.337 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.147 -8.907 9.707 1.00 0.00 H new ATOM 0 HD2 LYS A 4 9.489 -7.869 8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 4 8.386 -6.625 8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.301 -7.637 11.076 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.419 -6.377 10.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 7.360 -5.450 11.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 7.550 -5.066 9.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 6.466 -6.287 10.250 1.00 0.00 H new ATOM 75 N LYS A 5 7.529 -9.246 4.162 1.00 0.00 N ATOM 76 CA LYS A 5 8.229 -9.434 2.902 1.00 0.00 C ATOM 77 C LYS A 5 8.000 -8.212 2.010 1.00 0.00 C ATOM 78 O LYS A 5 6.905 -7.651 1.988 1.00 0.00 O ATOM 79 CB LYS A 5 7.817 -10.756 2.252 1.00 0.00 C ATOM 80 CG LYS A 5 9.044 -11.554 1.807 1.00 0.00 C ATOM 81 CD LYS A 5 8.794 -13.059 1.931 1.00 0.00 C ATOM 82 CE LYS A 5 8.844 -13.737 0.561 1.00 0.00 C ATOM 83 NZ LYS A 5 10.050 -14.588 0.447 1.00 0.00 N ATOM 0 H LYS A 5 6.744 -8.596 4.121 1.00 0.00 H new ATOM 0 HA LYS A 5 9.303 -9.510 3.070 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.232 -11.345 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 5 7.176 -10.559 1.393 1.00 0.00 H new ATOM 0 HG2 LYS A 5 9.288 -11.306 0.774 1.00 0.00 H new ATOM 0 HG3 LYS A 5 9.905 -11.273 2.414 1.00 0.00 H new ATOM 0 HD2 LYS A 5 9.542 -13.503 2.588 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.822 -13.233 2.392 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.949 -14.343 0.416 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.849 -12.982 -0.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 10.068 -15.041 -0.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 10.901 -14.002 0.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.029 -15.320 1.185 1.00 0.00 H new ATOM 97 N PRO A 6 9.078 -7.826 1.276 1.00 0.00 N ATOM 98 CA PRO A 6 9.005 -6.682 0.384 1.00 0.00 C ATOM 99 C PRO A 6 8.220 -7.024 -0.885 1.00 0.00 C ATOM 100 O PRO A 6 8.328 -8.133 -1.405 1.00 0.00 O ATOM 101 CB PRO A 6 10.451 -6.308 0.105 1.00 0.00 C ATOM 102 CG PRO A 6 11.276 -7.531 0.471 1.00 0.00 C ATOM 103 CD PRO A 6 10.389 -8.467 1.275 1.00 0.00 C ATOM 0 HA PRO A 6 8.467 -5.841 0.822 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.590 -6.042 -0.943 1.00 0.00 H new ATOM 0 HB3 PRO A 6 10.752 -5.443 0.696 1.00 0.00 H new ATOM 0 HG2 PRO A 6 11.641 -8.029 -0.428 1.00 0.00 H new ATOM 0 HG3 PRO A 6 12.151 -7.241 1.052 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.345 -9.457 0.822 1.00 0.00 H new ATOM 0 HD3 PRO A 6 10.767 -8.597 2.289 1.00 0.00 H new ATOM 111 N LYS A 7 7.448 -6.050 -1.345 1.00 0.00 N ATOM 112 CA LYS A 7 6.646 -6.235 -2.542 1.00 0.00 C ATOM 113 C LYS A 7 6.583 -4.917 -3.317 1.00 0.00 C ATOM 114 O LYS A 7 6.801 -3.848 -2.749 1.00 0.00 O ATOM 115 CB LYS A 7 5.271 -6.803 -2.184 1.00 0.00 C ATOM 116 CG LYS A 7 5.363 -8.294 -1.852 1.00 0.00 C ATOM 117 CD LYS A 7 5.180 -8.533 -0.352 1.00 0.00 C ATOM 118 CE LYS A 7 3.845 -9.223 -0.066 1.00 0.00 C ATOM 119 NZ LYS A 7 3.967 -10.686 -0.252 1.00 0.00 N ATOM 0 H LYS A 7 7.361 -5.131 -0.911 1.00 0.00 H new ATOM 0 HA LYS A 7 7.108 -6.971 -3.200 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.861 -6.262 -1.332 1.00 0.00 H new ATOM 0 HB3 LYS A 7 4.584 -6.654 -3.017 1.00 0.00 H new ATOM 0 HG2 LYS A 7 4.601 -8.842 -2.407 1.00 0.00 H new ATOM 0 HG3 LYS A 7 6.330 -8.682 -2.171 1.00 0.00 H new ATOM 0 HD2 LYS A 7 5.999 -9.146 0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 7 5.223 -7.582 0.179 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.528 -9.005 0.954 1.00 0.00 H new ATOM 0 HE3 LYS A 7 3.076 -8.829 -0.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 3.052 -11.139 -0.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 4.249 -10.889 -1.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 4.686 -11.060 0.399 1.00 0.00 H new ATOM 133 N LEU A 8 6.285 -5.037 -4.602 1.00 0.00 N ATOM 134 CA LEU A 8 6.191 -3.868 -5.461 1.00 0.00 C ATOM 135 C LEU A 8 4.718 -3.540 -5.709 1.00 0.00 C ATOM 136 O LEU A 8 3.889 -4.440 -5.827 1.00 0.00 O ATOM 137 CB LEU A 8 6.999 -4.079 -6.743 1.00 0.00 C ATOM 138 CG LEU A 8 8.372 -4.730 -6.571 1.00 0.00 C ATOM 139 CD1 LEU A 8 9.112 -4.141 -5.369 1.00 0.00 C ATOM 140 CD2 LEU A 8 8.250 -6.253 -6.478 1.00 0.00 C ATOM 0 H LEU A 8 6.105 -5.926 -5.070 1.00 0.00 H new ATOM 0 HA LEU A 8 6.633 -3.000 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.410 -4.694 -7.423 1.00 0.00 H new ATOM 0 HB3 LEU A 8 7.136 -3.111 -7.226 1.00 0.00 H new ATOM 0 HG LEU A 8 8.968 -4.508 -7.457 1.00 0.00 H new ATOM 0 HD11 LEU A 8 10.085 -4.622 -5.270 1.00 0.00 H new ATOM 0 HD12 LEU A 8 9.250 -3.070 -5.516 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.529 -4.311 -4.464 1.00 0.00 H new ATOM 0 HD21 LEU A 8 9.241 -6.691 -6.356 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.629 -6.517 -5.622 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.793 -6.638 -7.390 1.00 0.00 H new ATOM 152 N LEU A 9 4.436 -2.247 -5.781 1.00 0.00 N ATOM 153 CA LEU A 9 3.077 -1.788 -6.013 1.00 0.00 C ATOM 154 C LEU A 9 2.850 -1.621 -7.517 1.00 0.00 C ATOM 155 O LEU A 9 3.323 -0.657 -8.116 1.00 0.00 O ATOM 156 CB LEU A 9 2.793 -0.522 -5.203 1.00 0.00 C ATOM 157 CG LEU A 9 2.404 -0.735 -3.739 1.00 0.00 C ATOM 158 CD1 LEU A 9 3.177 -1.907 -3.131 1.00 0.00 C ATOM 159 CD2 LEU A 9 2.585 0.552 -2.931 1.00 0.00 C ATOM 0 H LEU A 9 5.126 -1.503 -5.683 1.00 0.00 H new ATOM 0 HA LEU A 9 2.359 -2.529 -5.662 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.679 0.112 -5.234 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.991 0.028 -5.695 1.00 0.00 H new ATOM 0 HG LEU A 9 1.346 -0.993 -3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.882 -2.037 -2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.954 -2.817 -3.687 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.247 -1.703 -3.182 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.302 0.373 -1.894 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.628 0.865 -2.973 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.954 1.336 -3.350 1.00 0.00 H new ATOM 171 N TYR A 10 2.125 -2.574 -8.083 1.00 0.00 N ATOM 172 CA TYR A 10 1.829 -2.545 -9.505 1.00 0.00 C ATOM 173 C TYR A 10 0.767 -1.490 -9.822 1.00 0.00 C ATOM 174 O TYR A 10 -0.071 -1.174 -8.979 1.00 0.00 O ATOM 175 CB TYR A 10 1.275 -3.928 -9.850 1.00 0.00 C ATOM 176 CG TYR A 10 1.129 -4.184 -11.351 1.00 0.00 C ATOM 177 CD1 TYR A 10 2.206 -3.989 -12.192 1.00 0.00 C ATOM 178 CD2 TYR A 10 -0.080 -4.609 -11.864 1.00 0.00 C ATOM 179 CE1 TYR A 10 2.068 -4.230 -13.605 1.00 0.00 C ATOM 180 CE2 TYR A 10 -0.217 -4.850 -13.277 1.00 0.00 C ATOM 181 CZ TYR A 10 0.864 -4.648 -14.078 1.00 0.00 C ATOM 182 OH TYR A 10 0.734 -4.876 -15.413 1.00 0.00 O ATOM 0 H TYR A 10 1.733 -3.372 -7.582 1.00 0.00 H new ATOM 0 HA TYR A 10 2.723 -2.299 -10.078 1.00 0.00 H new ATOM 0 HB2 TYR A 10 1.931 -4.687 -9.425 1.00 0.00 H new ATOM 0 HB3 TYR A 10 0.301 -4.046 -9.375 1.00 0.00 H new ATOM 0 HD1 TYR A 10 3.152 -3.656 -11.791 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -0.923 -4.761 -11.206 1.00 0.00 H new ATOM 0 HE1 TYR A 10 2.903 -4.082 -14.274 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -1.157 -5.184 -13.692 1.00 0.00 H new ATOM 0 HH TYR A 10 -0.180 -5.171 -15.607 1.00 0.00 H new ATOM 192 N CYS A 11 0.838 -0.973 -11.040 1.00 0.00 N ATOM 193 CA CYS A 11 -0.107 0.040 -11.479 1.00 0.00 C ATOM 194 C CYS A 11 -0.571 -0.316 -12.893 1.00 0.00 C ATOM 195 O CYS A 11 -0.221 0.366 -13.855 1.00 0.00 O ATOM 196 CB CYS A 11 0.497 1.444 -11.413 1.00 0.00 C ATOM 197 SG CYS A 11 -0.677 2.664 -12.107 1.00 0.00 S ATOM 0 H CYS A 11 1.535 -1.237 -11.736 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.966 0.054 -10.809 1.00 0.00 H new ATOM 0 HB2 CYS A 11 0.731 1.700 -10.380 1.00 0.00 H new ATOM 0 HB3 CYS A 11 1.434 1.472 -11.969 1.00 0.00 H new ATOM 0 HG CYS A 11 -0.375 3.852 -11.674 1.00 0.00 H new ATOM 203 N SER A 12 -1.352 -1.383 -12.974 1.00 0.00 N ATOM 204 CA SER A 12 -1.867 -1.838 -14.254 1.00 0.00 C ATOM 205 C SER A 12 -2.153 -0.638 -15.159 1.00 0.00 C ATOM 206 O SER A 12 -1.944 -0.706 -16.370 1.00 0.00 O ATOM 207 CB SER A 12 -3.132 -2.679 -14.071 1.00 0.00 C ATOM 208 OG SER A 12 -3.793 -2.926 -15.310 1.00 0.00 O ATOM 0 H SER A 12 -1.641 -1.946 -12.174 1.00 0.00 H new ATOM 0 HA SER A 12 -1.110 -2.467 -14.724 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.872 -3.629 -13.603 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.813 -2.166 -13.392 1.00 0.00 H new ATOM 0 HG SER A 12 -4.595 -3.467 -15.151 1.00 0.00 H new ATOM 214 N ASN A 13 -2.625 0.432 -14.538 1.00 0.00 N ATOM 215 CA ASN A 13 -2.942 1.645 -15.272 1.00 0.00 C ATOM 216 C ASN A 13 -1.847 1.910 -16.308 1.00 0.00 C ATOM 217 O ASN A 13 -2.140 2.172 -17.473 1.00 0.00 O ATOM 218 CB ASN A 13 -3.009 2.854 -14.337 1.00 0.00 C ATOM 219 CG ASN A 13 -3.993 3.901 -14.863 1.00 0.00 C ATOM 220 OD1 ASN A 13 -4.984 3.592 -15.504 1.00 0.00 O ATOM 221 ND2 ASN A 13 -3.664 5.153 -14.558 1.00 0.00 N ATOM 0 H ASN A 13 -2.796 0.484 -13.534 1.00 0.00 H new ATOM 0 HA ASN A 13 -3.911 1.505 -15.751 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -3.314 2.532 -13.341 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.018 3.298 -14.239 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.256 5.925 -14.864 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.820 5.341 -14.018 1.00 0.00 H new ATOM 228 N GLY A 14 -0.608 1.831 -15.845 1.00 0.00 N ATOM 229 CA GLY A 14 0.532 2.058 -16.717 1.00 0.00 C ATOM 230 C GLY A 14 1.505 0.879 -16.666 1.00 0.00 C ATOM 231 O GLY A 14 2.077 0.496 -17.686 1.00 0.00 O ATOM 0 H GLY A 14 -0.369 1.613 -14.878 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.188 2.206 -17.741 1.00 0.00 H new ATOM 0 HA3 GLY A 14 1.046 2.972 -16.419 1.00 0.00 H new ATOM 235 N GLY A 15 1.664 0.336 -15.468 1.00 0.00 N ATOM 236 CA GLY A 15 2.559 -0.792 -15.270 1.00 0.00 C ATOM 237 C GLY A 15 3.924 -0.327 -14.762 1.00 0.00 C ATOM 238 O GLY A 15 4.879 -0.234 -15.532 1.00 0.00 O ATOM 0 H GLY A 15 1.188 0.656 -14.624 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.119 -1.488 -14.556 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.681 -1.333 -16.209 1.00 0.00 H new ATOM 242 N HIS A 16 3.974 -0.047 -13.468 1.00 0.00 N ATOM 243 CA HIS A 16 5.207 0.407 -12.847 1.00 0.00 C ATOM 244 C HIS A 16 5.109 0.242 -11.329 1.00 0.00 C ATOM 245 O HIS A 16 4.014 0.256 -10.769 1.00 0.00 O ATOM 246 CB HIS A 16 5.531 1.842 -13.267 1.00 0.00 C ATOM 247 CG HIS A 16 5.969 1.977 -14.706 1.00 0.00 C ATOM 248 ND1 HIS A 16 5.102 2.338 -15.723 1.00 0.00 N ATOM 249 CD2 HIS A 16 7.189 1.796 -15.287 1.00 0.00 C ATOM 250 CE1 HIS A 16 5.781 2.369 -16.860 1.00 0.00 C ATOM 251 NE2 HIS A 16 7.074 2.032 -16.588 1.00 0.00 N ATOM 0 H HIS A 16 3.180 -0.126 -12.832 1.00 0.00 H new ATOM 0 HA HIS A 16 6.039 -0.208 -13.192 1.00 0.00 H new ATOM 0 HB2 HIS A 16 4.651 2.464 -13.106 1.00 0.00 H new ATOM 0 HB3 HIS A 16 6.318 2.230 -12.620 1.00 0.00 H new ATOM 0 HD2 HIS A 16 8.096 1.509 -14.775 1.00 0.00 H new ATOM 0 HE1 HIS A 16 5.381 2.618 -17.832 1.00 0.00 H new ATOM 0 HE2 HIS A 16 7.828 1.971 -17.272 1.00 0.00 H new ATOM 259 N PHE A 17 6.269 0.088 -10.707 1.00 0.00 N ATOM 260 CA PHE A 17 6.327 -0.080 -9.265 1.00 0.00 C ATOM 261 C PHE A 17 6.724 1.227 -8.576 1.00 0.00 C ATOM 262 O PHE A 17 7.555 1.975 -9.088 1.00 0.00 O ATOM 263 CB PHE A 17 7.396 -1.137 -8.981 1.00 0.00 C ATOM 264 CG PHE A 17 7.075 -2.517 -9.558 1.00 0.00 C ATOM 265 CD1 PHE A 17 5.781 -2.894 -9.742 1.00 0.00 C ATOM 266 CD2 PHE A 17 8.084 -3.368 -9.887 1.00 0.00 C ATOM 267 CE1 PHE A 17 5.483 -4.175 -10.277 1.00 0.00 C ATOM 268 CE2 PHE A 17 7.786 -4.649 -10.423 1.00 0.00 C ATOM 269 CZ PHE A 17 6.492 -5.025 -10.606 1.00 0.00 C ATOM 0 H PHE A 17 7.175 0.076 -11.175 1.00 0.00 H new ATOM 0 HA PHE A 17 5.349 -0.377 -8.885 1.00 0.00 H new ATOM 0 HB2 PHE A 17 8.347 -0.796 -9.390 1.00 0.00 H new ATOM 0 HB3 PHE A 17 7.526 -1.227 -7.903 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.980 -2.218 -9.481 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.112 -3.070 -9.741 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.455 -4.474 -10.423 1.00 0.00 H new ATOM 0 HE2 PHE A 17 8.587 -5.324 -10.685 1.00 0.00 H new ATOM 0 HZ PHE A 17 6.266 -5.999 -11.013 1.00 0.00 H new ATOM 279 N LEU A 18 6.111 1.462 -7.425 1.00 0.00 N ATOM 280 CA LEU A 18 6.390 2.666 -6.661 1.00 0.00 C ATOM 281 C LEU A 18 7.707 2.490 -5.903 1.00 0.00 C ATOM 282 O LEU A 18 7.808 1.646 -5.014 1.00 0.00 O ATOM 283 CB LEU A 18 5.204 3.016 -5.760 1.00 0.00 C ATOM 284 CG LEU A 18 5.209 4.423 -5.161 1.00 0.00 C ATOM 285 CD1 LEU A 18 4.747 5.458 -6.189 1.00 0.00 C ATOM 286 CD2 LEU A 18 4.374 4.477 -3.879 1.00 0.00 C ATOM 0 H LEU A 18 5.422 0.839 -7.003 1.00 0.00 H new ATOM 0 HA LEU A 18 6.517 3.519 -7.328 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.287 2.891 -6.336 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.169 2.295 -4.943 1.00 0.00 H new ATOM 0 HG LEU A 18 6.234 4.674 -4.889 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.760 6.450 -5.738 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.417 5.442 -7.048 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.734 5.221 -6.515 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.395 5.489 -3.474 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.345 4.197 -4.103 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.787 3.784 -3.146 1.00 0.00 H new ATOM 298 N ARG A 19 8.684 3.301 -6.282 1.00 0.00 N ATOM 299 CA ARG A 19 9.991 3.246 -5.649 1.00 0.00 C ATOM 300 C ARG A 19 10.252 4.528 -4.857 1.00 0.00 C ATOM 301 O ARG A 19 9.691 5.578 -5.167 1.00 0.00 O ATOM 302 CB ARG A 19 11.099 3.062 -6.689 1.00 0.00 C ATOM 303 CG ARG A 19 11.634 4.415 -7.163 1.00 0.00 C ATOM 304 CD ARG A 19 12.501 4.253 -8.414 1.00 0.00 C ATOM 305 NE ARG A 19 11.734 4.648 -9.616 1.00 0.00 N ATOM 306 CZ ARG A 19 12.294 5.038 -10.769 1.00 0.00 C ATOM 307 NH1 ARG A 19 13.628 5.089 -10.884 1.00 0.00 N ATOM 308 NH2 ARG A 19 11.519 5.379 -11.808 1.00 0.00 N ATOM 0 H ARG A 19 8.597 4.000 -7.020 1.00 0.00 H new ATOM 0 HA ARG A 19 9.996 2.391 -4.973 1.00 0.00 H new ATOM 0 HB2 ARG A 19 11.911 2.475 -6.261 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.714 2.500 -7.540 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.801 5.085 -7.377 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.219 4.878 -6.368 1.00 0.00 H new ATOM 0 HD2 ARG A 19 13.398 4.866 -8.327 1.00 0.00 H new ATOM 0 HD3 ARG A 19 12.831 3.218 -8.507 1.00 0.00 H new ATOM 0 HE ARG A 19 10.716 4.622 -9.564 1.00 0.00 H new ATOM 0 HH11 ARG A 19 14.218 4.831 -10.093 1.00 0.00 H new ATOM 0 HH12 ARG A 19 14.053 5.386 -11.762 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.503 5.342 -11.721 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.945 5.676 -12.686 1.00 0.00 H new ATOM 322 N ILE A 20 11.103 4.400 -3.849 1.00 0.00 N ATOM 323 CA ILE A 20 11.444 5.536 -3.010 1.00 0.00 C ATOM 324 C ILE A 20 12.963 5.723 -3.006 1.00 0.00 C ATOM 325 O ILE A 20 13.698 4.849 -2.551 1.00 0.00 O ATOM 326 CB ILE A 20 10.842 5.371 -1.613 1.00 0.00 C ATOM 327 CG1 ILE A 20 9.331 5.144 -1.692 1.00 0.00 C ATOM 328 CG2 ILE A 20 11.197 6.560 -0.718 1.00 0.00 C ATOM 329 CD1 ILE A 20 8.725 4.996 -0.294 1.00 0.00 C ATOM 0 H ILE A 20 11.566 3.527 -3.595 1.00 0.00 H new ATOM 0 HA ILE A 20 11.010 6.451 -3.413 1.00 0.00 H new ATOM 0 HB ILE A 20 11.278 4.483 -1.155 1.00 0.00 H new ATOM 0 HG12 ILE A 20 8.861 5.980 -2.210 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.124 4.249 -2.279 1.00 0.00 H new ATOM 0 HG21 ILE A 20 10.757 6.417 0.269 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.280 6.634 -0.624 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.807 7.477 -1.160 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.650 4.836 -0.378 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.180 4.144 0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 20 8.912 5.902 0.282 1.00 0.00 H new ATOM 341 N LEU A 21 13.387 6.869 -3.518 1.00 0.00 N ATOM 342 CA LEU A 21 14.805 7.182 -3.579 1.00 0.00 C ATOM 343 C LEU A 21 15.222 7.892 -2.289 1.00 0.00 C ATOM 344 O LEU A 21 14.388 8.476 -1.601 1.00 0.00 O ATOM 345 CB LEU A 21 15.124 7.975 -4.848 1.00 0.00 C ATOM 346 CG LEU A 21 14.563 7.407 -6.153 1.00 0.00 C ATOM 347 CD1 LEU A 21 14.725 8.405 -7.301 1.00 0.00 C ATOM 348 CD2 LEU A 21 15.195 6.052 -6.478 1.00 0.00 C ATOM 0 H LEU A 21 12.774 7.592 -3.894 1.00 0.00 H new ATOM 0 HA LEU A 21 15.395 6.268 -3.645 1.00 0.00 H new ATOM 0 HB2 LEU A 21 14.745 8.989 -4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 21 16.207 8.049 -4.943 1.00 0.00 H new ATOM 0 HG LEU A 21 13.494 7.240 -6.020 1.00 0.00 H new ATOM 0 HD11 LEU A 21 14.318 7.976 -8.216 1.00 0.00 H new ATOM 0 HD12 LEU A 21 14.190 9.324 -7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 21 15.783 8.627 -7.443 1.00 0.00 H new ATOM 0 HD21 LEU A 21 14.779 5.671 -7.410 1.00 0.00 H new ATOM 0 HD22 LEU A 21 16.274 6.169 -6.583 1.00 0.00 H new ATOM 0 HD23 LEU A 21 14.984 5.349 -5.672 1.00 0.00 H new ATOM 360 N PRO A 22 16.548 7.815 -1.994 1.00 0.00 N ATOM 361 CA PRO A 22 17.086 8.442 -0.800 1.00 0.00 C ATOM 362 C PRO A 22 17.177 9.960 -0.971 1.00 0.00 C ATOM 363 O PRO A 22 17.615 10.666 -0.064 1.00 0.00 O ATOM 364 CB PRO A 22 18.440 7.786 -0.587 1.00 0.00 C ATOM 365 CG PRO A 22 18.813 7.157 -1.919 1.00 0.00 C ATOM 366 CD PRO A 22 17.565 7.131 -2.787 1.00 0.00 C ATOM 0 HA PRO A 22 16.448 8.301 0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.185 8.520 -0.279 1.00 0.00 H new ATOM 0 HB3 PRO A 22 18.390 7.033 0.200 1.00 0.00 H new ATOM 0 HG2 PRO A 22 19.603 7.730 -2.404 1.00 0.00 H new ATOM 0 HG3 PRO A 22 19.196 6.147 -1.771 1.00 0.00 H new ATOM 0 HD2 PRO A 22 17.733 7.638 -3.737 1.00 0.00 H new ATOM 0 HD3 PRO A 22 17.265 6.109 -3.019 1.00 0.00 H new ATOM 374 N ASP A 23 16.756 10.417 -2.141 1.00 0.00 N ATOM 375 CA ASP A 23 16.785 11.838 -2.443 1.00 0.00 C ATOM 376 C ASP A 23 15.389 12.428 -2.233 1.00 0.00 C ATOM 377 O ASP A 23 15.125 13.564 -2.626 1.00 0.00 O ATOM 378 CB ASP A 23 17.187 12.084 -3.899 1.00 0.00 C ATOM 379 CG ASP A 23 18.580 12.688 -4.092 1.00 0.00 C ATOM 380 OD1 ASP A 23 19.506 12.209 -3.403 1.00 0.00 O ATOM 381 OD2 ASP A 23 18.686 13.614 -4.924 1.00 0.00 O ATOM 0 H ASP A 23 16.393 9.829 -2.891 1.00 0.00 H new ATOM 0 HA ASP A 23 17.514 12.308 -1.783 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.140 11.138 -4.438 1.00 0.00 H new ATOM 0 HB3 ASP A 23 16.453 12.748 -4.356 1.00 0.00 H new ATOM 386 N GLY A 24 14.531 11.631 -1.613 1.00 0.00 N ATOM 387 CA GLY A 24 13.169 12.060 -1.345 1.00 0.00 C ATOM 388 C GLY A 24 12.357 12.145 -2.639 1.00 0.00 C ATOM 389 O GLY A 24 11.670 13.136 -2.880 1.00 0.00 O ATOM 0 H GLY A 24 14.753 10.690 -1.288 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.692 11.361 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY A 24 13.180 13.033 -0.854 1.00 0.00 H new ATOM 393 N THR A 25 12.463 11.093 -3.438 1.00 0.00 N ATOM 394 CA THR A 25 11.747 11.037 -4.701 1.00 0.00 C ATOM 395 C THR A 25 10.906 9.762 -4.781 1.00 0.00 C ATOM 396 O THR A 25 11.330 8.704 -4.317 1.00 0.00 O ATOM 397 CB THR A 25 12.772 11.162 -5.831 1.00 0.00 C ATOM 398 OG1 THR A 25 12.936 12.567 -5.997 1.00 0.00 O ATOM 399 CG2 THR A 25 12.218 10.689 -7.177 1.00 0.00 C ATOM 0 H THR A 25 13.034 10.273 -3.235 1.00 0.00 H new ATOM 0 HA THR A 25 11.039 11.861 -4.792 1.00 0.00 H new ATOM 0 HB THR A 25 13.661 10.584 -5.581 1.00 0.00 H new ATOM 0 HG1 THR A 25 13.586 12.738 -6.710 1.00 0.00 H new ATOM 0 HG21 THR A 25 12.984 10.798 -7.945 1.00 0.00 H new ATOM 0 HG22 THR A 25 11.926 9.641 -7.102 1.00 0.00 H new ATOM 0 HG23 THR A 25 11.349 11.290 -7.444 1.00 0.00 H new ATOM 407 N VAL A 26 9.729 9.904 -5.372 1.00 0.00 N ATOM 408 CA VAL A 26 8.824 8.776 -5.519 1.00 0.00 C ATOM 409 C VAL A 26 8.251 8.769 -6.937 1.00 0.00 C ATOM 410 O VAL A 26 7.536 9.691 -7.326 1.00 0.00 O ATOM 411 CB VAL A 26 7.743 8.828 -4.437 1.00 0.00 C ATOM 412 CG1 VAL A 26 7.045 7.475 -4.294 1.00 0.00 C ATOM 413 CG2 VAL A 26 8.327 9.288 -3.100 1.00 0.00 C ATOM 0 H VAL A 26 9.381 10.783 -5.755 1.00 0.00 H new ATOM 0 HA VAL A 26 9.359 7.836 -5.380 1.00 0.00 H new ATOM 0 HB VAL A 26 6.996 9.559 -4.745 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.282 7.540 -3.519 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.578 7.204 -5.241 1.00 0.00 H new ATOM 0 HG13 VAL A 26 7.777 6.715 -4.020 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.538 9.316 -2.349 1.00 0.00 H new ATOM 0 HG22 VAL A 26 9.104 8.592 -2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.756 10.284 -3.213 1.00 0.00 H new ATOM 423 N ASP A 27 8.587 7.718 -7.671 1.00 0.00 N ATOM 424 CA ASP A 27 8.115 7.578 -9.038 1.00 0.00 C ATOM 425 C ASP A 27 7.949 6.093 -9.367 1.00 0.00 C ATOM 426 O ASP A 27 8.496 5.236 -8.675 1.00 0.00 O ATOM 427 CB ASP A 27 9.116 8.173 -10.030 1.00 0.00 C ATOM 428 CG ASP A 27 9.970 9.317 -9.480 1.00 0.00 C ATOM 429 OD1 ASP A 27 9.388 10.400 -9.252 1.00 0.00 O ATOM 430 OD2 ASP A 27 11.185 9.084 -9.301 1.00 0.00 O ATOM 0 H ASP A 27 9.181 6.955 -7.345 1.00 0.00 H new ATOM 0 HA ASP A 27 7.166 8.107 -9.122 1.00 0.00 H new ATOM 0 HB2 ASP A 27 9.778 7.379 -10.375 1.00 0.00 H new ATOM 0 HB3 ASP A 27 8.570 8.534 -10.902 1.00 0.00 H new ATOM 435 N GLY A 28 7.190 5.835 -10.422 1.00 0.00 N ATOM 436 CA GLY A 28 6.945 4.468 -10.850 1.00 0.00 C ATOM 437 C GLY A 28 8.126 3.927 -11.660 1.00 0.00 C ATOM 438 O GLY A 28 8.825 4.687 -12.328 1.00 0.00 O ATOM 0 H GLY A 28 6.737 6.549 -10.993 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.777 3.835 -9.979 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.038 4.429 -11.453 1.00 0.00 H new ATOM 442 N THR A 29 8.311 2.618 -11.573 1.00 0.00 N ATOM 443 CA THR A 29 9.395 1.967 -12.289 1.00 0.00 C ATOM 444 C THR A 29 9.122 0.467 -12.418 1.00 0.00 C ATOM 445 O THR A 29 8.701 -0.177 -11.458 1.00 0.00 O ATOM 446 CB THR A 29 10.702 2.286 -11.560 1.00 0.00 C ATOM 447 OG1 THR A 29 11.709 2.078 -12.547 1.00 0.00 O ATOM 448 CG2 THR A 29 11.030 1.263 -10.471 1.00 0.00 C ATOM 0 H THR A 29 7.729 1.991 -11.018 1.00 0.00 H new ATOM 0 HA THR A 29 9.476 2.341 -13.310 1.00 0.00 H new ATOM 0 HB THR A 29 10.637 3.279 -11.116 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.590 2.264 -12.160 1.00 0.00 H new ATOM 0 HG21 THR A 29 11.967 1.536 -9.985 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.229 1.249 -9.732 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.129 0.274 -10.919 1.00 0.00 H new ATOM 456 N ARG A 30 9.373 -0.047 -13.614 1.00 0.00 N ATOM 457 CA ARG A 30 9.160 -1.459 -13.881 1.00 0.00 C ATOM 458 C ARG A 30 10.448 -2.100 -14.404 1.00 0.00 C ATOM 459 O ARG A 30 10.410 -2.913 -15.327 1.00 0.00 O ATOM 460 CB ARG A 30 8.044 -1.663 -14.907 1.00 0.00 C ATOM 461 CG ARG A 30 7.001 -2.657 -14.393 1.00 0.00 C ATOM 462 CD ARG A 30 6.229 -3.291 -15.552 1.00 0.00 C ATOM 463 NE ARG A 30 5.805 -4.661 -15.188 1.00 0.00 N ATOM 464 CZ ARG A 30 6.652 -5.671 -14.948 1.00 0.00 C ATOM 465 NH1 ARG A 30 7.975 -5.471 -15.033 1.00 0.00 N ATOM 466 NH2 ARG A 30 6.178 -6.882 -14.625 1.00 0.00 N ATOM 0 H ARG A 30 9.722 0.489 -14.408 1.00 0.00 H new ATOM 0 HA ARG A 30 8.868 -1.934 -12.944 1.00 0.00 H new ATOM 0 HB2 ARG A 30 7.565 -0.708 -15.124 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.468 -2.027 -15.843 1.00 0.00 H new ATOM 0 HG2 ARG A 30 7.492 -3.436 -13.810 1.00 0.00 H new ATOM 0 HG3 ARG A 30 6.307 -2.148 -13.724 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.357 -2.684 -15.794 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.855 -3.320 -16.444 1.00 0.00 H new ATOM 0 HE ARG A 30 4.805 -4.848 -15.115 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.337 -4.550 -15.280 1.00 0.00 H new ATOM 0 HH12 ARG A 30 8.620 -6.240 -14.850 1.00 0.00 H new ATOM 0 HH21 ARG A 30 5.172 -7.036 -14.562 1.00 0.00 H new ATOM 0 HH22 ARG A 30 6.824 -7.650 -14.442 1.00 0.00 H new ATOM 480 N ASP A 31 11.556 -1.710 -13.792 1.00 0.00 N ATOM 481 CA ASP A 31 12.852 -2.237 -14.184 1.00 0.00 C ATOM 482 C ASP A 31 13.194 -3.444 -13.309 1.00 0.00 C ATOM 483 O ASP A 31 14.195 -4.120 -13.540 1.00 0.00 O ATOM 484 CB ASP A 31 13.952 -1.190 -13.995 1.00 0.00 C ATOM 485 CG ASP A 31 15.223 -1.433 -14.811 1.00 0.00 C ATOM 486 OD1 ASP A 31 15.105 -2.100 -15.861 1.00 0.00 O ATOM 487 OD2 ASP A 31 16.285 -0.948 -14.365 1.00 0.00 O ATOM 0 H ASP A 31 11.583 -1.035 -13.028 1.00 0.00 H new ATOM 0 HA ASP A 31 12.797 -2.518 -15.236 1.00 0.00 H new ATOM 0 HB2 ASP A 31 13.551 -0.212 -14.259 1.00 0.00 H new ATOM 0 HB3 ASP A 31 14.218 -1.151 -12.939 1.00 0.00 H new ATOM 492 N ARG A 32 12.342 -3.678 -12.321 1.00 0.00 N ATOM 493 CA ARG A 32 12.541 -4.792 -11.409 1.00 0.00 C ATOM 494 C ARG A 32 14.032 -4.984 -11.124 1.00 0.00 C ATOM 495 O ARG A 32 14.487 -6.108 -10.914 1.00 0.00 O ATOM 496 CB ARG A 32 11.968 -6.087 -11.989 1.00 0.00 C ATOM 497 CG ARG A 32 10.504 -5.906 -12.393 1.00 0.00 C ATOM 498 CD ARG A 32 9.662 -7.107 -11.956 1.00 0.00 C ATOM 499 NE ARG A 32 9.977 -8.280 -12.802 1.00 0.00 N ATOM 500 CZ ARG A 32 9.435 -9.494 -12.634 1.00 0.00 C ATOM 501 NH1 ARG A 32 8.550 -9.703 -11.650 1.00 0.00 N ATOM 502 NH2 ARG A 32 9.780 -10.500 -13.450 1.00 0.00 N ATOM 0 H ARG A 32 11.513 -3.115 -12.132 1.00 0.00 H new ATOM 0 HA ARG A 32 12.017 -4.560 -10.482 1.00 0.00 H new ATOM 0 HB2 ARG A 32 12.553 -6.391 -12.857 1.00 0.00 H new ATOM 0 HB3 ARG A 32 12.050 -6.887 -11.253 1.00 0.00 H new ATOM 0 HG2 ARG A 32 10.108 -4.996 -11.941 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.434 -5.782 -13.474 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.860 -7.339 -10.910 1.00 0.00 H new ATOM 0 HD3 ARG A 32 8.602 -6.866 -12.034 1.00 0.00 H new ATOM 0 HE ARG A 32 10.648 -8.157 -13.560 1.00 0.00 H new ATOM 0 HH11 ARG A 32 8.288 -8.938 -11.028 1.00 0.00 H new ATOM 0 HH12 ARG A 32 8.138 -10.627 -11.523 1.00 0.00 H new ATOM 0 HH21 ARG A 32 10.455 -10.341 -14.198 1.00 0.00 H new ATOM 0 HH22 ARG A 32 9.368 -11.424 -13.323 1.00 0.00 H new ATOM 516 N SER A 33 14.751 -3.871 -11.125 1.00 0.00 N ATOM 517 CA SER A 33 16.181 -3.904 -10.869 1.00 0.00 C ATOM 518 C SER A 33 16.541 -2.887 -9.784 1.00 0.00 C ATOM 519 O SER A 33 17.314 -3.190 -8.877 1.00 0.00 O ATOM 520 CB SER A 33 16.975 -3.621 -12.145 1.00 0.00 C ATOM 521 OG SER A 33 18.143 -4.432 -12.237 1.00 0.00 O ATOM 0 H SER A 33 14.370 -2.941 -11.299 1.00 0.00 H new ATOM 0 HA SER A 33 16.444 -4.904 -10.524 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.341 -3.799 -13.014 1.00 0.00 H new ATOM 0 HB3 SER A 33 17.261 -2.569 -12.169 1.00 0.00 H new ATOM 0 HG SER A 33 18.622 -4.223 -13.066 1.00 0.00 H new ATOM 527 N ASP A 34 15.963 -1.702 -9.912 1.00 0.00 N ATOM 528 CA ASP A 34 16.213 -0.639 -8.954 1.00 0.00 C ATOM 529 C ASP A 34 16.182 -1.217 -7.538 1.00 0.00 C ATOM 530 O ASP A 34 15.193 -1.826 -7.133 1.00 0.00 O ATOM 531 CB ASP A 34 15.140 0.448 -9.044 1.00 0.00 C ATOM 532 CG ASP A 34 15.670 1.883 -9.016 1.00 0.00 C ATOM 533 OD1 ASP A 34 16.003 2.387 -10.110 1.00 0.00 O ATOM 534 OD2 ASP A 34 15.729 2.444 -7.901 1.00 0.00 O ATOM 0 H ASP A 34 15.322 -1.454 -10.666 1.00 0.00 H new ATOM 0 HA ASP A 34 17.187 -0.204 -9.180 1.00 0.00 H new ATOM 0 HB2 ASP A 34 14.574 0.304 -9.964 1.00 0.00 H new ATOM 0 HB3 ASP A 34 14.442 0.318 -8.217 1.00 0.00 H new ATOM 539 N GLN A 35 17.278 -1.008 -6.823 1.00 0.00 N ATOM 540 CA GLN A 35 17.389 -1.501 -5.461 1.00 0.00 C ATOM 541 C GLN A 35 16.714 -0.531 -4.489 1.00 0.00 C ATOM 542 O GLN A 35 17.327 -0.093 -3.517 1.00 0.00 O ATOM 543 CB GLN A 35 18.853 -1.730 -5.078 1.00 0.00 C ATOM 544 CG GLN A 35 19.490 -2.801 -5.967 1.00 0.00 C ATOM 545 CD GLN A 35 20.988 -2.930 -5.681 1.00 0.00 C ATOM 546 OE1 GLN A 35 21.832 -2.551 -6.476 1.00 0.00 O ATOM 547 NE2 GLN A 35 21.268 -3.484 -4.505 1.00 0.00 N ATOM 0 H GLN A 35 18.097 -0.504 -7.162 1.00 0.00 H new ATOM 0 HA GLN A 35 16.877 -2.461 -5.400 1.00 0.00 H new ATOM 0 HB2 GLN A 35 19.408 -0.797 -5.172 1.00 0.00 H new ATOM 0 HB3 GLN A 35 18.916 -2.034 -4.033 1.00 0.00 H new ATOM 0 HG2 GLN A 35 19.000 -3.759 -5.796 1.00 0.00 H new ATOM 0 HG3 GLN A 35 19.337 -2.547 -7.016 1.00 0.00 H new ATOM 0 HE21 GLN A 35 20.512 -3.779 -3.887 1.00 0.00 H new ATOM 0 HE22 GLN A 35 22.239 -3.614 -4.221 1.00 0.00 H new ATOM 556 N HIS A 36 15.460 -0.224 -4.785 1.00 0.00 N ATOM 557 CA HIS A 36 14.694 0.686 -3.950 1.00 0.00 C ATOM 558 C HIS A 36 13.227 0.253 -3.930 1.00 0.00 C ATOM 559 O HIS A 36 12.611 0.185 -2.867 1.00 0.00 O ATOM 560 CB HIS A 36 14.880 2.133 -4.411 1.00 0.00 C ATOM 561 CG HIS A 36 16.314 2.606 -4.387 1.00 0.00 C ATOM 562 ND1 HIS A 36 17.280 2.114 -5.247 1.00 0.00 N ATOM 563 CD2 HIS A 36 16.934 3.532 -3.600 1.00 0.00 C ATOM 564 CE1 HIS A 36 18.426 2.722 -4.981 1.00 0.00 C ATOM 565 NE2 HIS A 36 18.210 3.600 -3.959 1.00 0.00 N ATOM 0 H HIS A 36 14.955 -0.589 -5.592 1.00 0.00 H new ATOM 0 HA HIS A 36 15.063 0.643 -2.925 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.492 2.233 -5.425 1.00 0.00 H new ATOM 0 HB3 HIS A 36 14.282 2.786 -3.775 1.00 0.00 H new ATOM 0 HD2 HIS A 36 16.466 4.111 -2.818 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.366 2.553 -5.484 1.00 0.00 H new ATOM 0 HE2 HIS A 36 18.913 4.208 -3.540 1.00 0.00 H new ATOM 573 N ILE A 37 12.710 -0.027 -5.117 1.00 0.00 N ATOM 574 CA ILE A 37 11.327 -0.451 -5.249 1.00 0.00 C ATOM 575 C ILE A 37 10.990 -1.437 -4.128 1.00 0.00 C ATOM 576 O ILE A 37 9.839 -1.532 -3.705 1.00 0.00 O ATOM 577 CB ILE A 37 11.067 -1.004 -6.652 1.00 0.00 C ATOM 578 CG1 ILE A 37 11.982 -2.194 -6.951 1.00 0.00 C ATOM 579 CG2 ILE A 37 11.196 0.097 -7.707 1.00 0.00 C ATOM 580 CD1 ILE A 37 11.487 -2.974 -8.170 1.00 0.00 C ATOM 0 H ILE A 37 13.224 0.031 -5.996 1.00 0.00 H new ATOM 0 HA ILE A 37 10.656 0.401 -5.137 1.00 0.00 H new ATOM 0 HB ILE A 37 10.041 -1.369 -6.691 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.998 -1.841 -7.129 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.021 -2.854 -6.084 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.007 -0.322 -8.695 1.00 0.00 H new ATOM 0 HG22 ILE A 37 10.471 0.884 -7.502 1.00 0.00 H new ATOM 0 HG23 ILE A 37 12.203 0.514 -7.677 1.00 0.00 H new ATOM 0 HD11 ILE A 37 12.155 -3.814 -8.360 1.00 0.00 H new ATOM 0 HD12 ILE A 37 10.481 -3.347 -7.979 1.00 0.00 H new ATOM 0 HD13 ILE A 37 11.472 -2.318 -9.040 1.00 0.00 H new ATOM 592 N GLN A 38 12.016 -2.146 -3.680 1.00 0.00 N ATOM 593 CA GLN A 38 11.844 -3.121 -2.616 1.00 0.00 C ATOM 594 C GLN A 38 11.300 -2.442 -1.357 1.00 0.00 C ATOM 595 O GLN A 38 12.062 -2.101 -0.453 1.00 0.00 O ATOM 596 CB GLN A 38 13.156 -3.850 -2.323 1.00 0.00 C ATOM 597 CG GLN A 38 13.494 -4.840 -3.439 1.00 0.00 C ATOM 598 CD GLN A 38 14.806 -5.571 -3.145 1.00 0.00 C ATOM 599 OE1 GLN A 38 15.877 -4.988 -3.110 1.00 0.00 O ATOM 600 NE2 GLN A 38 14.663 -6.877 -2.937 1.00 0.00 N ATOM 0 H GLN A 38 12.969 -2.065 -4.034 1.00 0.00 H new ATOM 0 HA GLN A 38 11.119 -3.866 -2.945 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.963 -3.125 -2.218 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.078 -4.380 -1.374 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.686 -5.564 -3.545 1.00 0.00 H new ATOM 0 HG3 GLN A 38 13.574 -4.310 -4.388 1.00 0.00 H new ATOM 0 HE21 GLN A 38 13.737 -7.302 -2.981 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.480 -7.453 -2.734 1.00 0.00 H new ATOM 609 N LEU A 39 9.987 -2.267 -1.338 1.00 0.00 N ATOM 610 CA LEU A 39 9.333 -1.635 -0.204 1.00 0.00 C ATOM 611 C LEU A 39 8.823 -2.716 0.752 1.00 0.00 C ATOM 612 O LEU A 39 8.420 -3.794 0.317 1.00 0.00 O ATOM 613 CB LEU A 39 8.244 -0.673 -0.682 1.00 0.00 C ATOM 614 CG LEU A 39 8.729 0.671 -1.229 1.00 0.00 C ATOM 615 CD1 LEU A 39 7.552 1.609 -1.502 1.00 0.00 C ATOM 616 CD2 LEU A 39 9.761 1.304 -0.292 1.00 0.00 C ATOM 0 H LEU A 39 9.358 -2.552 -2.089 1.00 0.00 H new ATOM 0 HA LEU A 39 10.043 -1.024 0.354 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.663 -1.170 -1.459 1.00 0.00 H new ATOM 0 HB3 LEU A 39 7.566 -0.481 0.150 1.00 0.00 H new ATOM 0 HG LEU A 39 9.226 0.492 -2.182 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.925 2.557 -1.890 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.886 1.153 -2.235 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.005 1.786 -0.576 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.089 2.258 -0.704 1.00 0.00 H new ATOM 0 HD22 LEU A 39 9.311 1.467 0.687 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.618 0.638 -0.191 1.00 0.00 H new ATOM 628 N GLN A 40 8.857 -2.389 2.035 1.00 0.00 N ATOM 629 CA GLN A 40 8.404 -3.318 3.056 1.00 0.00 C ATOM 630 C GLN A 40 7.058 -2.864 3.626 1.00 0.00 C ATOM 631 O GLN A 40 6.972 -1.815 4.262 1.00 0.00 O ATOM 632 CB GLN A 40 9.447 -3.467 4.165 1.00 0.00 C ATOM 633 CG GLN A 40 10.023 -4.884 4.190 1.00 0.00 C ATOM 634 CD GLN A 40 9.486 -5.673 5.386 1.00 0.00 C ATOM 635 OE1 GLN A 40 8.507 -5.306 6.015 1.00 0.00 O ATOM 636 NE2 GLN A 40 10.180 -6.773 5.664 1.00 0.00 N ATOM 0 H GLN A 40 9.191 -1.494 2.391 1.00 0.00 H new ATOM 0 HA GLN A 40 8.271 -4.297 2.595 1.00 0.00 H new ATOM 0 HB2 GLN A 40 10.251 -2.747 4.012 1.00 0.00 H new ATOM 0 HB3 GLN A 40 8.993 -3.238 5.129 1.00 0.00 H new ATOM 0 HG2 GLN A 40 9.768 -5.401 3.265 1.00 0.00 H new ATOM 0 HG3 GLN A 40 11.111 -4.837 4.239 1.00 0.00 H new ATOM 0 HE21 GLN A 40 10.990 -7.022 5.096 1.00 0.00 H new ATOM 0 HE22 GLN A 40 9.902 -7.368 6.445 1.00 0.00 H new ATOM 645 N LEU A 41 6.042 -3.678 3.379 1.00 0.00 N ATOM 646 CA LEU A 41 4.705 -3.373 3.860 1.00 0.00 C ATOM 647 C LEU A 41 4.530 -3.950 5.266 1.00 0.00 C ATOM 648 O LEU A 41 4.925 -5.085 5.529 1.00 0.00 O ATOM 649 CB LEU A 41 3.653 -3.858 2.861 1.00 0.00 C ATOM 650 CG LEU A 41 3.368 -2.927 1.681 1.00 0.00 C ATOM 651 CD1 LEU A 41 3.974 -3.478 0.389 1.00 0.00 C ATOM 652 CD2 LEU A 41 1.868 -2.660 1.543 1.00 0.00 C ATOM 0 H LEU A 41 6.118 -4.548 2.852 1.00 0.00 H new ATOM 0 HA LEU A 41 4.564 -2.295 3.938 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.972 -4.823 2.468 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.720 -4.026 3.399 1.00 0.00 H new ATOM 0 HG LEU A 41 3.848 -1.969 1.878 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.757 -2.797 -0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.054 -3.574 0.505 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.544 -4.456 0.174 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.693 -1.996 0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.344 -3.602 1.379 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.496 -2.192 2.455 1.00 0.00 H new ATOM 664 N SER A 42 3.938 -3.141 6.133 1.00 0.00 N ATOM 665 CA SER A 42 3.706 -3.557 7.506 1.00 0.00 C ATOM 666 C SER A 42 2.299 -3.147 7.946 1.00 0.00 C ATOM 667 O SER A 42 1.683 -2.276 7.334 1.00 0.00 O ATOM 668 CB SER A 42 4.753 -2.957 8.447 1.00 0.00 C ATOM 669 OG SER A 42 5.639 -2.072 7.767 1.00 0.00 O ATOM 0 H SER A 42 3.612 -2.200 5.911 1.00 0.00 H new ATOM 0 HA SER A 42 3.793 -4.642 7.554 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.251 -2.420 9.252 1.00 0.00 H new ATOM 0 HB3 SER A 42 5.327 -3.760 8.909 1.00 0.00 H new ATOM 0 HG SER A 42 6.291 -1.709 8.403 1.00 0.00 H new ATOM 675 N ALA A 43 1.833 -3.795 9.003 1.00 0.00 N ATOM 676 CA ALA A 43 0.510 -3.509 9.532 1.00 0.00 C ATOM 677 C ALA A 43 0.629 -3.116 11.006 1.00 0.00 C ATOM 678 O ALA A 43 1.210 -3.852 11.803 1.00 0.00 O ATOM 679 CB ALA A 43 -0.397 -4.723 9.323 1.00 0.00 C ATOM 0 H ALA A 43 2.347 -4.517 9.507 1.00 0.00 H new ATOM 0 HA ALA A 43 0.058 -2.670 9.003 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.389 -4.508 9.720 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.472 -4.942 8.258 1.00 0.00 H new ATOM 0 HB3 ALA A 43 0.023 -5.585 9.842 1.00 0.00 H new ATOM 685 N GLU A 44 0.069 -1.959 11.324 1.00 0.00 N ATOM 686 CA GLU A 44 0.105 -1.460 12.689 1.00 0.00 C ATOM 687 C GLU A 44 -1.294 -1.504 13.307 1.00 0.00 C ATOM 688 O GLU A 44 -1.455 -1.899 14.461 1.00 0.00 O ATOM 689 CB GLU A 44 0.682 -0.044 12.740 1.00 0.00 C ATOM 690 CG GLU A 44 -0.014 0.794 13.814 1.00 0.00 C ATOM 691 CD GLU A 44 0.885 1.939 14.285 1.00 0.00 C ATOM 692 OE1 GLU A 44 2.038 1.637 14.662 1.00 0.00 O ATOM 693 OE2 GLU A 44 0.399 3.090 14.257 1.00 0.00 O ATOM 0 H GLU A 44 -0.412 -1.352 10.660 1.00 0.00 H new ATOM 0 HA GLU A 44 0.760 -2.105 13.274 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.751 -0.091 12.946 1.00 0.00 H new ATOM 0 HB3 GLU A 44 0.566 0.435 11.768 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.946 1.198 13.418 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.276 0.161 14.661 1.00 0.00 H new ATOM 700 N SER A 45 -2.271 -1.093 12.512 1.00 0.00 N ATOM 701 CA SER A 45 -3.651 -1.081 12.966 1.00 0.00 C ATOM 702 C SER A 45 -4.542 -1.807 11.956 1.00 0.00 C ATOM 703 O SER A 45 -4.123 -2.068 10.829 1.00 0.00 O ATOM 704 CB SER A 45 -4.148 0.350 13.180 1.00 0.00 C ATOM 705 OG SER A 45 -3.072 1.267 13.360 1.00 0.00 O ATOM 0 H SER A 45 -2.134 -0.766 11.556 1.00 0.00 H new ATOM 0 HA SER A 45 -3.700 -1.601 13.923 1.00 0.00 H new ATOM 0 HB2 SER A 45 -4.747 0.658 12.323 1.00 0.00 H new ATOM 0 HB3 SER A 45 -4.800 0.381 14.053 1.00 0.00 H new ATOM 0 HG SER A 45 -3.102 1.948 12.656 1.00 0.00 H new ATOM 711 N VAL A 46 -5.753 -2.113 12.395 1.00 0.00 N ATOM 712 CA VAL A 46 -6.707 -2.803 11.543 1.00 0.00 C ATOM 713 C VAL A 46 -7.098 -1.891 10.379 1.00 0.00 C ATOM 714 O VAL A 46 -7.642 -0.808 10.590 1.00 0.00 O ATOM 715 CB VAL A 46 -7.908 -3.266 12.370 1.00 0.00 C ATOM 716 CG1 VAL A 46 -8.636 -2.074 12.995 1.00 0.00 C ATOM 717 CG2 VAL A 46 -8.863 -4.110 11.524 1.00 0.00 C ATOM 0 H VAL A 46 -6.096 -1.896 13.331 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.258 -3.700 11.116 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.535 -3.893 13.180 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -9.485 -2.431 13.577 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.952 -1.531 13.647 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -8.990 -1.410 12.207 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -9.708 -4.426 12.136 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -9.225 -3.518 10.684 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.337 -4.988 11.149 1.00 0.00 H new ATOM 727 N GLY A 47 -6.806 -2.361 9.176 1.00 0.00 N ATOM 728 CA GLY A 47 -7.120 -1.602 7.978 1.00 0.00 C ATOM 729 C GLY A 47 -6.028 -0.573 7.679 1.00 0.00 C ATOM 730 O GLY A 47 -6.136 0.193 6.722 1.00 0.00 O ATOM 0 H GLY A 47 -6.355 -3.260 9.005 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.227 -2.280 7.131 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.077 -1.096 8.104 1.00 0.00 H new ATOM 734 N GLU A 48 -5.000 -0.589 8.515 1.00 0.00 N ATOM 735 CA GLU A 48 -3.888 0.333 8.352 1.00 0.00 C ATOM 736 C GLU A 48 -2.611 -0.432 8.002 1.00 0.00 C ATOM 737 O GLU A 48 -2.340 -1.489 8.571 1.00 0.00 O ATOM 738 CB GLU A 48 -3.692 1.183 9.609 1.00 0.00 C ATOM 739 CG GLU A 48 -4.924 2.047 9.885 1.00 0.00 C ATOM 740 CD GLU A 48 -4.596 3.170 10.870 1.00 0.00 C ATOM 741 OE1 GLU A 48 -4.321 2.835 12.043 1.00 0.00 O ATOM 742 OE2 GLU A 48 -4.627 4.339 10.429 1.00 0.00 O ATOM 0 H GLU A 48 -4.914 -1.226 9.307 1.00 0.00 H new ATOM 0 HA GLU A 48 -4.119 1.009 7.529 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -3.499 0.535 10.464 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.816 1.820 9.488 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.290 2.473 8.951 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.725 1.427 10.288 1.00 0.00 H new ATOM 749 N VAL A 49 -1.859 0.131 7.067 1.00 0.00 N ATOM 750 CA VAL A 49 -0.616 -0.486 6.635 1.00 0.00 C ATOM 751 C VAL A 49 0.476 0.583 6.551 1.00 0.00 C ATOM 752 O VAL A 49 0.181 1.765 6.384 1.00 0.00 O ATOM 753 CB VAL A 49 -0.831 -1.226 5.314 1.00 0.00 C ATOM 754 CG1 VAL A 49 -1.874 -2.335 5.470 1.00 0.00 C ATOM 755 CG2 VAL A 49 -1.226 -0.255 4.199 1.00 0.00 C ATOM 0 H VAL A 49 -2.086 1.007 6.597 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.287 -1.231 7.359 1.00 0.00 H new ATOM 0 HB VAL A 49 0.114 -1.692 5.034 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.008 -2.845 4.516 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.535 -3.050 6.220 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.823 -1.901 5.785 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -1.373 -0.807 3.271 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.152 0.253 4.470 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.435 0.482 4.061 1.00 0.00 H new ATOM 765 N TYR A 50 1.715 0.128 6.669 1.00 0.00 N ATOM 766 CA TYR A 50 2.852 1.030 6.608 1.00 0.00 C ATOM 767 C TYR A 50 3.855 0.577 5.545 1.00 0.00 C ATOM 768 O TYR A 50 4.227 -0.594 5.497 1.00 0.00 O ATOM 769 CB TYR A 50 3.519 0.961 7.983 1.00 0.00 C ATOM 770 CG TYR A 50 3.065 2.056 8.951 1.00 0.00 C ATOM 771 CD1 TYR A 50 3.445 3.366 8.737 1.00 0.00 C ATOM 772 CD2 TYR A 50 2.276 1.735 10.036 1.00 0.00 C ATOM 773 CE1 TYR A 50 3.018 4.397 9.648 1.00 0.00 C ATOM 774 CE2 TYR A 50 1.849 2.766 10.946 1.00 0.00 C ATOM 775 CZ TYR A 50 2.241 4.046 10.707 1.00 0.00 C ATOM 776 OH TYR A 50 1.837 5.019 11.567 1.00 0.00 O ATOM 0 H TYR A 50 1.956 -0.854 6.807 1.00 0.00 H new ATOM 0 HA TYR A 50 2.528 2.038 6.350 1.00 0.00 H new ATOM 0 HB2 TYR A 50 3.311 -0.012 8.428 1.00 0.00 H new ATOM 0 HB3 TYR A 50 4.599 1.029 7.855 1.00 0.00 H new ATOM 0 HD1 TYR A 50 4.062 3.618 7.887 1.00 0.00 H new ATOM 0 HD2 TYR A 50 1.979 0.710 10.203 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.309 5.426 9.493 1.00 0.00 H new ATOM 0 HE2 TYR A 50 1.231 2.528 11.799 1.00 0.00 H new ATOM 0 HH TYR A 50 1.981 5.898 11.158 1.00 0.00 H new ATOM 786 N ILE A 51 4.263 1.529 4.719 1.00 0.00 N ATOM 787 CA ILE A 51 5.216 1.243 3.660 1.00 0.00 C ATOM 788 C ILE A 51 6.516 2.002 3.930 1.00 0.00 C ATOM 789 O ILE A 51 6.520 3.230 3.996 1.00 0.00 O ATOM 790 CB ILE A 51 4.601 1.544 2.291 1.00 0.00 C ATOM 791 CG1 ILE A 51 3.127 1.137 2.251 1.00 0.00 C ATOM 792 CG2 ILE A 51 5.409 0.885 1.171 1.00 0.00 C ATOM 793 CD1 ILE A 51 2.605 1.110 0.813 1.00 0.00 C ATOM 0 H ILE A 51 3.951 2.499 4.762 1.00 0.00 H new ATOM 0 HA ILE A 51 5.464 0.182 3.647 1.00 0.00 H new ATOM 0 HB ILE A 51 4.642 2.621 2.127 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.005 0.153 2.705 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.537 1.836 2.843 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.951 1.114 0.209 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.430 1.266 1.187 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.422 -0.195 1.319 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.555 0.818 0.813 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.706 2.101 0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 51 3.182 0.392 0.230 1.00 0.00 H new ATOM 805 N LYS A 52 7.589 1.239 4.080 1.00 0.00 N ATOM 806 CA LYS A 52 8.893 1.824 4.342 1.00 0.00 C ATOM 807 C LYS A 52 9.941 1.138 3.464 1.00 0.00 C ATOM 808 O LYS A 52 9.850 -0.061 3.205 1.00 0.00 O ATOM 809 CB LYS A 52 9.213 1.772 5.837 1.00 0.00 C ATOM 810 CG LYS A 52 10.583 2.390 6.127 1.00 0.00 C ATOM 811 CD LYS A 52 11.523 1.366 6.765 1.00 0.00 C ATOM 812 CE LYS A 52 11.443 1.424 8.291 1.00 0.00 C ATOM 813 NZ LYS A 52 11.608 0.072 8.871 1.00 0.00 N ATOM 0 H LYS A 52 7.582 0.221 4.025 1.00 0.00 H new ATOM 0 HA LYS A 52 8.897 2.881 4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.444 2.305 6.396 1.00 0.00 H new ATOM 0 HB3 LYS A 52 9.197 0.738 6.180 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.021 2.763 5.201 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.466 3.246 6.792 1.00 0.00 H new ATOM 0 HD2 LYS A 52 11.263 0.365 6.422 1.00 0.00 H new ATOM 0 HD3 LYS A 52 12.547 1.557 6.444 1.00 0.00 H new ATOM 0 HE2 LYS A 52 12.216 2.088 8.677 1.00 0.00 H new ATOM 0 HE3 LYS A 52 10.483 1.842 8.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 11.551 0.130 9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 10.855 -0.552 8.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 12.534 -0.313 8.596 1.00 0.00 H new ATOM 827 N SER A 53 10.913 1.927 3.031 1.00 0.00 N ATOM 828 CA SER A 53 11.978 1.410 2.188 1.00 0.00 C ATOM 829 C SER A 53 13.026 0.698 3.046 1.00 0.00 C ATOM 830 O SER A 53 13.427 1.207 4.091 1.00 0.00 O ATOM 831 CB SER A 53 12.629 2.530 1.375 1.00 0.00 C ATOM 832 OG SER A 53 12.882 2.135 0.029 1.00 0.00 O ATOM 0 H SER A 53 10.986 2.921 3.248 1.00 0.00 H new ATOM 0 HA SER A 53 11.544 0.695 1.489 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.980 3.406 1.380 1.00 0.00 H new ATOM 0 HB3 SER A 53 13.566 2.824 1.849 1.00 0.00 H new ATOM 0 HG SER A 53 13.296 2.878 -0.458 1.00 0.00 H new ATOM 838 N THR A 54 13.439 -0.468 2.572 1.00 0.00 N ATOM 839 CA THR A 54 14.433 -1.255 3.282 1.00 0.00 C ATOM 840 C THR A 54 15.841 -0.888 2.809 1.00 0.00 C ATOM 841 O THR A 54 16.828 -1.249 3.448 1.00 0.00 O ATOM 842 CB THR A 54 14.093 -2.734 3.087 1.00 0.00 C ATOM 843 OG1 THR A 54 14.422 -2.989 1.725 1.00 0.00 O ATOM 844 CG2 THR A 54 12.588 -3.003 3.164 1.00 0.00 C ATOM 0 H THR A 54 13.103 -0.887 1.705 1.00 0.00 H new ATOM 0 HA THR A 54 14.417 -1.041 4.351 1.00 0.00 H new ATOM 0 HB THR A 54 14.607 -3.328 3.843 1.00 0.00 H new ATOM 0 HG1 THR A 54 13.669 -2.733 1.153 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.401 -4.067 3.019 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.213 -2.698 4.141 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.077 -2.436 2.386 1.00 0.00 H new ATOM 852 N GLU A 55 15.889 -0.176 1.693 1.00 0.00 N ATOM 853 CA GLU A 55 17.160 0.243 1.126 1.00 0.00 C ATOM 854 C GLU A 55 17.685 1.480 1.858 1.00 0.00 C ATOM 855 O GLU A 55 18.677 1.404 2.581 1.00 0.00 O ATOM 856 CB GLU A 55 17.031 0.508 -0.375 1.00 0.00 C ATOM 857 CG GLU A 55 18.368 0.953 -0.970 1.00 0.00 C ATOM 858 CD GLU A 55 19.343 -0.223 -1.067 1.00 0.00 C ATOM 859 OE1 GLU A 55 19.255 -0.952 -2.078 1.00 0.00 O ATOM 860 OE2 GLU A 55 20.155 -0.365 -0.127 1.00 0.00 O ATOM 0 H GLU A 55 15.068 0.122 1.166 1.00 0.00 H new ATOM 0 HA GLU A 55 17.878 -0.566 1.258 1.00 0.00 H new ATOM 0 HB2 GLU A 55 16.687 -0.395 -0.879 1.00 0.00 H new ATOM 0 HB3 GLU A 55 16.278 1.276 -0.549 1.00 0.00 H new ATOM 0 HG2 GLU A 55 18.206 1.378 -1.960 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.801 1.740 -0.352 1.00 0.00 H new ATOM 867 N THR A 56 16.995 2.591 1.645 1.00 0.00 N ATOM 868 CA THR A 56 17.379 3.843 2.275 1.00 0.00 C ATOM 869 C THR A 56 16.898 3.879 3.726 1.00 0.00 C ATOM 870 O THR A 56 17.705 3.960 4.651 1.00 0.00 O ATOM 871 CB THR A 56 16.830 4.989 1.423 1.00 0.00 C ATOM 872 OG1 THR A 56 15.415 4.855 1.532 1.00 0.00 O ATOM 873 CG2 THR A 56 17.109 4.796 -0.069 1.00 0.00 C ATOM 0 H THR A 56 16.172 2.650 1.045 1.00 0.00 H new ATOM 0 HA THR A 56 18.463 3.946 2.323 1.00 0.00 H new ATOM 0 HB THR A 56 17.268 5.930 1.755 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.984 5.328 0.790 1.00 0.00 H new ATOM 0 HG21 THR A 56 16.698 5.637 -0.628 1.00 0.00 H new ATOM 0 HG22 THR A 56 18.185 4.741 -0.234 1.00 0.00 H new ATOM 0 HG23 THR A 56 16.642 3.872 -0.410 1.00 0.00 H new ATOM 881 N GLY A 57 15.583 3.817 3.882 1.00 0.00 N ATOM 882 CA GLY A 57 14.984 3.842 5.205 1.00 0.00 C ATOM 883 C GLY A 57 14.038 5.035 5.357 1.00 0.00 C ATOM 884 O GLY A 57 14.100 5.759 6.349 1.00 0.00 O ATOM 0 H GLY A 57 14.916 3.749 3.113 1.00 0.00 H new ATOM 0 HA2 GLY A 57 14.437 2.915 5.378 1.00 0.00 H new ATOM 0 HA3 GLY A 57 15.767 3.896 5.961 1.00 0.00 H new ATOM 888 N GLN A 58 13.183 5.201 4.358 1.00 0.00 N ATOM 889 CA GLN A 58 12.225 6.294 4.367 1.00 0.00 C ATOM 890 C GLN A 58 10.800 5.751 4.247 1.00 0.00 C ATOM 891 O GLN A 58 10.543 4.840 3.462 1.00 0.00 O ATOM 892 CB GLN A 58 12.525 7.296 3.252 1.00 0.00 C ATOM 893 CG GLN A 58 14.033 7.500 3.088 1.00 0.00 C ATOM 894 CD GLN A 58 14.349 8.238 1.786 1.00 0.00 C ATOM 895 OE1 GLN A 58 15.012 9.262 1.768 1.00 0.00 O ATOM 896 NE2 GLN A 58 13.838 7.664 0.701 1.00 0.00 N ATOM 0 H GLN A 58 13.134 4.597 3.537 1.00 0.00 H new ATOM 0 HA GLN A 58 12.314 6.821 5.317 1.00 0.00 H new ATOM 0 HB2 GLN A 58 12.099 6.940 2.314 1.00 0.00 H new ATOM 0 HB3 GLN A 58 12.048 8.250 3.477 1.00 0.00 H new ATOM 0 HG2 GLN A 58 14.421 8.067 3.934 1.00 0.00 H new ATOM 0 HG3 GLN A 58 14.537 6.533 3.094 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.292 6.807 0.787 1.00 0.00 H new ATOM 0 HE22 GLN A 58 13.992 8.081 -0.217 1.00 0.00 H new ATOM 905 N TYR A 59 9.910 6.333 5.038 1.00 0.00 N ATOM 906 CA TYR A 59 8.517 5.919 5.030 1.00 0.00 C ATOM 907 C TYR A 59 7.742 6.624 3.916 1.00 0.00 C ATOM 908 O TYR A 59 7.946 7.812 3.668 1.00 0.00 O ATOM 909 CB TYR A 59 7.943 6.345 6.383 1.00 0.00 C ATOM 910 CG TYR A 59 8.659 5.726 7.585 1.00 0.00 C ATOM 911 CD1 TYR A 59 8.381 4.427 7.961 1.00 0.00 C ATOM 912 CD2 TYR A 59 9.583 6.467 8.294 1.00 0.00 C ATOM 913 CE1 TYR A 59 9.055 3.845 9.092 1.00 0.00 C ATOM 914 CE2 TYR A 59 10.257 5.884 9.426 1.00 0.00 C ATOM 915 CZ TYR A 59 9.960 4.602 9.769 1.00 0.00 C ATOM 916 OH TYR A 59 10.596 4.053 10.837 1.00 0.00 O ATOM 0 H TYR A 59 10.127 7.088 5.689 1.00 0.00 H new ATOM 0 HA TYR A 59 8.437 4.845 4.861 1.00 0.00 H new ATOM 0 HB2 TYR A 59 7.994 7.431 6.462 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.888 6.072 6.421 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.658 3.847 7.407 1.00 0.00 H new ATOM 0 HD2 TYR A 59 9.801 7.483 8.000 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.847 2.830 9.396 1.00 0.00 H new ATOM 0 HE2 TYR A 59 10.982 6.452 9.990 1.00 0.00 H new ATOM 0 HH TYR A 59 11.214 4.709 11.222 1.00 0.00 H new ATOM 926 N LEU A 60 6.869 5.863 3.272 1.00 0.00 N ATOM 927 CA LEU A 60 6.062 6.400 2.190 1.00 0.00 C ATOM 928 C LEU A 60 4.920 7.233 2.776 1.00 0.00 C ATOM 929 O LEU A 60 4.082 6.713 3.512 1.00 0.00 O ATOM 930 CB LEU A 60 5.591 5.277 1.264 1.00 0.00 C ATOM 931 CG LEU A 60 4.747 5.707 0.063 1.00 0.00 C ATOM 932 CD1 LEU A 60 5.635 6.105 -1.118 1.00 0.00 C ATOM 933 CD2 LEU A 60 3.741 4.620 -0.318 1.00 0.00 C ATOM 0 H LEU A 60 6.703 4.878 3.479 1.00 0.00 H new ATOM 0 HA LEU A 60 6.657 7.067 1.567 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.468 4.746 0.895 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.012 4.566 1.853 1.00 0.00 H new ATOM 0 HG LEU A 60 4.175 6.590 0.347 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.009 6.406 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.277 6.937 -0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.252 5.256 -1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.154 4.952 -1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.274 3.705 -0.576 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.077 4.428 0.524 1.00 0.00 H new ATOM 945 N ALA A 61 4.922 8.511 2.428 1.00 0.00 N ATOM 946 CA ALA A 61 3.897 9.421 2.910 1.00 0.00 C ATOM 947 C ALA A 61 3.497 10.375 1.783 1.00 0.00 C ATOM 948 O ALA A 61 4.278 10.618 0.864 1.00 0.00 O ATOM 949 CB ALA A 61 4.411 10.161 4.146 1.00 0.00 C ATOM 0 H ALA A 61 5.618 8.938 1.817 1.00 0.00 H new ATOM 0 HA ALA A 61 3.005 8.871 3.208 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.642 10.844 4.507 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.653 9.440 4.927 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.305 10.727 3.885 1.00 0.00 H new ATOM 955 N MET A 62 2.281 10.891 1.890 1.00 0.00 N ATOM 956 CA MET A 62 1.769 11.813 0.892 1.00 0.00 C ATOM 957 C MET A 62 1.581 13.212 1.483 1.00 0.00 C ATOM 958 O MET A 62 0.769 13.405 2.386 1.00 0.00 O ATOM 959 CB MET A 62 0.428 11.299 0.362 1.00 0.00 C ATOM 960 CG MET A 62 -0.181 12.285 -0.637 1.00 0.00 C ATOM 961 SD MET A 62 -1.569 11.532 -1.469 1.00 0.00 S ATOM 962 CE MET A 62 -0.745 10.169 -2.275 1.00 0.00 C ATOM 0 H MET A 62 1.636 10.687 2.653 1.00 0.00 H new ATOM 0 HA MET A 62 2.492 11.876 0.079 1.00 0.00 H new ATOM 0 HB2 MET A 62 0.570 10.331 -0.118 1.00 0.00 H new ATOM 0 HB3 MET A 62 -0.261 11.145 1.193 1.00 0.00 H new ATOM 0 HG2 MET A 62 -0.503 13.188 -0.119 1.00 0.00 H new ATOM 0 HG3 MET A 62 0.570 12.587 -1.366 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.286 9.902 -3.183 1.00 0.00 H new ATOM 0 HE2 MET A 62 0.273 10.460 -2.532 1.00 0.00 H new ATOM 0 HE3 MET A 62 -0.718 9.311 -1.603 1.00 0.00 H new ATOM 972 N ASP A 63 2.347 14.152 0.949 1.00 0.00 N ATOM 973 CA ASP A 63 2.276 15.528 1.412 1.00 0.00 C ATOM 974 C ASP A 63 0.924 16.125 1.017 1.00 0.00 C ATOM 975 O ASP A 63 -0.001 15.396 0.662 1.00 0.00 O ATOM 976 CB ASP A 63 3.374 16.381 0.775 1.00 0.00 C ATOM 977 CG ASP A 63 4.304 17.084 1.766 1.00 0.00 C ATOM 978 OD1 ASP A 63 3.800 17.465 2.844 1.00 0.00 O ATOM 979 OD2 ASP A 63 5.497 17.225 1.422 1.00 0.00 O ATOM 0 H ASP A 63 3.020 13.988 0.200 1.00 0.00 H new ATOM 0 HA ASP A 63 2.403 15.527 2.495 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.975 15.746 0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.906 17.135 0.142 1.00 0.00 H new ATOM 984 N THR A 64 0.852 17.446 1.092 1.00 0.00 N ATOM 985 CA THR A 64 -0.372 18.149 0.746 1.00 0.00 C ATOM 986 C THR A 64 -0.427 18.415 -0.759 1.00 0.00 C ATOM 987 O THR A 64 -1.500 18.648 -1.313 1.00 0.00 O ATOM 988 CB THR A 64 -0.439 19.423 1.591 1.00 0.00 C ATOM 989 OG1 THR A 64 0.708 20.167 1.190 1.00 0.00 O ATOM 990 CG2 THR A 64 -0.206 19.152 3.079 1.00 0.00 C ATOM 0 H THR A 64 1.621 18.048 1.387 1.00 0.00 H new ATOM 0 HA THR A 64 -1.252 17.546 0.970 1.00 0.00 H new ATOM 0 HB THR A 64 -1.411 19.897 1.456 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.742 21.010 1.688 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.264 20.089 3.633 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.968 18.465 3.447 1.00 0.00 H new ATOM 0 HG23 THR A 64 0.780 18.709 3.218 1.00 0.00 H new ATOM 998 N ASP A 65 0.743 18.373 -1.379 1.00 0.00 N ATOM 999 CA ASP A 65 0.842 18.606 -2.810 1.00 0.00 C ATOM 1000 C ASP A 65 0.217 17.427 -3.558 1.00 0.00 C ATOM 1001 O ASP A 65 0.048 17.480 -4.776 1.00 0.00 O ATOM 1002 CB ASP A 65 2.302 18.725 -3.249 1.00 0.00 C ATOM 1003 CG ASP A 65 3.149 19.695 -2.424 1.00 0.00 C ATOM 1004 OD1 ASP A 65 3.172 20.888 -2.797 1.00 0.00 O ATOM 1005 OD2 ASP A 65 3.755 19.222 -1.438 1.00 0.00 O ATOM 0 H ASP A 65 1.631 18.181 -0.916 1.00 0.00 H new ATOM 0 HA ASP A 65 0.321 19.536 -3.037 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.761 17.737 -3.204 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.327 19.041 -4.292 1.00 0.00 H new ATOM 1010 N GLY A 66 -0.109 16.391 -2.800 1.00 0.00 N ATOM 1011 CA GLY A 66 -0.712 15.202 -3.376 1.00 0.00 C ATOM 1012 C GLY A 66 0.359 14.254 -3.921 1.00 0.00 C ATOM 1013 O GLY A 66 0.041 13.181 -4.433 1.00 0.00 O ATOM 0 H GLY A 66 0.033 16.351 -1.791 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.307 14.689 -2.620 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.393 15.487 -4.178 1.00 0.00 H new ATOM 1017 N LEU A 67 1.605 14.684 -3.792 1.00 0.00 N ATOM 1018 CA LEU A 67 2.724 13.887 -4.265 1.00 0.00 C ATOM 1019 C LEU A 67 3.164 12.926 -3.158 1.00 0.00 C ATOM 1020 O LEU A 67 2.667 12.997 -2.035 1.00 0.00 O ATOM 1021 CB LEU A 67 3.848 14.791 -4.776 1.00 0.00 C ATOM 1022 CG LEU A 67 3.496 15.691 -5.963 1.00 0.00 C ATOM 1023 CD1 LEU A 67 3.173 17.112 -5.497 1.00 0.00 C ATOM 1024 CD2 LEU A 67 4.608 15.671 -7.014 1.00 0.00 C ATOM 0 H LEU A 67 1.865 15.574 -3.367 1.00 0.00 H new ATOM 0 HA LEU A 67 2.424 13.277 -5.117 1.00 0.00 H new ATOM 0 HB2 LEU A 67 4.182 15.423 -3.953 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.693 14.163 -5.059 1.00 0.00 H new ATOM 0 HG LEU A 67 2.597 15.296 -6.437 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.926 17.731 -6.360 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.324 17.087 -4.814 1.00 0.00 H new ATOM 0 HD13 LEU A 67 4.038 17.532 -4.985 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.333 16.318 -7.847 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.536 16.028 -6.568 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.747 14.653 -7.377 1.00 0.00 H new ATOM 1036 N LEU A 68 4.092 12.050 -3.514 1.00 0.00 N ATOM 1037 CA LEU A 68 4.605 11.076 -2.565 1.00 0.00 C ATOM 1038 C LEU A 68 6.058 11.415 -2.227 1.00 0.00 C ATOM 1039 O LEU A 68 6.840 11.762 -3.111 1.00 0.00 O ATOM 1040 CB LEU A 68 4.413 9.655 -3.099 1.00 0.00 C ATOM 1041 CG LEU A 68 2.965 9.193 -3.273 1.00 0.00 C ATOM 1042 CD1 LEU A 68 2.846 8.176 -4.410 1.00 0.00 C ATOM 1043 CD2 LEU A 68 2.401 8.651 -1.958 1.00 0.00 C ATOM 0 H LEU A 68 4.502 11.994 -4.446 1.00 0.00 H new ATOM 0 HA LEU A 68 4.042 11.120 -1.633 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.916 9.580 -4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.915 8.963 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 68 2.362 10.058 -3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.807 7.864 -4.512 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.181 8.631 -5.342 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.465 7.307 -4.187 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.371 8.329 -2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.001 7.803 -1.627 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.429 9.434 -1.200 1.00 0.00 H new ATOM 1055 N TYR A 69 6.375 11.304 -0.945 1.00 0.00 N ATOM 1056 CA TYR A 69 7.720 11.595 -0.480 1.00 0.00 C ATOM 1057 C TYR A 69 8.076 10.740 0.739 1.00 0.00 C ATOM 1058 O TYR A 69 7.194 10.175 1.383 1.00 0.00 O ATOM 1059 CB TYR A 69 7.715 13.069 -0.069 1.00 0.00 C ATOM 1060 CG TYR A 69 7.059 13.335 1.287 1.00 0.00 C ATOM 1061 CD1 TYR A 69 7.666 12.897 2.445 1.00 0.00 C ATOM 1062 CD2 TYR A 69 5.858 14.014 1.351 1.00 0.00 C ATOM 1063 CE1 TYR A 69 7.048 13.148 3.722 1.00 0.00 C ATOM 1064 CE2 TYR A 69 5.240 14.264 2.627 1.00 0.00 C ATOM 1065 CZ TYR A 69 5.866 13.819 3.749 1.00 0.00 C ATOM 1066 OH TYR A 69 5.282 14.056 4.955 1.00 0.00 O ATOM 0 H TYR A 69 5.724 11.017 -0.215 1.00 0.00 H new ATOM 0 HA TYR A 69 8.450 11.381 -1.260 1.00 0.00 H new ATOM 0 HB2 TYR A 69 8.743 13.431 -0.041 1.00 0.00 H new ATOM 0 HB3 TYR A 69 7.194 13.647 -0.833 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.605 12.366 2.395 1.00 0.00 H new ATOM 0 HD2 TYR A 69 5.383 14.357 0.444 1.00 0.00 H new ATOM 0 HE1 TYR A 69 7.513 12.811 4.637 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.301 14.793 2.692 1.00 0.00 H new ATOM 0 HH TYR A 69 4.443 14.545 4.822 1.00 0.00 H new ATOM 1076 N GLY A 70 9.369 10.673 1.017 1.00 0.00 N ATOM 1077 CA GLY A 70 9.852 9.897 2.147 1.00 0.00 C ATOM 1078 C GLY A 70 10.010 10.776 3.389 1.00 0.00 C ATOM 1079 O GLY A 70 10.717 11.782 3.356 1.00 0.00 O ATOM 0 H GLY A 70 10.097 11.143 0.480 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.157 9.085 2.358 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.809 9.440 1.896 1.00 0.00 H new ATOM 1083 N SER A 71 9.340 10.364 4.455 1.00 0.00 N ATOM 1084 CA SER A 71 9.397 11.102 5.706 1.00 0.00 C ATOM 1085 C SER A 71 10.607 10.650 6.525 1.00 0.00 C ATOM 1086 O SER A 71 10.921 9.462 6.571 1.00 0.00 O ATOM 1087 CB SER A 71 8.110 10.916 6.513 1.00 0.00 C ATOM 1088 OG SER A 71 8.025 11.835 7.600 1.00 0.00 O ATOM 0 H SER A 71 8.755 9.529 4.479 1.00 0.00 H new ATOM 0 HA SER A 71 9.499 12.162 5.474 1.00 0.00 H new ATOM 0 HB2 SER A 71 7.249 11.048 5.858 1.00 0.00 H new ATOM 0 HB3 SER A 71 8.066 9.896 6.896 1.00 0.00 H new ATOM 0 HG SER A 71 8.125 11.351 8.446 1.00 0.00 H new ATOM 1094 N GLN A 72 11.254 11.622 7.150 1.00 0.00 N ATOM 1095 CA GLN A 72 12.424 11.340 7.965 1.00 0.00 C ATOM 1096 C GLN A 72 12.069 10.351 9.078 1.00 0.00 C ATOM 1097 O GLN A 72 12.851 9.454 9.389 1.00 0.00 O ATOM 1098 CB GLN A 72 13.013 12.628 8.543 1.00 0.00 C ATOM 1099 CG GLN A 72 14.523 12.495 8.749 1.00 0.00 C ATOM 1100 CD GLN A 72 15.281 13.555 7.947 1.00 0.00 C ATOM 1101 OE1 GLN A 72 14.947 14.728 7.949 1.00 0.00 O ATOM 1102 NE2 GLN A 72 16.318 13.078 7.264 1.00 0.00 N ATOM 0 H GLN A 72 10.990 12.606 7.109 1.00 0.00 H new ATOM 0 HA GLN A 72 13.184 10.885 7.330 1.00 0.00 H new ATOM 0 HB2 GLN A 72 12.806 13.461 7.871 1.00 0.00 H new ATOM 0 HB3 GLN A 72 12.531 12.858 9.493 1.00 0.00 H new ATOM 0 HG2 GLN A 72 14.760 12.597 9.808 1.00 0.00 H new ATOM 0 HG3 GLN A 72 14.849 11.501 8.444 1.00 0.00 H new ATOM 0 HE21 GLN A 72 16.543 12.084 7.306 1.00 0.00 H new ATOM 0 HE22 GLN A 72 16.888 13.706 6.698 1.00 0.00 H new ATOM 1111 N THR A 73 10.889 10.549 9.647 1.00 0.00 N ATOM 1112 CA THR A 73 10.421 9.686 10.718 1.00 0.00 C ATOM 1113 C THR A 73 9.035 9.128 10.387 1.00 0.00 C ATOM 1114 O THR A 73 8.357 9.632 9.494 1.00 0.00 O ATOM 1115 CB THR A 73 10.458 10.487 12.021 1.00 0.00 C ATOM 1116 OG1 THR A 73 10.129 11.815 11.622 1.00 0.00 O ATOM 1117 CG2 THR A 73 11.872 10.610 12.593 1.00 0.00 C ATOM 0 H THR A 73 10.243 11.294 9.387 1.00 0.00 H new ATOM 0 HA THR A 73 11.067 8.816 10.836 1.00 0.00 H new ATOM 0 HB THR A 73 9.809 10.013 12.757 1.00 0.00 H new ATOM 0 HG1 THR A 73 10.128 12.402 12.407 1.00 0.00 H new ATOM 0 HG21 THR A 73 11.842 11.187 13.517 1.00 0.00 H new ATOM 0 HG22 THR A 73 12.269 9.616 12.799 1.00 0.00 H new ATOM 0 HG23 THR A 73 12.514 11.114 11.871 1.00 0.00 H new ATOM 1125 N PRO A 74 8.647 8.068 11.145 1.00 0.00 N ATOM 1126 CA PRO A 74 7.354 7.436 10.941 1.00 0.00 C ATOM 1127 C PRO A 74 6.226 8.300 11.509 1.00 0.00 C ATOM 1128 O PRO A 74 6.022 8.342 12.721 1.00 0.00 O ATOM 1129 CB PRO A 74 7.466 6.082 11.623 1.00 0.00 C ATOM 1130 CG PRO A 74 8.645 6.192 12.577 1.00 0.00 C ATOM 1131 CD PRO A 74 9.424 7.445 12.212 1.00 0.00 C ATOM 0 HA PRO A 74 7.106 7.317 9.886 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.550 5.839 12.161 1.00 0.00 H new ATOM 0 HB3 PRO A 74 7.627 5.289 10.893 1.00 0.00 H new ATOM 0 HG2 PRO A 74 8.298 6.245 13.609 1.00 0.00 H new ATOM 0 HG3 PRO A 74 9.282 5.311 12.500 1.00 0.00 H new ATOM 0 HD2 PRO A 74 9.526 8.111 13.069 1.00 0.00 H new ATOM 0 HD3 PRO A 74 10.432 7.201 11.877 1.00 0.00 H new ATOM 1139 N ASN A 75 5.523 8.967 10.606 1.00 0.00 N ATOM 1140 CA ASN A 75 4.421 9.827 11.001 1.00 0.00 C ATOM 1141 C ASN A 75 3.108 9.238 10.483 1.00 0.00 C ATOM 1142 O ASN A 75 3.107 8.458 9.532 1.00 0.00 O ATOM 1143 CB ASN A 75 4.576 11.229 10.408 1.00 0.00 C ATOM 1144 CG ASN A 75 5.319 12.154 11.375 1.00 0.00 C ATOM 1145 OD1 ASN A 75 4.728 12.912 12.127 1.00 0.00 O ATOM 1146 ND2 ASN A 75 6.643 12.051 11.313 1.00 0.00 N ATOM 0 H ASN A 75 5.695 8.929 9.601 1.00 0.00 H new ATOM 0 HA ASN A 75 4.419 9.893 12.089 1.00 0.00 H new ATOM 0 HB2 ASN A 75 5.119 11.171 9.465 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.593 11.644 10.185 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.228 12.627 11.918 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.074 11.396 10.660 1.00 0.00 H new ATOM 1153 N GLU A 76 2.022 9.633 11.131 1.00 0.00 N ATOM 1154 CA GLU A 76 0.706 9.153 10.748 1.00 0.00 C ATOM 1155 C GLU A 76 0.501 9.312 9.240 1.00 0.00 C ATOM 1156 O GLU A 76 -0.305 8.602 8.640 1.00 0.00 O ATOM 1157 CB GLU A 76 -0.392 9.878 11.529 1.00 0.00 C ATOM 1158 CG GLU A 76 -1.049 8.943 12.546 1.00 0.00 C ATOM 1159 CD GLU A 76 -1.514 9.717 13.782 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -0.723 10.561 14.254 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -2.651 9.447 14.226 1.00 0.00 O ATOM 0 H GLU A 76 2.027 10.280 11.919 1.00 0.00 H new ATOM 0 HA GLU A 76 0.642 8.093 10.995 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.032 10.741 12.043 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.145 10.257 10.838 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.900 8.440 12.086 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.342 8.168 12.842 1.00 0.00 H new ATOM 1168 N GLU A 77 1.244 10.249 8.670 1.00 0.00 N ATOM 1169 CA GLU A 77 1.155 10.511 7.243 1.00 0.00 C ATOM 1170 C GLU A 77 1.693 9.319 6.450 1.00 0.00 C ATOM 1171 O GLU A 77 1.446 9.204 5.251 1.00 0.00 O ATOM 1172 CB GLU A 77 1.898 11.797 6.874 1.00 0.00 C ATOM 1173 CG GLU A 77 1.373 12.985 7.682 1.00 0.00 C ATOM 1174 CD GLU A 77 2.347 14.163 7.621 1.00 0.00 C ATOM 1175 OE1 GLU A 77 3.496 13.974 8.075 1.00 0.00 O ATOM 1176 OE2 GLU A 77 1.921 15.226 7.120 1.00 0.00 O ATOM 0 H GLU A 77 1.911 10.837 9.170 1.00 0.00 H new ATOM 0 HA GLU A 77 0.106 10.650 6.984 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.965 11.670 7.058 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.780 11.996 5.809 1.00 0.00 H new ATOM 0 HG2 GLU A 77 0.401 13.292 7.295 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.223 12.686 8.719 1.00 0.00 H new ATOM 1183 N CYS A 78 2.420 8.462 7.152 1.00 0.00 N ATOM 1184 CA CYS A 78 2.996 7.283 6.528 1.00 0.00 C ATOM 1185 C CYS A 78 1.984 6.141 6.633 1.00 0.00 C ATOM 1186 O CYS A 78 2.121 5.121 5.960 1.00 0.00 O ATOM 1187 CB CYS A 78 4.342 6.912 7.154 1.00 0.00 C ATOM 1188 SG CYS A 78 5.540 8.275 6.915 1.00 0.00 S ATOM 0 H CYS A 78 2.623 8.561 8.147 1.00 0.00 H new ATOM 0 HA CYS A 78 3.203 7.489 5.478 1.00 0.00 H new ATOM 0 HB2 CYS A 78 4.215 6.711 8.218 1.00 0.00 H new ATOM 0 HB3 CYS A 78 4.724 5.997 6.700 1.00 0.00 H new ATOM 0 HG CYS A 78 5.196 9.289 7.651 1.00 0.00 H new ATOM 1194 N LEU A 79 0.990 6.350 7.484 1.00 0.00 N ATOM 1195 CA LEU A 79 -0.045 5.351 7.686 1.00 0.00 C ATOM 1196 C LEU A 79 -1.148 5.547 6.645 1.00 0.00 C ATOM 1197 O LEU A 79 -1.686 6.645 6.504 1.00 0.00 O ATOM 1198 CB LEU A 79 -0.549 5.386 9.130 1.00 0.00 C ATOM 1199 CG LEU A 79 -1.243 4.117 9.630 1.00 0.00 C ATOM 1200 CD1 LEU A 79 -0.602 2.867 9.024 1.00 0.00 C ATOM 1201 CD2 LEU A 79 -1.262 4.068 11.159 1.00 0.00 C ATOM 0 H LEU A 79 0.880 7.197 8.042 1.00 0.00 H new ATOM 0 HA LEU A 79 0.359 4.349 7.538 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.297 5.595 9.784 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.244 6.220 9.231 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.280 4.141 9.296 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.114 1.979 9.396 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.685 2.906 7.938 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.450 2.824 9.306 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.761 3.156 11.488 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.239 4.078 11.536 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.799 4.935 11.544 1.00 0.00 H new ATOM 1213 N PHE A 80 -1.454 4.467 5.941 1.00 0.00 N ATOM 1214 CA PHE A 80 -2.483 4.507 4.917 1.00 0.00 C ATOM 1215 C PHE A 80 -3.524 3.409 5.142 1.00 0.00 C ATOM 1216 O PHE A 80 -3.296 2.482 5.918 1.00 0.00 O ATOM 1217 CB PHE A 80 -1.789 4.267 3.575 1.00 0.00 C ATOM 1218 CG PHE A 80 -1.005 5.474 3.055 1.00 0.00 C ATOM 1219 CD1 PHE A 80 0.057 5.949 3.758 1.00 0.00 C ATOM 1220 CD2 PHE A 80 -1.372 6.072 1.890 1.00 0.00 C ATOM 1221 CE1 PHE A 80 0.784 7.070 3.275 1.00 0.00 C ATOM 1222 CE2 PHE A 80 -0.645 7.192 1.407 1.00 0.00 C ATOM 1223 CZ PHE A 80 0.418 7.668 2.110 1.00 0.00 C ATOM 0 H PHE A 80 -1.007 3.558 6.060 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.996 5.468 4.944 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -1.109 3.421 3.675 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -2.539 3.987 2.835 1.00 0.00 H new ATOM 0 HD1 PHE A 80 0.348 5.474 4.683 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -2.216 5.695 1.332 1.00 0.00 H new ATOM 0 HE1 PHE A 80 1.628 7.447 3.834 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -0.936 7.666 0.481 1.00 0.00 H new ATOM 0 HZ PHE A 80 0.971 8.520 1.743 1.00 0.00 H new ATOM 1233 N LEU A 81 -4.645 3.549 4.450 1.00 0.00 N ATOM 1234 CA LEU A 81 -5.722 2.580 4.565 1.00 0.00 C ATOM 1235 C LEU A 81 -5.721 1.674 3.332 1.00 0.00 C ATOM 1236 O LEU A 81 -5.795 2.157 2.203 1.00 0.00 O ATOM 1237 CB LEU A 81 -7.056 3.288 4.807 1.00 0.00 C ATOM 1238 CG LEU A 81 -7.105 4.235 6.008 1.00 0.00 C ATOM 1239 CD1 LEU A 81 -6.193 3.741 7.133 1.00 0.00 C ATOM 1240 CD2 LEU A 81 -6.774 5.669 5.589 1.00 0.00 C ATOM 0 H LEU A 81 -4.831 4.319 3.807 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.566 1.938 5.432 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.311 3.855 3.912 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.829 2.530 4.935 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.123 4.240 6.398 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.246 4.432 7.974 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.516 2.751 7.455 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.166 3.688 6.772 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.816 6.322 6.461 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.773 5.701 5.160 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -7.498 6.008 4.847 1.00 0.00 H new ATOM 1252 N GLU A 82 -5.637 0.377 3.590 1.00 0.00 N ATOM 1253 CA GLU A 82 -5.626 -0.600 2.515 1.00 0.00 C ATOM 1254 C GLU A 82 -6.946 -1.373 2.487 1.00 0.00 C ATOM 1255 O GLU A 82 -7.583 -1.559 3.522 1.00 0.00 O ATOM 1256 CB GLU A 82 -4.436 -1.552 2.652 1.00 0.00 C ATOM 1257 CG GLU A 82 -4.567 -2.736 1.692 1.00 0.00 C ATOM 1258 CD GLU A 82 -5.417 -3.849 2.307 1.00 0.00 C ATOM 1259 OE1 GLU A 82 -4.973 -4.397 3.340 1.00 0.00 O ATOM 1260 OE2 GLU A 82 -6.491 -4.128 1.732 1.00 0.00 O ATOM 0 H GLU A 82 -5.576 -0.020 4.528 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.518 -0.070 1.569 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.510 -1.014 2.447 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.373 -1.916 3.677 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.019 -2.403 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -3.577 -3.122 1.448 1.00 0.00 H new ATOM 1267 N ARG A 83 -7.317 -1.803 1.290 1.00 0.00 N ATOM 1268 CA ARG A 83 -8.550 -2.552 1.113 1.00 0.00 C ATOM 1269 C ARG A 83 -8.451 -3.453 -0.120 1.00 0.00 C ATOM 1270 O ARG A 83 -7.753 -3.126 -1.078 1.00 0.00 O ATOM 1271 CB ARG A 83 -9.747 -1.613 0.955 1.00 0.00 C ATOM 1272 CG ARG A 83 -10.860 -1.972 1.941 1.00 0.00 C ATOM 1273 CD ARG A 83 -12.224 -1.987 1.247 1.00 0.00 C ATOM 1274 NE ARG A 83 -12.839 -3.328 1.368 1.00 0.00 N ATOM 1275 CZ ARG A 83 -13.102 -3.930 2.536 1.00 0.00 C ATOM 1276 NH1 ARG A 83 -12.804 -3.316 3.689 1.00 0.00 N ATOM 1277 NH2 ARG A 83 -13.662 -5.148 2.550 1.00 0.00 N ATOM 0 H ARG A 83 -6.786 -1.647 0.433 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.697 -3.163 2.003 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -9.430 -0.583 1.119 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -10.127 -1.671 -0.065 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.661 -2.950 2.380 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -10.872 -1.252 2.759 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -12.877 -1.237 1.694 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -12.109 -1.724 0.195 1.00 0.00 H new ATOM 0 HE ARG A 83 -13.077 -3.824 0.509 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -12.377 -2.390 3.678 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -13.004 -3.775 4.578 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -13.888 -5.616 1.672 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -13.862 -5.607 3.439 1.00 0.00 H new ATOM 1291 N LEU A 84 -9.161 -4.570 -0.054 1.00 0.00 N ATOM 1292 CA LEU A 84 -9.162 -5.521 -1.153 1.00 0.00 C ATOM 1293 C LEU A 84 -10.319 -5.199 -2.100 1.00 0.00 C ATOM 1294 O LEU A 84 -11.463 -5.069 -1.666 1.00 0.00 O ATOM 1295 CB LEU A 84 -9.185 -6.956 -0.620 1.00 0.00 C ATOM 1296 CG LEU A 84 -8.686 -8.036 -1.582 1.00 0.00 C ATOM 1297 CD1 LEU A 84 -8.263 -9.294 -0.821 1.00 0.00 C ATOM 1298 CD2 LEU A 84 -9.732 -8.340 -2.655 1.00 0.00 C ATOM 0 H LEU A 84 -9.739 -4.838 0.743 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.242 -5.435 -1.732 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.580 -6.996 0.286 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -10.208 -7.199 -0.331 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.802 -7.656 -2.094 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.912 -10.046 -1.528 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.460 -9.046 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.115 -9.687 -0.266 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.352 -9.111 -3.326 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -10.648 -8.691 -2.181 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.942 -7.435 -3.225 1.00 0.00 H new ATOM 1310 N GLU A 85 -9.982 -5.078 -3.376 1.00 0.00 N ATOM 1311 CA GLU A 85 -10.979 -4.773 -4.388 1.00 0.00 C ATOM 1312 C GLU A 85 -11.435 -6.055 -5.087 1.00 0.00 C ATOM 1313 O GLU A 85 -10.726 -7.060 -5.073 1.00 0.00 O ATOM 1314 CB GLU A 85 -10.442 -3.759 -5.399 1.00 0.00 C ATOM 1315 CG GLU A 85 -10.172 -2.409 -4.730 1.00 0.00 C ATOM 1316 CD GLU A 85 -11.457 -1.585 -4.621 1.00 0.00 C ATOM 1317 OE1 GLU A 85 -12.244 -1.629 -5.591 1.00 0.00 O ATOM 1318 OE2 GLU A 85 -11.623 -0.929 -3.570 1.00 0.00 O ATOM 0 H GLU A 85 -9.032 -5.186 -3.732 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.842 -4.324 -3.896 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.523 -4.138 -5.846 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.161 -3.631 -6.208 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -9.753 -2.569 -3.737 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -9.429 -1.856 -5.305 1.00 0.00 H new ATOM 1325 N GLU A 86 -12.616 -5.979 -5.682 1.00 0.00 N ATOM 1326 CA GLU A 86 -13.175 -7.121 -6.386 1.00 0.00 C ATOM 1327 C GLU A 86 -12.591 -7.212 -7.797 1.00 0.00 C ATOM 1328 O GLU A 86 -13.332 -7.328 -8.773 1.00 0.00 O ATOM 1329 CB GLU A 86 -14.703 -7.045 -6.428 1.00 0.00 C ATOM 1330 CG GLU A 86 -15.296 -7.146 -5.022 1.00 0.00 C ATOM 1331 CD GLU A 86 -16.792 -6.825 -5.033 1.00 0.00 C ATOM 1332 OE1 GLU A 86 -17.515 -7.517 -5.782 1.00 0.00 O ATOM 1333 OE2 GLU A 86 -17.179 -5.895 -4.293 1.00 0.00 O ATOM 0 H GLU A 86 -13.202 -5.144 -5.691 1.00 0.00 H new ATOM 0 HA GLU A 86 -12.904 -8.026 -5.843 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.011 -6.107 -6.890 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.094 -7.850 -7.050 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.139 -8.150 -4.629 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.778 -6.458 -4.355 1.00 0.00 H new ATOM 1340 N ASN A 87 -11.269 -7.157 -7.861 1.00 0.00 N ATOM 1341 CA ASN A 87 -10.577 -7.232 -9.136 1.00 0.00 C ATOM 1342 C ASN A 87 -9.123 -7.643 -8.899 1.00 0.00 C ATOM 1343 O ASN A 87 -8.242 -7.302 -9.687 1.00 0.00 O ATOM 1344 CB ASN A 87 -10.577 -5.876 -9.843 1.00 0.00 C ATOM 1345 CG ASN A 87 -11.119 -6.000 -11.269 1.00 0.00 C ATOM 1346 OD1 ASN A 87 -12.315 -5.978 -11.510 1.00 0.00 O ATOM 1347 ND2 ASN A 87 -10.175 -6.130 -12.197 1.00 0.00 N ATOM 0 H ASN A 87 -10.658 -7.061 -7.050 1.00 0.00 H new ATOM 0 HA ASN A 87 -11.094 -7.962 -9.758 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -11.185 -5.168 -9.279 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -9.564 -5.476 -9.869 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -10.434 -6.219 -13.179 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -9.192 -6.141 -11.926 1.00 0.00 H new ATOM 1354 N HIS A 88 -8.916 -8.368 -7.810 1.00 0.00 N ATOM 1355 CA HIS A 88 -7.583 -8.829 -7.459 1.00 0.00 C ATOM 1356 C HIS A 88 -6.617 -7.642 -7.448 1.00 0.00 C ATOM 1357 O HIS A 88 -5.537 -7.710 -8.033 1.00 0.00 O ATOM 1358 CB HIS A 88 -7.132 -9.951 -8.396 1.00 0.00 C ATOM 1359 CG HIS A 88 -5.849 -10.626 -7.973 1.00 0.00 C ATOM 1360 ND1 HIS A 88 -5.093 -11.405 -8.832 1.00 0.00 N ATOM 1361 CD2 HIS A 88 -5.196 -10.629 -6.776 1.00 0.00 C ATOM 1362 CE1 HIS A 88 -4.037 -11.852 -8.170 1.00 0.00 C ATOM 1363 NE2 HIS A 88 -4.102 -11.371 -6.895 1.00 0.00 N ATOM 0 H HIS A 88 -9.649 -8.648 -7.158 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.594 -9.255 -6.456 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -7.922 -10.700 -8.456 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -7.003 -9.543 -9.399 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -5.515 -10.114 -5.882 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -3.260 -12.487 -8.570 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -3.423 -11.552 -6.156 1.00 0.00 H new ATOM 1371 N TYR A 89 -7.040 -6.583 -6.774 1.00 0.00 N ATOM 1372 CA TYR A 89 -6.226 -5.383 -6.678 1.00 0.00 C ATOM 1373 C TYR A 89 -6.384 -4.722 -5.307 1.00 0.00 C ATOM 1374 O TYR A 89 -7.475 -4.714 -4.740 1.00 0.00 O ATOM 1375 CB TYR A 89 -6.750 -4.430 -7.754 1.00 0.00 C ATOM 1376 CG TYR A 89 -6.087 -4.610 -9.121 1.00 0.00 C ATOM 1377 CD1 TYR A 89 -4.726 -4.825 -9.205 1.00 0.00 C ATOM 1378 CD2 TYR A 89 -6.850 -4.559 -10.270 1.00 0.00 C ATOM 1379 CE1 TYR A 89 -4.102 -4.994 -10.492 1.00 0.00 C ATOM 1380 CE2 TYR A 89 -6.225 -4.728 -11.557 1.00 0.00 C ATOM 1381 CZ TYR A 89 -4.883 -4.937 -11.604 1.00 0.00 C ATOM 1382 OH TYR A 89 -4.293 -5.098 -12.819 1.00 0.00 O ATOM 0 H TYR A 89 -7.936 -6.531 -6.289 1.00 0.00 H new ATOM 0 HA TYR A 89 -5.171 -5.623 -6.811 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -7.825 -4.575 -7.861 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.599 -3.403 -7.421 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -4.129 -4.866 -8.306 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.915 -4.392 -10.204 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -3.038 -5.162 -10.572 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -6.810 -4.689 -12.464 1.00 0.00 H new ATOM 0 HH TYR A 89 -4.972 -5.034 -13.523 1.00 0.00 H new ATOM 1392 N ASN A 90 -5.278 -4.182 -4.816 1.00 0.00 N ATOM 1393 CA ASN A 90 -5.280 -3.520 -3.522 1.00 0.00 C ATOM 1394 C ASN A 90 -5.076 -2.017 -3.724 1.00 0.00 C ATOM 1395 O ASN A 90 -4.435 -1.597 -4.687 1.00 0.00 O ATOM 1396 CB ASN A 90 -4.144 -4.037 -2.637 1.00 0.00 C ATOM 1397 CG ASN A 90 -4.255 -5.549 -2.431 1.00 0.00 C ATOM 1398 OD1 ASN A 90 -4.659 -6.293 -3.309 1.00 0.00 O ATOM 1399 ND2 ASN A 90 -3.874 -5.960 -1.225 1.00 0.00 N ATOM 0 H ASN A 90 -4.375 -4.189 -5.290 1.00 0.00 H new ATOM 0 HA ASN A 90 -6.235 -3.726 -3.039 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.184 -3.798 -3.095 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -4.171 -3.532 -1.672 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.910 -6.952 -0.989 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -3.546 -5.284 -0.536 1.00 0.00 H new ATOM 1406 N THR A 91 -5.632 -1.247 -2.800 1.00 0.00 N ATOM 1407 CA THR A 91 -5.519 0.200 -2.864 1.00 0.00 C ATOM 1408 C THR A 91 -4.988 0.753 -1.539 1.00 0.00 C ATOM 1409 O THR A 91 -4.988 0.054 -0.527 1.00 0.00 O ATOM 1410 CB THR A 91 -6.886 0.765 -3.254 1.00 0.00 C ATOM 1411 OG1 THR A 91 -7.785 0.175 -2.318 1.00 0.00 O ATOM 1412 CG2 THR A 91 -7.368 0.247 -4.610 1.00 0.00 C ATOM 0 H THR A 91 -6.162 -1.598 -2.003 1.00 0.00 H new ATOM 0 HA THR A 91 -4.797 0.507 -3.621 1.00 0.00 H new ATOM 0 HB THR A 91 -6.835 1.854 -3.278 1.00 0.00 H new ATOM 0 HG1 THR A 91 -8.696 0.489 -2.497 1.00 0.00 H new ATOM 0 HG21 THR A 91 -8.342 0.679 -4.839 1.00 0.00 H new ATOM 0 HG22 THR A 91 -6.654 0.532 -5.383 1.00 0.00 H new ATOM 0 HG23 THR A 91 -7.451 -0.839 -4.576 1.00 0.00 H new ATOM 1420 N TYR A 92 -4.549 2.002 -1.589 1.00 0.00 N ATOM 1421 CA TYR A 92 -4.018 2.656 -0.406 1.00 0.00 C ATOM 1422 C TYR A 92 -4.376 4.143 -0.394 1.00 0.00 C ATOM 1423 O TYR A 92 -4.222 4.831 -1.402 1.00 0.00 O ATOM 1424 CB TYR A 92 -2.497 2.511 -0.491 1.00 0.00 C ATOM 1425 CG TYR A 92 -2.014 1.062 -0.581 1.00 0.00 C ATOM 1426 CD1 TYR A 92 -2.244 0.191 0.465 1.00 0.00 C ATOM 1427 CD2 TYR A 92 -1.349 0.625 -1.709 1.00 0.00 C ATOM 1428 CE1 TYR A 92 -1.790 -1.172 0.380 1.00 0.00 C ATOM 1429 CE2 TYR A 92 -0.895 -0.739 -1.794 1.00 0.00 C ATOM 1430 CZ TYR A 92 -1.138 -1.570 -0.745 1.00 0.00 C ATOM 1431 OH TYR A 92 -0.709 -2.859 -0.825 1.00 0.00 O ATOM 0 H TYR A 92 -4.550 2.578 -2.431 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.431 2.208 0.498 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -2.138 3.058 -1.363 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.048 2.979 0.385 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -2.765 0.533 1.347 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -1.169 1.306 -2.528 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -1.963 -1.863 1.192 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -0.374 -1.094 -2.671 1.00 0.00 H new ATOM 0 HH TYR A 92 -0.261 -3.002 -1.685 1.00 0.00 H new ATOM 1441 N ILE A 93 -4.847 4.597 0.758 1.00 0.00 N ATOM 1442 CA ILE A 93 -5.229 5.990 0.915 1.00 0.00 C ATOM 1443 C ILE A 93 -4.616 6.540 2.204 1.00 0.00 C ATOM 1444 O ILE A 93 -4.684 5.898 3.251 1.00 0.00 O ATOM 1445 CB ILE A 93 -6.750 6.140 0.844 1.00 0.00 C ATOM 1446 CG1 ILE A 93 -7.263 5.855 -0.569 1.00 0.00 C ATOM 1447 CG2 ILE A 93 -7.189 7.517 1.346 1.00 0.00 C ATOM 1448 CD1 ILE A 93 -8.755 5.515 -0.552 1.00 0.00 C ATOM 0 H ILE A 93 -4.973 4.024 1.592 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.835 6.588 0.094 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.198 5.398 1.505 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.092 6.724 -1.204 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.703 5.027 -1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -8.274 7.598 1.285 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.873 7.644 2.381 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -6.732 8.291 0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -9.095 5.317 -1.569 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -8.920 4.631 0.064 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -9.315 6.354 -0.140 1.00 0.00 H new ATOM 1460 N SER A 94 -4.032 7.724 2.086 1.00 0.00 N ATOM 1461 CA SER A 94 -3.408 8.368 3.230 1.00 0.00 C ATOM 1462 C SER A 94 -4.443 8.591 4.334 1.00 0.00 C ATOM 1463 O SER A 94 -5.586 8.951 4.055 1.00 0.00 O ATOM 1464 CB SER A 94 -2.764 9.697 2.830 1.00 0.00 C ATOM 1465 OG SER A 94 -1.719 10.073 3.722 1.00 0.00 O ATOM 0 H SER A 94 -3.978 8.254 1.216 1.00 0.00 H new ATOM 0 HA SER A 94 -2.622 7.712 3.605 1.00 0.00 H new ATOM 0 HB2 SER A 94 -2.366 9.617 1.818 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.524 10.478 2.813 1.00 0.00 H new ATOM 0 HG SER A 94 -0.912 9.557 3.516 1.00 0.00 H new ATOM 1471 N LYS A 95 -4.006 8.366 5.565 1.00 0.00 N ATOM 1472 CA LYS A 95 -4.881 8.538 6.712 1.00 0.00 C ATOM 1473 C LYS A 95 -5.211 10.023 6.879 1.00 0.00 C ATOM 1474 O LYS A 95 -6.351 10.436 6.673 1.00 0.00 O ATOM 1475 CB LYS A 95 -4.261 7.902 7.958 1.00 0.00 C ATOM 1476 CG LYS A 95 -5.327 7.205 8.806 1.00 0.00 C ATOM 1477 CD LYS A 95 -5.189 7.587 10.282 1.00 0.00 C ATOM 1478 CE LYS A 95 -6.525 7.438 11.013 1.00 0.00 C ATOM 1479 NZ LYS A 95 -6.302 7.078 12.431 1.00 0.00 N ATOM 0 H LYS A 95 -3.058 8.066 5.793 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.825 8.018 6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.498 7.182 7.662 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -3.762 8.668 8.552 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.319 7.479 8.447 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.235 6.124 8.696 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -4.438 6.955 10.756 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.838 8.616 10.364 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -7.086 8.371 10.952 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -7.129 6.671 10.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.219 6.981 12.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -5.786 6.177 12.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -5.745 7.823 12.895 1.00 0.00 H new ATOM 1493 N LYS A 96 -4.192 10.784 7.250 1.00 0.00 N ATOM 1494 CA LYS A 96 -4.359 12.214 7.447 1.00 0.00 C ATOM 1495 C LYS A 96 -5.124 12.802 6.259 1.00 0.00 C ATOM 1496 O LYS A 96 -5.830 13.799 6.402 1.00 0.00 O ATOM 1497 CB LYS A 96 -3.006 12.883 7.698 1.00 0.00 C ATOM 1498 CG LYS A 96 -2.988 13.589 9.055 1.00 0.00 C ATOM 1499 CD LYS A 96 -1.856 14.617 9.123 1.00 0.00 C ATOM 1500 CE LYS A 96 -2.364 15.957 9.658 1.00 0.00 C ATOM 1501 NZ LYS A 96 -1.435 17.049 9.290 1.00 0.00 N ATOM 0 H LYS A 96 -3.248 10.437 7.419 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.955 12.408 8.339 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -2.214 12.135 7.663 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.800 13.603 6.906 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.944 14.084 9.224 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -2.865 12.854 9.850 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -1.059 14.243 9.766 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -1.427 14.757 8.131 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -3.355 16.164 9.255 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -2.465 15.908 10.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -1.795 17.951 9.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -0.497 16.858 9.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -1.359 17.106 8.254 1.00 0.00 H new ATOM 1515 N HIS A 97 -4.957 12.159 5.112 1.00 0.00 N ATOM 1516 CA HIS A 97 -5.623 12.606 3.900 1.00 0.00 C ATOM 1517 C HIS A 97 -6.492 11.475 3.346 1.00 0.00 C ATOM 1518 O HIS A 97 -6.367 11.106 2.179 1.00 0.00 O ATOM 1519 CB HIS A 97 -4.606 13.126 2.882 1.00 0.00 C ATOM 1520 CG HIS A 97 -3.432 13.846 3.500 1.00 0.00 C ATOM 1521 ND1 HIS A 97 -2.970 15.065 3.033 1.00 0.00 N ATOM 1522 CD2 HIS A 97 -2.632 13.509 4.552 1.00 0.00 C ATOM 1523 CE1 HIS A 97 -1.938 15.433 3.777 1.00 0.00 C ATOM 1524 NE2 HIS A 97 -1.729 14.468 4.718 1.00 0.00 N ATOM 0 H HIS A 97 -4.370 11.333 4.997 1.00 0.00 H new ATOM 0 HA HIS A 97 -6.281 13.444 4.129 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.235 12.287 2.293 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.111 13.802 2.192 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -3.358 15.590 2.249 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.718 12.613 5.149 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -1.362 16.339 3.659 1.00 0.00 H new ATOM 1532 N ALA A 98 -7.354 10.957 4.209 1.00 0.00 N ATOM 1533 CA ALA A 98 -8.244 9.876 3.820 1.00 0.00 C ATOM 1534 C ALA A 98 -9.574 10.463 3.341 1.00 0.00 C ATOM 1535 O ALA A 98 -10.191 9.937 2.417 1.00 0.00 O ATOM 1536 CB ALA A 98 -8.421 8.913 4.995 1.00 0.00 C ATOM 0 H ALA A 98 -7.455 11.266 5.176 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.818 9.307 2.993 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -9.089 8.102 4.703 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.452 8.502 5.277 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.849 9.448 5.843 1.00 0.00 H new ATOM 1542 N GLU A 99 -9.975 11.545 3.992 1.00 0.00 N ATOM 1543 CA GLU A 99 -11.220 12.209 3.645 1.00 0.00 C ATOM 1544 C GLU A 99 -11.059 12.988 2.338 1.00 0.00 C ATOM 1545 O GLU A 99 -12.041 13.465 1.770 1.00 0.00 O ATOM 1546 CB GLU A 99 -11.686 13.127 4.776 1.00 0.00 C ATOM 1547 CG GLU A 99 -12.768 12.451 5.620 1.00 0.00 C ATOM 1548 CD GLU A 99 -14.164 12.776 5.084 1.00 0.00 C ATOM 1549 OE1 GLU A 99 -14.517 12.196 4.034 1.00 0.00 O ATOM 1550 OE2 GLU A 99 -14.846 13.596 5.735 1.00 0.00 O ATOM 0 H GLU A 99 -9.460 11.979 4.758 1.00 0.00 H new ATOM 0 HA GLU A 99 -11.987 11.448 3.500 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -10.838 13.390 5.408 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.073 14.057 4.359 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -12.615 11.372 5.617 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.686 12.781 6.655 1.00 0.00 H new ATOM 1557 N LYS A 100 -9.813 13.093 1.898 1.00 0.00 N ATOM 1558 CA LYS A 100 -9.512 13.806 0.668 1.00 0.00 C ATOM 1559 C LYS A 100 -9.567 12.830 -0.509 1.00 0.00 C ATOM 1560 O LYS A 100 -9.442 13.237 -1.663 1.00 0.00 O ATOM 1561 CB LYS A 100 -8.178 14.546 0.791 1.00 0.00 C ATOM 1562 CG LYS A 100 -8.154 15.430 2.040 1.00 0.00 C ATOM 1563 CD LYS A 100 -7.247 16.645 1.834 1.00 0.00 C ATOM 1564 CE LYS A 100 -6.745 17.188 3.173 1.00 0.00 C ATOM 1565 NZ LYS A 100 -6.109 18.512 2.991 1.00 0.00 N ATOM 0 H LYS A 100 -9.001 12.696 2.371 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.261 14.575 0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.361 13.826 0.835 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.015 15.159 -0.096 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -9.165 15.762 2.274 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.803 14.850 2.894 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -6.398 16.368 1.209 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -7.793 17.425 1.303 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -7.576 17.271 3.873 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -6.029 16.491 3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -5.774 18.866 3.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -5.303 18.423 2.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -6.802 19.179 2.595 1.00 0.00 H new ATOM 1579 N ASN A 101 -9.756 11.562 -0.176 1.00 0.00 N ATOM 1580 CA ASN A 101 -9.830 10.525 -1.191 1.00 0.00 C ATOM 1581 C ASN A 101 -8.612 10.630 -2.111 1.00 0.00 C ATOM 1582 O ASN A 101 -8.750 10.914 -3.299 1.00 0.00 O ATOM 1583 CB ASN A 101 -11.086 10.684 -2.050 1.00 0.00 C ATOM 1584 CG ASN A 101 -12.220 11.327 -1.250 1.00 0.00 C ATOM 1585 OD1 ASN A 101 -12.240 12.521 -1.002 1.00 0.00 O ATOM 1586 ND2 ASN A 101 -13.161 10.471 -0.861 1.00 0.00 N ATOM 0 H ASN A 101 -9.860 11.229 0.782 1.00 0.00 H new ATOM 0 HA ASN A 101 -9.858 9.560 -0.685 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -10.859 11.297 -2.922 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -11.404 9.709 -2.419 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -13.960 10.803 -0.321 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -13.083 9.483 -1.103 1.00 0.00 H new ATOM 1593 N TRP A 102 -7.447 10.394 -1.525 1.00 0.00 N ATOM 1594 CA TRP A 102 -6.205 10.458 -2.277 1.00 0.00 C ATOM 1595 C TRP A 102 -5.632 9.042 -2.366 1.00 0.00 C ATOM 1596 O TRP A 102 -5.544 8.340 -1.360 1.00 0.00 O ATOM 1597 CB TRP A 102 -5.233 11.458 -1.647 1.00 0.00 C ATOM 1598 CG TRP A 102 -5.716 12.909 -1.692 1.00 0.00 C ATOM 1599 CD1 TRP A 102 -6.844 13.386 -2.236 1.00 0.00 C ATOM 1600 CD2 TRP A 102 -5.036 14.059 -1.146 1.00 0.00 C ATOM 1601 NE1 TRP A 102 -6.940 14.754 -2.082 1.00 0.00 N ATOM 1602 CE2 TRP A 102 -5.806 15.176 -1.398 1.00 0.00 C ATOM 1603 CE3 TRP A 102 -3.812 14.152 -0.462 1.00 0.00 C ATOM 1604 CZ2 TRP A 102 -5.436 16.467 -1.001 1.00 0.00 C ATOM 1605 CZ3 TRP A 102 -3.456 15.448 -0.072 1.00 0.00 C ATOM 1606 CH2 TRP A 102 -4.220 16.584 -0.318 1.00 0.00 C ATOM 0 H TRP A 102 -7.337 10.158 -0.539 1.00 0.00 H new ATOM 0 HA TRP A 102 -6.385 10.825 -3.288 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -5.060 11.176 -0.609 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -4.274 11.389 -2.160 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -7.585 12.777 -2.732 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -7.703 15.346 -2.410 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -3.194 13.291 -0.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -6.056 17.326 -1.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -2.523 15.575 0.457 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -3.877 17.552 0.016 1.00 0.00 H new ATOM 1617 N PHE A 103 -5.258 8.665 -3.580 1.00 0.00 N ATOM 1618 CA PHE A 103 -4.696 7.345 -3.813 1.00 0.00 C ATOM 1619 C PHE A 103 -3.232 7.441 -4.246 1.00 0.00 C ATOM 1620 O PHE A 103 -2.834 8.411 -4.890 1.00 0.00 O ATOM 1621 CB PHE A 103 -5.508 6.706 -4.941 1.00 0.00 C ATOM 1622 CG PHE A 103 -6.975 6.455 -4.587 1.00 0.00 C ATOM 1623 CD1 PHE A 103 -7.870 7.478 -4.629 1.00 0.00 C ATOM 1624 CD2 PHE A 103 -7.385 5.208 -4.229 1.00 0.00 C ATOM 1625 CE1 PHE A 103 -9.232 7.245 -4.300 1.00 0.00 C ATOM 1626 CE2 PHE A 103 -8.746 4.975 -3.900 1.00 0.00 C ATOM 1627 CZ PHE A 103 -9.641 5.998 -3.943 1.00 0.00 C ATOM 0 H PHE A 103 -5.333 9.250 -4.412 1.00 0.00 H new ATOM 0 HA PHE A 103 -4.738 6.756 -2.897 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -5.462 7.351 -5.818 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -5.044 5.759 -5.217 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.545 8.468 -4.913 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.675 4.395 -4.195 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.942 8.058 -4.333 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.071 3.985 -3.615 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.677 5.820 -3.694 1.00 0.00 H new ATOM 1637 N VAL A 104 -2.470 6.423 -3.875 1.00 0.00 N ATOM 1638 CA VAL A 104 -1.059 6.380 -4.216 1.00 0.00 C ATOM 1639 C VAL A 104 -0.909 6.090 -5.711 1.00 0.00 C ATOM 1640 O VAL A 104 0.133 6.372 -6.300 1.00 0.00 O ATOM 1641 CB VAL A 104 -0.337 5.359 -3.334 1.00 0.00 C ATOM 1642 CG1 VAL A 104 1.050 5.036 -3.892 1.00 0.00 C ATOM 1643 CG2 VAL A 104 -0.246 5.852 -1.888 1.00 0.00 C ATOM 0 H VAL A 104 -2.804 5.621 -3.341 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.590 7.345 -4.023 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.922 4.439 -3.338 1.00 0.00 H new ATOM 0 HG11 VAL A 104 1.541 4.308 -3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 104 0.951 4.622 -4.896 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.647 5.947 -3.932 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.271 5.108 -1.282 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.305 6.792 -1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.250 6.008 -1.493 1.00 0.00 H new ATOM 1653 N GLY A 105 -1.966 5.530 -6.282 1.00 0.00 N ATOM 1654 CA GLY A 105 -1.965 5.199 -7.696 1.00 0.00 C ATOM 1655 C GLY A 105 -1.086 6.171 -8.486 1.00 0.00 C ATOM 1656 O GLY A 105 -1.009 7.353 -8.155 1.00 0.00 O ATOM 0 H GLY A 105 -2.829 5.297 -5.790 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.602 4.180 -7.834 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -2.984 5.230 -8.081 1.00 0.00 H new ATOM 1660 N LEU A 106 -0.447 5.637 -9.517 1.00 0.00 N ATOM 1661 CA LEU A 106 0.423 6.443 -10.357 1.00 0.00 C ATOM 1662 C LEU A 106 -0.259 6.685 -11.705 1.00 0.00 C ATOM 1663 O LEU A 106 -1.176 5.956 -12.081 1.00 0.00 O ATOM 1664 CB LEU A 106 1.804 5.796 -10.474 1.00 0.00 C ATOM 1665 CG LEU A 106 2.491 5.436 -9.154 1.00 0.00 C ATOM 1666 CD1 LEU A 106 3.070 4.021 -9.205 1.00 0.00 C ATOM 1667 CD2 LEU A 106 3.551 6.476 -8.787 1.00 0.00 C ATOM 0 H LEU A 106 -0.514 4.656 -9.790 1.00 0.00 H new ATOM 0 HA LEU A 106 0.592 7.420 -9.904 1.00 0.00 H new ATOM 0 HB2 LEU A 106 1.709 4.889 -11.070 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.455 6.474 -11.026 1.00 0.00 H new ATOM 0 HG LEU A 106 1.740 5.448 -8.364 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.552 3.791 -8.255 1.00 0.00 H new ATOM 0 HD12 LEU A 106 2.268 3.306 -9.387 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.803 3.957 -10.009 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.024 6.197 -7.845 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.305 6.520 -9.573 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.080 7.453 -8.681 1.00 0.00 H new ATOM 1679 N LYS A 107 0.215 7.711 -12.395 1.00 0.00 N ATOM 1680 CA LYS A 107 -0.337 8.059 -13.694 1.00 0.00 C ATOM 1681 C LYS A 107 -0.079 6.914 -14.676 1.00 0.00 C ATOM 1682 O LYS A 107 0.123 5.773 -14.265 1.00 0.00 O ATOM 1683 CB LYS A 107 0.209 9.408 -14.165 1.00 0.00 C ATOM 1684 CG LYS A 107 0.019 10.482 -13.091 1.00 0.00 C ATOM 1685 CD LYS A 107 -1.341 11.167 -13.236 1.00 0.00 C ATOM 1686 CE LYS A 107 -1.225 12.446 -14.069 1.00 0.00 C ATOM 1687 NZ LYS A 107 -2.533 12.798 -14.664 1.00 0.00 N ATOM 0 H LYS A 107 0.975 8.313 -12.080 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.418 8.185 -13.627 1.00 0.00 H new ATOM 0 HB2 LYS A 107 1.268 9.312 -14.405 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.299 9.710 -15.081 1.00 0.00 H new ATOM 0 HG2 LYS A 107 0.099 10.031 -12.102 1.00 0.00 H new ATOM 0 HG3 LYS A 107 0.814 11.224 -13.169 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.048 10.484 -13.708 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.739 11.406 -12.250 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.872 13.265 -13.442 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.486 12.307 -14.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.436 13.668 -15.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.855 12.023 -15.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.229 12.951 -13.907 1.00 0.00 H new ATOM 1701 N LYS A 108 -0.094 7.260 -15.955 1.00 0.00 N ATOM 1702 CA LYS A 108 0.135 6.276 -16.999 1.00 0.00 C ATOM 1703 C LYS A 108 1.397 6.651 -17.779 1.00 0.00 C ATOM 1704 O LYS A 108 1.848 5.895 -18.638 1.00 0.00 O ATOM 1705 CB LYS A 108 -1.108 6.125 -17.877 1.00 0.00 C ATOM 1706 CG LYS A 108 -1.591 4.673 -17.900 1.00 0.00 C ATOM 1707 CD LYS A 108 -2.737 4.492 -18.898 1.00 0.00 C ATOM 1708 CE LYS A 108 -2.221 3.944 -20.230 1.00 0.00 C ATOM 1709 NZ LYS A 108 -3.351 3.516 -21.086 1.00 0.00 N ATOM 0 H LYS A 108 -0.261 8.208 -16.292 1.00 0.00 H new ATOM 0 HA LYS A 108 0.309 5.292 -16.563 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.903 6.770 -17.502 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -0.883 6.453 -18.892 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.764 4.015 -18.167 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.922 4.380 -16.904 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -3.481 3.811 -18.484 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -3.236 5.447 -19.062 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.637 4.708 -20.743 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.554 3.101 -20.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -2.984 3.147 -21.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -3.891 2.772 -20.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -3.972 4.329 -21.273 1.00 0.00 H new ATOM 1723 N ASN A 109 1.931 7.818 -17.451 1.00 0.00 N ATOM 1724 CA ASN A 109 3.132 8.303 -18.111 1.00 0.00 C ATOM 1725 C ASN A 109 4.353 7.954 -17.258 1.00 0.00 C ATOM 1726 O ASN A 109 5.444 8.473 -17.488 1.00 0.00 O ATOM 1727 CB ASN A 109 3.092 9.823 -18.279 1.00 0.00 C ATOM 1728 CG ASN A 109 2.422 10.211 -19.599 1.00 0.00 C ATOM 1729 OD1 ASN A 109 1.879 9.386 -20.315 1.00 0.00 O ATOM 1730 ND2 ASN A 109 2.491 11.509 -19.880 1.00 0.00 N ATOM 0 H ASN A 109 1.555 8.442 -16.737 1.00 0.00 H new ATOM 0 HA ASN A 109 3.191 7.833 -19.093 1.00 0.00 H new ATOM 0 HB2 ASN A 109 2.549 10.270 -17.446 1.00 0.00 H new ATOM 0 HB3 ASN A 109 4.106 10.223 -18.250 1.00 0.00 H new ATOM 0 HD21 ASN A 109 2.074 11.868 -20.739 1.00 0.00 H new ATOM 0 HD22 ASN A 109 2.961 12.146 -19.236 1.00 0.00 H new ATOM 1737 N GLY A 110 4.128 7.077 -16.290 1.00 0.00 N ATOM 1738 CA GLY A 110 5.197 6.653 -15.402 1.00 0.00 C ATOM 1739 C GLY A 110 5.493 7.723 -14.349 1.00 0.00 C ATOM 1740 O GLY A 110 6.652 7.978 -14.027 1.00 0.00 O ATOM 0 H GLY A 110 3.222 6.649 -16.102 1.00 0.00 H new ATOM 0 HA2 GLY A 110 4.918 5.721 -14.910 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.097 6.450 -15.982 1.00 0.00 H new ATOM 1744 N SER A 111 4.424 8.321 -13.843 1.00 0.00 N ATOM 1745 CA SER A 111 4.555 9.358 -12.833 1.00 0.00 C ATOM 1746 C SER A 111 3.496 9.166 -11.746 1.00 0.00 C ATOM 1747 O SER A 111 2.512 8.457 -11.950 1.00 0.00 O ATOM 1748 CB SER A 111 4.430 10.750 -13.455 1.00 0.00 C ATOM 1749 OG SER A 111 5.688 11.416 -13.531 1.00 0.00 O ATOM 0 H SER A 111 3.464 8.107 -14.113 1.00 0.00 H new ATOM 0 HA SER A 111 5.545 9.277 -12.385 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.005 10.663 -14.455 1.00 0.00 H new ATOM 0 HB3 SER A 111 3.737 11.350 -12.865 1.00 0.00 H new ATOM 0 HG SER A 111 5.566 12.300 -13.935 1.00 0.00 H new ATOM 1755 N CYS A 112 3.734 9.810 -10.613 1.00 0.00 N ATOM 1756 CA CYS A 112 2.813 9.719 -9.492 1.00 0.00 C ATOM 1757 C CYS A 112 1.621 10.636 -9.774 1.00 0.00 C ATOM 1758 O CYS A 112 1.798 11.774 -10.206 1.00 0.00 O ATOM 1759 CB CYS A 112 3.498 10.063 -8.168 1.00 0.00 C ATOM 1760 SG CYS A 112 3.965 11.832 -8.147 1.00 0.00 S ATOM 0 H CYS A 112 4.551 10.397 -10.447 1.00 0.00 H new ATOM 0 HA CYS A 112 2.463 8.692 -9.388 1.00 0.00 H new ATOM 0 HB2 CYS A 112 2.829 9.845 -7.335 1.00 0.00 H new ATOM 0 HB3 CYS A 112 4.384 9.443 -8.036 1.00 0.00 H new ATOM 0 HG CYS A 112 3.251 12.480 -9.019 1.00 0.00 H new ATOM 1766 N LYS A 113 0.434 10.106 -9.518 1.00 0.00 N ATOM 1767 CA LYS A 113 -0.786 10.862 -9.739 1.00 0.00 C ATOM 1768 C LYS A 113 -1.157 11.610 -8.457 1.00 0.00 C ATOM 1769 O LYS A 113 -1.395 10.992 -7.420 1.00 0.00 O ATOM 1770 CB LYS A 113 -1.897 9.948 -10.261 1.00 0.00 C ATOM 1771 CG LYS A 113 -3.243 10.675 -10.279 1.00 0.00 C ATOM 1772 CD LYS A 113 -4.340 9.784 -10.865 1.00 0.00 C ATOM 1773 CE LYS A 113 -5.009 10.457 -12.065 1.00 0.00 C ATOM 1774 NZ LYS A 113 -4.747 9.688 -13.303 1.00 0.00 N ATOM 0 H LYS A 113 0.292 9.162 -9.160 1.00 0.00 H new ATOM 0 HA LYS A 113 -0.633 11.613 -10.514 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -1.650 9.608 -11.267 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.968 9.060 -9.632 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -3.513 10.972 -9.266 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -3.159 11.589 -10.867 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -3.913 8.829 -11.170 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -5.087 9.570 -10.100 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -6.083 10.531 -11.896 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -4.633 11.474 -12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -4.816 10.320 -14.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -3.792 9.277 -13.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -5.448 8.925 -13.393 1.00 0.00 H new ATOM 1788 N ARG A 114 -1.194 12.930 -8.569 1.00 0.00 N ATOM 1789 CA ARG A 114 -1.532 13.768 -7.431 1.00 0.00 C ATOM 1790 C ARG A 114 -2.638 13.115 -6.600 1.00 0.00 C ATOM 1791 O ARG A 114 -3.595 12.572 -7.150 1.00 0.00 O ATOM 1792 CB ARG A 114 -1.996 15.153 -7.886 1.00 0.00 C ATOM 1793 CG ARG A 114 -0.857 16.171 -7.795 1.00 0.00 C ATOM 1794 CD ARG A 114 -0.221 16.406 -9.167 1.00 0.00 C ATOM 1795 NE ARG A 114 -0.788 17.625 -9.785 1.00 0.00 N ATOM 1796 CZ ARG A 114 -0.558 18.868 -9.342 1.00 0.00 C ATOM 1797 NH1 ARG A 114 0.228 19.065 -8.275 1.00 0.00 N ATOM 1798 NH2 ARG A 114 -1.115 19.916 -9.966 1.00 0.00 N ATOM 0 H ARG A 114 -0.996 13.439 -9.430 1.00 0.00 H new ATOM 0 HA ARG A 114 -0.634 13.879 -6.823 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.359 15.100 -8.912 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -2.832 15.481 -7.268 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.237 17.113 -7.400 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -0.101 15.814 -7.096 1.00 0.00 H new ATOM 0 HD2 ARG A 114 0.859 16.509 -9.063 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -0.398 15.545 -9.812 1.00 0.00 H new ATOM 0 HE ARG A 114 -1.392 17.512 -10.599 1.00 0.00 H new ATOM 0 HH11 ARG A 114 0.652 18.268 -7.800 1.00 0.00 H new ATOM 0 HH12 ARG A 114 0.403 20.012 -7.938 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -1.714 19.767 -10.778 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.940 20.863 -9.629 1.00 0.00 H new ATOM 1812 N GLY A 115 -2.469 13.188 -5.288 1.00 0.00 N ATOM 1813 CA GLY A 115 -3.441 12.611 -4.375 1.00 0.00 C ATOM 1814 C GLY A 115 -4.852 13.116 -4.684 1.00 0.00 C ATOM 1815 O GLY A 115 -5.761 12.323 -4.924 1.00 0.00 O ATOM 0 H GLY A 115 -1.673 13.638 -4.835 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -3.415 11.524 -4.451 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -3.177 12.865 -3.349 1.00 0.00 H new ATOM 1819 N PRO A 116 -4.994 14.469 -4.668 1.00 0.00 N ATOM 1820 CA PRO A 116 -6.278 15.090 -4.943 1.00 0.00 C ATOM 1821 C PRO A 116 -6.603 15.039 -6.438 1.00 0.00 C ATOM 1822 O PRO A 116 -7.159 15.988 -6.989 1.00 0.00 O ATOM 1823 CB PRO A 116 -6.152 16.508 -4.411 1.00 0.00 C ATOM 1824 CG PRO A 116 -4.661 16.773 -4.279 1.00 0.00 C ATOM 1825 CD PRO A 116 -3.940 15.439 -4.388 1.00 0.00 C ATOM 0 HA PRO A 116 -7.107 14.571 -4.462 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.617 17.223 -5.090 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.653 16.610 -3.449 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -4.324 17.454 -5.060 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -4.441 17.249 -3.324 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.195 15.455 -5.184 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.414 15.197 -3.465 1.00 0.00 H new ATOM 1833 N ARG A 117 -6.241 13.922 -7.052 1.00 0.00 N ATOM 1834 CA ARG A 117 -6.486 13.735 -8.472 1.00 0.00 C ATOM 1835 C ARG A 117 -6.824 12.272 -8.764 1.00 0.00 C ATOM 1836 O ARG A 117 -6.743 11.829 -9.909 1.00 0.00 O ATOM 1837 CB ARG A 117 -5.267 14.145 -9.300 1.00 0.00 C ATOM 1838 CG ARG A 117 -5.104 15.666 -9.320 1.00 0.00 C ATOM 1839 CD ARG A 117 -5.172 16.206 -10.750 1.00 0.00 C ATOM 1840 NE ARG A 117 -3.869 16.015 -11.426 1.00 0.00 N ATOM 1841 CZ ARG A 117 -3.590 16.457 -12.660 1.00 0.00 C ATOM 1842 NH1 ARG A 117 -4.521 17.118 -13.361 1.00 0.00 N ATOM 1843 NH2 ARG A 117 -2.380 16.238 -13.193 1.00 0.00 N ATOM 0 H ARG A 117 -5.780 13.137 -6.592 1.00 0.00 H new ATOM 0 HA ARG A 117 -7.329 14.368 -8.749 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.370 13.685 -8.885 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -5.374 13.774 -10.319 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -5.885 16.127 -8.716 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -4.150 15.939 -8.869 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -5.957 15.692 -11.304 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -5.432 17.264 -10.736 1.00 0.00 H new ATOM 0 HE ARG A 117 -3.137 15.515 -10.921 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -5.442 17.285 -12.955 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -4.309 17.455 -14.300 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -1.671 15.735 -12.659 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -2.168 16.575 -14.132 1.00 0.00 H new ATOM 1857 N THR A 118 -7.196 11.562 -7.709 1.00 0.00 N ATOM 1858 CA THR A 118 -7.546 10.157 -7.838 1.00 0.00 C ATOM 1859 C THR A 118 -9.011 9.936 -7.457 1.00 0.00 C ATOM 1860 O THR A 118 -9.616 10.775 -6.790 1.00 0.00 O ATOM 1861 CB THR A 118 -6.567 9.346 -6.987 1.00 0.00 C ATOM 1862 OG1 THR A 118 -6.402 10.127 -5.807 1.00 0.00 O ATOM 1863 CG2 THR A 118 -5.166 9.292 -7.598 1.00 0.00 C ATOM 0 H THR A 118 -7.263 11.933 -6.761 1.00 0.00 H new ATOM 0 HA THR A 118 -7.457 9.820 -8.871 1.00 0.00 H new ATOM 0 HB THR A 118 -6.948 8.332 -6.863 1.00 0.00 H new ATOM 0 HG1 THR A 118 -5.811 10.885 -5.997 1.00 0.00 H new ATOM 0 HG21 THR A 118 -4.511 8.705 -6.955 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.217 8.829 -8.584 1.00 0.00 H new ATOM 0 HG23 THR A 118 -4.771 10.303 -7.692 1.00 0.00 H new ATOM 1871 N HIS A 119 -9.539 8.803 -7.895 1.00 0.00 N ATOM 1872 CA HIS A 119 -10.921 8.461 -7.608 1.00 0.00 C ATOM 1873 C HIS A 119 -11.160 6.982 -7.921 1.00 0.00 C ATOM 1874 O HIS A 119 -10.216 6.240 -8.187 1.00 0.00 O ATOM 1875 CB HIS A 119 -11.878 9.388 -8.360 1.00 0.00 C ATOM 1876 CG HIS A 119 -12.513 10.449 -7.494 1.00 0.00 C ATOM 1877 ND1 HIS A 119 -13.348 10.149 -6.432 1.00 0.00 N ATOM 1878 CD2 HIS A 119 -12.425 11.809 -7.543 1.00 0.00 C ATOM 1879 CE1 HIS A 119 -13.741 11.286 -5.875 1.00 0.00 C ATOM 1880 NE2 HIS A 119 -13.168 12.313 -6.565 1.00 0.00 N ATOM 0 H HIS A 119 -9.034 8.110 -8.447 1.00 0.00 H new ATOM 0 HA HIS A 119 -11.123 8.609 -6.547 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -11.335 9.873 -9.171 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -12.665 8.788 -8.817 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.849 12.379 -8.256 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.399 11.382 -5.024 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -13.290 13.305 -6.363 1.00 0.00 H new ATOM 1888 N TYR A 120 -12.427 6.598 -7.877 1.00 0.00 N ATOM 1889 CA TYR A 120 -12.802 5.221 -8.153 1.00 0.00 C ATOM 1890 C TYR A 120 -13.147 5.032 -9.631 1.00 0.00 C ATOM 1891 O TYR A 120 -13.833 5.864 -10.224 1.00 0.00 O ATOM 1892 CB TYR A 120 -14.050 4.948 -7.311 1.00 0.00 C ATOM 1893 CG TYR A 120 -13.833 5.111 -5.805 1.00 0.00 C ATOM 1894 CD1 TYR A 120 -12.947 4.286 -5.142 1.00 0.00 C ATOM 1895 CD2 TYR A 120 -14.524 6.083 -5.110 1.00 0.00 C ATOM 1896 CE1 TYR A 120 -12.743 4.440 -3.725 1.00 0.00 C ATOM 1897 CE2 TYR A 120 -14.320 6.236 -3.693 1.00 0.00 C ATOM 1898 CZ TYR A 120 -13.439 5.407 -3.071 1.00 0.00 C ATOM 1899 OH TYR A 120 -13.247 5.552 -1.732 1.00 0.00 O ATOM 0 H TYR A 120 -13.207 7.216 -7.654 1.00 0.00 H new ATOM 0 HA TYR A 120 -11.981 4.545 -7.916 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -14.845 5.623 -7.628 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -14.395 3.934 -7.510 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -12.407 3.525 -5.686 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -15.217 6.728 -5.629 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -12.053 3.802 -3.194 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.854 6.992 -3.137 1.00 0.00 H new ATOM 0 HH TYR A 120 -13.809 6.282 -1.398 1.00 0.00 H new ATOM 1909 N GLY A 121 -12.655 3.933 -10.185 1.00 0.00 N ATOM 1910 CA GLY A 121 -12.903 3.625 -11.583 1.00 0.00 C ATOM 1911 C GLY A 121 -11.608 3.686 -12.396 1.00 0.00 C ATOM 1912 O GLY A 121 -11.600 3.362 -13.582 1.00 0.00 O ATOM 0 H GLY A 121 -12.086 3.245 -9.691 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -13.343 2.631 -11.668 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -13.627 4.330 -11.992 1.00 0.00 H new ATOM 1916 N GLN A 122 -10.545 4.105 -11.725 1.00 0.00 N ATOM 1917 CA GLN A 122 -9.248 4.213 -12.370 1.00 0.00 C ATOM 1918 C GLN A 122 -8.401 2.975 -12.069 1.00 0.00 C ATOM 1919 O GLN A 122 -8.572 2.339 -11.031 1.00 0.00 O ATOM 1920 CB GLN A 122 -8.525 5.490 -11.937 1.00 0.00 C ATOM 1921 CG GLN A 122 -9.414 6.719 -12.141 1.00 0.00 C ATOM 1922 CD GLN A 122 -8.611 8.010 -11.973 1.00 0.00 C ATOM 1923 OE1 GLN A 122 -7.691 8.302 -12.720 1.00 0.00 O ATOM 1924 NE2 GLN A 122 -9.008 8.766 -10.953 1.00 0.00 N ATOM 0 H GLN A 122 -10.556 4.374 -10.741 1.00 0.00 H new ATOM 0 HA GLN A 122 -9.403 4.270 -13.447 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.240 5.413 -10.888 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.605 5.603 -12.510 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.858 6.690 -13.136 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -10.235 6.701 -11.424 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -9.785 8.463 -10.366 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -8.535 9.648 -10.758 1.00 0.00 H new ATOM 1933 N LYS A 123 -7.505 2.671 -12.997 1.00 0.00 N ATOM 1934 CA LYS A 123 -6.631 1.520 -12.845 1.00 0.00 C ATOM 1935 C LYS A 123 -5.351 1.950 -12.126 1.00 0.00 C ATOM 1936 O LYS A 123 -4.423 1.156 -11.975 1.00 0.00 O ATOM 1937 CB LYS A 123 -6.382 0.853 -14.199 1.00 0.00 C ATOM 1938 CG LYS A 123 -5.807 -0.553 -14.020 1.00 0.00 C ATOM 1939 CD LYS A 123 -6.880 -1.526 -13.526 1.00 0.00 C ATOM 1940 CE LYS A 123 -7.498 -2.299 -14.692 1.00 0.00 C ATOM 1941 NZ LYS A 123 -8.527 -3.242 -14.201 1.00 0.00 N ATOM 0 H LYS A 123 -7.366 3.202 -13.857 1.00 0.00 H new ATOM 0 HA LYS A 123 -7.106 0.760 -12.225 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.316 0.799 -14.759 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.692 1.460 -14.786 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -5.399 -0.906 -14.967 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -4.982 -0.524 -13.308 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -6.442 -2.225 -12.813 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.658 -0.976 -12.996 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -7.944 -1.603 -15.402 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -6.721 -2.845 -15.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.596 -4.051 -14.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.263 -3.581 -13.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -9.446 -2.758 -14.152 1.00 0.00 H new ATOM 1955 N ALA A 124 -5.341 3.205 -11.701 1.00 0.00 N ATOM 1956 CA ALA A 124 -4.190 3.749 -11.001 1.00 0.00 C ATOM 1957 C ALA A 124 -4.280 3.383 -9.518 1.00 0.00 C ATOM 1958 O ALA A 124 -3.289 2.974 -8.915 1.00 0.00 O ATOM 1959 CB ALA A 124 -4.124 5.261 -11.226 1.00 0.00 C ATOM 0 H ALA A 124 -6.112 3.861 -11.828 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.266 3.321 -11.390 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.261 5.670 -10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.031 5.466 -12.292 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.033 5.726 -10.845 1.00 0.00 H new ATOM 1965 N ILE A 125 -5.477 3.545 -8.973 1.00 0.00 N ATOM 1966 CA ILE A 125 -5.709 3.237 -7.572 1.00 0.00 C ATOM 1967 C ILE A 125 -5.499 1.739 -7.342 1.00 0.00 C ATOM 1968 O ILE A 125 -4.997 1.332 -6.295 1.00 0.00 O ATOM 1969 CB ILE A 125 -7.086 3.739 -7.134 1.00 0.00 C ATOM 1970 CG1 ILE A 125 -8.190 2.785 -7.597 1.00 0.00 C ATOM 1971 CG2 ILE A 125 -7.326 5.171 -7.617 1.00 0.00 C ATOM 1972 CD1 ILE A 125 -9.574 3.381 -7.333 1.00 0.00 C ATOM 0 H ILE A 125 -6.296 3.885 -9.476 1.00 0.00 H new ATOM 0 HA ILE A 125 -4.989 3.761 -6.943 1.00 0.00 H new ATOM 0 HB ILE A 125 -7.113 3.758 -6.044 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -8.075 2.579 -8.661 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -8.095 1.832 -7.076 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.312 5.504 -7.292 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.565 5.829 -7.198 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.273 5.202 -8.705 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -10.341 2.684 -7.671 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -9.694 3.563 -6.265 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -9.675 4.321 -7.875 1.00 0.00 H new ATOM 1984 N LEU A 126 -5.893 0.959 -8.338 1.00 0.00 N ATOM 1985 CA LEU A 126 -5.754 -0.486 -8.258 1.00 0.00 C ATOM 1986 C LEU A 126 -4.268 -0.851 -8.242 1.00 0.00 C ATOM 1987 O LEU A 126 -3.590 -0.752 -9.264 1.00 0.00 O ATOM 1988 CB LEU A 126 -6.541 -1.163 -9.381 1.00 0.00 C ATOM 1989 CG LEU A 126 -8.034 -0.832 -9.448 1.00 0.00 C ATOM 1990 CD1 LEU A 126 -8.684 -1.475 -10.674 1.00 0.00 C ATOM 1991 CD2 LEU A 126 -8.742 -1.227 -8.150 1.00 0.00 C ATOM 0 H LEU A 126 -6.309 1.300 -9.205 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.185 -0.859 -7.329 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.085 -0.890 -10.333 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.433 -2.242 -9.274 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.140 0.247 -9.557 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -9.744 -1.224 -10.697 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.203 -1.102 -11.578 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.569 -2.558 -10.621 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -9.801 -0.981 -8.224 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.629 -2.299 -7.985 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -8.301 -0.683 -7.315 1.00 0.00 H new ATOM 2003 N PHE A 127 -3.805 -1.264 -7.071 1.00 0.00 N ATOM 2004 CA PHE A 127 -2.413 -1.644 -6.909 1.00 0.00 C ATOM 2005 C PHE A 127 -2.290 -3.111 -6.491 1.00 0.00 C ATOM 2006 O PHE A 127 -2.956 -3.552 -5.556 1.00 0.00 O ATOM 2007 CB PHE A 127 -1.834 -0.761 -5.802 1.00 0.00 C ATOM 2008 CG PHE A 127 -1.063 0.457 -6.317 1.00 0.00 C ATOM 2009 CD1 PHE A 127 -1.312 0.942 -7.563 1.00 0.00 C ATOM 2010 CD2 PHE A 127 -0.128 1.053 -5.529 1.00 0.00 C ATOM 2011 CE1 PHE A 127 -0.597 2.072 -8.041 1.00 0.00 C ATOM 2012 CE2 PHE A 127 0.587 2.183 -6.007 1.00 0.00 C ATOM 2013 CZ PHE A 127 0.338 2.668 -7.253 1.00 0.00 C ATOM 0 H PHE A 127 -4.370 -1.344 -6.226 1.00 0.00 H new ATOM 0 HA PHE A 127 -1.881 -1.517 -7.852 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -2.647 -0.419 -5.161 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -1.170 -1.363 -5.181 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -2.053 0.468 -8.189 1.00 0.00 H new ATOM 0 HD2 PHE A 127 0.071 0.667 -4.540 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.796 2.458 -9.030 1.00 0.00 H new ATOM 0 HE2 PHE A 127 1.328 2.657 -5.381 1.00 0.00 H new ATOM 0 HZ PHE A 127 0.883 3.527 -7.617 1.00 0.00 H new ATOM 2023 N LEU A 128 -1.433 -3.827 -7.204 1.00 0.00 N ATOM 2024 CA LEU A 128 -1.214 -5.235 -6.919 1.00 0.00 C ATOM 2025 C LEU A 128 0.219 -5.433 -6.420 1.00 0.00 C ATOM 2026 O LEU A 128 1.175 -5.145 -7.138 1.00 0.00 O ATOM 2027 CB LEU A 128 -1.564 -6.089 -8.139 1.00 0.00 C ATOM 2028 CG LEU A 128 -2.638 -7.158 -7.923 1.00 0.00 C ATOM 2029 CD1 LEU A 128 -2.922 -7.918 -9.220 1.00 0.00 C ATOM 2030 CD2 LEU A 128 -2.253 -8.098 -6.780 1.00 0.00 C ATOM 0 H LEU A 128 -0.882 -3.458 -7.979 1.00 0.00 H new ATOM 0 HA LEU A 128 -1.878 -5.571 -6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.895 -5.426 -8.939 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.655 -6.580 -8.487 1.00 0.00 H new ATOM 0 HG LEU A 128 -3.563 -6.660 -7.632 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -3.688 -8.672 -9.040 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -3.271 -7.221 -9.981 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -2.009 -8.404 -9.564 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -3.033 -8.848 -6.647 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -1.311 -8.592 -7.017 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -2.141 -7.525 -5.860 1.00 0.00 H new ATOM 2042 N PRO A 129 0.324 -5.935 -5.161 1.00 0.00 N ATOM 2043 CA PRO A 129 1.624 -6.175 -4.557 1.00 0.00 C ATOM 2044 C PRO A 129 2.281 -7.424 -5.148 1.00 0.00 C ATOM 2045 O PRO A 129 1.725 -8.519 -5.069 1.00 0.00 O ATOM 2046 CB PRO A 129 1.350 -6.297 -3.067 1.00 0.00 C ATOM 2047 CG PRO A 129 -0.137 -6.584 -2.939 1.00 0.00 C ATOM 2048 CD PRO A 129 -0.787 -6.287 -4.281 1.00 0.00 C ATOM 0 HA PRO A 129 2.333 -5.371 -4.753 1.00 0.00 H new ATOM 0 HB2 PRO A 129 1.942 -7.099 -2.625 1.00 0.00 H new ATOM 0 HB3 PRO A 129 1.617 -5.379 -2.544 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.302 -7.624 -2.657 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.579 -5.967 -2.156 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -1.331 -7.153 -4.658 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.504 -5.470 -4.202 1.00 0.00 H new ATOM 2056 N LEU A 130 3.455 -7.219 -5.726 1.00 0.00 N ATOM 2057 CA LEU A 130 4.193 -8.315 -6.330 1.00 0.00 C ATOM 2058 C LEU A 130 5.316 -8.750 -5.386 1.00 0.00 C ATOM 2059 O LEU A 130 5.934 -7.916 -4.725 1.00 0.00 O ATOM 2060 CB LEU A 130 4.680 -7.928 -7.728 1.00 0.00 C ATOM 2061 CG LEU A 130 3.615 -7.901 -8.826 1.00 0.00 C ATOM 2062 CD1 LEU A 130 2.978 -9.281 -9.005 1.00 0.00 C ATOM 2063 CD2 LEU A 130 2.571 -6.818 -8.551 1.00 0.00 C ATOM 0 H LEU A 130 3.914 -6.310 -5.789 1.00 0.00 H new ATOM 0 HA LEU A 130 3.543 -9.178 -6.472 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.139 -6.941 -7.671 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.462 -8.627 -8.025 1.00 0.00 H new ATOM 0 HG LEU A 130 4.101 -7.646 -9.768 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.224 -9.235 -9.791 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.746 -10.003 -9.281 1.00 0.00 H new ATOM 0 HD13 LEU A 130 2.509 -9.589 -8.071 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.826 -6.820 -9.347 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.083 -7.017 -7.597 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.059 -5.844 -8.514 1.00 0.00 H new ATOM 2075 N PRO A 131 5.553 -10.088 -5.352 1.00 0.00 N ATOM 2076 CA PRO A 131 6.591 -10.643 -4.499 1.00 0.00 C ATOM 2077 C PRO A 131 7.980 -10.378 -5.083 1.00 0.00 C ATOM 2078 O PRO A 131 8.178 -10.479 -6.293 1.00 0.00 O ATOM 2079 CB PRO A 131 6.264 -12.124 -4.394 1.00 0.00 C ATOM 2080 CG PRO A 131 5.334 -12.429 -5.558 1.00 0.00 C ATOM 2081 CD PRO A 131 4.841 -11.106 -6.120 1.00 0.00 C ATOM 0 HA PRO A 131 6.614 -10.183 -3.511 1.00 0.00 H new ATOM 0 HB2 PRO A 131 7.169 -12.729 -4.449 1.00 0.00 H new ATOM 0 HB3 PRO A 131 5.785 -12.352 -3.442 1.00 0.00 H new ATOM 0 HG2 PRO A 131 5.858 -12.998 -6.326 1.00 0.00 H new ATOM 0 HG3 PRO A 131 4.494 -13.039 -5.226 1.00 0.00 H new ATOM 0 HD2 PRO A 131 5.058 -11.023 -7.185 1.00 0.00 H new ATOM 0 HD3 PRO A 131 3.762 -11.005 -6.006 1.00 0.00 H new ATOM 2089 N VAL A 132 8.905 -10.043 -4.196 1.00 0.00 N ATOM 2090 CA VAL A 132 10.270 -9.762 -4.608 1.00 0.00 C ATOM 2091 C VAL A 132 11.239 -10.337 -3.573 1.00 0.00 C ATOM 2092 O VAL A 132 10.926 -10.388 -2.385 1.00 0.00 O ATOM 2093 CB VAL A 132 10.452 -8.259 -4.828 1.00 0.00 C ATOM 2094 CG1 VAL A 132 10.783 -7.549 -3.513 1.00 0.00 C ATOM 2095 CG2 VAL A 132 11.524 -7.985 -5.884 1.00 0.00 C ATOM 0 H VAL A 132 8.736 -9.960 -3.193 1.00 0.00 H new ATOM 0 HA VAL A 132 10.488 -10.244 -5.561 1.00 0.00 H new ATOM 0 HB VAL A 132 9.508 -7.858 -5.197 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.907 -6.482 -3.697 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.971 -7.702 -2.802 1.00 0.00 H new ATOM 0 HG13 VAL A 132 11.707 -7.956 -3.102 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.633 -6.909 -6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 132 12.474 -8.407 -5.556 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.230 -8.443 -6.828 1.00 0.00 H new ATOM 2105 N SER A 133 12.398 -10.755 -4.062 1.00 0.00 N ATOM 2106 CA SER A 133 13.415 -11.324 -3.194 1.00 0.00 C ATOM 2107 C SER A 133 12.844 -12.525 -2.437 1.00 0.00 C ATOM 2108 O SER A 133 12.013 -12.363 -1.545 1.00 0.00 O ATOM 2109 CB SER A 133 13.946 -10.280 -2.210 1.00 0.00 C ATOM 2110 OG SER A 133 14.512 -10.880 -1.049 1.00 0.00 O ATOM 0 H SER A 133 12.655 -10.711 -5.048 1.00 0.00 H new ATOM 0 HA SER A 133 14.248 -11.656 -3.814 1.00 0.00 H new ATOM 0 HB2 SER A 133 14.699 -9.666 -2.704 1.00 0.00 H new ATOM 0 HB3 SER A 133 13.135 -9.614 -1.915 1.00 0.00 H new ATOM 0 HG SER A 133 14.841 -10.180 -0.447 1.00 0.00 H new ATOM 2116 N SER A 134 13.314 -13.703 -2.820 1.00 0.00 N ATOM 2117 CA SER A 134 12.861 -14.931 -2.189 1.00 0.00 C ATOM 2118 C SER A 134 14.059 -15.712 -1.644 1.00 0.00 C ATOM 2119 O SER A 134 15.177 -15.560 -2.133 1.00 0.00 O ATOM 2120 CB SER A 134 12.066 -15.794 -3.170 1.00 0.00 C ATOM 2121 OG SER A 134 12.762 -15.985 -4.399 1.00 0.00 O ATOM 0 H SER A 134 14.004 -13.833 -3.560 1.00 0.00 H new ATOM 0 HA SER A 134 12.201 -14.667 -1.363 1.00 0.00 H new ATOM 0 HB2 SER A 134 11.860 -16.763 -2.716 1.00 0.00 H new ATOM 0 HB3 SER A 134 11.103 -15.324 -3.368 1.00 0.00 H new ATOM 0 HG SER A 134 12.222 -16.542 -4.997 1.00 0.00 H new ATOM 2127 N ASP A 135 13.784 -16.530 -0.640 1.00 0.00 N ATOM 2128 CA ASP A 135 14.825 -17.335 -0.024 1.00 0.00 C ATOM 2129 C ASP A 135 14.180 -18.448 0.805 1.00 0.00 C ATOM 2130 O ASP A 135 14.622 -19.595 0.762 1.00 0.00 O ATOM 2131 CB ASP A 135 15.693 -16.491 0.912 1.00 0.00 C ATOM 2132 CG ASP A 135 17.144 -16.314 0.463 1.00 0.00 C ATOM 2133 OD1 ASP A 135 17.698 -17.300 -0.069 1.00 0.00 O ATOM 2134 OD2 ASP A 135 17.667 -15.196 0.661 1.00 0.00 O ATOM 0 H ASP A 135 12.855 -16.653 -0.237 1.00 0.00 H new ATOM 0 HA ASP A 135 15.447 -17.747 -0.819 1.00 0.00 H new ATOM 0 HB2 ASP A 135 15.238 -15.506 1.016 1.00 0.00 H new ATOM 0 HB3 ASP A 135 15.688 -16.950 1.901 1.00 0.00 H new ATOM 2139 N LEU A 136 13.144 -18.070 1.541 1.00 0.00 N ATOM 2140 CA LEU A 136 12.434 -19.021 2.378 1.00 0.00 C ATOM 2141 C LEU A 136 11.088 -19.357 1.732 1.00 0.00 C ATOM 2142 O LEU A 136 10.943 -20.402 1.100 1.00 0.00 O ATOM 2143 CB LEU A 136 12.314 -18.491 3.808 1.00 0.00 C ATOM 2144 CG LEU A 136 13.235 -17.324 4.171 1.00 0.00 C ATOM 2145 CD1 LEU A 136 12.456 -16.009 4.233 1.00 0.00 C ATOM 2146 CD2 LEU A 136 13.991 -17.605 5.471 1.00 0.00 C ATOM 0 H LEU A 136 12.780 -17.118 1.574 1.00 0.00 H new ATOM 0 HA LEU A 136 12.993 -19.953 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.283 -18.179 3.973 1.00 0.00 H new ATOM 0 HB3 LEU A 136 12.513 -19.312 4.497 1.00 0.00 H new ATOM 0 HG LEU A 136 13.980 -17.219 3.382 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.134 -15.196 4.493 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.004 -15.808 3.262 1.00 0.00 H new ATOM 0 HD13 LEU A 136 11.674 -16.085 4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 136 14.638 -16.760 5.706 1.00 0.00 H new ATOM 0 HD22 LEU A 136 13.278 -17.752 6.282 1.00 0.00 H new ATOM 0 HD23 LEU A 136 14.596 -18.504 5.353 1.00 0.00 H new ATOM 2158 N GLU A 137 10.138 -18.452 1.914 1.00 0.00 N ATOM 2159 CA GLU A 137 8.809 -18.639 1.357 1.00 0.00 C ATOM 2160 C GLU A 137 8.247 -20.000 1.772 1.00 0.00 C ATOM 2161 O GLU A 137 8.458 -20.998 1.085 1.00 0.00 O ATOM 2162 CB GLU A 137 8.828 -18.494 -0.166 1.00 0.00 C ATOM 2163 CG GLU A 137 7.771 -17.492 -0.635 1.00 0.00 C ATOM 2164 CD GLU A 137 6.552 -18.212 -1.216 1.00 0.00 C ATOM 2165 OE1 GLU A 137 5.942 -18.996 -0.458 1.00 0.00 O ATOM 2166 OE2 GLU A 137 6.259 -17.962 -2.405 1.00 0.00 O ATOM 0 H GLU A 137 10.262 -17.587 2.440 1.00 0.00 H new ATOM 0 HA GLU A 137 8.156 -17.862 1.755 1.00 0.00 H new ATOM 0 HB2 GLU A 137 9.815 -18.166 -0.491 1.00 0.00 H new ATOM 0 HB3 GLU A 137 8.646 -19.464 -0.629 1.00 0.00 H new ATOM 0 HG2 GLU A 137 7.463 -16.865 0.202 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.200 -16.831 -1.388 1.00 0.00 H new ATOM 2173 N HIS A 138 7.542 -19.996 2.893 1.00 0.00 N ATOM 2174 CA HIS A 138 6.948 -21.218 3.408 1.00 0.00 C ATOM 2175 C HIS A 138 6.031 -20.886 4.587 1.00 0.00 C ATOM 2176 O HIS A 138 6.503 -20.651 5.698 1.00 0.00 O ATOM 2177 CB HIS A 138 8.029 -22.239 3.767 1.00 0.00 C ATOM 2178 CG HIS A 138 7.705 -23.652 3.343 1.00 0.00 C ATOM 2179 ND1 HIS A 138 6.408 -24.111 3.194 1.00 0.00 N ATOM 2180 CD2 HIS A 138 8.523 -24.701 3.039 1.00 0.00 C ATOM 2181 CE1 HIS A 138 6.455 -25.380 2.817 1.00 0.00 C ATOM 2182 NE2 HIS A 138 7.766 -25.744 2.721 1.00 0.00 N ATOM 0 H HIS A 138 7.368 -19.166 3.460 1.00 0.00 H new ATOM 0 HA HIS A 138 6.335 -21.682 2.635 1.00 0.00 H new ATOM 0 HB2 HIS A 138 8.968 -21.937 3.302 1.00 0.00 H new ATOM 0 HB3 HIS A 138 8.187 -22.221 4.845 1.00 0.00 H new ATOM 0 HD2 HIS A 138 9.603 -24.685 3.054 1.00 0.00 H new ATOM 0 HE1 HIS A 138 5.604 -26.015 2.620 1.00 0.00 H new ATOM 0 HE2 HIS A 138 8.108 -26.666 2.450 1.00 0.00 H new ATOM 2190 N HIS A 139 4.736 -20.878 4.304 1.00 0.00 N ATOM 2191 CA HIS A 139 3.749 -20.579 5.327 1.00 0.00 C ATOM 2192 C HIS A 139 2.670 -21.664 5.333 1.00 0.00 C ATOM 2193 O HIS A 139 2.461 -22.341 4.327 1.00 0.00 O ATOM 2194 CB HIS A 139 3.175 -19.174 5.135 1.00 0.00 C ATOM 2195 CG HIS A 139 2.706 -18.521 6.413 1.00 0.00 C ATOM 2196 ND1 HIS A 139 1.926 -17.378 6.428 1.00 0.00 N ATOM 2197 CD2 HIS A 139 2.913 -18.864 7.717 1.00 0.00 C ATOM 2198 CE1 HIS A 139 1.682 -17.055 7.690 1.00 0.00 C ATOM 2199 NE2 HIS A 139 2.295 -17.977 8.487 1.00 0.00 N ATOM 0 H HIS A 139 4.348 -21.074 3.381 1.00 0.00 H new ATOM 0 HA HIS A 139 4.225 -20.583 6.308 1.00 0.00 H new ATOM 0 HB2 HIS A 139 3.935 -18.542 4.674 1.00 0.00 H new ATOM 0 HB3 HIS A 139 2.339 -19.227 4.438 1.00 0.00 H new ATOM 0 HD2 HIS A 139 3.483 -19.713 8.064 1.00 0.00 H new ATOM 0 HE1 HIS A 139 1.100 -16.210 8.028 1.00 0.00 H new ATOM 0 HE2 HIS A 139 2.281 -17.984 9.507 1.00 0.00 H new ATOM 2207 N HIS A 140 2.013 -21.795 6.476 1.00 0.00 N ATOM 2208 CA HIS A 140 0.961 -22.786 6.625 1.00 0.00 C ATOM 2209 C HIS A 140 -0.248 -22.151 7.315 1.00 0.00 C ATOM 2210 O HIS A 140 -0.189 -20.999 7.743 1.00 0.00 O ATOM 2211 CB HIS A 140 1.481 -24.023 7.360 1.00 0.00 C ATOM 2212 CG HIS A 140 1.938 -25.134 6.445 1.00 0.00 C ATOM 2213 ND1 HIS A 140 3.075 -25.040 5.662 1.00 0.00 N ATOM 2214 CD2 HIS A 140 1.400 -26.363 6.198 1.00 0.00 C ATOM 2215 CE1 HIS A 140 3.206 -26.167 4.977 1.00 0.00 C ATOM 2216 NE2 HIS A 140 2.167 -26.985 5.310 1.00 0.00 N ATOM 0 H HIS A 140 2.189 -21.231 7.308 1.00 0.00 H new ATOM 0 HA HIS A 140 0.636 -23.128 5.642 1.00 0.00 H new ATOM 0 HB2 HIS A 140 2.312 -23.729 8.001 1.00 0.00 H new ATOM 0 HB3 HIS A 140 0.694 -24.403 8.012 1.00 0.00 H new ATOM 0 HD2 HIS A 140 0.503 -26.762 6.648 1.00 0.00 H new ATOM 0 HE1 HIS A 140 3.997 -26.397 4.278 1.00 0.00 H new ATOM 0 HE2 HIS A 140 2.005 -27.921 4.938 1.00 0.00 H new ATOM 2224 N HIS A 141 -1.316 -22.930 7.400 1.00 0.00 N ATOM 2225 CA HIS A 141 -2.538 -22.458 8.030 1.00 0.00 C ATOM 2226 C HIS A 141 -3.200 -23.608 8.791 1.00 0.00 C ATOM 2227 O HIS A 141 -2.881 -24.774 8.561 1.00 0.00 O ATOM 2228 CB HIS A 141 -3.468 -21.815 7.000 1.00 0.00 C ATOM 2229 CG HIS A 141 -4.153 -20.561 7.488 1.00 0.00 C ATOM 2230 ND1 HIS A 141 -3.524 -19.329 7.525 1.00 0.00 N ATOM 2231 CD2 HIS A 141 -5.418 -20.362 7.958 1.00 0.00 C ATOM 2232 CE1 HIS A 141 -4.381 -18.436 7.999 1.00 0.00 C ATOM 2233 NE2 HIS A 141 -5.554 -19.079 8.267 1.00 0.00 N ATOM 0 H HIS A 141 -1.361 -23.885 7.043 1.00 0.00 H new ATOM 0 HA HIS A 141 -2.300 -21.679 8.754 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -2.893 -21.578 6.105 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -4.227 -22.541 6.708 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -6.180 -21.120 8.061 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -4.185 -17.384 8.147 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -6.397 -18.645 8.643 1.00 0.00 H new ATOM 2241 N HIS A 142 -4.111 -23.240 9.680 1.00 0.00 N ATOM 2242 CA HIS A 142 -4.821 -24.227 10.476 1.00 0.00 C ATOM 2243 C HIS A 142 -5.973 -24.814 9.657 1.00 0.00 C ATOM 2244 O HIS A 142 -6.264 -24.339 8.560 1.00 0.00 O ATOM 2245 CB HIS A 142 -5.284 -23.624 11.803 1.00 0.00 C ATOM 2246 CG HIS A 142 -5.319 -24.609 12.947 1.00 0.00 C ATOM 2247 ND1 HIS A 142 -4.200 -24.929 13.695 1.00 0.00 N ATOM 2248 CD2 HIS A 142 -6.349 -25.340 13.462 1.00 0.00 C ATOM 2249 CE1 HIS A 142 -4.552 -25.815 14.616 1.00 0.00 C ATOM 2250 NE2 HIS A 142 -5.884 -26.068 14.470 1.00 0.00 N ATOM 0 H HIS A 142 -4.374 -22.272 9.867 1.00 0.00 H new ATOM 0 HA HIS A 142 -4.148 -25.046 10.731 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -4.621 -22.800 12.067 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -6.280 -23.202 11.670 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -7.370 -25.328 13.109 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -3.899 -26.259 15.353 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -6.433 -26.711 15.041 1.00 0.00 H new ATOM 2258 N HIS A 143 -6.597 -25.837 10.222 1.00 0.00 N ATOM 2259 CA HIS A 143 -7.711 -26.493 9.558 1.00 0.00 C ATOM 2260 C HIS A 143 -8.839 -25.485 9.332 1.00 0.00 C ATOM 2261 O HIS A 143 -9.439 -24.994 10.287 1.00 0.00 O ATOM 2262 CB HIS A 143 -8.164 -27.724 10.346 1.00 0.00 C ATOM 2263 CG HIS A 143 -8.163 -29.002 9.542 1.00 0.00 C ATOM 2264 ND1 HIS A 143 -9.278 -29.812 9.421 1.00 0.00 N ATOM 2265 CD2 HIS A 143 -7.172 -29.600 8.821 1.00 0.00 C ATOM 2266 CE1 HIS A 143 -8.961 -30.849 8.659 1.00 0.00 C ATOM 2267 NE2 HIS A 143 -7.655 -30.716 8.289 1.00 0.00 N ATOM 0 H HIS A 143 -6.353 -26.228 11.132 1.00 0.00 H new ATOM 0 HA HIS A 143 -7.394 -26.856 8.580 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -7.512 -27.850 11.210 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -9.169 -27.548 10.729 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -6.165 -29.229 8.703 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -9.621 -31.657 8.380 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -7.135 -31.367 7.700 1.00 0.00 H new TER 2275 HIS A 143