USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1093 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 40 GLN : amide:sc= 0.47 X(o=0.17,f=0.12) USER MOD Set 1.2: A 59 LYS NZ :NH3+ -177:sc= -0.302 (180deg=0) USER MOD Set 2.1: A 54 SER OG : rot 42:sc= -0.725! USER MOD Set 2.2: A 94 THR OG1 : rot -129:sc= -2.29! USER MOD Set 3.1: A 18 CYS SG : rot 92:sc= 0.282 USER MOD Set 3.2: A 21 SER OG : rot -49:sc= -3.68! USER MOD Set 4.1: A 13 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 116 TYR OH : rot -82:sc= 0.913 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= -0.996 (180deg=-1.34!) USER MOD Single : A 2 ASN :FLIP amide:sc= -6.04! C(o=-9.9!,f=-6!) USER MOD Single : A 3 LYS NZ :NH3+ -165:sc= -0.147 (180deg=-0.541) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.133 F(o=-1.9!,f=-0.13) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.034 USER MOD Single : A 29 SER OG : rot -103:sc= 1.57 USER MOD Single : A 31 CYS SG : rot -21:sc= -19.2! USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 144:sc= -1.07 (180deg=-4.52!) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 164:sc= -0.494 (180deg=-1.46) USER MOD Single : A 75 SER OG : rot -80:sc= 0.0768 USER MOD Single : A 77 SER OG : rot -67:sc= 0.146! USER MOD Single : A 79 THR OG1 : rot -130:sc= -1.1 USER MOD Single : A 80 LYS NZ :NH3+ 141:sc= -1.59 (180deg=-3.8!) USER MOD Single : A 82 GLN :FLIP amide:sc= -3.45! C(o=-5.4!,f=-3.4!) USER MOD Single : A 85 LYS NZ :NH3+ 169:sc= -0.931! (180deg=-1.1) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.12 X(o=-1.1,f=-1.1) USER MOD Single : A 89 ASN : amide:sc= -4.5! C(o=-4.5!,f=-12!) USER MOD Single : A 91 LYS NZ :NH3+ -99:sc= -0.0189 (180deg=-0.72) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 10:sc= 0.776 USER MOD Single : A 99 GLN : amide:sc= -0.0828 K(o=-0.083,f=-0.82) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.551 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN :FLIP amide:sc= -0.798 F(o=-3.3!,f=-0.8) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= -7.57! C(o=-7.6!,f=-16!) USER MOD Single : A 126 HIS : no HE2:sc= 0.985 K(o=0.98,f=-3.5!) USER MOD Single : A 129 THR OG1 : rot 130:sc= 0 USER MOD Single : A 130 TYR OH : rot -147:sc= 0.728 USER MOD Single : A 131 ASN :FLIP amide:sc= -3.88! C(o=-7!,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.674 4.911 -19.181 1.00 0.00 N ATOM 2 CA MET A 1 -0.521 5.999 -18.222 1.00 0.00 C ATOM 3 C MET A 1 -1.282 5.690 -16.937 1.00 0.00 C ATOM 4 O MET A 1 -1.476 6.564 -16.094 1.00 0.00 O ATOM 5 CB MET A 1 -1.042 7.304 -18.824 1.00 0.00 C ATOM 6 CG MET A 1 -0.850 7.281 -20.342 1.00 0.00 C ATOM 7 SD MET A 1 -1.471 8.824 -21.053 1.00 0.00 S ATOM 8 CE MET A 1 0.095 9.730 -21.025 1.00 0.00 C ATOM 0 H1 MET A 1 -0.032 5.064 -19.985 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.444 4.007 -18.720 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.656 4.885 -19.523 1.00 0.00 H new ATOM 0 HA MET A 1 0.538 6.105 -17.988 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.097 7.432 -18.583 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.511 8.153 -18.393 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.205 7.156 -20.584 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.379 6.431 -20.773 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.057 10.731 -21.428 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.455 9.803 -19.999 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.831 9.202 -21.631 1.00 0.00 H new ATOM 18 N ASN A 2 -1.710 4.439 -16.795 1.00 0.00 N ATOM 19 CA ASN A 2 -2.450 4.023 -15.610 1.00 0.00 C ATOM 20 C ASN A 2 -3.321 5.164 -15.092 1.00 0.00 C ATOM 21 O ASN A 2 -3.638 6.100 -15.826 1.00 0.00 O ATOM 22 CB ASN A 2 -1.478 3.586 -14.514 1.00 0.00 C ATOM 23 CG ASN A 2 -0.449 4.682 -14.263 1.00 0.00 C ATOM 24 OD1 ASN A 2 -0.853 5.897 -14.013 1.00 0.00 O flip ATOM 25 ND2 ASN A 2 0.755 4.424 -14.298 1.00 0.00 N flip ATOM 0 H ASN A 2 -1.558 3.700 -17.482 1.00 0.00 H new ATOM 0 HA ASN A 2 -3.092 3.185 -15.883 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -2.025 3.372 -13.596 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.976 2.664 -14.808 1.00 0.00 H new ATOM 0 HD21 ASN A 2 1.067 3.473 -14.494 1.00 0.00 H new ATOM 0 HD22 ASN A 2 1.440 5.161 -14.131 1.00 0.00 H new ATOM 32 N LYS A 3 -3.709 5.075 -13.824 1.00 0.00 N ATOM 33 CA LYS A 3 -4.546 6.103 -13.215 1.00 0.00 C ATOM 34 C LYS A 3 -3.701 7.288 -12.758 1.00 0.00 C ATOM 35 O LYS A 3 -2.492 7.325 -12.983 1.00 0.00 O ATOM 36 CB LYS A 3 -5.297 5.520 -12.017 1.00 0.00 C ATOM 37 CG LYS A 3 -6.467 4.668 -12.512 1.00 0.00 C ATOM 38 CD LYS A 3 -7.289 4.183 -11.317 1.00 0.00 C ATOM 39 CE LYS A 3 -8.624 4.927 -11.278 1.00 0.00 C ATOM 40 NZ LYS A 3 -8.373 6.396 -11.257 1.00 0.00 N ATOM 0 H LYS A 3 -3.459 4.307 -13.201 1.00 0.00 H new ATOM 0 HA LYS A 3 -5.260 6.450 -13.962 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.623 4.914 -11.412 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.663 6.324 -11.378 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -7.095 5.251 -13.186 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -6.095 3.816 -13.080 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -7.461 3.109 -11.393 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.739 4.353 -10.391 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -9.226 4.662 -12.148 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -9.192 4.631 -10.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -9.243 6.893 -10.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.618 6.609 -10.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.083 6.712 -12.204 1.00 0.00 H new ATOM 54 N GLU A 4 -4.349 8.253 -12.112 1.00 0.00 N ATOM 55 CA GLU A 4 -3.648 9.436 -11.623 1.00 0.00 C ATOM 56 C GLU A 4 -2.810 9.085 -10.398 1.00 0.00 C ATOM 57 O GLU A 4 -3.025 8.053 -9.763 1.00 0.00 O ATOM 58 CB GLU A 4 -4.656 10.528 -11.265 1.00 0.00 C ATOM 59 CG GLU A 4 -5.602 10.755 -12.448 1.00 0.00 C ATOM 60 CD GLU A 4 -5.966 12.232 -12.552 1.00 0.00 C ATOM 61 OE1 GLU A 4 -5.154 13.052 -12.156 1.00 0.00 O ATOM 62 OE2 GLU A 4 -7.052 12.521 -13.027 1.00 0.00 O ATOM 0 H GLU A 4 -5.350 8.240 -11.916 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.987 9.801 -12.409 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.224 10.238 -10.381 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -4.135 11.453 -11.019 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.128 10.423 -13.372 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.505 10.158 -12.321 1.00 0.00 H new ATOM 69 N LEU A 5 -1.852 9.947 -10.073 1.00 0.00 N ATOM 70 CA LEU A 5 -0.989 9.717 -8.932 1.00 0.00 C ATOM 71 C LEU A 5 -1.773 9.839 -7.631 1.00 0.00 C ATOM 72 O LEU A 5 -1.445 9.198 -6.634 1.00 0.00 O ATOM 73 CB LEU A 5 0.154 10.731 -8.948 1.00 0.00 C ATOM 74 CG LEU A 5 1.412 10.087 -8.373 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.088 9.469 -7.025 1.00 0.00 C ATOM 76 CD2 LEU A 5 1.922 9.005 -9.328 1.00 0.00 C ATOM 0 H LEU A 5 -1.658 10.807 -10.585 1.00 0.00 H new ATOM 0 HA LEU A 5 -0.584 8.707 -8.994 1.00 0.00 H new ATOM 0 HB2 LEU A 5 0.339 11.070 -9.967 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -0.117 11.610 -8.364 1.00 0.00 H new ATOM 0 HG LEU A 5 2.185 10.846 -8.249 1.00 0.00 H new ATOM 0 HD11 LEU A 5 1.985 9.008 -6.611 1.00 0.00 H new ATOM 0 HD12 LEU A 5 0.732 10.244 -6.346 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.314 8.711 -7.149 1.00 0.00 H new ATOM 0 HD21 LEU A 5 2.820 8.548 -8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 5 1.154 8.243 -9.458 1.00 0.00 H new ATOM 0 HD23 LEU A 5 2.155 9.453 -10.294 1.00 0.00 H new ATOM 88 N LEU A 6 -2.814 10.666 -7.645 1.00 0.00 N ATOM 89 CA LEU A 6 -3.632 10.863 -6.453 1.00 0.00 C ATOM 90 C LEU A 6 -4.123 9.543 -5.874 1.00 0.00 C ATOM 91 O LEU A 6 -5.038 9.534 -5.050 1.00 0.00 O ATOM 92 CB LEU A 6 -4.826 11.770 -6.727 1.00 0.00 C ATOM 93 CG LEU A 6 -5.841 11.040 -7.615 1.00 0.00 C ATOM 94 CD1 LEU A 6 -7.101 10.716 -6.808 1.00 0.00 C ATOM 95 CD2 LEU A 6 -6.219 11.936 -8.797 1.00 0.00 C ATOM 0 H LEU A 6 -3.109 11.205 -8.459 1.00 0.00 H new ATOM 0 HA LEU A 6 -2.985 11.346 -5.721 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -5.295 12.062 -5.788 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -4.494 12.686 -7.216 1.00 0.00 H new ATOM 0 HG LEU A 6 -5.396 10.114 -7.979 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -7.818 10.198 -7.445 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -6.838 10.079 -5.964 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.545 11.641 -6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -6.940 11.419 -9.429 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.660 12.861 -8.426 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -5.327 12.167 -9.379 1.00 0.00 H new ATOM 107 N GLN A 7 -3.516 8.427 -6.270 1.00 0.00 N ATOM 108 CA GLN A 7 -3.938 7.156 -5.722 1.00 0.00 C ATOM 109 C GLN A 7 -3.760 7.268 -4.224 1.00 0.00 C ATOM 110 O GLN A 7 -4.538 6.721 -3.441 1.00 0.00 O ATOM 111 CB GLN A 7 -3.066 6.027 -6.272 1.00 0.00 C ATOM 112 CG GLN A 7 -1.630 6.205 -5.771 1.00 0.00 C ATOM 113 CD GLN A 7 -0.647 5.674 -6.809 1.00 0.00 C ATOM 114 OE1 GLN A 7 -1.092 4.982 -7.821 1.00 0.00 O flip ATOM 115 NE2 GLN A 7 0.559 5.895 -6.693 1.00 0.00 N flip ATOM 0 H GLN A 7 -2.755 8.382 -6.947 1.00 0.00 H new ATOM 0 HA GLN A 7 -4.971 6.930 -5.988 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -3.458 5.061 -5.952 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -3.086 6.034 -7.362 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -1.432 7.259 -5.576 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -1.497 5.676 -4.827 1.00 0.00 H new ATOM 0 HE21 GLN A 7 0.904 6.436 -5.901 1.00 0.00 H new ATOM 0 HE22 GLN A 7 1.212 5.537 -7.389 1.00 0.00 H new ATOM 124 N LEU A 8 -2.774 8.071 -3.843 1.00 0.00 N ATOM 125 CA LEU A 8 -2.539 8.362 -2.444 1.00 0.00 C ATOM 126 C LEU A 8 -2.773 9.866 -2.259 1.00 0.00 C ATOM 127 O LEU A 8 -1.852 10.666 -2.364 1.00 0.00 O ATOM 128 CB LEU A 8 -1.113 7.962 -2.055 1.00 0.00 C ATOM 129 CG LEU A 8 -1.096 6.490 -1.637 1.00 0.00 C ATOM 130 CD1 LEU A 8 0.348 5.990 -1.578 1.00 0.00 C ATOM 131 CD2 LEU A 8 -1.745 6.341 -0.258 1.00 0.00 C ATOM 0 H LEU A 8 -2.128 8.529 -4.486 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.211 7.796 -1.799 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.437 8.121 -2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.758 8.588 -1.237 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.653 5.902 -2.366 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.358 4.942 -1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.809 6.093 -2.560 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.908 6.579 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.732 5.292 0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.190 6.931 0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.776 6.694 -0.301 1.00 0.00 H new ATOM 143 N PRO A 9 -4.003 10.250 -2.035 1.00 0.00 N ATOM 144 CA PRO A 9 -4.418 11.685 -1.894 1.00 0.00 C ATOM 145 C PRO A 9 -3.477 12.542 -1.055 1.00 0.00 C ATOM 146 O PRO A 9 -3.523 13.768 -1.120 1.00 0.00 O ATOM 147 CB PRO A 9 -5.787 11.588 -1.233 1.00 0.00 C ATOM 148 CG PRO A 9 -6.348 10.286 -1.698 1.00 0.00 C ATOM 149 CD PRO A 9 -5.157 9.344 -1.886 1.00 0.00 C ATOM 0 HA PRO A 9 -4.413 12.184 -2.863 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.704 11.617 -0.147 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.427 12.421 -1.526 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.050 9.883 -0.968 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.896 10.411 -2.632 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.035 8.680 -1.030 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.284 8.712 -2.765 1.00 0.00 H new ATOM 157 N LEU A 10 -2.652 11.905 -0.255 1.00 0.00 N ATOM 158 CA LEU A 10 -1.736 12.653 0.610 1.00 0.00 C ATOM 159 C LEU A 10 -0.846 13.611 -0.156 1.00 0.00 C ATOM 160 O LEU A 10 -0.679 14.762 0.247 1.00 0.00 O ATOM 161 CB LEU A 10 -0.824 11.743 1.402 1.00 0.00 C ATOM 162 CG LEU A 10 -0.442 10.527 0.575 1.00 0.00 C ATOM 163 CD1 LEU A 10 1.001 10.688 0.106 1.00 0.00 C ATOM 164 CD2 LEU A 10 -0.594 9.280 1.445 1.00 0.00 C ATOM 0 H LEU A 10 -2.588 10.890 -0.177 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.394 13.212 1.276 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.074 12.286 1.699 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.322 11.426 2.318 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.087 10.430 -0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.289 9.822 -0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.088 11.590 -0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.658 10.768 0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.323 8.397 0.866 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.061 9.360 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.628 9.193 1.778 1.00 0.00 H new ATOM 176 N PHE A 11 -0.227 13.132 -1.224 1.00 0.00 N ATOM 177 CA PHE A 11 0.687 13.989 -1.957 1.00 0.00 C ATOM 178 C PHE A 11 0.053 14.726 -3.149 1.00 0.00 C ATOM 179 O PHE A 11 0.048 15.955 -3.168 1.00 0.00 O ATOM 180 CB PHE A 11 1.951 13.258 -2.397 1.00 0.00 C ATOM 181 CG PHE A 11 1.682 11.898 -3.013 1.00 0.00 C ATOM 182 CD1 PHE A 11 0.382 11.477 -3.301 1.00 0.00 C ATOM 183 CD2 PHE A 11 2.765 11.060 -3.310 1.00 0.00 C ATOM 184 CE1 PHE A 11 0.163 10.222 -3.884 1.00 0.00 C ATOM 185 CE2 PHE A 11 2.546 9.806 -3.889 1.00 0.00 C ATOM 186 CZ PHE A 11 1.246 9.387 -4.176 1.00 0.00 C ATOM 0 H PHE A 11 -0.335 12.187 -1.592 1.00 0.00 H new ATOM 0 HA PHE A 11 0.963 14.755 -1.233 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.485 13.876 -3.119 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.608 13.134 -1.536 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.456 12.120 -3.074 1.00 0.00 H new ATOM 0 HD2 PHE A 11 3.772 11.383 -3.091 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.843 9.899 -4.108 1.00 0.00 H new ATOM 0 HE2 PHE A 11 3.383 9.162 -4.114 1.00 0.00 H new ATOM 0 HZ PHE A 11 1.077 8.419 -4.623 1.00 0.00 H new ATOM 196 N GLU A 12 -0.452 14.006 -4.150 1.00 0.00 N ATOM 197 CA GLU A 12 -1.041 14.661 -5.314 1.00 0.00 C ATOM 198 C GLU A 12 -2.070 15.703 -4.883 1.00 0.00 C ATOM 199 O GLU A 12 -2.452 16.568 -5.670 1.00 0.00 O ATOM 200 CB GLU A 12 -1.714 13.621 -6.215 1.00 0.00 C ATOM 201 CG GLU A 12 -1.509 13.991 -7.681 1.00 0.00 C ATOM 202 CD GLU A 12 -0.022 14.072 -8.011 1.00 0.00 C ATOM 203 OE1 GLU A 12 0.751 13.411 -7.338 1.00 0.00 O ATOM 204 OE2 GLU A 12 0.321 14.793 -8.933 1.00 0.00 O ATOM 0 H GLU A 12 -0.465 12.986 -4.179 1.00 0.00 H new ATOM 0 HA GLU A 12 -0.244 15.160 -5.866 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.297 12.633 -6.019 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.779 13.568 -5.990 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -1.989 13.249 -8.319 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -1.986 14.948 -7.890 1.00 0.00 H new ATOM 211 N SER A 13 -2.500 15.624 -3.629 1.00 0.00 N ATOM 212 CA SER A 13 -3.472 16.580 -3.110 1.00 0.00 C ATOM 213 C SER A 13 -2.771 17.607 -2.227 1.00 0.00 C ATOM 214 O SER A 13 -3.416 18.360 -1.499 1.00 0.00 O ATOM 215 CB SER A 13 -4.549 15.856 -2.302 1.00 0.00 C ATOM 216 OG SER A 13 -5.784 16.542 -2.449 1.00 0.00 O ATOM 0 H SER A 13 -2.196 14.917 -2.959 1.00 0.00 H new ATOM 0 HA SER A 13 -3.943 17.089 -3.951 1.00 0.00 H new ATOM 0 HB2 SER A 13 -4.648 14.827 -2.646 1.00 0.00 H new ATOM 0 HB3 SER A 13 -4.265 15.815 -1.250 1.00 0.00 H new ATOM 0 HG SER A 13 -6.478 16.080 -1.934 1.00 0.00 H new ATOM 222 N ALA A 14 -1.446 17.628 -2.303 1.00 0.00 N ATOM 223 CA ALA A 14 -0.651 18.556 -1.517 1.00 0.00 C ATOM 224 C ALA A 14 0.141 19.461 -2.436 1.00 0.00 C ATOM 225 O ALA A 14 0.308 19.162 -3.619 1.00 0.00 O ATOM 226 CB ALA A 14 0.342 17.784 -0.653 1.00 0.00 C ATOM 0 H ALA A 14 -0.900 17.010 -2.904 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.324 19.143 -0.892 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.935 18.485 -0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.200 17.117 0.017 1.00 0.00 H new ATOM 0 HB3 ALA A 14 1.001 17.197 -1.293 1.00 0.00 H new ATOM 232 N SER A 15 0.669 20.540 -1.887 1.00 0.00 N ATOM 233 CA SER A 15 1.483 21.425 -2.688 1.00 0.00 C ATOM 234 C SER A 15 2.670 20.621 -3.195 1.00 0.00 C ATOM 235 O SER A 15 3.218 19.781 -2.471 1.00 0.00 O ATOM 236 CB SER A 15 1.972 22.607 -1.851 1.00 0.00 C ATOM 237 OG SER A 15 2.570 23.572 -2.706 1.00 0.00 O ATOM 0 H SER A 15 0.551 20.817 -0.913 1.00 0.00 H new ATOM 0 HA SER A 15 0.902 21.823 -3.520 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.139 23.052 -1.308 1.00 0.00 H new ATOM 0 HB3 SER A 15 2.692 22.267 -1.107 1.00 0.00 H new ATOM 0 HG SER A 15 2.883 24.332 -2.173 1.00 0.00 H new ATOM 243 N ARG A 16 3.069 20.851 -4.430 1.00 0.00 N ATOM 244 CA ARG A 16 4.188 20.102 -4.957 1.00 0.00 C ATOM 245 C ARG A 16 5.301 20.113 -3.924 1.00 0.00 C ATOM 246 O ARG A 16 6.185 19.256 -3.928 1.00 0.00 O ATOM 247 CB ARG A 16 4.677 20.706 -6.276 1.00 0.00 C ATOM 248 CG ARG A 16 4.219 19.828 -7.442 1.00 0.00 C ATOM 249 CD ARG A 16 5.232 18.704 -7.661 1.00 0.00 C ATOM 250 NE ARG A 16 6.258 19.126 -8.606 1.00 0.00 N ATOM 251 CZ ARG A 16 7.302 18.350 -8.879 1.00 0.00 C ATOM 252 NH1 ARG A 16 7.421 17.189 -8.298 1.00 0.00 N ATOM 253 NH2 ARG A 16 8.208 18.750 -9.730 1.00 0.00 N ATOM 0 H ARG A 16 2.651 21.528 -5.068 1.00 0.00 H new ATOM 0 HA ARG A 16 3.878 19.077 -5.161 1.00 0.00 H new ATOM 0 HB2 ARG A 16 4.285 21.717 -6.392 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.764 20.784 -6.271 1.00 0.00 H new ATOM 0 HG2 ARG A 16 3.235 19.409 -7.231 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.123 20.428 -8.347 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.693 18.430 -6.712 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.724 17.816 -8.037 1.00 0.00 H new ATOM 0 HE ARG A 16 6.173 20.033 -9.066 1.00 0.00 H new ATOM 0 HH11 ARG A 16 6.713 16.876 -7.634 1.00 0.00 H new ATOM 0 HH12 ARG A 16 8.222 16.594 -8.508 1.00 0.00 H new ATOM 0 HH21 ARG A 16 8.115 19.658 -10.185 1.00 0.00 H new ATOM 0 HH22 ARG A 16 9.009 18.154 -9.939 1.00 0.00 H new ATOM 267 N GLY A 17 5.230 21.089 -3.023 1.00 0.00 N ATOM 268 CA GLY A 17 6.214 21.207 -1.962 1.00 0.00 C ATOM 269 C GLY A 17 6.216 19.946 -1.108 1.00 0.00 C ATOM 270 O GLY A 17 7.274 19.455 -0.715 1.00 0.00 O ATOM 0 H GLY A 17 4.503 21.805 -3.010 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.204 21.368 -2.389 1.00 0.00 H new ATOM 0 HA3 GLY A 17 5.990 22.075 -1.342 1.00 0.00 H new ATOM 274 N CYS A 18 5.024 19.410 -0.837 1.00 0.00 N ATOM 275 CA CYS A 18 4.926 18.193 -0.047 1.00 0.00 C ATOM 276 C CYS A 18 5.462 17.028 -0.851 1.00 0.00 C ATOM 277 O CYS A 18 6.282 16.256 -0.368 1.00 0.00 O ATOM 278 CB CYS A 18 3.470 17.917 0.346 1.00 0.00 C ATOM 279 SG CYS A 18 3.332 17.870 2.151 1.00 0.00 S ATOM 0 H CYS A 18 4.132 19.795 -1.148 1.00 0.00 H new ATOM 0 HA CYS A 18 5.513 18.318 0.863 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.819 18.692 -0.059 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.140 16.969 -0.080 1.00 0.00 H new ATOM 0 HG CYS A 18 3.038 19.056 2.595 1.00 0.00 H new ATOM 285 N LEU A 19 5.015 16.901 -2.090 1.00 0.00 N ATOM 286 CA LEU A 19 5.508 15.805 -2.901 1.00 0.00 C ATOM 287 C LEU A 19 7.027 15.828 -2.884 1.00 0.00 C ATOM 288 O LEU A 19 7.670 14.782 -2.929 1.00 0.00 O ATOM 289 CB LEU A 19 4.978 15.878 -4.331 1.00 0.00 C ATOM 290 CG LEU A 19 5.439 14.638 -5.099 1.00 0.00 C ATOM 291 CD1 LEU A 19 4.511 13.461 -4.779 1.00 0.00 C ATOM 292 CD2 LEU A 19 5.397 14.926 -6.600 1.00 0.00 C ATOM 0 H LEU A 19 4.339 17.517 -2.541 1.00 0.00 H new ATOM 0 HA LEU A 19 5.149 14.865 -2.481 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.889 15.934 -4.326 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.342 16.781 -4.821 1.00 0.00 H new ATOM 0 HG LEU A 19 6.458 14.386 -4.804 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.841 12.578 -5.327 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.540 13.256 -3.709 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.492 13.711 -5.073 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.725 14.043 -7.149 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.378 15.178 -6.894 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.058 15.762 -6.829 1.00 0.00 H new ATOM 304 N ARG A 20 7.597 17.026 -2.773 1.00 0.00 N ATOM 305 CA ARG A 20 9.044 17.159 -2.694 1.00 0.00 C ATOM 306 C ARG A 20 9.492 16.621 -1.340 1.00 0.00 C ATOM 307 O ARG A 20 10.542 15.995 -1.216 1.00 0.00 O ATOM 308 CB ARG A 20 9.455 18.627 -2.850 1.00 0.00 C ATOM 309 CG ARG A 20 10.780 18.879 -2.138 1.00 0.00 C ATOM 310 CD ARG A 20 10.557 18.967 -0.626 1.00 0.00 C ATOM 311 NE ARG A 20 11.132 20.202 -0.105 1.00 0.00 N ATOM 312 CZ ARG A 20 11.127 20.468 1.197 1.00 0.00 C ATOM 313 NH1 ARG A 20 10.598 19.619 2.034 1.00 0.00 N ATOM 314 NH2 ARG A 20 11.649 21.580 1.638 1.00 0.00 N ATOM 0 H ARG A 20 7.084 17.907 -2.736 1.00 0.00 H new ATOM 0 HA ARG A 20 9.518 16.595 -3.497 1.00 0.00 H new ATOM 0 HB2 ARG A 20 9.548 18.876 -3.907 1.00 0.00 H new ATOM 0 HB3 ARG A 20 8.682 19.275 -2.437 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.481 18.076 -2.364 1.00 0.00 H new ATOM 0 HG3 ARG A 20 11.227 19.804 -2.502 1.00 0.00 H new ATOM 0 HD2 ARG A 20 9.490 18.932 -0.405 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.013 18.108 -0.133 1.00 0.00 H new ATOM 0 HE ARG A 20 11.545 20.874 -0.752 1.00 0.00 H new ATOM 0 HH11 ARG A 20 10.188 18.751 1.689 1.00 0.00 H new ATOM 0 HH12 ARG A 20 10.594 19.823 3.033 1.00 0.00 H new ATOM 0 HH21 ARG A 20 12.061 22.245 0.983 1.00 0.00 H new ATOM 0 HH22 ARG A 20 11.645 21.784 2.637 1.00 0.00 H new ATOM 328 N SER A 21 8.645 16.846 -0.338 1.00 0.00 N ATOM 329 CA SER A 21 8.892 16.361 1.014 1.00 0.00 C ATOM 330 C SER A 21 8.948 14.835 0.988 1.00 0.00 C ATOM 331 O SER A 21 9.940 14.218 1.403 1.00 0.00 O ATOM 332 CB SER A 21 7.763 16.881 1.905 1.00 0.00 C ATOM 333 OG SER A 21 6.607 16.074 1.733 1.00 0.00 O ATOM 0 H SER A 21 7.774 17.367 -0.441 1.00 0.00 H new ATOM 0 HA SER A 21 9.843 16.717 1.409 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.075 16.868 2.949 1.00 0.00 H new ATOM 0 HB3 SER A 21 7.536 17.917 1.653 1.00 0.00 H new ATOM 0 HG SER A 21 6.421 15.969 0.777 1.00 0.00 H new ATOM 339 N LEU A 22 7.913 14.227 0.442 1.00 0.00 N ATOM 340 CA LEU A 22 7.890 12.784 0.329 1.00 0.00 C ATOM 341 C LEU A 22 9.062 12.322 -0.518 1.00 0.00 C ATOM 342 O LEU A 22 9.791 11.401 -0.151 1.00 0.00 O ATOM 343 CB LEU A 22 6.594 12.332 -0.329 1.00 0.00 C ATOM 344 CG LEU A 22 5.757 11.569 0.682 1.00 0.00 C ATOM 345 CD1 LEU A 22 5.363 12.491 1.825 1.00 0.00 C ATOM 346 CD2 LEU A 22 4.500 11.066 0.007 1.00 0.00 C ATOM 0 H LEU A 22 7.089 14.702 0.075 1.00 0.00 H new ATOM 0 HA LEU A 22 7.959 12.351 1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 22 6.040 13.195 -0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.811 11.700 -1.190 1.00 0.00 H new ATOM 0 HG LEU A 22 6.338 10.732 1.070 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.762 11.939 2.548 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.261 12.869 2.313 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.783 13.327 1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.895 10.517 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.930 11.912 -0.376 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.769 10.406 -0.818 1.00 0.00 H new ATOM 358 N SER A 23 9.226 12.964 -1.669 1.00 0.00 N ATOM 359 CA SER A 23 10.298 12.600 -2.569 1.00 0.00 C ATOM 360 C SER A 23 11.643 12.683 -1.876 1.00 0.00 C ATOM 361 O SER A 23 12.557 11.919 -2.188 1.00 0.00 O ATOM 362 CB SER A 23 10.266 13.443 -3.835 1.00 0.00 C ATOM 363 OG SER A 23 11.595 13.759 -4.228 1.00 0.00 O ATOM 0 H SER A 23 8.635 13.729 -1.993 1.00 0.00 H new ATOM 0 HA SER A 23 10.147 11.563 -2.867 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.759 12.901 -4.633 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.700 14.358 -3.661 1.00 0.00 H new ATOM 0 HG SER A 23 11.575 14.301 -5.044 1.00 0.00 H new ATOM 369 N LEU A 24 11.760 13.579 -0.906 1.00 0.00 N ATOM 370 CA LEU A 24 12.998 13.690 -0.164 1.00 0.00 C ATOM 371 C LEU A 24 13.295 12.347 0.490 1.00 0.00 C ATOM 372 O LEU A 24 14.452 11.943 0.608 1.00 0.00 O ATOM 373 CB LEU A 24 12.887 14.779 0.897 1.00 0.00 C ATOM 374 CG LEU A 24 13.825 15.930 0.539 1.00 0.00 C ATOM 375 CD1 LEU A 24 15.277 15.478 0.705 1.00 0.00 C ATOM 376 CD2 LEU A 24 13.587 16.363 -0.910 1.00 0.00 C ATOM 0 H LEU A 24 11.025 14.227 -0.621 1.00 0.00 H new ATOM 0 HA LEU A 24 13.808 13.960 -0.841 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.860 15.138 0.960 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.144 14.376 1.877 1.00 0.00 H new ATOM 0 HG LEU A 24 13.628 16.772 1.202 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.945 16.300 0.449 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.449 15.179 1.739 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.473 14.633 0.045 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.259 17.184 -1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.778 15.522 -1.577 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.554 16.691 -1.027 1.00 0.00 H new ATOM 388 N ILE A 25 12.232 11.653 0.903 1.00 0.00 N ATOM 389 CA ILE A 25 12.394 10.339 1.533 1.00 0.00 C ATOM 390 C ILE A 25 11.723 9.225 0.725 1.00 0.00 C ATOM 391 O ILE A 25 11.374 8.182 1.278 1.00 0.00 O ATOM 392 CB ILE A 25 11.813 10.333 2.942 1.00 0.00 C ATOM 393 CG1 ILE A 25 12.405 9.148 3.709 1.00 0.00 C ATOM 394 CG2 ILE A 25 10.309 10.140 2.866 1.00 0.00 C ATOM 395 CD1 ILE A 25 13.270 9.649 4.865 1.00 0.00 C ATOM 0 H ILE A 25 11.267 11.970 0.816 1.00 0.00 H new ATOM 0 HA ILE A 25 13.467 10.149 1.571 1.00 0.00 H new ATOM 0 HB ILE A 25 12.047 11.275 3.439 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.604 8.516 4.092 1.00 0.00 H new ATOM 0 HG13 ILE A 25 13.003 8.533 3.037 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.891 10.135 3.873 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.866 10.955 2.293 1.00 0.00 H new ATOM 0 HG23 ILE A 25 10.088 9.191 2.377 1.00 0.00 H new ATOM 0 HD11 ILE A 25 13.686 8.798 5.404 1.00 0.00 H new ATOM 0 HD12 ILE A 25 14.082 10.262 4.473 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.660 10.245 5.544 1.00 0.00 H new ATOM 407 N ILE A 26 11.529 9.446 -0.569 1.00 0.00 N ATOM 408 CA ILE A 26 10.887 8.465 -1.415 1.00 0.00 C ATOM 409 C ILE A 26 11.684 7.165 -1.471 1.00 0.00 C ATOM 410 O ILE A 26 12.908 7.177 -1.596 1.00 0.00 O ATOM 411 CB ILE A 26 10.757 9.062 -2.826 1.00 0.00 C ATOM 412 CG1 ILE A 26 9.298 9.419 -3.117 1.00 0.00 C ATOM 413 CG2 ILE A 26 11.239 8.076 -3.871 1.00 0.00 C ATOM 414 CD1 ILE A 26 8.513 8.155 -3.383 1.00 0.00 C ATOM 0 H ILE A 26 11.810 10.300 -1.051 1.00 0.00 H new ATOM 0 HA ILE A 26 9.906 8.226 -1.004 1.00 0.00 H new ATOM 0 HB ILE A 26 11.372 9.961 -2.868 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.868 9.955 -2.271 1.00 0.00 H new ATOM 0 HG13 ILE A 26 9.240 10.084 -3.979 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.138 8.518 -4.862 1.00 0.00 H new ATOM 0 HG22 ILE A 26 12.285 7.833 -3.687 1.00 0.00 H new ATOM 0 HG23 ILE A 26 10.640 7.167 -3.817 1.00 0.00 H new ATOM 0 HD11 ILE A 26 7.474 8.409 -3.590 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.938 7.637 -4.242 1.00 0.00 H new ATOM 0 HD13 ILE A 26 8.560 7.506 -2.508 1.00 0.00 H new ATOM 426 N LYS A 27 10.970 6.044 -1.424 1.00 0.00 N ATOM 427 CA LYS A 27 11.618 4.740 -1.520 1.00 0.00 C ATOM 428 C LYS A 27 11.059 3.987 -2.725 1.00 0.00 C ATOM 429 O LYS A 27 9.873 4.093 -3.031 1.00 0.00 O ATOM 430 CB LYS A 27 11.405 3.926 -0.240 1.00 0.00 C ATOM 431 CG LYS A 27 11.646 4.818 0.980 1.00 0.00 C ATOM 432 CD LYS A 27 13.125 5.206 1.046 1.00 0.00 C ATOM 433 CE LYS A 27 13.588 5.218 2.503 1.00 0.00 C ATOM 434 NZ LYS A 27 14.993 5.711 2.575 1.00 0.00 N ATOM 0 H LYS A 27 9.956 6.011 -1.321 1.00 0.00 H new ATOM 0 HA LYS A 27 12.690 4.888 -1.647 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.392 3.525 -0.216 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.085 3.074 -0.221 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.027 5.713 0.917 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.356 4.293 1.890 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.723 4.500 0.470 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.274 6.189 0.599 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.936 5.858 3.097 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.521 4.215 2.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 15.308 5.719 3.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.610 5.083 2.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.043 6.675 2.188 1.00 0.00 H new ATOM 448 N THR A 28 11.914 3.244 -3.419 1.00 0.00 N ATOM 449 CA THR A 28 11.466 2.507 -4.596 1.00 0.00 C ATOM 450 C THR A 28 11.723 1.008 -4.452 1.00 0.00 C ATOM 451 O THR A 28 12.825 0.584 -4.106 1.00 0.00 O ATOM 452 CB THR A 28 12.184 3.031 -5.839 1.00 0.00 C ATOM 453 OG1 THR A 28 13.164 2.088 -6.250 1.00 0.00 O ATOM 454 CG2 THR A 28 12.859 4.366 -5.517 1.00 0.00 C ATOM 0 H THR A 28 12.903 3.136 -3.194 1.00 0.00 H new ATOM 0 HA THR A 28 10.391 2.659 -4.695 1.00 0.00 H new ATOM 0 HB THR A 28 11.462 3.178 -6.642 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.625 2.422 -7.048 1.00 0.00 H new ATOM 0 HG21 THR A 28 13.371 4.738 -6.404 1.00 0.00 H new ATOM 0 HG22 THR A 28 12.106 5.088 -5.203 1.00 0.00 H new ATOM 0 HG23 THR A 28 13.582 4.224 -4.714 1.00 0.00 H new ATOM 462 N SER A 29 10.693 0.216 -4.741 1.00 0.00 N ATOM 463 CA SER A 29 10.796 -1.239 -4.667 1.00 0.00 C ATOM 464 C SER A 29 10.376 -1.847 -6.006 1.00 0.00 C ATOM 465 O SER A 29 9.407 -1.401 -6.617 1.00 0.00 O ATOM 466 CB SER A 29 9.898 -1.775 -3.548 1.00 0.00 C ATOM 467 OG SER A 29 8.721 -0.982 -3.472 1.00 0.00 O ATOM 0 H SER A 29 9.776 0.558 -5.029 1.00 0.00 H new ATOM 0 HA SER A 29 11.828 -1.515 -4.450 1.00 0.00 H new ATOM 0 HB2 SER A 29 9.638 -2.816 -3.742 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.429 -1.751 -2.596 1.00 0.00 H new ATOM 0 HG SER A 29 8.786 -0.373 -2.707 1.00 0.00 H new ATOM 473 N PHE A 30 11.112 -2.849 -6.472 1.00 0.00 N ATOM 474 CA PHE A 30 10.789 -3.471 -7.754 1.00 0.00 C ATOM 475 C PHE A 30 10.727 -4.993 -7.643 1.00 0.00 C ATOM 476 O PHE A 30 11.369 -5.591 -6.781 1.00 0.00 O ATOM 477 CB PHE A 30 11.840 -3.080 -8.794 1.00 0.00 C ATOM 478 CG PHE A 30 13.171 -3.682 -8.417 1.00 0.00 C ATOM 479 CD1 PHE A 30 13.434 -5.030 -8.690 1.00 0.00 C ATOM 480 CD2 PHE A 30 14.145 -2.892 -7.795 1.00 0.00 C ATOM 481 CE1 PHE A 30 14.669 -5.588 -8.341 1.00 0.00 C ATOM 482 CE2 PHE A 30 15.381 -3.449 -7.446 1.00 0.00 C ATOM 483 CZ PHE A 30 15.643 -4.798 -7.719 1.00 0.00 C ATOM 0 H PHE A 30 11.922 -3.244 -5.994 1.00 0.00 H new ATOM 0 HA PHE A 30 9.806 -3.114 -8.060 1.00 0.00 H new ATOM 0 HB2 PHE A 30 11.538 -3.430 -9.781 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.923 -1.995 -8.852 1.00 0.00 H new ATOM 0 HD1 PHE A 30 12.683 -5.640 -9.170 1.00 0.00 H new ATOM 0 HD2 PHE A 30 13.943 -1.852 -7.584 1.00 0.00 H new ATOM 0 HE1 PHE A 30 14.871 -6.628 -8.551 1.00 0.00 H new ATOM 0 HE2 PHE A 30 16.132 -2.839 -6.966 1.00 0.00 H new ATOM 0 HZ PHE A 30 16.596 -5.228 -7.450 1.00 0.00 H new ATOM 493 N CYS A 31 9.950 -5.610 -8.534 1.00 0.00 N ATOM 494 CA CYS A 31 9.809 -7.063 -8.541 1.00 0.00 C ATOM 495 C CYS A 31 9.699 -7.584 -9.972 1.00 0.00 C ATOM 496 O CYS A 31 9.240 -6.877 -10.868 1.00 0.00 O ATOM 497 CB CYS A 31 8.568 -7.483 -7.754 1.00 0.00 C ATOM 498 SG CYS A 31 8.462 -6.520 -6.226 1.00 0.00 S ATOM 0 H CYS A 31 9.413 -5.128 -9.255 1.00 0.00 H new ATOM 0 HA CYS A 31 10.695 -7.490 -8.071 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.673 -7.327 -8.357 1.00 0.00 H new ATOM 0 HB3 CYS A 31 8.615 -8.547 -7.522 1.00 0.00 H new ATOM 0 HG CYS A 31 9.636 -6.048 -5.928 1.00 0.00 H new ATOM 504 N ALA A 32 10.131 -8.823 -10.174 1.00 0.00 N ATOM 505 CA ALA A 32 10.091 -9.441 -11.492 1.00 0.00 C ATOM 506 C ALA A 32 9.142 -10.640 -11.497 1.00 0.00 C ATOM 507 O ALA A 32 8.682 -11.074 -10.440 1.00 0.00 O ATOM 508 CB ALA A 32 11.498 -9.904 -11.859 1.00 0.00 C ATOM 0 H ALA A 32 10.513 -9.420 -9.440 1.00 0.00 H new ATOM 0 HA ALA A 32 9.730 -8.713 -12.218 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.482 -10.369 -12.845 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.171 -9.047 -11.873 1.00 0.00 H new ATOM 0 HB3 ALA A 32 11.847 -10.627 -11.122 1.00 0.00 H new ATOM 514 N PRO A 33 8.856 -11.198 -12.647 1.00 0.00 N ATOM 515 CA PRO A 33 7.966 -12.389 -12.742 1.00 0.00 C ATOM 516 C PRO A 33 8.551 -13.559 -11.957 1.00 0.00 C ATOM 517 O PRO A 33 9.700 -13.946 -12.173 1.00 0.00 O ATOM 518 CB PRO A 33 7.909 -12.705 -14.242 1.00 0.00 C ATOM 519 CG PRO A 33 8.395 -11.477 -14.939 1.00 0.00 C ATOM 520 CD PRO A 33 9.334 -10.764 -13.969 1.00 0.00 C ATOM 0 HA PRO A 33 6.976 -12.207 -12.323 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.534 -13.564 -14.484 1.00 0.00 H new ATOM 0 HB3 PRO A 33 6.893 -12.953 -14.550 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.915 -11.736 -15.861 1.00 0.00 H new ATOM 0 HG3 PRO A 33 7.560 -10.832 -15.214 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.373 -11.049 -14.134 1.00 0.00 H new ATOM 0 HD3 PRO A 33 9.279 -9.681 -14.080 1.00 0.00 H new ATOM 528 N GLY A 34 7.771 -14.110 -11.035 1.00 0.00 N ATOM 529 CA GLY A 34 8.248 -15.219 -10.222 1.00 0.00 C ATOM 530 C GLY A 34 9.291 -14.733 -9.218 1.00 0.00 C ATOM 531 O GLY A 34 9.885 -15.530 -8.491 1.00 0.00 O ATOM 0 H GLY A 34 6.817 -13.811 -10.834 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.412 -15.677 -9.694 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.681 -15.988 -10.862 1.00 0.00 H new ATOM 535 N GLU A 35 9.519 -13.420 -9.196 1.00 0.00 N ATOM 536 CA GLU A 35 10.508 -12.836 -8.289 1.00 0.00 C ATOM 537 C GLU A 35 9.962 -12.738 -6.867 1.00 0.00 C ATOM 538 O GLU A 35 8.872 -12.220 -6.648 1.00 0.00 O ATOM 539 CB GLU A 35 10.916 -11.453 -8.779 1.00 0.00 C ATOM 540 CG GLU A 35 12.394 -11.229 -8.487 1.00 0.00 C ATOM 541 CD GLU A 35 13.245 -11.737 -9.646 1.00 0.00 C ATOM 542 OE1 GLU A 35 12.974 -12.828 -10.121 1.00 0.00 O ATOM 543 OE2 GLU A 35 14.155 -11.029 -10.042 1.00 0.00 O ATOM 0 H GLU A 35 9.037 -12.745 -9.790 1.00 0.00 H new ATOM 0 HA GLU A 35 11.380 -13.489 -8.278 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.728 -11.364 -9.849 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.316 -10.688 -8.285 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.583 -10.168 -8.326 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.673 -11.746 -7.568 1.00 0.00 H new ATOM 550 N PHE A 36 10.731 -13.242 -5.906 1.00 0.00 N ATOM 551 CA PHE A 36 10.315 -13.217 -4.505 1.00 0.00 C ATOM 552 C PHE A 36 10.651 -11.882 -3.845 1.00 0.00 C ATOM 553 O PHE A 36 11.819 -11.503 -3.753 1.00 0.00 O ATOM 554 CB PHE A 36 11.004 -14.346 -3.741 1.00 0.00 C ATOM 555 CG PHE A 36 10.702 -15.663 -4.413 1.00 0.00 C ATOM 556 CD1 PHE A 36 9.460 -16.278 -4.220 1.00 0.00 C ATOM 557 CD2 PHE A 36 11.665 -16.270 -5.228 1.00 0.00 C ATOM 558 CE1 PHE A 36 9.179 -17.500 -4.843 1.00 0.00 C ATOM 559 CE2 PHE A 36 11.386 -17.492 -5.851 1.00 0.00 C ATOM 560 CZ PHE A 36 10.142 -18.107 -5.658 1.00 0.00 C ATOM 0 H PHE A 36 11.642 -13.671 -6.069 1.00 0.00 H new ATOM 0 HA PHE A 36 9.234 -13.351 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 36 12.081 -14.177 -3.714 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.658 -14.365 -2.708 1.00 0.00 H new ATOM 0 HD1 PHE A 36 8.718 -15.810 -3.590 1.00 0.00 H new ATOM 0 HD2 PHE A 36 12.624 -15.795 -5.376 1.00 0.00 H new ATOM 0 HE1 PHE A 36 8.220 -17.974 -4.695 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.129 -17.960 -6.480 1.00 0.00 H new ATOM 0 HZ PHE A 36 9.926 -19.050 -6.138 1.00 0.00 H new ATOM 570 N LEU A 37 9.622 -11.176 -3.377 1.00 0.00 N ATOM 571 CA LEU A 37 9.829 -9.892 -2.719 1.00 0.00 C ATOM 572 C LEU A 37 9.955 -10.057 -1.207 1.00 0.00 C ATOM 573 O LEU A 37 10.777 -9.386 -0.583 1.00 0.00 O ATOM 574 CB LEU A 37 8.684 -8.929 -3.023 1.00 0.00 C ATOM 575 CG LEU A 37 9.195 -7.485 -2.963 1.00 0.00 C ATOM 576 CD1 LEU A 37 10.247 -7.255 -4.051 1.00 0.00 C ATOM 577 CD2 LEU A 37 8.025 -6.523 -3.180 1.00 0.00 C ATOM 0 H LEU A 37 8.647 -11.470 -3.441 1.00 0.00 H new ATOM 0 HA LEU A 37 10.759 -9.480 -3.110 1.00 0.00 H new ATOM 0 HB2 LEU A 37 8.272 -9.139 -4.010 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.877 -9.070 -2.304 1.00 0.00 H new ATOM 0 HG LEU A 37 9.645 -7.306 -1.986 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.604 -6.226 -4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.083 -7.937 -3.899 1.00 0.00 H new ATOM 0 HD13 LEU A 37 9.804 -7.437 -5.030 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.386 -5.495 -3.138 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.576 -6.710 -4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 37 7.278 -6.677 -2.401 1.00 0.00 H new ATOM 589 N ILE A 38 9.161 -10.952 -0.604 1.00 0.00 N ATOM 590 CA ILE A 38 9.268 -11.144 0.824 1.00 0.00 C ATOM 591 C ILE A 38 9.281 -12.614 1.157 1.00 0.00 C ATOM 592 O ILE A 38 8.834 -13.453 0.377 1.00 0.00 O ATOM 593 CB ILE A 38 8.157 -10.422 1.600 1.00 0.00 C ATOM 594 CG1 ILE A 38 6.897 -11.273 1.695 1.00 0.00 C ATOM 595 CG2 ILE A 38 7.833 -9.088 0.948 1.00 0.00 C ATOM 596 CD1 ILE A 38 7.011 -12.191 2.894 1.00 0.00 C ATOM 0 H ILE A 38 8.465 -11.530 -1.074 1.00 0.00 H new ATOM 0 HA ILE A 38 10.212 -10.699 1.138 1.00 0.00 H new ATOM 0 HB ILE A 38 8.524 -10.247 2.611 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.018 -10.635 1.791 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.768 -11.858 0.784 1.00 0.00 H new ATOM 0 HG21 ILE A 38 7.044 -8.590 1.511 1.00 0.00 H new ATOM 0 HG22 ILE A 38 8.724 -8.461 0.940 1.00 0.00 H new ATOM 0 HG23 ILE A 38 7.498 -9.255 -0.076 1.00 0.00 H new ATOM 0 HD11 ILE A 38 6.113 -12.804 2.970 1.00 0.00 H new ATOM 0 HD12 ILE A 38 7.882 -12.836 2.777 1.00 0.00 H new ATOM 0 HD13 ILE A 38 7.120 -11.595 3.800 1.00 0.00 H new ATOM 608 N ARG A 39 9.810 -12.911 2.325 1.00 0.00 N ATOM 609 CA ARG A 39 9.903 -14.284 2.783 1.00 0.00 C ATOM 610 C ARG A 39 9.330 -14.417 4.187 1.00 0.00 C ATOM 611 O ARG A 39 9.880 -13.880 5.148 1.00 0.00 O ATOM 612 CB ARG A 39 11.364 -14.713 2.770 1.00 0.00 C ATOM 613 CG ARG A 39 11.509 -16.124 3.324 1.00 0.00 C ATOM 614 CD ARG A 39 10.924 -17.116 2.326 1.00 0.00 C ATOM 615 NE ARG A 39 11.931 -18.096 1.935 1.00 0.00 N ATOM 616 CZ ARG A 39 12.466 -18.923 2.826 1.00 0.00 C ATOM 617 NH1 ARG A 39 12.093 -18.866 4.075 1.00 0.00 N ATOM 618 NH2 ARG A 39 13.366 -19.792 2.453 1.00 0.00 N ATOM 0 H ARG A 39 10.183 -12.220 2.976 1.00 0.00 H new ATOM 0 HA ARG A 39 9.326 -14.926 2.118 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.752 -14.674 1.752 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.958 -14.019 3.365 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.560 -16.350 3.506 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.994 -16.206 4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.066 -17.623 2.768 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.562 -16.585 1.445 1.00 0.00 H new ATOM 0 HE ARG A 39 12.229 -18.147 0.961 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.391 -18.186 4.367 1.00 0.00 H new ATOM 0 HH12 ARG A 39 12.504 -19.501 4.759 1.00 0.00 H new ATOM 0 HH21 ARG A 39 13.659 -19.836 1.477 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.777 -20.427 3.138 1.00 0.00 H new ATOM 632 N GLN A 40 8.221 -15.135 4.278 1.00 0.00 N ATOM 633 CA GLN A 40 7.535 -15.361 5.550 1.00 0.00 C ATOM 634 C GLN A 40 8.358 -14.861 6.733 1.00 0.00 C ATOM 635 O GLN A 40 9.518 -15.239 6.901 1.00 0.00 O ATOM 636 CB GLN A 40 7.255 -16.854 5.724 1.00 0.00 C ATOM 637 CG GLN A 40 6.982 -17.155 7.200 1.00 0.00 C ATOM 638 CD GLN A 40 6.418 -18.564 7.349 1.00 0.00 C ATOM 639 OE1 GLN A 40 7.016 -19.407 8.017 1.00 0.00 O ATOM 640 NE2 GLN A 40 5.294 -18.872 6.760 1.00 0.00 N ATOM 0 H GLN A 40 7.769 -15.578 3.478 1.00 0.00 H new ATOM 0 HA GLN A 40 6.600 -14.801 5.528 1.00 0.00 H new ATOM 0 HB2 GLN A 40 6.398 -17.147 5.118 1.00 0.00 H new ATOM 0 HB3 GLN A 40 8.107 -17.438 5.375 1.00 0.00 H new ATOM 0 HG2 GLN A 40 7.903 -17.060 7.775 1.00 0.00 H new ATOM 0 HG3 GLN A 40 6.278 -16.428 7.604 1.00 0.00 H new ATOM 0 HE21 GLN A 40 4.800 -18.172 6.207 1.00 0.00 H new ATOM 0 HE22 GLN A 40 4.910 -19.812 6.853 1.00 0.00 H new ATOM 649 N GLY A 41 7.742 -14.019 7.557 1.00 0.00 N ATOM 650 CA GLY A 41 8.416 -13.483 8.732 1.00 0.00 C ATOM 651 C GLY A 41 9.127 -12.168 8.433 1.00 0.00 C ATOM 652 O GLY A 41 9.842 -11.639 9.284 1.00 0.00 O ATOM 0 H GLY A 41 6.783 -13.695 7.433 1.00 0.00 H new ATOM 0 HA2 GLY A 41 7.688 -13.328 9.528 1.00 0.00 H new ATOM 0 HA3 GLY A 41 9.140 -14.211 9.098 1.00 0.00 H new ATOM 656 N ASP A 42 8.932 -11.637 7.231 1.00 0.00 N ATOM 657 CA ASP A 42 9.576 -10.379 6.868 1.00 0.00 C ATOM 658 C ASP A 42 8.988 -9.231 7.677 1.00 0.00 C ATOM 659 O ASP A 42 8.009 -9.407 8.401 1.00 0.00 O ATOM 660 CB ASP A 42 9.403 -10.091 5.379 1.00 0.00 C ATOM 661 CG ASP A 42 10.341 -10.977 4.567 1.00 0.00 C ATOM 662 OD1 ASP A 42 10.890 -11.904 5.139 1.00 0.00 O ATOM 663 OD2 ASP A 42 10.501 -10.716 3.387 1.00 0.00 O ATOM 0 H ASP A 42 8.346 -12.047 6.504 1.00 0.00 H new ATOM 0 HA ASP A 42 10.640 -10.470 7.089 1.00 0.00 H new ATOM 0 HB2 ASP A 42 8.370 -10.272 5.082 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.614 -9.041 5.176 1.00 0.00 H new ATOM 668 N ALA A 43 9.599 -8.058 7.556 1.00 0.00 N ATOM 669 CA ALA A 43 9.135 -6.887 8.289 1.00 0.00 C ATOM 670 C ALA A 43 8.538 -5.849 7.344 1.00 0.00 C ATOM 671 O ALA A 43 9.263 -5.142 6.644 1.00 0.00 O ATOM 672 CB ALA A 43 10.305 -6.268 9.050 1.00 0.00 C ATOM 0 H ALA A 43 10.411 -7.893 6.961 1.00 0.00 H new ATOM 0 HA ALA A 43 8.360 -7.203 8.987 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.959 -5.392 9.599 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.711 -6.998 9.750 1.00 0.00 H new ATOM 0 HB3 ALA A 43 11.081 -5.971 8.345 1.00 0.00 H new ATOM 678 N LEU A 44 7.214 -5.759 7.338 1.00 0.00 N ATOM 679 CA LEU A 44 6.524 -4.798 6.485 1.00 0.00 C ATOM 680 C LEU A 44 6.156 -3.548 7.280 1.00 0.00 C ATOM 681 O LEU A 44 5.307 -3.596 8.170 1.00 0.00 O ATOM 682 CB LEU A 44 5.260 -5.428 5.911 1.00 0.00 C ATOM 683 CG LEU A 44 4.505 -4.392 5.086 1.00 0.00 C ATOM 684 CD1 LEU A 44 5.472 -3.707 4.125 1.00 0.00 C ATOM 685 CD2 LEU A 44 3.425 -5.097 4.281 1.00 0.00 C ATOM 0 H LEU A 44 6.598 -6.336 7.911 1.00 0.00 H new ATOM 0 HA LEU A 44 7.191 -4.515 5.671 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.518 -6.285 5.289 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.627 -5.798 6.717 1.00 0.00 H new ATOM 0 HG LEU A 44 4.057 -3.650 5.747 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.934 -2.966 3.534 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.262 -3.215 4.693 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.912 -4.450 3.461 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.878 -4.365 3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.885 -5.831 3.619 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.736 -5.601 4.959 1.00 0.00 H new ATOM 697 N GLN A 45 6.800 -2.431 6.956 1.00 0.00 N ATOM 698 CA GLN A 45 6.528 -1.179 7.654 1.00 0.00 C ATOM 699 C GLN A 45 6.156 -0.076 6.668 1.00 0.00 C ATOM 700 O GLN A 45 5.259 0.726 6.926 1.00 0.00 O ATOM 701 CB GLN A 45 7.758 -0.752 8.456 1.00 0.00 C ATOM 702 CG GLN A 45 8.533 -1.992 8.902 1.00 0.00 C ATOM 703 CD GLN A 45 9.771 -1.579 9.691 1.00 0.00 C ATOM 704 OE1 GLN A 45 10.868 -1.513 9.135 1.00 0.00 O ATOM 705 NE2 GLN A 45 9.663 -1.297 10.960 1.00 0.00 N ATOM 0 H GLN A 45 7.506 -2.366 6.223 1.00 0.00 H new ATOM 0 HA GLN A 45 5.688 -1.341 8.329 1.00 0.00 H new ATOM 0 HB2 GLN A 45 8.396 -0.110 7.849 1.00 0.00 H new ATOM 0 HB3 GLN A 45 7.454 -0.168 9.325 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.896 -2.628 9.517 1.00 0.00 H new ATOM 0 HG3 GLN A 45 8.826 -2.580 8.032 1.00 0.00 H new ATOM 0 HE21 GLN A 45 8.754 -1.352 11.419 1.00 0.00 H new ATOM 0 HE22 GLN A 45 10.488 -1.021 11.493 1.00 0.00 H new ATOM 714 N ALA A 46 6.862 -0.037 5.544 1.00 0.00 N ATOM 715 CA ALA A 46 6.613 0.973 4.527 1.00 0.00 C ATOM 716 C ALA A 46 5.303 0.696 3.790 1.00 0.00 C ATOM 717 O ALA A 46 4.892 -0.456 3.652 1.00 0.00 O ATOM 718 CB ALA A 46 7.773 0.978 3.527 1.00 0.00 C ATOM 0 H ALA A 46 7.610 -0.692 5.316 1.00 0.00 H new ATOM 0 HA ALA A 46 6.533 1.945 5.013 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.591 1.733 2.763 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.702 1.206 4.049 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.852 -0.002 3.057 1.00 0.00 H new ATOM 724 N ILE A 47 4.662 1.758 3.302 1.00 0.00 N ATOM 725 CA ILE A 47 3.412 1.608 2.563 1.00 0.00 C ATOM 726 C ILE A 47 3.736 1.330 1.102 1.00 0.00 C ATOM 727 O ILE A 47 4.595 1.991 0.519 1.00 0.00 O ATOM 728 CB ILE A 47 2.564 2.877 2.677 1.00 0.00 C ATOM 729 CG1 ILE A 47 1.247 2.674 1.923 1.00 0.00 C ATOM 730 CG2 ILE A 47 3.321 4.057 2.066 1.00 0.00 C ATOM 731 CD1 ILE A 47 0.538 1.424 2.451 1.00 0.00 C ATOM 0 H ILE A 47 4.984 2.720 3.404 1.00 0.00 H new ATOM 0 HA ILE A 47 2.842 0.779 2.983 1.00 0.00 H new ATOM 0 HB ILE A 47 2.359 3.084 3.727 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.607 3.547 2.048 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.440 2.571 0.855 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.715 4.960 2.148 1.00 0.00 H new ATOM 0 HG22 ILE A 47 4.261 4.201 2.598 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.527 3.853 1.015 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.399 1.282 1.912 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.177 0.553 2.303 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.331 1.545 3.514 1.00 0.00 H new ATOM 743 N TYR A 48 3.095 0.312 0.529 1.00 0.00 N ATOM 744 CA TYR A 48 3.392 -0.072 -0.839 1.00 0.00 C ATOM 745 C TYR A 48 2.252 0.259 -1.797 1.00 0.00 C ATOM 746 O TYR A 48 1.082 0.263 -1.419 1.00 0.00 O ATOM 747 CB TYR A 48 3.559 -1.584 -0.925 1.00 0.00 C ATOM 748 CG TYR A 48 4.756 -2.130 -0.169 1.00 0.00 C ATOM 749 CD1 TYR A 48 5.239 -1.569 1.024 1.00 0.00 C ATOM 750 CD2 TYR A 48 5.370 -3.254 -0.697 1.00 0.00 C ATOM 751 CE1 TYR A 48 6.343 -2.144 1.669 1.00 0.00 C ATOM 752 CE2 TYR A 48 6.472 -3.832 -0.058 1.00 0.00 C ATOM 753 CZ TYR A 48 6.959 -3.276 1.127 1.00 0.00 C ATOM 754 OH TYR A 48 8.045 -3.843 1.763 1.00 0.00 O ATOM 0 H TYR A 48 2.378 -0.251 0.987 1.00 0.00 H new ATOM 0 HA TYR A 48 4.294 0.475 -1.115 1.00 0.00 H new ATOM 0 HB2 TYR A 48 2.656 -2.059 -0.541 1.00 0.00 H new ATOM 0 HB3 TYR A 48 3.648 -1.868 -1.974 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.761 -0.696 1.444 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.994 -3.689 -1.611 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.718 -1.712 2.585 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.945 -4.706 -0.480 1.00 0.00 H new ATOM 0 HH TYR A 48 8.352 -4.623 1.255 1.00 0.00 H new ATOM 764 N PHE A 49 2.628 0.471 -3.056 1.00 0.00 N ATOM 765 CA PHE A 49 1.679 0.749 -4.132 1.00 0.00 C ATOM 766 C PHE A 49 2.253 0.213 -5.433 1.00 0.00 C ATOM 767 O PHE A 49 3.437 0.389 -5.712 1.00 0.00 O ATOM 768 CB PHE A 49 1.445 2.249 -4.297 1.00 0.00 C ATOM 769 CG PHE A 49 -0.037 2.545 -4.392 1.00 0.00 C ATOM 770 CD1 PHE A 49 -0.734 2.355 -5.603 1.00 0.00 C ATOM 771 CD2 PHE A 49 -0.714 3.034 -3.269 1.00 0.00 C ATOM 772 CE1 PHE A 49 -2.099 2.655 -5.675 1.00 0.00 C ATOM 773 CE2 PHE A 49 -2.080 3.329 -3.346 1.00 0.00 C ATOM 774 CZ PHE A 49 -2.771 3.140 -4.547 1.00 0.00 C ATOM 0 H PHE A 49 3.602 0.455 -3.360 1.00 0.00 H new ATOM 0 HA PHE A 49 0.731 0.272 -3.885 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.876 2.786 -3.452 1.00 0.00 H new ATOM 0 HB3 PHE A 49 1.952 2.606 -5.194 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.216 1.979 -6.473 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.182 3.184 -2.341 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.635 2.512 -6.602 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.601 3.703 -2.477 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.825 3.369 -4.604 1.00 0.00 H new ATOM 784 N VAL A 50 1.423 -0.429 -6.226 1.00 0.00 N ATOM 785 CA VAL A 50 1.875 -0.964 -7.485 1.00 0.00 C ATOM 786 C VAL A 50 1.414 -0.052 -8.622 1.00 0.00 C ATOM 787 O VAL A 50 0.257 0.362 -8.662 1.00 0.00 O ATOM 788 CB VAL A 50 1.334 -2.382 -7.606 1.00 0.00 C ATOM 789 CG1 VAL A 50 0.691 -2.574 -8.957 1.00 0.00 C ATOM 790 CG2 VAL A 50 2.472 -3.386 -7.422 1.00 0.00 C ATOM 0 H VAL A 50 0.437 -0.591 -6.020 1.00 0.00 H new ATOM 0 HA VAL A 50 2.963 -1.005 -7.542 1.00 0.00 H new ATOM 0 HB VAL A 50 0.585 -2.546 -6.832 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.306 -3.591 -9.036 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.129 -1.866 -9.073 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.431 -2.404 -9.739 1.00 0.00 H new ATOM 0 HG21 VAL A 50 2.081 -4.400 -7.509 1.00 0.00 H new ATOM 0 HG22 VAL A 50 3.229 -3.222 -8.189 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.919 -3.253 -6.437 1.00 0.00 H new ATOM 800 N CYS A 51 2.327 0.276 -9.530 1.00 0.00 N ATOM 801 CA CYS A 51 1.992 1.159 -10.641 1.00 0.00 C ATOM 802 C CYS A 51 1.584 0.356 -11.875 1.00 0.00 C ATOM 803 O CYS A 51 0.743 0.795 -12.661 1.00 0.00 O ATOM 804 CB CYS A 51 3.189 2.048 -10.979 1.00 0.00 C ATOM 805 SG CYS A 51 2.967 3.674 -10.215 1.00 0.00 S ATOM 0 H CYS A 51 3.293 -0.051 -9.520 1.00 0.00 H new ATOM 0 HA CYS A 51 1.149 1.781 -10.339 1.00 0.00 H new ATOM 0 HB2 CYS A 51 4.110 1.588 -10.620 1.00 0.00 H new ATOM 0 HB3 CYS A 51 3.285 2.152 -12.060 1.00 0.00 H new ATOM 0 HG CYS A 51 3.985 4.430 -10.500 1.00 0.00 H new ATOM 811 N SER A 52 2.186 -0.817 -12.041 1.00 0.00 N ATOM 812 CA SER A 52 1.873 -1.668 -13.187 1.00 0.00 C ATOM 813 C SER A 52 2.504 -3.047 -13.017 1.00 0.00 C ATOM 814 O SER A 52 3.565 -3.181 -12.410 1.00 0.00 O ATOM 815 CB SER A 52 2.390 -1.025 -14.474 1.00 0.00 C ATOM 816 OG SER A 52 3.364 -1.875 -15.066 1.00 0.00 O ATOM 0 H SER A 52 2.886 -1.199 -11.405 1.00 0.00 H new ATOM 0 HA SER A 52 0.790 -1.779 -13.247 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.566 -0.859 -15.168 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.825 -0.050 -14.257 1.00 0.00 H new ATOM 0 HG SER A 52 3.696 -1.466 -15.892 1.00 0.00 H new ATOM 822 N GLY A 53 1.841 -4.068 -13.553 1.00 0.00 N ATOM 823 CA GLY A 53 2.344 -5.435 -13.452 1.00 0.00 C ATOM 824 C GLY A 53 1.405 -6.291 -12.607 1.00 0.00 C ATOM 825 O GLY A 53 0.241 -5.938 -12.417 1.00 0.00 O ATOM 0 H GLY A 53 0.960 -3.976 -14.059 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.441 -5.867 -14.448 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.339 -5.430 -13.008 1.00 0.00 H new ATOM 829 N SER A 54 1.908 -7.415 -12.100 1.00 0.00 N ATOM 830 CA SER A 54 1.074 -8.292 -11.278 1.00 0.00 C ATOM 831 C SER A 54 1.915 -9.055 -10.261 1.00 0.00 C ATOM 832 O SER A 54 3.019 -9.508 -10.565 1.00 0.00 O ATOM 833 CB SER A 54 0.323 -9.286 -12.165 1.00 0.00 C ATOM 834 OG SER A 54 0.279 -8.790 -13.496 1.00 0.00 O ATOM 0 H SER A 54 2.866 -7.736 -12.239 1.00 0.00 H new ATOM 0 HA SER A 54 0.360 -7.668 -10.741 1.00 0.00 H new ATOM 0 HB2 SER A 54 0.818 -10.257 -12.143 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.688 -9.436 -11.787 1.00 0.00 H new ATOM 0 HG SER A 54 1.149 -8.405 -13.730 1.00 0.00 H new ATOM 840 N MET A 55 1.381 -9.200 -9.049 1.00 0.00 N ATOM 841 CA MET A 55 2.100 -9.919 -8.000 1.00 0.00 C ATOM 842 C MET A 55 1.132 -10.492 -6.972 1.00 0.00 C ATOM 843 O MET A 55 -0.047 -10.136 -6.946 1.00 0.00 O ATOM 844 CB MET A 55 3.102 -8.989 -7.314 1.00 0.00 C ATOM 845 CG MET A 55 2.378 -7.757 -6.778 1.00 0.00 C ATOM 846 SD MET A 55 2.490 -7.729 -4.971 1.00 0.00 S ATOM 847 CE MET A 55 4.291 -7.851 -4.853 1.00 0.00 C ATOM 0 H MET A 55 0.469 -8.836 -8.773 1.00 0.00 H new ATOM 0 HA MET A 55 2.639 -10.746 -8.462 1.00 0.00 H new ATOM 0 HB2 MET A 55 3.600 -9.513 -6.498 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.876 -8.689 -8.020 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.821 -6.852 -7.194 1.00 0.00 H new ATOM 0 HG3 MET A 55 1.333 -7.773 -7.088 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.642 -7.253 -4.012 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.576 -8.892 -4.702 1.00 0.00 H new ATOM 0 HE3 MET A 55 4.742 -7.481 -5.774 1.00 0.00 H new ATOM 857 N GLU A 56 1.634 -11.400 -6.140 1.00 0.00 N ATOM 858 CA GLU A 56 0.794 -12.028 -5.129 1.00 0.00 C ATOM 859 C GLU A 56 1.636 -12.737 -4.065 1.00 0.00 C ATOM 860 O GLU A 56 2.771 -13.136 -4.322 1.00 0.00 O ATOM 861 CB GLU A 56 -0.126 -13.040 -5.811 1.00 0.00 C ATOM 862 CG GLU A 56 0.687 -13.892 -6.798 1.00 0.00 C ATOM 863 CD GLU A 56 1.834 -14.586 -6.070 1.00 0.00 C ATOM 864 OE1 GLU A 56 1.624 -15.027 -4.954 1.00 0.00 O ATOM 865 OE2 GLU A 56 2.908 -14.669 -6.645 1.00 0.00 O ATOM 0 H GLU A 56 2.605 -11.713 -6.146 1.00 0.00 H new ATOM 0 HA GLU A 56 0.209 -11.254 -4.632 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.597 -13.680 -5.064 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.927 -12.521 -6.337 1.00 0.00 H new ATOM 0 HG2 GLU A 56 0.041 -14.635 -7.267 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.080 -13.262 -7.596 1.00 0.00 H new ATOM 872 N VAL A 57 1.054 -12.910 -2.878 1.00 0.00 N ATOM 873 CA VAL A 57 1.742 -13.599 -1.787 1.00 0.00 C ATOM 874 C VAL A 57 1.247 -15.051 -1.732 1.00 0.00 C ATOM 875 O VAL A 57 0.036 -15.297 -1.803 1.00 0.00 O ATOM 876 CB VAL A 57 1.486 -12.882 -0.453 1.00 0.00 C ATOM 877 CG1 VAL A 57 0.993 -11.459 -0.720 1.00 0.00 C ATOM 878 CG2 VAL A 57 0.438 -13.640 0.359 1.00 0.00 C ATOM 0 H VAL A 57 0.115 -12.585 -2.649 1.00 0.00 H new ATOM 0 HA VAL A 57 2.817 -13.590 -1.964 1.00 0.00 H new ATOM 0 HB VAL A 57 2.417 -12.846 0.113 1.00 0.00 H new ATOM 0 HG11 VAL A 57 0.812 -10.953 0.228 1.00 0.00 H new ATOM 0 HG12 VAL A 57 1.748 -10.912 -1.285 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.067 -11.496 -1.294 1.00 0.00 H new ATOM 0 HG21 VAL A 57 0.265 -13.123 1.303 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.494 -13.689 -0.205 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.794 -14.651 0.559 1.00 0.00 H new ATOM 888 N LEU A 58 2.190 -15.999 -1.647 1.00 0.00 N ATOM 889 CA LEU A 58 1.855 -17.424 -1.638 1.00 0.00 C ATOM 890 C LEU A 58 2.016 -18.073 -0.264 1.00 0.00 C ATOM 891 O LEU A 58 3.090 -18.028 0.339 1.00 0.00 O ATOM 892 CB LEU A 58 2.760 -18.157 -2.632 1.00 0.00 C ATOM 893 CG LEU A 58 1.959 -18.551 -3.871 1.00 0.00 C ATOM 894 CD1 LEU A 58 2.884 -19.265 -4.856 1.00 0.00 C ATOM 895 CD2 LEU A 58 0.818 -19.491 -3.467 1.00 0.00 C ATOM 0 H LEU A 58 3.189 -15.802 -1.584 1.00 0.00 H new ATOM 0 HA LEU A 58 0.804 -17.504 -1.915 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.595 -17.517 -2.917 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.184 -19.046 -2.164 1.00 0.00 H new ATOM 0 HG LEU A 58 1.541 -17.659 -4.338 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.320 -19.550 -5.744 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.697 -18.597 -5.141 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.296 -20.158 -4.386 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.247 -19.772 -4.352 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.231 -20.386 -3.003 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.163 -18.984 -2.758 1.00 0.00 H new ATOM 907 N LYS A 59 0.940 -18.708 0.198 1.00 0.00 N ATOM 908 CA LYS A 59 0.954 -19.418 1.473 1.00 0.00 C ATOM 909 C LYS A 59 -0.236 -20.380 1.558 1.00 0.00 C ATOM 910 O LYS A 59 -1.327 -20.073 1.079 1.00 0.00 O ATOM 911 CB LYS A 59 0.938 -18.432 2.646 1.00 0.00 C ATOM 912 CG LYS A 59 2.196 -18.613 3.503 1.00 0.00 C ATOM 913 CD LYS A 59 2.355 -20.078 3.918 1.00 0.00 C ATOM 914 CE LYS A 59 3.654 -20.649 3.337 1.00 0.00 C ATOM 915 NZ LYS A 59 4.792 -20.300 4.233 1.00 0.00 N ATOM 0 H LYS A 59 0.047 -18.744 -0.293 1.00 0.00 H new ATOM 0 HA LYS A 59 1.875 -19.998 1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.888 -17.410 2.271 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.048 -18.593 3.254 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.074 -18.290 2.944 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.133 -17.982 4.390 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.367 -20.157 5.005 1.00 0.00 H new ATOM 0 HD3 LYS A 59 1.503 -20.659 3.565 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.575 -21.731 3.236 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.826 -20.247 2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.681 -20.642 3.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.839 -19.267 4.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.652 -20.746 5.162 1.00 0.00 H new ATOM 929 N ASP A 60 -0.017 -21.538 2.172 1.00 0.00 N ATOM 930 CA ASP A 60 -1.071 -22.543 2.326 1.00 0.00 C ATOM 931 C ASP A 60 -1.607 -23.033 0.979 1.00 0.00 C ATOM 932 O ASP A 60 -2.818 -23.159 0.791 1.00 0.00 O ATOM 933 CB ASP A 60 -2.225 -21.960 3.144 1.00 0.00 C ATOM 934 CG ASP A 60 -1.683 -21.251 4.381 1.00 0.00 C ATOM 935 OD1 ASP A 60 -0.480 -21.291 4.583 1.00 0.00 O ATOM 936 OD2 ASP A 60 -2.478 -20.677 5.107 1.00 0.00 O ATOM 0 H ASP A 60 0.881 -21.807 2.573 1.00 0.00 H new ATOM 0 HA ASP A 60 -0.631 -23.397 2.841 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.796 -21.260 2.534 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -2.909 -22.755 3.441 1.00 0.00 H new ATOM 941 N ASN A 61 -0.698 -23.348 0.063 1.00 0.00 N ATOM 942 CA ASN A 61 -1.080 -23.875 -1.248 1.00 0.00 C ATOM 943 C ASN A 61 -1.830 -22.846 -2.094 1.00 0.00 C ATOM 944 O ASN A 61 -1.994 -23.035 -3.299 1.00 0.00 O ATOM 945 CB ASN A 61 -1.955 -25.119 -1.064 1.00 0.00 C ATOM 946 CG ASN A 61 -1.262 -26.344 -1.654 1.00 0.00 C ATOM 947 OD1 ASN A 61 -1.594 -26.775 -2.759 1.00 0.00 O ATOM 948 ND2 ASN A 61 -0.311 -26.930 -0.979 1.00 0.00 N ATOM 0 H ASN A 61 0.308 -23.249 0.201 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.162 -24.129 -1.778 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.153 -25.280 -0.004 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.919 -24.969 -1.549 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.160 -27.748 -1.366 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.039 -26.570 -0.064 1.00 0.00 H new ATOM 955 N THR A 62 -2.285 -21.762 -1.476 1.00 0.00 N ATOM 956 CA THR A 62 -3.009 -20.738 -2.224 1.00 0.00 C ATOM 957 C THR A 62 -2.423 -19.365 -1.969 1.00 0.00 C ATOM 958 O THR A 62 -1.792 -19.122 -0.940 1.00 0.00 O ATOM 959 CB THR A 62 -4.487 -20.719 -1.836 1.00 0.00 C ATOM 960 OG1 THR A 62 -5.003 -22.041 -1.877 1.00 0.00 O ATOM 961 CG2 THR A 62 -5.269 -19.828 -2.816 1.00 0.00 C ATOM 0 H THR A 62 -2.170 -21.570 -0.481 1.00 0.00 H new ATOM 0 HA THR A 62 -2.913 -20.984 -3.281 1.00 0.00 H new ATOM 0 HB THR A 62 -4.591 -20.319 -0.827 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.950 -22.030 -1.627 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.322 -19.817 -2.536 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.873 -18.813 -2.780 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.166 -20.222 -3.827 1.00 0.00 H new ATOM 969 N VAL A 63 -2.656 -18.465 -2.909 1.00 0.00 N ATOM 970 CA VAL A 63 -2.172 -17.109 -2.779 1.00 0.00 C ATOM 971 C VAL A 63 -2.965 -16.392 -1.699 1.00 0.00 C ATOM 972 O VAL A 63 -4.192 -16.326 -1.763 1.00 0.00 O ATOM 973 CB VAL A 63 -2.321 -16.384 -4.110 1.00 0.00 C ATOM 974 CG1 VAL A 63 -0.947 -16.221 -4.758 1.00 0.00 C ATOM 975 CG2 VAL A 63 -3.208 -17.219 -5.028 1.00 0.00 C ATOM 0 H VAL A 63 -3.176 -18.652 -3.766 1.00 0.00 H new ATOM 0 HA VAL A 63 -1.118 -17.120 -2.500 1.00 0.00 H new ATOM 0 HB VAL A 63 -2.766 -15.402 -3.947 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -1.053 -15.702 -5.711 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -0.300 -15.641 -4.099 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -0.506 -17.203 -4.927 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -3.322 -16.710 -5.985 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.749 -18.195 -5.188 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -4.187 -17.350 -4.567 1.00 0.00 H new ATOM 985 N LEU A 64 -2.270 -15.860 -0.703 1.00 0.00 N ATOM 986 CA LEU A 64 -2.952 -15.162 0.373 1.00 0.00 C ATOM 987 C LEU A 64 -3.404 -13.800 -0.120 1.00 0.00 C ATOM 988 O LEU A 64 -4.308 -13.191 0.453 1.00 0.00 O ATOM 989 CB LEU A 64 -2.025 -14.995 1.581 1.00 0.00 C ATOM 990 CG LEU A 64 -2.559 -15.805 2.766 1.00 0.00 C ATOM 991 CD1 LEU A 64 -2.213 -17.283 2.574 1.00 0.00 C ATOM 992 CD2 LEU A 64 -1.914 -15.297 4.058 1.00 0.00 C ATOM 0 H LEU A 64 -1.254 -15.897 -0.619 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.818 -15.748 0.682 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.019 -15.328 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.954 -13.942 1.852 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.641 -15.691 2.826 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.594 -17.858 3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.668 -17.646 1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.131 -17.399 2.515 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.292 -15.871 4.904 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.832 -15.413 3.995 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.158 -14.244 4.197 1.00 0.00 H new ATOM 1004 N ALA A 65 -2.788 -13.334 -1.202 1.00 0.00 N ATOM 1005 CA ALA A 65 -3.173 -12.045 -1.762 1.00 0.00 C ATOM 1006 C ALA A 65 -2.994 -12.032 -3.276 1.00 0.00 C ATOM 1007 O ALA A 65 -1.956 -12.443 -3.795 1.00 0.00 O ATOM 1008 CB ALA A 65 -2.344 -10.924 -1.137 1.00 0.00 C ATOM 0 H ALA A 65 -2.038 -13.816 -1.698 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.227 -11.883 -1.534 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -2.643 -9.968 -1.566 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.509 -10.906 -0.060 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.287 -11.097 -1.339 1.00 0.00 H new ATOM 1014 N ILE A 66 -4.015 -11.541 -3.972 1.00 0.00 N ATOM 1015 CA ILE A 66 -3.972 -11.453 -5.425 1.00 0.00 C ATOM 1016 C ILE A 66 -4.233 -10.009 -5.852 1.00 0.00 C ATOM 1017 O ILE A 66 -5.366 -9.538 -5.768 1.00 0.00 O ATOM 1018 CB ILE A 66 -5.049 -12.352 -6.035 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -4.619 -13.814 -5.925 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -5.244 -11.986 -7.507 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -5.053 -14.368 -4.568 1.00 0.00 C ATOM 0 H ILE A 66 -4.880 -11.199 -3.553 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.990 -11.775 -5.772 1.00 0.00 H new ATOM 0 HB ILE A 66 -5.987 -12.210 -5.498 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.067 -14.398 -6.729 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.538 -13.896 -6.035 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -6.011 -12.626 -7.943 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -5.554 -10.944 -7.585 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.306 -12.127 -8.044 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.748 -15.411 -4.486 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.584 -13.789 -3.772 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -6.137 -14.299 -4.477 1.00 0.00 H new ATOM 1033 N LEU A 67 -3.197 -9.298 -6.294 1.00 0.00 N ATOM 1034 CA LEU A 67 -3.393 -7.908 -6.700 1.00 0.00 C ATOM 1035 C LEU A 67 -2.730 -7.593 -8.039 1.00 0.00 C ATOM 1036 O LEU A 67 -1.858 -8.331 -8.512 1.00 0.00 O ATOM 1037 CB LEU A 67 -2.868 -6.958 -5.623 1.00 0.00 C ATOM 1038 CG LEU A 67 -1.894 -7.693 -4.708 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -0.635 -8.017 -5.501 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -1.532 -6.797 -3.522 1.00 0.00 C ATOM 0 H LEU A 67 -2.242 -9.647 -6.379 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.466 -7.762 -6.824 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.371 -6.107 -6.088 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.699 -6.562 -5.040 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.350 -8.611 -4.337 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.073 -8.543 -4.861 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.893 -8.648 -6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.182 -7.092 -5.859 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.836 -7.322 -2.868 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.067 -5.881 -3.887 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.435 -6.548 -2.965 1.00 0.00 H new ATOM 1052 N GLY A 68 -3.152 -6.478 -8.640 1.00 0.00 N ATOM 1053 CA GLY A 68 -2.607 -6.050 -9.923 1.00 0.00 C ATOM 1054 C GLY A 68 -2.217 -4.569 -9.901 1.00 0.00 C ATOM 1055 O GLY A 68 -1.898 -4.012 -8.852 1.00 0.00 O ATOM 0 H GLY A 68 -3.867 -5.859 -8.257 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.733 -6.654 -10.168 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.344 -6.222 -10.708 1.00 0.00 H new ATOM 1059 N LYS A 69 -2.233 -3.953 -11.081 1.00 0.00 N ATOM 1060 CA LYS A 69 -1.867 -2.550 -11.241 1.00 0.00 C ATOM 1061 C LYS A 69 -2.694 -1.611 -10.361 1.00 0.00 C ATOM 1062 O LYS A 69 -3.924 -1.663 -10.356 1.00 0.00 O ATOM 1063 CB LYS A 69 -2.064 -2.157 -12.697 1.00 0.00 C ATOM 1064 CG LYS A 69 -1.527 -3.263 -13.606 1.00 0.00 C ATOM 1065 CD LYS A 69 -1.469 -2.754 -15.048 1.00 0.00 C ATOM 1066 CE LYS A 69 -1.051 -3.894 -15.979 1.00 0.00 C ATOM 1067 NZ LYS A 69 -1.651 -5.171 -15.501 1.00 0.00 N ATOM 0 H LYS A 69 -2.500 -4.413 -11.951 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.826 -2.449 -10.933 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.122 -1.989 -12.898 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.547 -1.220 -12.904 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -0.534 -3.569 -13.277 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.168 -4.142 -13.545 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.443 -2.366 -15.347 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -0.760 -1.930 -15.125 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.378 -3.685 -16.997 1.00 0.00 H new ATOM 0 HE3 LYS A 69 0.036 -3.977 -16.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.602 -5.883 -16.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.126 -5.512 -14.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.645 -5.011 -15.240 1.00 0.00 H new ATOM 1081 N GLY A 70 -1.995 -0.728 -9.648 1.00 0.00 N ATOM 1082 CA GLY A 70 -2.646 0.259 -8.791 1.00 0.00 C ATOM 1083 C GLY A 70 -2.961 -0.316 -7.417 1.00 0.00 C ATOM 1084 O GLY A 70 -3.227 0.422 -6.468 1.00 0.00 O ATOM 0 H GLY A 70 -0.976 -0.677 -9.648 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.000 1.130 -8.683 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -3.567 0.601 -9.263 1.00 0.00 H new ATOM 1088 N ASP A 71 -2.944 -1.634 -7.319 1.00 0.00 N ATOM 1089 CA ASP A 71 -3.243 -2.296 -6.058 1.00 0.00 C ATOM 1090 C ASP A 71 -2.459 -1.666 -4.913 1.00 0.00 C ATOM 1091 O ASP A 71 -1.673 -0.739 -5.118 1.00 0.00 O ATOM 1092 CB ASP A 71 -2.878 -3.773 -6.155 1.00 0.00 C ATOM 1093 CG ASP A 71 -1.364 -3.932 -6.072 1.00 0.00 C ATOM 1094 OD1 ASP A 71 -0.791 -3.462 -5.103 1.00 0.00 O ATOM 1095 OD2 ASP A 71 -0.799 -4.523 -6.977 1.00 0.00 O ATOM 0 H ASP A 71 -2.728 -2.265 -8.091 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.309 -2.184 -5.859 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.357 -4.330 -5.350 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.247 -4.188 -7.093 1.00 0.00 H new ATOM 1100 N LEU A 72 -2.670 -2.188 -3.710 1.00 0.00 N ATOM 1101 CA LEU A 72 -1.973 -1.689 -2.534 1.00 0.00 C ATOM 1102 C LEU A 72 -1.548 -2.850 -1.648 1.00 0.00 C ATOM 1103 O LEU A 72 -2.302 -3.807 -1.458 1.00 0.00 O ATOM 1104 CB LEU A 72 -2.873 -0.738 -1.740 1.00 0.00 C ATOM 1105 CG LEU A 72 -2.060 -0.088 -0.621 1.00 0.00 C ATOM 1106 CD1 LEU A 72 -1.311 1.125 -1.172 1.00 0.00 C ATOM 1107 CD2 LEU A 72 -3.001 0.361 0.501 1.00 0.00 C ATOM 0 H LEU A 72 -3.317 -2.955 -3.525 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.088 -1.144 -2.863 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -3.283 0.027 -2.399 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.718 -1.284 -1.321 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.344 -0.810 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.731 1.588 -0.374 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.640 0.807 -1.970 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.027 1.846 -1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.421 0.824 1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.718 1.082 0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.535 -0.503 0.896 1.00 0.00 H new ATOM 1119 N ILE A 73 -0.336 -2.760 -1.113 1.00 0.00 N ATOM 1120 CA ILE A 73 0.186 -3.816 -0.257 1.00 0.00 C ATOM 1121 C ILE A 73 0.596 -3.255 1.095 1.00 0.00 C ATOM 1122 O ILE A 73 1.399 -2.328 1.199 1.00 0.00 O ATOM 1123 CB ILE A 73 1.353 -4.559 -0.940 1.00 0.00 C ATOM 1124 CG1 ILE A 73 2.536 -4.777 0.021 1.00 0.00 C ATOM 1125 CG2 ILE A 73 1.802 -3.780 -2.153 1.00 0.00 C ATOM 1126 CD1 ILE A 73 2.129 -5.781 1.100 1.00 0.00 C ATOM 0 H ILE A 73 0.298 -1.974 -1.255 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.608 -4.544 -0.089 1.00 0.00 H new ATOM 0 HB ILE A 73 0.997 -5.544 -1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.402 -5.146 -0.528 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.827 -3.832 0.478 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.627 -4.303 -2.637 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.972 -3.686 -2.853 1.00 0.00 H new ATOM 0 HG23 ILE A 73 2.132 -2.788 -1.846 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.963 -5.939 1.783 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.274 -5.393 1.654 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.859 -6.728 0.633 1.00 0.00 H new ATOM 1138 N GLY A 74 0.010 -3.832 2.120 1.00 0.00 N ATOM 1139 CA GLY A 74 0.271 -3.420 3.494 1.00 0.00 C ATOM 1140 C GLY A 74 -1.022 -3.396 4.304 1.00 0.00 C ATOM 1141 O GLY A 74 -2.107 -3.234 3.747 1.00 0.00 O ATOM 0 H GLY A 74 -0.659 -4.597 2.033 1.00 0.00 H new ATOM 0 HA2 GLY A 74 0.983 -4.105 3.955 1.00 0.00 H new ATOM 0 HA3 GLY A 74 0.729 -2.431 3.502 1.00 0.00 H new ATOM 1145 N SER A 75 -0.901 -3.559 5.619 1.00 0.00 N ATOM 1146 CA SER A 75 -2.074 -3.556 6.489 1.00 0.00 C ATOM 1147 C SER A 75 -2.556 -2.127 6.733 1.00 0.00 C ATOM 1148 O SER A 75 -1.759 -1.188 6.755 1.00 0.00 O ATOM 1149 CB SER A 75 -1.734 -4.218 7.828 1.00 0.00 C ATOM 1150 OG SER A 75 -0.339 -4.486 7.878 1.00 0.00 O ATOM 0 H SER A 75 -0.013 -3.693 6.102 1.00 0.00 H new ATOM 0 HA SER A 75 -2.869 -4.117 5.998 1.00 0.00 H new ATOM 0 HB2 SER A 75 -2.020 -3.565 8.653 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.298 -5.143 7.943 1.00 0.00 H new ATOM 0 HG SER A 75 -0.144 -5.302 7.372 1.00 0.00 H new ATOM 1156 N ASP A 76 -3.865 -1.970 6.908 1.00 0.00 N ATOM 1157 CA ASP A 76 -4.448 -0.652 7.143 1.00 0.00 C ATOM 1158 C ASP A 76 -4.077 -0.128 8.526 1.00 0.00 C ATOM 1159 O ASP A 76 -3.228 -0.700 9.211 1.00 0.00 O ATOM 1160 CB ASP A 76 -5.970 -0.721 7.017 1.00 0.00 C ATOM 1161 CG ASP A 76 -6.513 0.623 6.540 1.00 0.00 C ATOM 1162 OD1 ASP A 76 -6.248 0.976 5.404 1.00 0.00 O ATOM 1163 OD2 ASP A 76 -7.184 1.278 7.320 1.00 0.00 O ATOM 0 H ASP A 76 -4.540 -2.735 6.892 1.00 0.00 H new ATOM 0 HA ASP A 76 -4.049 0.031 6.393 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.250 -1.506 6.315 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.412 -0.981 7.979 1.00 0.00 H new ATOM 1168 N SER A 77 -4.720 0.964 8.926 1.00 0.00 N ATOM 1169 CA SER A 77 -4.456 1.568 10.228 1.00 0.00 C ATOM 1170 C SER A 77 -3.077 2.217 10.251 1.00 0.00 C ATOM 1171 O SER A 77 -2.352 2.123 11.242 1.00 0.00 O ATOM 1172 CB SER A 77 -4.538 0.504 11.322 1.00 0.00 C ATOM 1173 OG SER A 77 -3.226 0.067 11.650 1.00 0.00 O ATOM 0 H SER A 77 -5.425 1.448 8.370 1.00 0.00 H new ATOM 0 HA SER A 77 -5.208 2.336 10.409 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.030 0.911 12.205 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.140 -0.338 10.982 1.00 0.00 H new ATOM 0 HG SER A 77 -2.838 -0.407 10.885 1.00 0.00 H new ATOM 1179 N LEU A 78 -2.722 2.882 9.156 1.00 0.00 N ATOM 1180 CA LEU A 78 -1.429 3.549 9.065 1.00 0.00 C ATOM 1181 C LEU A 78 -1.289 4.587 10.174 1.00 0.00 C ATOM 1182 O LEU A 78 -0.220 5.167 10.367 1.00 0.00 O ATOM 1183 CB LEU A 78 -1.286 4.231 7.701 1.00 0.00 C ATOM 1184 CG LEU A 78 -0.223 3.507 6.871 1.00 0.00 C ATOM 1185 CD1 LEU A 78 -0.778 2.166 6.383 1.00 0.00 C ATOM 1186 CD2 LEU A 78 0.161 4.370 5.666 1.00 0.00 C ATOM 0 H LEU A 78 -3.307 2.973 8.325 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.644 2.801 9.178 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.241 4.220 7.176 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.008 5.276 7.834 1.00 0.00 H new ATOM 0 HG LEU A 78 0.659 3.331 7.487 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.020 1.652 5.792 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.049 1.550 7.241 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.661 2.340 5.768 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.918 3.854 5.075 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.721 4.548 5.050 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.559 5.323 6.013 1.00 0.00 H new ATOM 1198 N THR A 79 -2.379 4.816 10.900 1.00 0.00 N ATOM 1199 CA THR A 79 -2.375 5.786 11.989 1.00 0.00 C ATOM 1200 C THR A 79 -1.625 5.235 13.198 1.00 0.00 C ATOM 1201 O THR A 79 -0.694 5.864 13.702 1.00 0.00 O ATOM 1202 CB THR A 79 -3.812 6.124 12.390 1.00 0.00 C ATOM 1203 OG1 THR A 79 -4.655 6.019 11.251 1.00 0.00 O ATOM 1204 CG2 THR A 79 -3.871 7.548 12.942 1.00 0.00 C ATOM 0 H THR A 79 -3.272 4.345 10.755 1.00 0.00 H new ATOM 0 HA THR A 79 -1.870 6.688 11.644 1.00 0.00 H new ATOM 0 HB THR A 79 -4.148 5.428 13.158 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.200 6.830 11.171 1.00 0.00 H new ATOM 0 HG21 THR A 79 -4.896 7.786 13.227 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.224 7.627 13.816 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.535 8.249 12.178 1.00 0.00 H new ATOM 1212 N LYS A 80 -2.038 4.060 13.658 1.00 0.00 N ATOM 1213 CA LYS A 80 -1.399 3.434 14.810 1.00 0.00 C ATOM 1214 C LYS A 80 -0.107 2.740 14.394 1.00 0.00 C ATOM 1215 O LYS A 80 0.696 2.346 15.239 1.00 0.00 O ATOM 1216 CB LYS A 80 -2.349 2.414 15.441 1.00 0.00 C ATOM 1217 CG LYS A 80 -2.567 1.252 14.470 1.00 0.00 C ATOM 1218 CD LYS A 80 -3.907 0.580 14.771 1.00 0.00 C ATOM 1219 CE LYS A 80 -3.905 0.057 16.209 1.00 0.00 C ATOM 1220 NZ LYS A 80 -4.311 1.151 17.136 1.00 0.00 N ATOM 0 H LYS A 80 -2.807 3.524 13.255 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.162 4.210 15.538 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.933 2.045 16.379 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -3.302 2.887 15.679 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.553 1.615 13.442 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -1.757 0.529 14.563 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -4.721 1.291 14.633 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.079 -0.241 14.075 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -4.590 -0.786 16.302 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.913 -0.308 16.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.922 0.764 17.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.464 1.574 17.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.831 1.879 16.607 1.00 0.00 H new ATOM 1234 N GLU A 81 0.082 2.601 13.083 1.00 0.00 N ATOM 1235 CA GLU A 81 1.278 1.956 12.544 1.00 0.00 C ATOM 1236 C GLU A 81 1.943 1.068 13.591 1.00 0.00 C ATOM 1237 O GLU A 81 2.662 1.551 14.465 1.00 0.00 O ATOM 1238 CB GLU A 81 2.272 3.019 12.072 1.00 0.00 C ATOM 1239 CG GLU A 81 3.520 2.338 11.508 1.00 0.00 C ATOM 1240 CD GLU A 81 4.685 2.496 12.480 1.00 0.00 C ATOM 1241 OE1 GLU A 81 4.791 1.684 13.385 1.00 0.00 O ATOM 1242 OE2 GLU A 81 5.454 3.427 12.306 1.00 0.00 O ATOM 0 H GLU A 81 -0.577 2.926 12.375 1.00 0.00 H new ATOM 0 HA GLU A 81 0.977 1.332 11.703 1.00 0.00 H new ATOM 0 HB2 GLU A 81 1.813 3.648 11.310 1.00 0.00 H new ATOM 0 HB3 GLU A 81 2.544 3.671 12.902 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.321 1.280 11.335 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.778 2.775 10.544 1.00 0.00 H new ATOM 1249 N GLN A 82 1.699 -0.235 13.493 1.00 0.00 N ATOM 1250 CA GLN A 82 2.280 -1.188 14.431 1.00 0.00 C ATOM 1251 C GLN A 82 3.276 -2.096 13.714 1.00 0.00 C ATOM 1252 O GLN A 82 3.385 -2.065 12.489 1.00 0.00 O ATOM 1253 CB GLN A 82 1.176 -2.038 15.067 1.00 0.00 C ATOM 1254 CG GLN A 82 1.025 -1.680 16.543 1.00 0.00 C ATOM 1255 CD GLN A 82 0.958 -0.167 16.720 1.00 0.00 C ATOM 1256 OE1 GLN A 82 -0.112 0.480 16.343 1.00 0.00 O flip ATOM 1257 NE2 GLN A 82 1.904 0.444 17.217 1.00 0.00 N flip ATOM 0 H GLN A 82 1.106 -0.653 12.777 1.00 0.00 H new ATOM 0 HA GLN A 82 2.802 -0.634 15.211 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.233 -1.873 14.546 1.00 0.00 H new ATOM 0 HB3 GLN A 82 1.416 -3.096 14.964 1.00 0.00 H new ATOM 0 HG2 GLN A 82 0.122 -2.140 16.944 1.00 0.00 H new ATOM 0 HG3 GLN A 82 1.866 -2.082 17.109 1.00 0.00 H new ATOM 0 HE21 GLN A 82 2.740 -0.062 17.511 1.00 0.00 H new ATOM 0 HE22 GLN A 82 1.852 1.456 17.335 1.00 0.00 H new ATOM 1266 N VAL A 83 3.998 -2.903 14.484 1.00 0.00 N ATOM 1267 CA VAL A 83 4.979 -3.814 13.905 1.00 0.00 C ATOM 1268 C VAL A 83 4.284 -4.959 13.179 1.00 0.00 C ATOM 1269 O VAL A 83 3.710 -5.849 13.806 1.00 0.00 O ATOM 1270 CB VAL A 83 5.886 -4.375 14.999 1.00 0.00 C ATOM 1271 CG1 VAL A 83 5.032 -4.751 16.204 1.00 0.00 C ATOM 1272 CG2 VAL A 83 6.609 -5.617 14.474 1.00 0.00 C ATOM 0 H VAL A 83 3.924 -2.945 15.500 1.00 0.00 H new ATOM 0 HA VAL A 83 5.582 -3.257 13.188 1.00 0.00 H new ATOM 0 HB VAL A 83 6.624 -3.627 15.290 1.00 0.00 H new ATOM 0 HG11 VAL A 83 5.670 -5.153 16.991 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.514 -3.866 16.573 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.300 -5.504 15.911 1.00 0.00 H new ATOM 0 HG21 VAL A 83 7.256 -6.018 15.254 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.876 -6.371 14.188 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.211 -5.348 13.606 1.00 0.00 H new ATOM 1282 N ILE A 84 4.334 -4.927 11.851 1.00 0.00 N ATOM 1283 CA ILE A 84 3.701 -5.964 11.047 1.00 0.00 C ATOM 1284 C ILE A 84 4.736 -6.716 10.224 1.00 0.00 C ATOM 1285 O ILE A 84 5.545 -6.112 9.522 1.00 0.00 O ATOM 1286 CB ILE A 84 2.667 -5.339 10.110 1.00 0.00 C ATOM 1287 CG1 ILE A 84 1.637 -4.557 10.933 1.00 0.00 C ATOM 1288 CG2 ILE A 84 1.958 -6.442 9.322 1.00 0.00 C ATOM 1289 CD1 ILE A 84 1.733 -3.069 10.591 1.00 0.00 C ATOM 0 H ILE A 84 4.803 -4.199 11.313 1.00 0.00 H new ATOM 0 HA ILE A 84 3.210 -6.665 11.721 1.00 0.00 H new ATOM 0 HB ILE A 84 3.168 -4.663 9.417 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.633 -4.925 10.723 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.816 -4.709 11.998 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.221 -5.996 8.654 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.690 -6.998 8.736 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.458 -7.119 10.014 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.001 -2.513 11.176 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.734 -2.706 10.824 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.533 -2.926 9.529 1.00 0.00 H new ATOM 1301 N LYS A 85 4.693 -8.039 10.306 1.00 0.00 N ATOM 1302 CA LYS A 85 5.621 -8.870 9.552 1.00 0.00 C ATOM 1303 C LYS A 85 4.845 -9.828 8.660 1.00 0.00 C ATOM 1304 O LYS A 85 3.890 -10.464 9.102 1.00 0.00 O ATOM 1305 CB LYS A 85 6.528 -9.659 10.502 1.00 0.00 C ATOM 1306 CG LYS A 85 5.910 -9.693 11.896 1.00 0.00 C ATOM 1307 CD LYS A 85 6.632 -10.737 12.749 1.00 0.00 C ATOM 1308 CE LYS A 85 5.946 -10.852 14.109 1.00 0.00 C ATOM 1309 NZ LYS A 85 4.580 -10.261 14.030 1.00 0.00 N ATOM 0 H LYS A 85 4.030 -8.557 10.883 1.00 0.00 H new ATOM 0 HA LYS A 85 6.245 -8.226 8.932 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.665 -10.674 10.130 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.515 -9.199 10.543 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.986 -8.711 12.363 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.849 -9.933 11.829 1.00 0.00 H new ATOM 0 HD2 LYS A 85 6.624 -11.703 12.244 1.00 0.00 H new ATOM 0 HD3 LYS A 85 7.677 -10.455 12.880 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.884 -11.898 14.409 1.00 0.00 H new ATOM 0 HE3 LYS A 85 6.533 -10.336 14.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.047 -10.502 14.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.653 -9.227 13.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.085 -10.641 13.198 1.00 0.00 H new ATOM 1323 N THR A 86 5.250 -9.921 7.399 1.00 0.00 N ATOM 1324 CA THR A 86 4.563 -10.801 6.460 1.00 0.00 C ATOM 1325 C THR A 86 4.932 -12.255 6.728 1.00 0.00 C ATOM 1326 O THR A 86 6.090 -12.650 6.594 1.00 0.00 O ATOM 1327 CB THR A 86 4.916 -10.417 5.017 1.00 0.00 C ATOM 1328 OG1 THR A 86 4.822 -9.006 4.872 1.00 0.00 O ATOM 1329 CG2 THR A 86 3.935 -11.094 4.058 1.00 0.00 C ATOM 0 H THR A 86 6.039 -9.407 7.007 1.00 0.00 H new ATOM 0 HA THR A 86 3.488 -10.686 6.598 1.00 0.00 H new ATOM 0 HB THR A 86 5.931 -10.742 4.788 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.048 -8.756 3.952 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.184 -10.823 3.032 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.001 -12.176 4.174 1.00 0.00 H new ATOM 0 HG23 THR A 86 2.920 -10.766 4.284 1.00 0.00 H new ATOM 1337 N ASN A 87 3.933 -13.043 7.123 1.00 0.00 N ATOM 1338 CA ASN A 87 4.145 -14.454 7.432 1.00 0.00 C ATOM 1339 C ASN A 87 4.130 -15.306 6.164 1.00 0.00 C ATOM 1340 O ASN A 87 4.578 -16.452 6.172 1.00 0.00 O ATOM 1341 CB ASN A 87 3.054 -14.938 8.391 1.00 0.00 C ATOM 1342 CG ASN A 87 3.653 -15.870 9.438 1.00 0.00 C ATOM 1343 OD1 ASN A 87 3.402 -17.076 9.414 1.00 0.00 O ATOM 1344 ND2 ASN A 87 4.434 -15.382 10.364 1.00 0.00 N ATOM 0 H ASN A 87 2.970 -12.727 7.236 1.00 0.00 H new ATOM 0 HA ASN A 87 5.124 -14.559 7.900 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.583 -14.085 8.879 1.00 0.00 H new ATOM 0 HB3 ASN A 87 2.274 -15.457 7.834 1.00 0.00 H new ATOM 0 HD21 ASN A 87 4.837 -16.000 11.069 1.00 0.00 H new ATOM 0 HD22 ASN A 87 4.641 -14.383 10.383 1.00 0.00 H new ATOM 1351 N ALA A 88 3.615 -14.741 5.079 1.00 0.00 N ATOM 1352 CA ALA A 88 3.549 -15.456 3.809 1.00 0.00 C ATOM 1353 C ALA A 88 4.774 -15.136 2.959 1.00 0.00 C ATOM 1354 O ALA A 88 5.717 -14.517 3.435 1.00 0.00 O ATOM 1355 CB ALA A 88 2.279 -15.065 3.047 1.00 0.00 C ATOM 0 H ALA A 88 3.238 -13.794 5.052 1.00 0.00 H new ATOM 0 HA ALA A 88 3.527 -16.526 4.016 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.241 -15.605 2.101 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.403 -15.319 3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.287 -13.993 2.852 1.00 0.00 H new ATOM 1361 N ASN A 89 4.751 -15.557 1.700 1.00 0.00 N ATOM 1362 CA ASN A 89 5.864 -15.285 0.796 1.00 0.00 C ATOM 1363 C ASN A 89 5.359 -14.425 -0.353 1.00 0.00 C ATOM 1364 O ASN A 89 4.309 -14.708 -0.909 1.00 0.00 O ATOM 1365 CB ASN A 89 6.433 -16.596 0.244 1.00 0.00 C ATOM 1366 CG ASN A 89 7.900 -16.734 0.634 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.208 -17.095 1.770 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.827 -16.470 -0.247 1.00 0.00 N ATOM 0 H ASN A 89 3.982 -16.083 1.284 1.00 0.00 H new ATOM 0 HA ASN A 89 6.654 -14.764 1.338 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.864 -17.441 0.632 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.333 -16.617 -0.841 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.811 -16.563 0.005 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.567 -16.171 -1.187 1.00 0.00 H new ATOM 1375 N VAL A 90 6.090 -13.378 -0.716 1.00 0.00 N ATOM 1376 CA VAL A 90 5.658 -12.532 -1.789 1.00 0.00 C ATOM 1377 C VAL A 90 6.420 -12.869 -3.047 1.00 0.00 C ATOM 1378 O VAL A 90 7.650 -12.922 -3.034 1.00 0.00 O ATOM 1379 CB VAL A 90 5.904 -11.087 -1.431 1.00 0.00 C ATOM 1380 CG1 VAL A 90 5.809 -10.275 -2.697 1.00 0.00 C ATOM 1381 CG2 VAL A 90 4.871 -10.604 -0.420 1.00 0.00 C ATOM 0 H VAL A 90 6.972 -13.108 -0.281 1.00 0.00 H new ATOM 0 HA VAL A 90 4.593 -12.690 -1.956 1.00 0.00 H new ATOM 0 HB VAL A 90 6.890 -10.976 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.983 -9.223 -2.469 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.559 -10.621 -3.408 1.00 0.00 H new ATOM 0 HG13 VAL A 90 4.816 -10.393 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.064 -9.560 -0.173 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.873 -10.698 -0.847 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.937 -11.209 0.485 1.00 0.00 H new ATOM 1391 N LYS A 91 5.679 -13.080 -4.125 1.00 0.00 N ATOM 1392 CA LYS A 91 6.286 -13.402 -5.404 1.00 0.00 C ATOM 1393 C LYS A 91 5.560 -12.684 -6.532 1.00 0.00 C ATOM 1394 O LYS A 91 4.373 -12.910 -6.765 1.00 0.00 O ATOM 1395 CB LYS A 91 6.230 -14.912 -5.642 1.00 0.00 C ATOM 1396 CG LYS A 91 7.145 -15.278 -6.812 1.00 0.00 C ATOM 1397 CD LYS A 91 6.826 -16.697 -7.286 1.00 0.00 C ATOM 1398 CE LYS A 91 5.465 -16.708 -7.985 1.00 0.00 C ATOM 1399 NZ LYS A 91 5.548 -17.538 -9.219 1.00 0.00 N ATOM 0 H LYS A 91 4.660 -13.034 -4.138 1.00 0.00 H new ATOM 0 HA LYS A 91 7.326 -13.075 -5.386 1.00 0.00 H new ATOM 0 HB2 LYS A 91 6.541 -15.444 -4.743 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.207 -15.219 -5.857 1.00 0.00 H new ATOM 0 HG2 LYS A 91 7.008 -14.571 -7.630 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.189 -15.212 -6.505 1.00 0.00 H new ATOM 0 HD2 LYS A 91 7.600 -17.046 -7.969 1.00 0.00 H new ATOM 0 HD3 LYS A 91 6.817 -17.382 -6.438 1.00 0.00 H new ATOM 0 HE2 LYS A 91 4.703 -17.108 -7.315 1.00 0.00 H new ATOM 0 HE3 LYS A 91 5.165 -15.691 -8.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.675 -16.920 -10.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 6.356 -18.189 -9.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.671 -18.086 -9.328 1.00 0.00 H new ATOM 1413 N ALA A 92 6.287 -11.826 -7.239 1.00 0.00 N ATOM 1414 CA ALA A 92 5.707 -11.093 -8.349 1.00 0.00 C ATOM 1415 C ALA A 92 5.435 -12.050 -9.498 1.00 0.00 C ATOM 1416 O ALA A 92 6.352 -12.721 -9.979 1.00 0.00 O ATOM 1417 CB ALA A 92 6.660 -9.991 -8.811 1.00 0.00 C ATOM 0 H ALA A 92 7.271 -11.625 -7.062 1.00 0.00 H new ATOM 0 HA ALA A 92 4.773 -10.635 -8.024 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.213 -9.449 -9.644 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.846 -9.302 -7.987 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.602 -10.436 -9.131 1.00 0.00 H new ATOM 1423 N LEU A 93 4.175 -12.109 -9.922 1.00 0.00 N ATOM 1424 CA LEU A 93 3.773 -12.991 -11.007 1.00 0.00 C ATOM 1425 C LEU A 93 4.288 -12.454 -12.337 1.00 0.00 C ATOM 1426 O LEU A 93 4.884 -13.184 -13.130 1.00 0.00 O ATOM 1427 CB LEU A 93 2.245 -13.079 -11.052 1.00 0.00 C ATOM 1428 CG LEU A 93 1.788 -14.477 -10.630 1.00 0.00 C ATOM 1429 CD1 LEU A 93 2.484 -14.878 -9.327 1.00 0.00 C ATOM 1430 CD2 LEU A 93 0.275 -14.465 -10.413 1.00 0.00 C ATOM 0 H LEU A 93 3.416 -11.554 -9.528 1.00 0.00 H new ATOM 0 HA LEU A 93 4.195 -13.981 -10.835 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.810 -12.330 -10.390 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.889 -12.860 -12.059 1.00 0.00 H new ATOM 0 HG LEU A 93 2.045 -15.194 -11.410 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.155 -15.874 -9.031 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.564 -14.882 -9.477 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.229 -14.164 -8.544 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.057 -15.459 -10.112 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.025 -13.747 -9.632 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.223 -14.181 -11.340 1.00 0.00 H new ATOM 1442 N THR A 94 4.062 -11.166 -12.559 1.00 0.00 N ATOM 1443 CA THR A 94 4.510 -10.511 -13.779 1.00 0.00 C ATOM 1444 C THR A 94 5.334 -9.283 -13.419 1.00 0.00 C ATOM 1445 O THR A 94 5.074 -8.632 -12.404 1.00 0.00 O ATOM 1446 CB THR A 94 3.306 -10.093 -14.627 1.00 0.00 C ATOM 1447 OG1 THR A 94 2.385 -9.380 -13.815 1.00 0.00 O ATOM 1448 CG2 THR A 94 2.626 -11.336 -15.203 1.00 0.00 C ATOM 0 H THR A 94 3.570 -10.554 -11.908 1.00 0.00 H new ATOM 0 HA THR A 94 5.121 -11.207 -14.354 1.00 0.00 H new ATOM 0 HB THR A 94 3.641 -9.456 -15.445 1.00 0.00 H new ATOM 0 HG1 THR A 94 1.490 -9.766 -13.918 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.769 -11.036 -15.806 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.334 -11.883 -15.826 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.289 -11.977 -14.388 1.00 0.00 H new ATOM 1456 N TYR A 95 6.325 -8.969 -14.247 1.00 0.00 N ATOM 1457 CA TYR A 95 7.178 -7.818 -13.981 1.00 0.00 C ATOM 1458 C TYR A 95 6.325 -6.620 -13.601 1.00 0.00 C ATOM 1459 O TYR A 95 5.493 -6.160 -14.383 1.00 0.00 O ATOM 1460 CB TYR A 95 8.008 -7.484 -15.221 1.00 0.00 C ATOM 1461 CG TYR A 95 7.629 -8.418 -16.344 1.00 0.00 C ATOM 1462 CD1 TYR A 95 6.288 -8.547 -16.722 1.00 0.00 C ATOM 1463 CD2 TYR A 95 8.618 -9.155 -17.006 1.00 0.00 C ATOM 1464 CE1 TYR A 95 5.935 -9.413 -17.764 1.00 0.00 C ATOM 1465 CE2 TYR A 95 8.265 -10.022 -18.048 1.00 0.00 C ATOM 1466 CZ TYR A 95 6.923 -10.151 -18.426 1.00 0.00 C ATOM 1467 OH TYR A 95 6.576 -11.007 -19.451 1.00 0.00 O ATOM 0 H TYR A 95 6.555 -9.487 -15.095 1.00 0.00 H new ATOM 0 HA TYR A 95 7.848 -8.059 -13.156 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.836 -6.450 -15.520 1.00 0.00 H new ATOM 0 HB3 TYR A 95 9.071 -7.579 -14.997 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.525 -7.979 -16.210 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.653 -9.055 -16.713 1.00 0.00 H new ATOM 0 HE1 TYR A 95 4.900 -9.512 -18.057 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.027 -10.591 -18.560 1.00 0.00 H new ATOM 0 HH TYR A 95 7.382 -11.440 -19.802 1.00 0.00 H new ATOM 1477 N CYS A 96 6.527 -6.129 -12.384 1.00 0.00 N ATOM 1478 CA CYS A 96 5.757 -4.996 -11.901 1.00 0.00 C ATOM 1479 C CYS A 96 6.642 -4.002 -11.163 1.00 0.00 C ATOM 1480 O CYS A 96 7.600 -4.382 -10.486 1.00 0.00 O ATOM 1481 CB CYS A 96 4.661 -5.486 -10.956 1.00 0.00 C ATOM 1482 SG CYS A 96 5.346 -5.698 -9.295 1.00 0.00 S ATOM 0 H CYS A 96 7.211 -6.495 -11.722 1.00 0.00 H new ATOM 0 HA CYS A 96 5.316 -4.496 -12.763 1.00 0.00 H new ATOM 0 HB2 CYS A 96 3.839 -4.770 -10.933 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.252 -6.430 -11.315 1.00 0.00 H new ATOM 0 HG CYS A 96 6.539 -5.184 -9.249 1.00 0.00 H new ATOM 1488 N ASP A 97 6.292 -2.730 -11.281 1.00 0.00 N ATOM 1489 CA ASP A 97 7.033 -1.678 -10.604 1.00 0.00 C ATOM 1490 C ASP A 97 6.340 -1.359 -9.288 1.00 0.00 C ATOM 1491 O ASP A 97 5.133 -1.119 -9.260 1.00 0.00 O ATOM 1492 CB ASP A 97 7.093 -0.425 -11.479 1.00 0.00 C ATOM 1493 CG ASP A 97 7.687 0.736 -10.687 1.00 0.00 C ATOM 1494 OD1 ASP A 97 8.902 0.810 -10.605 1.00 0.00 O ATOM 1495 OD2 ASP A 97 6.918 1.532 -10.175 1.00 0.00 O ATOM 0 H ASP A 97 5.502 -2.403 -11.837 1.00 0.00 H new ATOM 0 HA ASP A 97 8.052 -2.014 -10.414 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.698 -0.619 -12.365 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.093 -0.165 -11.826 1.00 0.00 H new ATOM 1500 N LEU A 98 7.094 -1.377 -8.199 1.00 0.00 N ATOM 1501 CA LEU A 98 6.507 -1.108 -6.895 1.00 0.00 C ATOM 1502 C LEU A 98 7.033 0.185 -6.292 1.00 0.00 C ATOM 1503 O LEU A 98 8.240 0.400 -6.195 1.00 0.00 O ATOM 1504 CB LEU A 98 6.810 -2.260 -5.937 1.00 0.00 C ATOM 1505 CG LEU A 98 5.647 -3.254 -5.929 1.00 0.00 C ATOM 1506 CD1 LEU A 98 6.206 -4.671 -5.947 1.00 0.00 C ATOM 1507 CD2 LEU A 98 4.806 -3.049 -4.667 1.00 0.00 C ATOM 0 H LEU A 98 8.095 -1.571 -8.190 1.00 0.00 H new ATOM 0 HA LEU A 98 5.431 -1.008 -7.039 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.728 -2.764 -6.240 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.976 -1.874 -4.931 1.00 0.00 H new ATOM 0 HG LEU A 98 5.020 -3.095 -6.806 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.384 -5.387 -5.941 1.00 0.00 H new ATOM 0 HD12 LEU A 98 6.806 -4.814 -6.846 1.00 0.00 H new ATOM 0 HD13 LEU A 98 6.829 -4.828 -5.067 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.978 -3.758 -4.663 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.427 -3.211 -3.786 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.413 -2.032 -4.653 1.00 0.00 H new ATOM 1519 N GLN A 99 6.111 1.027 -5.855 1.00 0.00 N ATOM 1520 CA GLN A 99 6.476 2.279 -5.220 1.00 0.00 C ATOM 1521 C GLN A 99 6.099 2.199 -3.750 1.00 0.00 C ATOM 1522 O GLN A 99 4.996 1.774 -3.410 1.00 0.00 O ATOM 1523 CB GLN A 99 5.744 3.446 -5.889 1.00 0.00 C ATOM 1524 CG GLN A 99 5.967 3.390 -7.400 1.00 0.00 C ATOM 1525 CD GLN A 99 7.434 3.654 -7.717 1.00 0.00 C ATOM 1526 OE1 GLN A 99 8.191 2.721 -7.985 1.00 0.00 O ATOM 1527 NE2 GLN A 99 7.884 4.878 -7.701 1.00 0.00 N ATOM 0 H GLN A 99 5.107 0.865 -5.929 1.00 0.00 H new ATOM 0 HA GLN A 99 7.548 2.448 -5.322 1.00 0.00 H new ATOM 0 HB2 GLN A 99 4.678 3.396 -5.666 1.00 0.00 H new ATOM 0 HB3 GLN A 99 6.109 4.393 -5.492 1.00 0.00 H new ATOM 0 HG2 GLN A 99 5.673 2.413 -7.784 1.00 0.00 H new ATOM 0 HG3 GLN A 99 5.340 4.130 -7.897 1.00 0.00 H new ATOM 0 HE21 GLN A 99 7.255 5.650 -7.479 1.00 0.00 H new ATOM 0 HE22 GLN A 99 8.865 5.064 -7.911 1.00 0.00 H new ATOM 1536 N TYR A 100 7.011 2.593 -2.877 1.00 0.00 N ATOM 1537 CA TYR A 100 6.742 2.535 -1.452 1.00 0.00 C ATOM 1538 C TYR A 100 7.622 3.519 -0.696 1.00 0.00 C ATOM 1539 O TYR A 100 8.568 4.083 -1.250 1.00 0.00 O ATOM 1540 CB TYR A 100 6.939 1.104 -0.923 1.00 0.00 C ATOM 1541 CG TYR A 100 8.408 0.747 -0.818 1.00 0.00 C ATOM 1542 CD1 TYR A 100 9.375 1.407 -1.588 1.00 0.00 C ATOM 1543 CD2 TYR A 100 8.797 -0.270 0.058 1.00 0.00 C ATOM 1544 CE1 TYR A 100 10.724 1.046 -1.474 1.00 0.00 C ATOM 1545 CE2 TYR A 100 10.141 -0.630 0.168 1.00 0.00 C ATOM 1546 CZ TYR A 100 11.106 0.027 -0.597 1.00 0.00 C ATOM 1547 OH TYR A 100 12.434 -0.328 -0.487 1.00 0.00 O ATOM 0 H TYR A 100 7.933 2.952 -3.126 1.00 0.00 H new ATOM 0 HA TYR A 100 5.702 2.819 -1.288 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.470 1.009 0.056 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.439 0.398 -1.586 1.00 0.00 H new ATOM 0 HD1 TYR A 100 9.081 2.193 -2.268 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.054 -0.780 0.653 1.00 0.00 H new ATOM 0 HE1 TYR A 100 11.470 1.556 -2.065 1.00 0.00 H new ATOM 0 HE2 TYR A 100 10.435 -1.418 0.846 1.00 0.00 H new ATOM 0 HH TYR A 100 12.526 -1.052 0.167 1.00 0.00 H new ATOM 1557 N ILE A 101 7.283 3.744 0.564 1.00 0.00 N ATOM 1558 CA ILE A 101 8.026 4.683 1.388 1.00 0.00 C ATOM 1559 C ILE A 101 7.910 4.295 2.856 1.00 0.00 C ATOM 1560 O ILE A 101 6.959 3.625 3.258 1.00 0.00 O ATOM 1561 CB ILE A 101 7.488 6.104 1.135 1.00 0.00 C ATOM 1562 CG1 ILE A 101 7.138 6.825 2.440 1.00 0.00 C ATOM 1563 CG2 ILE A 101 6.221 5.988 0.303 1.00 0.00 C ATOM 1564 CD1 ILE A 101 5.773 6.338 2.913 1.00 0.00 C ATOM 0 H ILE A 101 6.501 3.291 1.036 1.00 0.00 H new ATOM 0 HA ILE A 101 9.084 4.658 1.125 1.00 0.00 H new ATOM 0 HB ILE A 101 8.262 6.678 0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.895 6.624 3.198 1.00 0.00 H new ATOM 0 HG13 ILE A 101 7.122 7.904 2.284 1.00 0.00 H new ATOM 0 HG21 ILE A 101 5.820 6.983 0.110 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.451 5.500 -0.644 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.482 5.398 0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.509 6.842 3.842 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.024 6.561 2.153 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.809 5.262 3.082 1.00 0.00 H new ATOM 1576 N SER A 102 8.874 4.725 3.657 1.00 0.00 N ATOM 1577 CA SER A 102 8.841 4.421 5.075 1.00 0.00 C ATOM 1578 C SER A 102 7.804 5.298 5.765 1.00 0.00 C ATOM 1579 O SER A 102 7.829 6.523 5.639 1.00 0.00 O ATOM 1580 CB SER A 102 10.214 4.661 5.700 1.00 0.00 C ATOM 1581 OG SER A 102 10.434 6.060 5.827 1.00 0.00 O ATOM 0 H SER A 102 9.676 5.277 3.353 1.00 0.00 H new ATOM 0 HA SER A 102 8.573 3.372 5.203 1.00 0.00 H new ATOM 0 HB2 SER A 102 10.270 4.182 6.678 1.00 0.00 H new ATOM 0 HB3 SER A 102 10.992 4.214 5.081 1.00 0.00 H new ATOM 0 HG SER A 102 11.314 6.218 6.229 1.00 0.00 H new ATOM 1587 N LEU A 103 6.888 4.666 6.485 1.00 0.00 N ATOM 1588 CA LEU A 103 5.837 5.398 7.183 1.00 0.00 C ATOM 1589 C LEU A 103 6.435 6.556 7.976 1.00 0.00 C ATOM 1590 O LEU A 103 5.838 7.628 8.068 1.00 0.00 O ATOM 1591 CB LEU A 103 5.098 4.455 8.135 1.00 0.00 C ATOM 1592 CG LEU A 103 3.677 4.213 7.624 1.00 0.00 C ATOM 1593 CD1 LEU A 103 2.850 5.489 7.786 1.00 0.00 C ATOM 1594 CD2 LEU A 103 3.727 3.822 6.145 1.00 0.00 C ATOM 0 H LEU A 103 6.850 3.653 6.602 1.00 0.00 H new ATOM 0 HA LEU A 103 5.139 5.796 6.447 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.633 3.508 8.212 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.066 4.885 9.136 1.00 0.00 H new ATOM 0 HG LEU A 103 3.218 3.408 8.198 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.838 5.315 7.421 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.814 5.768 8.839 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.309 6.295 7.213 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.715 3.649 5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.187 4.626 5.571 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.315 2.911 6.029 1.00 0.00 H new ATOM 1606 N LYS A 104 7.619 6.340 8.537 1.00 0.00 N ATOM 1607 CA LYS A 104 8.286 7.386 9.304 1.00 0.00 C ATOM 1608 C LYS A 104 8.705 8.525 8.380 1.00 0.00 C ATOM 1609 O LYS A 104 8.595 9.701 8.728 1.00 0.00 O ATOM 1610 CB LYS A 104 9.521 6.823 10.007 1.00 0.00 C ATOM 1611 CG LYS A 104 9.193 5.451 10.592 1.00 0.00 C ATOM 1612 CD LYS A 104 10.196 5.115 11.698 1.00 0.00 C ATOM 1613 CE LYS A 104 10.350 3.596 11.809 1.00 0.00 C ATOM 1614 NZ LYS A 104 11.644 3.183 11.196 1.00 0.00 N ATOM 0 H LYS A 104 8.132 5.461 8.477 1.00 0.00 H new ATOM 0 HA LYS A 104 7.589 7.763 10.052 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.348 6.741 9.302 1.00 0.00 H new ATOM 0 HB3 LYS A 104 9.842 7.500 10.798 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.179 5.447 10.992 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.230 4.692 9.810 1.00 0.00 H new ATOM 0 HD2 LYS A 104 11.161 5.573 11.479 1.00 0.00 H new ATOM 0 HD3 LYS A 104 9.856 5.526 12.648 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.317 3.292 12.855 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.521 3.098 11.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 11.750 2.151 11.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 11.658 3.461 10.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 12.429 3.649 11.695 1.00 0.00 H new ATOM 1628 N GLY A 105 9.189 8.157 7.199 1.00 0.00 N ATOM 1629 CA GLY A 105 9.631 9.137 6.214 1.00 0.00 C ATOM 1630 C GLY A 105 8.477 10.008 5.741 1.00 0.00 C ATOM 1631 O GLY A 105 8.608 11.228 5.636 1.00 0.00 O ATOM 0 H GLY A 105 9.285 7.186 6.900 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.409 9.765 6.647 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.074 8.623 5.361 1.00 0.00 H new ATOM 1635 N LEU A 106 7.356 9.363 5.431 1.00 0.00 N ATOM 1636 CA LEU A 106 6.186 10.071 4.934 1.00 0.00 C ATOM 1637 C LEU A 106 5.554 10.957 5.998 1.00 0.00 C ATOM 1638 O LEU A 106 5.103 12.053 5.706 1.00 0.00 O ATOM 1639 CB LEU A 106 5.144 9.074 4.433 1.00 0.00 C ATOM 1640 CG LEU A 106 3.800 9.780 4.263 1.00 0.00 C ATOM 1641 CD1 LEU A 106 3.088 9.229 3.026 1.00 0.00 C ATOM 1642 CD2 LEU A 106 2.933 9.531 5.498 1.00 0.00 C ATOM 0 H LEU A 106 7.236 8.354 5.516 1.00 0.00 H new ATOM 0 HA LEU A 106 6.523 10.710 4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.464 8.645 3.483 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.046 8.249 5.139 1.00 0.00 H new ATOM 0 HG LEU A 106 3.966 10.851 4.143 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.129 9.732 2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.704 9.403 2.144 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.923 8.158 3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.974 10.035 5.377 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.768 8.460 5.617 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.438 9.920 6.382 1.00 0.00 H new ATOM 1654 N ARG A 107 5.488 10.470 7.222 1.00 0.00 N ATOM 1655 CA ARG A 107 4.868 11.240 8.289 1.00 0.00 C ATOM 1656 C ARG A 107 5.687 12.471 8.676 1.00 0.00 C ATOM 1657 O ARG A 107 5.133 13.464 9.135 1.00 0.00 O ATOM 1658 CB ARG A 107 4.618 10.366 9.519 1.00 0.00 C ATOM 1659 CG ARG A 107 4.078 11.230 10.659 1.00 0.00 C ATOM 1660 CD ARG A 107 2.773 11.884 10.215 1.00 0.00 C ATOM 1661 NE ARG A 107 1.735 11.674 11.217 1.00 0.00 N ATOM 1662 CZ ARG A 107 1.796 12.266 12.405 1.00 0.00 C ATOM 1663 NH1 ARG A 107 2.800 13.047 12.695 1.00 0.00 N ATOM 1664 NH2 ARG A 107 0.852 12.064 13.284 1.00 0.00 N ATOM 0 H ARG A 107 5.850 9.558 7.503 1.00 0.00 H new ATOM 0 HA ARG A 107 3.912 11.593 7.902 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.906 9.577 9.278 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.543 9.878 9.825 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.910 10.620 11.546 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.808 11.993 10.931 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.928 12.952 10.060 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.456 11.466 9.260 1.00 0.00 H new ATOM 0 HE ARG A 107 0.948 11.062 11.002 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.539 13.204 12.010 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.846 13.501 13.607 1.00 0.00 H new ATOM 0 HH21 ARG A 107 0.068 11.452 13.059 1.00 0.00 H new ATOM 0 HH22 ARG A 107 0.899 12.518 14.196 1.00 0.00 H new ATOM 1678 N GLU A 108 6.998 12.395 8.506 1.00 0.00 N ATOM 1679 CA GLU A 108 7.870 13.515 8.858 1.00 0.00 C ATOM 1680 C GLU A 108 7.632 14.657 7.887 1.00 0.00 C ATOM 1681 O GLU A 108 7.351 15.792 8.276 1.00 0.00 O ATOM 1682 CB GLU A 108 9.336 13.080 8.791 1.00 0.00 C ATOM 1683 CG GLU A 108 10.130 13.788 9.890 1.00 0.00 C ATOM 1684 CD GLU A 108 11.600 13.874 9.497 1.00 0.00 C ATOM 1685 OE1 GLU A 108 11.914 13.519 8.373 1.00 0.00 O ATOM 1686 OE2 GLU A 108 12.392 14.293 10.325 1.00 0.00 O ATOM 0 H GLU A 108 7.482 11.580 8.130 1.00 0.00 H new ATOM 0 HA GLU A 108 7.645 13.842 9.873 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.411 11.999 8.912 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.753 13.321 7.813 1.00 0.00 H new ATOM 0 HG2 GLU A 108 9.729 14.789 10.053 1.00 0.00 H new ATOM 0 HG3 GLU A 108 10.027 13.247 10.831 1.00 0.00 H new ATOM 1693 N VAL A 109 7.717 14.322 6.617 1.00 0.00 N ATOM 1694 CA VAL A 109 7.484 15.283 5.556 1.00 0.00 C ATOM 1695 C VAL A 109 6.095 15.884 5.727 1.00 0.00 C ATOM 1696 O VAL A 109 5.910 17.110 5.789 1.00 0.00 O ATOM 1697 CB VAL A 109 7.587 14.554 4.212 1.00 0.00 C ATOM 1698 CG1 VAL A 109 9.059 14.370 3.855 1.00 0.00 C ATOM 1699 CG2 VAL A 109 6.920 13.190 4.301 1.00 0.00 C ATOM 0 H VAL A 109 7.948 13.383 6.291 1.00 0.00 H new ATOM 0 HA VAL A 109 8.222 16.085 5.592 1.00 0.00 H new ATOM 0 HB VAL A 109 7.086 15.146 3.446 1.00 0.00 H new ATOM 0 HG11 VAL A 109 9.140 13.852 2.899 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.540 15.345 3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.550 13.781 4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 109 7.000 12.682 3.340 1.00 0.00 H new ATOM 0 HG22 VAL A 109 7.413 12.593 5.069 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.868 13.315 4.559 1.00 0.00 H new ATOM 1709 N LEU A 110 5.120 15.009 5.845 1.00 0.00 N ATOM 1710 CA LEU A 110 3.759 15.440 6.048 1.00 0.00 C ATOM 1711 C LEU A 110 3.671 16.219 7.355 1.00 0.00 C ATOM 1712 O LEU A 110 2.856 17.132 7.489 1.00 0.00 O ATOM 1713 CB LEU A 110 2.845 14.211 6.037 1.00 0.00 C ATOM 1714 CG LEU A 110 1.801 14.350 4.926 1.00 0.00 C ATOM 1715 CD1 LEU A 110 2.495 14.678 3.605 1.00 0.00 C ATOM 1716 CD2 LEU A 110 1.061 13.026 4.778 1.00 0.00 C ATOM 0 H LEU A 110 5.246 13.998 5.804 1.00 0.00 H new ATOM 0 HA LEU A 110 3.433 16.105 5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.436 13.308 5.882 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.350 14.106 7.002 1.00 0.00 H new ATOM 0 HG LEU A 110 1.104 15.149 5.179 1.00 0.00 H new ATOM 0 HD11 LEU A 110 1.749 14.776 2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.043 15.615 3.705 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.189 13.877 3.350 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.314 13.113 3.989 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.770 12.239 4.521 1.00 0.00 H new ATOM 0 HD23 LEU A 110 0.568 12.777 5.718 1.00 0.00 H new ATOM 1728 N ARG A 111 4.555 15.898 8.297 1.00 0.00 N ATOM 1729 CA ARG A 111 4.584 16.633 9.552 1.00 0.00 C ATOM 1730 C ARG A 111 4.697 18.106 9.215 1.00 0.00 C ATOM 1731 O ARG A 111 4.074 18.958 9.850 1.00 0.00 O ATOM 1732 CB ARG A 111 5.774 16.203 10.411 1.00 0.00 C ATOM 1733 CG ARG A 111 5.466 16.478 11.883 1.00 0.00 C ATOM 1734 CD ARG A 111 6.592 15.913 12.750 1.00 0.00 C ATOM 1735 NE ARG A 111 6.300 16.133 14.161 1.00 0.00 N ATOM 1736 CZ ARG A 111 5.406 15.389 14.802 1.00 0.00 C ATOM 1737 NH1 ARG A 111 4.772 14.438 14.170 1.00 0.00 N ATOM 1738 NH2 ARG A 111 5.161 15.607 16.065 1.00 0.00 N ATOM 0 H ARG A 111 5.245 15.151 8.216 1.00 0.00 H new ATOM 0 HA ARG A 111 3.677 16.431 10.122 1.00 0.00 H new ATOM 0 HB2 ARG A 111 5.979 15.143 10.263 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.670 16.746 10.108 1.00 0.00 H new ATOM 0 HG2 ARG A 111 5.365 17.550 12.051 1.00 0.00 H new ATOM 0 HG3 ARG A 111 4.515 16.022 12.159 1.00 0.00 H new ATOM 0 HD2 ARG A 111 6.709 14.847 12.557 1.00 0.00 H new ATOM 0 HD3 ARG A 111 7.537 16.390 12.488 1.00 0.00 H new ATOM 0 HE ARG A 111 6.791 16.871 14.665 1.00 0.00 H new ATOM 0 HH11 ARG A 111 4.963 14.266 13.183 1.00 0.00 H new ATOM 0 HH12 ARG A 111 4.086 13.867 14.663 1.00 0.00 H new ATOM 0 HH21 ARG A 111 5.656 16.349 16.560 1.00 0.00 H new ATOM 0 HH22 ARG A 111 4.474 15.036 16.557 1.00 0.00 H new ATOM 1752 N LEU A 112 5.471 18.389 8.168 1.00 0.00 N ATOM 1753 CA LEU A 112 5.625 19.757 7.705 1.00 0.00 C ATOM 1754 C LEU A 112 4.256 20.253 7.274 1.00 0.00 C ATOM 1755 O LEU A 112 3.944 21.439 7.370 1.00 0.00 O ATOM 1756 CB LEU A 112 6.601 19.817 6.529 1.00 0.00 C ATOM 1757 CG LEU A 112 7.104 21.252 6.354 1.00 0.00 C ATOM 1758 CD1 LEU A 112 8.139 21.569 7.435 1.00 0.00 C ATOM 1759 CD2 LEU A 112 7.746 21.400 4.971 1.00 0.00 C ATOM 0 H LEU A 112 5.993 17.695 7.633 1.00 0.00 H new ATOM 0 HA LEU A 112 6.026 20.383 8.502 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.441 19.145 6.705 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.109 19.479 5.617 1.00 0.00 H new ATOM 0 HG LEU A 112 6.267 21.944 6.443 1.00 0.00 H new ATOM 0 HD11 LEU A 112 8.496 22.591 7.309 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.682 21.463 8.419 1.00 0.00 H new ATOM 0 HD13 LEU A 112 8.978 20.879 7.349 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.105 22.421 4.844 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.583 20.707 4.882 1.00 0.00 H new ATOM 0 HD23 LEU A 112 7.007 21.177 4.201 1.00 0.00 H new ATOM 1771 N TYR A 113 3.434 19.303 6.829 1.00 0.00 N ATOM 1772 CA TYR A 113 2.062 19.603 6.413 1.00 0.00 C ATOM 1773 C TYR A 113 1.081 18.871 7.335 1.00 0.00 C ATOM 1774 O TYR A 113 0.650 17.759 7.042 1.00 0.00 O ATOM 1775 CB TYR A 113 1.839 19.159 4.965 1.00 0.00 C ATOM 1776 CG TYR A 113 1.863 20.367 4.060 1.00 0.00 C ATOM 1777 CD1 TYR A 113 3.087 20.937 3.689 1.00 0.00 C ATOM 1778 CD2 TYR A 113 0.664 20.915 3.590 1.00 0.00 C ATOM 1779 CE1 TYR A 113 3.111 22.056 2.848 1.00 0.00 C ATOM 1780 CE2 TYR A 113 0.688 22.034 2.749 1.00 0.00 C ATOM 1781 CZ TYR A 113 1.912 22.604 2.378 1.00 0.00 C ATOM 1782 OH TYR A 113 1.935 23.707 1.548 1.00 0.00 O ATOM 0 H TYR A 113 3.693 18.320 6.747 1.00 0.00 H new ATOM 0 HA TYR A 113 1.895 20.678 6.480 1.00 0.00 H new ATOM 0 HB2 TYR A 113 2.613 18.452 4.667 1.00 0.00 H new ATOM 0 HB3 TYR A 113 0.884 18.642 4.875 1.00 0.00 H new ATOM 0 HD1 TYR A 113 4.012 20.514 4.051 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -0.280 20.475 3.876 1.00 0.00 H new ATOM 0 HE1 TYR A 113 4.055 22.496 2.562 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -0.237 22.457 2.387 1.00 0.00 H new ATOM 0 HH TYR A 113 1.018 23.959 1.313 1.00 0.00 H new ATOM 1792 N PRO A 114 0.761 19.466 8.457 1.00 0.00 N ATOM 1793 CA PRO A 114 -0.147 18.861 9.488 1.00 0.00 C ATOM 1794 C PRO A 114 -1.578 18.584 9.012 1.00 0.00 C ATOM 1795 O PRO A 114 -2.155 17.558 9.366 1.00 0.00 O ATOM 1796 CB PRO A 114 -0.167 19.894 10.623 1.00 0.00 C ATOM 1797 CG PRO A 114 0.986 20.808 10.373 1.00 0.00 C ATOM 1798 CD PRO A 114 1.238 20.790 8.871 1.00 0.00 C ATOM 0 HA PRO A 114 0.228 17.877 9.771 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -1.107 20.446 10.631 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -0.075 19.408 11.594 1.00 0.00 H new ATOM 0 HG2 PRO A 114 0.761 21.818 10.716 1.00 0.00 H new ATOM 0 HG3 PRO A 114 1.869 20.475 10.918 1.00 0.00 H new ATOM 0 HD2 PRO A 114 0.696 21.588 8.364 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.295 20.926 8.640 1.00 0.00 H new ATOM 1806 N GLU A 115 -2.165 19.497 8.245 1.00 0.00 N ATOM 1807 CA GLU A 115 -3.543 19.301 7.796 1.00 0.00 C ATOM 1808 C GLU A 115 -3.653 18.085 6.883 1.00 0.00 C ATOM 1809 O GLU A 115 -4.469 17.186 7.113 1.00 0.00 O ATOM 1810 CB GLU A 115 -4.030 20.544 7.047 1.00 0.00 C ATOM 1811 CG GLU A 115 -4.053 21.741 8.001 1.00 0.00 C ATOM 1812 CD GLU A 115 -4.396 23.014 7.234 1.00 0.00 C ATOM 1813 OE1 GLU A 115 -5.463 23.058 6.644 1.00 0.00 O ATOM 1814 OE2 GLU A 115 -3.587 23.927 7.250 1.00 0.00 O ATOM 0 H GLU A 115 -1.724 20.360 7.927 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.165 19.134 8.676 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.374 20.752 6.202 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -5.027 20.370 6.642 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.786 21.573 8.790 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.083 21.849 8.485 1.00 0.00 H new ATOM 1821 N TYR A 116 -2.819 18.057 5.859 1.00 0.00 N ATOM 1822 CA TYR A 116 -2.820 16.948 4.918 1.00 0.00 C ATOM 1823 C TYR A 116 -2.257 15.698 5.574 1.00 0.00 C ATOM 1824 O TYR A 116 -2.668 14.580 5.265 1.00 0.00 O ATOM 1825 CB TYR A 116 -1.980 17.312 3.697 1.00 0.00 C ATOM 1826 CG TYR A 116 -2.880 17.855 2.614 1.00 0.00 C ATOM 1827 CD1 TYR A 116 -3.778 17.004 1.960 1.00 0.00 C ATOM 1828 CD2 TYR A 116 -2.821 19.210 2.267 1.00 0.00 C ATOM 1829 CE1 TYR A 116 -4.617 17.508 0.959 1.00 0.00 C ATOM 1830 CE2 TYR A 116 -3.659 19.713 1.266 1.00 0.00 C ATOM 1831 CZ TYR A 116 -4.558 18.863 0.612 1.00 0.00 C ATOM 1832 OH TYR A 116 -5.385 19.359 -0.375 1.00 0.00 O ATOM 0 H TYR A 116 -2.134 18.786 5.657 1.00 0.00 H new ATOM 0 HA TYR A 116 -3.846 16.749 4.608 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -1.229 18.054 3.967 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -1.445 16.434 3.335 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -3.824 15.959 2.227 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -2.129 19.867 2.772 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -5.310 16.851 0.454 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -3.612 20.758 0.998 1.00 0.00 H new ATOM 0 HH TYR A 116 -4.992 19.176 -1.254 1.00 0.00 H new ATOM 1842 N ALA A 117 -1.299 15.899 6.467 1.00 0.00 N ATOM 1843 CA ALA A 117 -0.659 14.790 7.156 1.00 0.00 C ATOM 1844 C ALA A 117 -1.628 14.040 8.048 1.00 0.00 C ATOM 1845 O ALA A 117 -1.838 12.843 7.872 1.00 0.00 O ATOM 1846 CB ALA A 117 0.510 15.314 7.971 1.00 0.00 C ATOM 0 H ALA A 117 -0.948 16.820 6.731 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.303 14.084 6.406 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.993 14.485 8.489 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.229 15.795 7.308 1.00 0.00 H new ATOM 0 HB3 ALA A 117 0.149 16.038 8.702 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.230 14.733 8.993 1.00 0.00 N ATOM 1853 CA GLN A 118 -3.173 14.074 9.869 1.00 0.00 C ATOM 1854 C GLN A 118 -4.190 13.337 9.011 1.00 0.00 C ATOM 1855 O GLN A 118 -4.683 12.271 9.380 1.00 0.00 O ATOM 1856 CB GLN A 118 -3.874 15.110 10.746 1.00 0.00 C ATOM 1857 CG GLN A 118 -2.879 15.726 11.730 1.00 0.00 C ATOM 1858 CD GLN A 118 -2.116 14.632 12.467 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -1.028 14.142 11.938 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -2.521 14.213 13.551 1.00 0.00 N flip ATOM 0 H GLN A 118 -2.088 15.727 9.171 1.00 0.00 H new ATOM 0 HA GLN A 118 -2.656 13.367 10.518 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -4.311 15.890 10.122 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -4.694 14.642 11.291 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.180 16.369 11.196 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.408 16.355 12.446 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -3.372 14.598 13.961 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -2.006 13.480 14.039 1.00 0.00 H new ATOM 1869 N LYS A 119 -4.472 13.911 7.848 1.00 0.00 N ATOM 1870 CA LYS A 119 -5.407 13.310 6.905 1.00 0.00 C ATOM 1871 C LYS A 119 -4.792 12.091 6.205 1.00 0.00 C ATOM 1872 O LYS A 119 -5.515 11.202 5.755 1.00 0.00 O ATOM 1873 CB LYS A 119 -5.813 14.345 5.854 1.00 0.00 C ATOM 1874 CG LYS A 119 -7.328 14.296 5.644 1.00 0.00 C ATOM 1875 CD LYS A 119 -7.765 15.503 4.813 1.00 0.00 C ATOM 1876 CE LYS A 119 -8.096 16.671 5.744 1.00 0.00 C ATOM 1877 NZ LYS A 119 -9.572 16.756 5.929 1.00 0.00 N ATOM 0 H LYS A 119 -4.066 14.793 7.535 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.282 12.978 7.464 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.512 15.342 6.176 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.299 14.145 4.914 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.606 13.372 5.137 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.840 14.299 6.606 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -6.972 15.788 4.122 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.636 15.247 4.210 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -7.605 16.532 6.707 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.717 17.603 5.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.797 17.550 6.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -10.029 16.907 5.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.921 15.870 6.347 1.00 0.00 H new ATOM 1891 N PHE A 120 -3.461 12.069 6.080 1.00 0.00 N ATOM 1892 CA PHE A 120 -2.780 10.973 5.390 1.00 0.00 C ATOM 1893 C PHE A 120 -3.130 9.613 5.983 1.00 0.00 C ATOM 1894 O PHE A 120 -3.242 8.625 5.255 1.00 0.00 O ATOM 1895 CB PHE A 120 -1.267 11.214 5.441 1.00 0.00 C ATOM 1896 CG PHE A 120 -0.556 10.125 6.216 1.00 0.00 C ATOM 1897 CD1 PHE A 120 -0.337 8.871 5.634 1.00 0.00 C ATOM 1898 CD2 PHE A 120 -0.095 10.383 7.515 1.00 0.00 C ATOM 1899 CE1 PHE A 120 0.340 7.880 6.351 1.00 0.00 C ATOM 1900 CE2 PHE A 120 0.578 9.388 8.230 1.00 0.00 C ATOM 1901 CZ PHE A 120 0.796 8.136 7.648 1.00 0.00 C ATOM 0 H PHE A 120 -2.840 12.791 6.445 1.00 0.00 H new ATOM 0 HA PHE A 120 -3.118 10.957 4.354 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -0.870 11.258 4.427 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.067 12.181 5.904 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -0.690 8.669 4.633 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -0.260 11.351 7.964 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.511 6.913 5.902 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.929 9.587 9.232 1.00 0.00 H new ATOM 0 HZ PHE A 120 1.316 7.367 8.200 1.00 0.00 H new ATOM 1911 N VAL A 121 -3.283 9.555 7.295 1.00 0.00 N ATOM 1912 CA VAL A 121 -3.599 8.293 7.946 1.00 0.00 C ATOM 1913 C VAL A 121 -4.976 7.782 7.524 1.00 0.00 C ATOM 1914 O VAL A 121 -5.160 6.585 7.298 1.00 0.00 O ATOM 1915 CB VAL A 121 -3.559 8.464 9.465 1.00 0.00 C ATOM 1916 CG1 VAL A 121 -2.238 9.116 9.872 1.00 0.00 C ATOM 1917 CG2 VAL A 121 -4.722 9.355 9.908 1.00 0.00 C ATOM 0 H VAL A 121 -3.195 10.354 7.923 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.852 7.561 7.640 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.644 7.487 9.942 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.211 9.237 10.955 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.408 8.484 9.557 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.152 10.092 9.395 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.695 9.478 10.991 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -4.635 10.331 9.430 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.666 8.892 9.619 1.00 0.00 H new ATOM 1927 N SER A 122 -5.943 8.689 7.434 1.00 0.00 N ATOM 1928 CA SER A 122 -7.303 8.313 7.055 1.00 0.00 C ATOM 1929 C SER A 122 -7.483 8.294 5.537 1.00 0.00 C ATOM 1930 O SER A 122 -8.322 7.561 5.016 1.00 0.00 O ATOM 1931 CB SER A 122 -8.301 9.291 7.671 1.00 0.00 C ATOM 1932 OG SER A 122 -8.664 10.263 6.698 1.00 0.00 O ATOM 0 H SER A 122 -5.813 9.684 7.617 1.00 0.00 H new ATOM 0 HA SER A 122 -7.484 7.306 7.431 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.186 8.757 8.017 1.00 0.00 H new ATOM 0 HB3 SER A 122 -7.862 9.777 8.542 1.00 0.00 H new ATOM 0 HG SER A 122 -9.306 10.892 7.088 1.00 0.00 H new ATOM 1938 N GLU A 123 -6.712 9.115 4.834 1.00 0.00 N ATOM 1939 CA GLU A 123 -6.822 9.187 3.379 1.00 0.00 C ATOM 1940 C GLU A 123 -6.400 7.873 2.725 1.00 0.00 C ATOM 1941 O GLU A 123 -6.874 7.535 1.641 1.00 0.00 O ATOM 1942 CB GLU A 123 -5.950 10.326 2.845 1.00 0.00 C ATOM 1943 CG GLU A 123 -6.830 11.538 2.527 1.00 0.00 C ATOM 1944 CD GLU A 123 -5.980 12.804 2.488 1.00 0.00 C ATOM 1945 OE1 GLU A 123 -4.963 12.831 3.161 1.00 0.00 O ATOM 1946 OE2 GLU A 123 -6.360 13.726 1.785 1.00 0.00 O ATOM 0 H GLU A 123 -6.011 9.734 5.240 1.00 0.00 H new ATOM 0 HA GLU A 123 -7.867 9.375 3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.194 10.596 3.582 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -5.420 10.003 1.949 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -7.328 11.395 1.568 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -7.612 11.638 3.280 1.00 0.00 H new ATOM 1953 N ILE A 124 -5.505 7.141 3.378 1.00 0.00 N ATOM 1954 CA ILE A 124 -5.031 5.878 2.831 1.00 0.00 C ATOM 1955 C ILE A 124 -6.186 4.895 2.623 1.00 0.00 C ATOM 1956 O ILE A 124 -6.236 4.192 1.614 1.00 0.00 O ATOM 1957 CB ILE A 124 -3.977 5.270 3.760 1.00 0.00 C ATOM 1958 CG1 ILE A 124 -2.854 4.669 2.913 1.00 0.00 C ATOM 1959 CG2 ILE A 124 -4.606 4.181 4.635 1.00 0.00 C ATOM 1960 CD1 ILE A 124 -2.208 3.498 3.655 1.00 0.00 C ATOM 0 H ILE A 124 -5.097 7.397 4.277 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.581 6.075 1.858 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.575 6.048 4.409 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.251 4.329 1.956 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.105 5.430 2.695 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.846 3.757 5.291 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.404 4.614 5.238 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.016 3.396 4.000 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -1.410 3.076 3.044 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -1.795 3.850 4.600 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -2.959 2.732 3.850 1.00 0.00 H new ATOM 1972 N GLN A 125 -7.107 4.843 3.582 1.00 0.00 N ATOM 1973 CA GLN A 125 -8.243 3.933 3.482 1.00 0.00 C ATOM 1974 C GLN A 125 -8.904 4.049 2.112 1.00 0.00 C ATOM 1975 O GLN A 125 -9.454 3.078 1.593 1.00 0.00 O ATOM 1976 CB GLN A 125 -9.272 4.252 4.569 1.00 0.00 C ATOM 1977 CG GLN A 125 -8.754 3.779 5.919 1.00 0.00 C ATOM 1978 CD GLN A 125 -7.568 4.626 6.361 1.00 0.00 C ATOM 1979 OE1 GLN A 125 -7.396 5.750 5.890 1.00 0.00 O ATOM 1980 NE2 GLN A 125 -6.733 4.152 7.245 1.00 0.00 N ATOM 0 H GLN A 125 -7.090 5.413 4.427 1.00 0.00 H new ATOM 0 HA GLN A 125 -7.877 2.915 3.616 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.464 5.324 4.598 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.220 3.764 4.341 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -9.549 3.840 6.662 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.457 2.732 5.855 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.877 3.220 7.634 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -5.936 4.713 7.547 1.00 0.00 H new ATOM 1989 N HIS A 126 -8.850 5.244 1.534 1.00 0.00 N ATOM 1990 CA HIS A 126 -9.450 5.478 0.225 1.00 0.00 C ATOM 1991 C HIS A 126 -8.658 4.773 -0.873 1.00 0.00 C ATOM 1992 O HIS A 126 -9.154 4.583 -1.984 1.00 0.00 O ATOM 1993 CB HIS A 126 -9.505 6.973 -0.063 1.00 0.00 C ATOM 1994 CG HIS A 126 -10.693 7.273 -0.934 1.00 0.00 C ATOM 1995 ND1 HIS A 126 -10.937 6.585 -2.114 1.00 0.00 N ATOM 1996 CD2 HIS A 126 -11.717 8.178 -0.810 1.00 0.00 C ATOM 1997 CE1 HIS A 126 -12.068 7.083 -2.647 1.00 0.00 C ATOM 1998 NE2 HIS A 126 -12.583 8.057 -1.893 1.00 0.00 N ATOM 0 H HIS A 126 -8.400 6.061 1.948 1.00 0.00 H new ATOM 0 HA HIS A 126 -10.461 5.072 0.238 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -9.575 7.532 0.870 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -8.588 7.293 -0.558 1.00 0.00 H new ATOM 0 HD1 HIS A 126 -10.364 5.838 -2.506 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.833 8.878 0.004 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -12.506 6.737 -3.572 1.00 0.00 H new ATOM 2007 N ASP A 127 -7.426 4.392 -0.556 1.00 0.00 N ATOM 2008 CA ASP A 127 -6.573 3.711 -1.525 1.00 0.00 C ATOM 2009 C ASP A 127 -6.184 2.325 -1.018 1.00 0.00 C ATOM 2010 O ASP A 127 -5.189 1.749 -1.458 1.00 0.00 O ATOM 2011 CB ASP A 127 -5.313 4.539 -1.785 1.00 0.00 C ATOM 2012 CG ASP A 127 -5.510 5.960 -1.269 1.00 0.00 C ATOM 2013 OD1 ASP A 127 -6.552 6.532 -1.546 1.00 0.00 O ATOM 2014 OD2 ASP A 127 -4.615 6.457 -0.604 1.00 0.00 O ATOM 0 H ASP A 127 -6.997 4.541 0.357 1.00 0.00 H new ATOM 0 HA ASP A 127 -7.129 3.599 -2.456 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -4.457 4.079 -1.291 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -5.093 4.558 -2.852 1.00 0.00 H new ATOM 2019 N LEU A 128 -6.972 1.800 -0.086 1.00 0.00 N ATOM 2020 CA LEU A 128 -6.700 0.484 0.479 1.00 0.00 C ATOM 2021 C LEU A 128 -7.200 -0.621 -0.448 1.00 0.00 C ATOM 2022 O LEU A 128 -8.402 -0.764 -0.666 1.00 0.00 O ATOM 2023 CB LEU A 128 -7.383 0.354 1.842 1.00 0.00 C ATOM 2024 CG LEU A 128 -7.273 -1.091 2.331 1.00 0.00 C ATOM 2025 CD1 LEU A 128 -5.800 -1.493 2.406 1.00 0.00 C ATOM 2026 CD2 LEU A 128 -7.908 -1.208 3.718 1.00 0.00 C ATOM 0 H LEU A 128 -7.799 2.262 0.292 1.00 0.00 H new ATOM 0 HA LEU A 128 -5.621 0.379 0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.917 1.029 2.560 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.431 0.644 1.765 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.793 -1.751 1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -5.721 -2.523 2.754 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.349 -1.409 1.417 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.278 -0.834 3.100 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.830 -2.237 4.068 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -7.388 -0.548 4.413 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.958 -0.922 3.663 1.00 0.00 H new ATOM 2038 N THR A 129 -6.268 -1.405 -0.983 1.00 0.00 N ATOM 2039 CA THR A 129 -6.626 -2.501 -1.876 1.00 0.00 C ATOM 2040 C THR A 129 -6.554 -3.830 -1.135 1.00 0.00 C ATOM 2041 O THR A 129 -7.543 -4.559 -1.053 1.00 0.00 O ATOM 2042 CB THR A 129 -5.684 -2.535 -3.078 1.00 0.00 C ATOM 2043 OG1 THR A 129 -5.827 -1.334 -3.824 1.00 0.00 O ATOM 2044 CG2 THR A 129 -6.028 -3.734 -3.962 1.00 0.00 C ATOM 0 H THR A 129 -5.267 -1.303 -0.815 1.00 0.00 H new ATOM 0 HA THR A 129 -7.646 -2.340 -2.226 1.00 0.00 H new ATOM 0 HB THR A 129 -4.654 -2.626 -2.732 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.943 -0.945 -3.990 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.356 -3.758 -4.820 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.917 -4.654 -3.387 1.00 0.00 H new ATOM 0 HG23 THR A 129 -7.057 -3.646 -4.310 1.00 0.00 H new ATOM 2052 N TYR A 130 -5.380 -4.143 -0.590 1.00 0.00 N ATOM 2053 CA TYR A 130 -5.206 -5.387 0.146 1.00 0.00 C ATOM 2054 C TYR A 130 -4.498 -5.124 1.469 1.00 0.00 C ATOM 2055 O TYR A 130 -3.387 -4.594 1.499 1.00 0.00 O ATOM 2056 CB TYR A 130 -4.392 -6.382 -0.686 1.00 0.00 C ATOM 2057 CG TYR A 130 -4.383 -7.722 0.009 1.00 0.00 C ATOM 2058 CD1 TYR A 130 -3.451 -7.977 1.022 1.00 0.00 C ATOM 2059 CD2 TYR A 130 -5.306 -8.708 -0.357 1.00 0.00 C ATOM 2060 CE1 TYR A 130 -3.443 -9.218 1.670 1.00 0.00 C ATOM 2061 CE2 TYR A 130 -5.298 -9.950 0.290 1.00 0.00 C ATOM 2062 CZ TYR A 130 -4.366 -10.205 1.304 1.00 0.00 C ATOM 2063 OH TYR A 130 -4.360 -11.428 1.942 1.00 0.00 O ATOM 0 H TYR A 130 -4.546 -3.558 -0.644 1.00 0.00 H new ATOM 0 HA TYR A 130 -6.190 -5.810 0.348 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -4.823 -6.479 -1.682 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -3.372 -6.019 -0.814 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -2.738 -7.216 1.304 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -6.025 -8.511 -1.139 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -2.725 -9.414 2.452 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -6.010 -10.711 0.007 1.00 0.00 H new ATOM 0 HH TYR A 130 -4.625 -12.128 1.309 1.00 0.00 H new ATOM 2073 N ASN A 131 -5.155 -5.492 2.565 1.00 0.00 N ATOM 2074 CA ASN A 131 -4.587 -5.288 3.892 1.00 0.00 C ATOM 2075 C ASN A 131 -3.732 -6.483 4.296 1.00 0.00 C ATOM 2076 O ASN A 131 -4.244 -7.578 4.519 1.00 0.00 O ATOM 2077 CB ASN A 131 -5.707 -5.091 4.915 1.00 0.00 C ATOM 2078 CG ASN A 131 -5.186 -5.366 6.321 1.00 0.00 C ATOM 2079 OD1 ASN A 131 -5.303 -4.449 7.242 1.00 0.00 O flip ATOM 2080 ND2 ASN A 131 -4.659 -6.446 6.589 1.00 0.00 N flip ATOM 0 H ASN A 131 -6.076 -5.930 2.560 1.00 0.00 H new ATOM 0 HA ASN A 131 -3.959 -4.397 3.866 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -6.091 -4.073 4.854 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -6.538 -5.759 4.689 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.568 -7.162 5.868 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -4.313 -6.625 7.532 1.00 0.00 H new ATOM 2087 N LEU A 132 -2.424 -6.264 4.384 1.00 0.00 N ATOM 2088 CA LEU A 132 -1.507 -7.333 4.759 1.00 0.00 C ATOM 2089 C LEU A 132 -1.389 -7.433 6.275 1.00 0.00 C ATOM 2090 O LEU A 132 -0.904 -6.511 6.931 1.00 0.00 O ATOM 2091 CB LEU A 132 -0.128 -7.059 4.157 1.00 0.00 C ATOM 2092 CG LEU A 132 0.732 -8.324 4.233 1.00 0.00 C ATOM 2093 CD1 LEU A 132 1.632 -8.408 2.998 1.00 0.00 C ATOM 2094 CD2 LEU A 132 1.604 -8.269 5.489 1.00 0.00 C ATOM 0 H LEU A 132 -1.979 -5.364 4.203 1.00 0.00 H new ATOM 0 HA LEU A 132 -1.897 -8.276 4.376 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -0.231 -6.740 3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 132 0.358 -6.245 4.694 1.00 0.00 H new ATOM 0 HG LEU A 132 0.085 -9.200 4.272 1.00 0.00 H new ATOM 0 HD11 LEU A 132 2.243 -9.309 3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.015 -8.443 2.100 1.00 0.00 H new ATOM 0 HD13 LEU A 132 2.279 -7.532 2.959 1.00 0.00 H new ATOM 0 HD21 LEU A 132 2.217 -9.168 5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 132 2.249 -7.392 5.446 1.00 0.00 H new ATOM 0 HD23 LEU A 132 0.967 -8.208 6.372 1.00 0.00 H new ATOM 2106 N ARG A 133 -1.825 -8.561 6.825 1.00 0.00 N ATOM 2107 CA ARG A 133 -1.755 -8.773 8.265 1.00 0.00 C ATOM 2108 C ARG A 133 -0.599 -9.710 8.610 1.00 0.00 C ATOM 2109 O ARG A 133 -0.199 -10.543 7.796 1.00 0.00 O ATOM 2110 CB ARG A 133 -3.083 -9.351 8.774 1.00 0.00 C ATOM 2111 CG ARG A 133 -2.957 -10.861 8.989 1.00 0.00 C ATOM 2112 CD ARG A 133 -4.328 -11.442 9.325 1.00 0.00 C ATOM 2113 NE ARG A 133 -5.296 -11.081 8.297 1.00 0.00 N ATOM 2114 CZ ARG A 133 -5.194 -11.556 7.060 1.00 0.00 C ATOM 2115 NH1 ARG A 133 -4.215 -12.363 6.750 1.00 0.00 N ATOM 2116 NH2 ARG A 133 -6.072 -11.217 6.157 1.00 0.00 N ATOM 0 H ARG A 133 -2.228 -9.337 6.300 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.578 -7.815 8.754 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -3.364 -8.866 9.709 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -3.877 -9.144 8.056 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -2.559 -11.335 8.092 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -2.255 -11.067 9.797 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -4.261 -12.527 9.406 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -4.661 -11.070 10.294 1.00 0.00 H new ATOM 0 HE ARG A 133 -6.065 -10.453 8.531 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -3.529 -12.628 7.457 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -4.136 -12.728 5.801 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -6.837 -10.587 6.400 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -5.994 -11.581 5.208 1.00 0.00 H new ATOM 2130 N GLU A 134 -0.067 -9.569 9.818 1.00 0.00 N ATOM 2131 CA GLU A 134 1.043 -10.406 10.258 1.00 0.00 C ATOM 2132 C GLU A 134 0.545 -11.776 10.706 1.00 0.00 C ATOM 2133 O GLU A 134 -0.584 -11.916 11.175 1.00 0.00 O ATOM 2134 CB GLU A 134 1.785 -9.729 11.410 1.00 0.00 C ATOM 2135 CG GLU A 134 0.917 -9.763 12.668 1.00 0.00 C ATOM 2136 CD GLU A 134 1.165 -11.056 13.439 1.00 0.00 C ATOM 2137 OE1 GLU A 134 1.862 -11.909 12.917 1.00 0.00 O ATOM 2138 OE2 GLU A 134 0.652 -11.173 14.539 1.00 0.00 O ATOM 0 H GLU A 134 -0.384 -8.887 10.507 1.00 0.00 H new ATOM 0 HA GLU A 134 1.723 -10.540 9.416 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.731 -10.237 11.595 1.00 0.00 H new ATOM 0 HB3 GLU A 134 2.022 -8.698 11.147 1.00 0.00 H new ATOM 0 HG2 GLU A 134 1.144 -8.904 13.300 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -0.136 -9.689 12.395 1.00 0.00 H new ATOM 2145 N GLY A 135 1.400 -12.782 10.558 1.00 0.00 N ATOM 2146 CA GLY A 135 1.043 -14.141 10.949 1.00 0.00 C ATOM 2147 C GLY A 135 -0.019 -14.714 10.017 1.00 0.00 C ATOM 2148 O GLY A 135 -1.156 -14.243 9.991 1.00 0.00 O ATOM 0 H GLY A 135 2.339 -12.684 10.173 1.00 0.00 H new ATOM 0 HA2 GLY A 135 1.930 -14.774 10.929 1.00 0.00 H new ATOM 0 HA3 GLY A 135 0.673 -14.143 11.974 1.00 0.00 H new TER 2152 GLY A 135