USER MOD reduce.3.24.130724 H: found=0, std=0, add=849, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 847 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 21 TYR OH : rot -36:sc= -0.88! USER MOD Set 1.2: A 56 ASN : amide:sc= -2.86! C(o=-3.7!,f=-6.4!) USER MOD Single : A 1 MET CE :methyl 157:sc= -4.6! (180deg=-6.04!) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.0309 (180deg=-0.259) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.133) USER MOD Single : A 11 ASN : amide:sc= -0.805 K(o=-0.81,f=-1.5) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -106:sc= -13.3! (180deg=-26.5!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -156:sc=-0.000583 (180deg=-0.678) USER MOD Single : A 43 HIS : no HD1:sc= -2.85! C(o=-2.8!,f=-2.2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -1.21 K(o=-1.2,f=-5.9!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.0194 USER MOD Single : A 62 LYS NZ :NH3+ -162:sc= -0.0206 (180deg=-0.262) USER MOD Single : A 63 HIS : no HD1:sc= -0.0173 X(o=-0.017,f=-0.3) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -70:sc= -4.06 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 99:sc= 0.0461 USER MOD Single : A 75 LYS NZ :NH3+ -164:sc= 0.436 (180deg=0.319) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc=-0.00751 X(o=-0.0075,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc=-0.00425 (180deg=-0.00425) USER MOD Single : A 94 GLN : amide:sc= -0.0513 X(o=-0.051,f=-0.31) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 16.984 -3.753 3.090 1.00 0.00 N ATOM 2 CA MET A 1 16.248 -2.886 2.175 1.00 0.00 C ATOM 3 C MET A 1 16.015 -1.514 2.836 1.00 0.00 C ATOM 4 O MET A 1 15.964 -1.437 4.063 1.00 0.00 O ATOM 5 CB MET A 1 14.920 -3.559 1.806 1.00 0.00 C ATOM 6 CG MET A 1 15.097 -4.759 0.895 1.00 0.00 C ATOM 7 SD MET A 1 13.887 -6.055 1.211 1.00 0.00 S ATOM 8 CE MET A 1 14.818 -7.108 2.321 1.00 0.00 C ATOM 0 H1 MET A 1 17.875 -4.052 2.644 1.00 0.00 H new ATOM 0 H2 MET A 1 17.193 -3.235 3.967 1.00 0.00 H new ATOM 0 H3 MET A 1 16.410 -4.591 3.312 1.00 0.00 H new ATOM 0 HA MET A 1 16.822 -2.727 1.262 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.413 -3.874 2.718 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.273 -2.831 1.317 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.016 -4.437 -0.143 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.100 -5.164 1.026 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.130 -7.704 2.920 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.460 -7.770 1.741 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.431 -6.492 2.978 1.00 0.00 H new ATOM 18 N ASP A 2 15.875 -0.428 2.052 1.00 0.00 N ATOM 19 CA ASP A 2 15.655 0.889 2.656 1.00 0.00 C ATOM 20 C ASP A 2 14.546 1.603 1.931 1.00 0.00 C ATOM 21 O ASP A 2 14.349 1.390 0.750 1.00 0.00 O ATOM 22 CB ASP A 2 16.930 1.733 2.655 1.00 0.00 C ATOM 23 CG ASP A 2 18.153 0.943 3.079 1.00 0.00 C ATOM 24 OD1 ASP A 2 18.003 0.009 3.895 1.00 0.00 O ATOM 25 OD2 ASP A 2 19.263 1.261 2.602 1.00 0.00 O ATOM 0 H ASP A 2 15.909 -0.438 1.033 1.00 0.00 H new ATOM 0 HA ASP A 2 15.367 0.740 3.697 1.00 0.00 H new ATOM 0 HB2 ASP A 2 17.092 2.138 1.656 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.800 2.582 3.326 1.00 0.00 H new ATOM 30 N LEU A 3 13.777 2.412 2.621 1.00 0.00 N ATOM 31 CA LEU A 3 12.678 3.069 1.946 1.00 0.00 C ATOM 32 C LEU A 3 12.765 4.587 1.894 1.00 0.00 C ATOM 33 O LEU A 3 12.611 5.255 2.917 1.00 0.00 O ATOM 34 CB LEU A 3 11.369 2.670 2.618 1.00 0.00 C ATOM 35 CG LEU A 3 10.253 2.158 1.703 1.00 0.00 C ATOM 36 CD1 LEU A 3 9.208 3.234 1.476 1.00 0.00 C ATOM 37 CD2 LEU A 3 10.789 1.653 0.372 1.00 0.00 C ATOM 0 H LEU A 3 13.882 2.627 3.612 1.00 0.00 H new ATOM 0 HA LEU A 3 12.728 2.734 0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.587 1.896 3.354 1.00 0.00 H new ATOM 0 HB3 LEU A 3 10.991 3.533 3.165 1.00 0.00 H new ATOM 0 HG LEU A 3 9.787 1.313 2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.425 2.849 0.823 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.773 3.526 2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.675 4.102 1.010 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.961 1.300 -0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.305 2.463 -0.144 1.00 0.00 H new ATOM 0 HD23 LEU A 3 11.486 0.833 0.548 1.00 0.00 H new ATOM 49 N ILE A 4 12.889 5.143 0.688 1.00 0.00 N ATOM 50 CA ILE A 4 12.844 6.599 0.559 1.00 0.00 C ATOM 51 C ILE A 4 11.506 6.934 -0.064 1.00 0.00 C ATOM 52 O ILE A 4 11.244 6.606 -1.221 1.00 0.00 O ATOM 53 CB ILE A 4 13.954 7.143 -0.342 1.00 0.00 C ATOM 54 CG1 ILE A 4 15.233 6.335 -0.148 1.00 0.00 C ATOM 55 CG2 ILE A 4 14.195 8.620 -0.063 1.00 0.00 C ATOM 56 CD1 ILE A 4 15.859 6.510 1.218 1.00 0.00 C ATOM 0 H ILE A 4 13.017 4.629 -0.184 1.00 0.00 H new ATOM 0 HA ILE A 4 12.981 7.050 1.542 1.00 0.00 H new ATOM 0 HB ILE A 4 13.641 7.045 -1.381 1.00 0.00 H new ATOM 0 HG12 ILE A 4 15.013 5.279 -0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 4 15.956 6.627 -0.910 1.00 0.00 H new ATOM 0 HG21 ILE A 4 14.988 8.989 -0.714 1.00 0.00 H new ATOM 0 HG22 ILE A 4 13.280 9.180 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 4 14.490 8.750 0.978 1.00 0.00 H new ATOM 0 HD11 ILE A 4 16.764 5.906 1.284 1.00 0.00 H new ATOM 0 HD12 ILE A 4 16.111 7.559 1.371 1.00 0.00 H new ATOM 0 HD13 ILE A 4 15.153 6.191 1.985 1.00 0.00 H new ATOM 68 N ILE A 5 10.638 7.521 0.732 1.00 0.00 N ATOM 69 CA ILE A 5 9.290 7.825 0.288 1.00 0.00 C ATOM 70 C ILE A 5 8.879 9.291 0.126 1.00 0.00 C ATOM 71 O ILE A 5 9.186 10.148 0.954 1.00 0.00 O ATOM 72 CB ILE A 5 8.250 7.100 1.130 1.00 0.00 C ATOM 73 CG1 ILE A 5 8.668 6.984 2.601 1.00 0.00 C ATOM 74 CG2 ILE A 5 8.019 5.732 0.531 1.00 0.00 C ATOM 75 CD1 ILE A 5 9.179 8.268 3.227 1.00 0.00 C ATOM 0 H ILE A 5 10.840 7.799 1.692 1.00 0.00 H new ATOM 0 HA ILE A 5 9.321 7.455 -0.737 1.00 0.00 H new ATOM 0 HB ILE A 5 7.327 7.680 1.119 1.00 0.00 H new ATOM 0 HG12 ILE A 5 7.814 6.631 3.179 1.00 0.00 H new ATOM 0 HG13 ILE A 5 9.445 6.224 2.683 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.276 5.197 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.660 5.839 -0.493 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.954 5.172 0.531 1.00 0.00 H new ATOM 0 HD11 ILE A 5 9.449 8.084 4.267 1.00 0.00 H new ATOM 0 HD12 ILE A 5 10.056 8.615 2.681 1.00 0.00 H new ATOM 0 HD13 ILE A 5 8.400 9.029 3.184 1.00 0.00 H new ATOM 87 N LYS A 6 8.055 9.517 -0.892 1.00 0.00 N ATOM 88 CA LYS A 6 7.427 10.813 -1.133 1.00 0.00 C ATOM 89 C LYS A 6 5.919 10.540 -1.205 1.00 0.00 C ATOM 90 O LYS A 6 5.255 10.773 -2.218 1.00 0.00 O ATOM 91 CB LYS A 6 7.939 11.474 -2.413 1.00 0.00 C ATOM 92 CG LYS A 6 8.222 12.961 -2.257 1.00 0.00 C ATOM 93 CD LYS A 6 7.826 13.738 -3.502 1.00 0.00 C ATOM 94 CE LYS A 6 7.206 15.079 -3.149 1.00 0.00 C ATOM 95 NZ LYS A 6 7.533 16.125 -4.159 1.00 0.00 N ATOM 0 H LYS A 6 7.802 8.804 -1.576 1.00 0.00 H new ATOM 0 HA LYS A 6 7.669 11.515 -0.335 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.851 10.970 -2.733 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.203 11.333 -3.205 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.676 13.348 -1.397 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.283 13.111 -2.055 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.704 13.896 -4.128 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.118 13.152 -4.088 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.124 14.971 -3.076 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.562 15.397 -2.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.092 17.025 -3.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.565 16.247 -4.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.171 15.834 -5.090 1.00 0.00 H new ATOM 109 N GLU A 7 5.438 9.945 -0.114 1.00 0.00 N ATOM 110 CA GLU A 7 4.052 9.480 0.062 1.00 0.00 C ATOM 111 C GLU A 7 2.963 10.552 -0.019 1.00 0.00 C ATOM 112 O GLU A 7 3.067 11.611 0.599 1.00 0.00 O ATOM 113 CB GLU A 7 3.968 8.713 1.384 1.00 0.00 C ATOM 114 CG GLU A 7 5.199 7.846 1.642 1.00 0.00 C ATOM 115 CD GLU A 7 6.152 8.541 2.602 1.00 0.00 C ATOM 116 OE1 GLU A 7 6.952 9.379 2.134 1.00 0.00 O ATOM 117 OE2 GLU A 7 6.079 8.277 3.818 1.00 0.00 O ATOM 0 H GLU A 7 6.019 9.764 0.704 1.00 0.00 H new ATOM 0 HA GLU A 7 3.835 8.842 -0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 7 3.850 9.422 2.204 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.079 8.082 1.377 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.893 6.885 2.056 1.00 0.00 H new ATOM 0 HG3 GLU A 7 5.709 7.640 0.701 1.00 0.00 H new ATOM 124 N LYS A 8 1.874 10.226 -0.756 1.00 0.00 N ATOM 125 CA LYS A 8 0.730 11.098 -0.886 1.00 0.00 C ATOM 126 C LYS A 8 -0.508 10.216 -0.752 1.00 0.00 C ATOM 127 O LYS A 8 -0.527 9.115 -1.291 1.00 0.00 O ATOM 128 CB LYS A 8 0.741 11.837 -2.230 1.00 0.00 C ATOM 129 CG LYS A 8 1.818 12.903 -2.330 1.00 0.00 C ATOM 130 CD LYS A 8 2.241 13.133 -3.771 1.00 0.00 C ATOM 131 CE LYS A 8 3.640 13.724 -3.855 1.00 0.00 C ATOM 132 NZ LYS A 8 4.411 13.169 -5.001 1.00 0.00 N ATOM 0 H LYS A 8 1.785 9.348 -1.268 1.00 0.00 H new ATOM 0 HA LYS A 8 0.743 11.870 -0.116 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.883 11.113 -3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.233 12.301 -2.388 1.00 0.00 H new ATOM 0 HG2 LYS A 8 1.449 13.836 -1.905 1.00 0.00 H new ATOM 0 HG3 LYS A 8 2.684 12.604 -1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 8 2.211 12.189 -4.315 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.532 13.804 -4.257 1.00 0.00 H new ATOM 0 HE2 LYS A 8 3.571 14.807 -3.955 1.00 0.00 H new ATOM 0 HE3 LYS A 8 4.175 13.523 -2.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 5.288 13.714 -5.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.646 12.174 -4.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 3.839 13.231 -5.867 1.00 0.00 H new ATOM 146 N ARG A 9 -1.518 10.636 0.002 1.00 0.00 N ATOM 147 CA ARG A 9 -2.685 9.770 0.187 1.00 0.00 C ATOM 148 C ARG A 9 -4.014 10.458 -0.088 1.00 0.00 C ATOM 149 O ARG A 9 -4.263 11.577 0.361 1.00 0.00 O ATOM 150 CB ARG A 9 -2.694 9.206 1.608 1.00 0.00 C ATOM 151 CG ARG A 9 -2.627 10.275 2.688 1.00 0.00 C ATOM 152 CD ARG A 9 -3.835 10.220 3.609 1.00 0.00 C ATOM 153 NE ARG A 9 -4.242 11.551 4.056 1.00 0.00 N ATOM 154 CZ ARG A 9 -3.515 12.315 4.868 1.00 0.00 C ATOM 155 NH1 ARG A 9 -2.343 11.886 5.322 1.00 0.00 N ATOM 156 NH2 ARG A 9 -3.959 13.511 5.228 1.00 0.00 N ATOM 0 H ARG A 9 -1.559 11.536 0.481 1.00 0.00 H new ATOM 0 HA ARG A 9 -2.587 8.972 -0.549 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -3.599 8.615 1.749 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -1.848 8.528 1.726 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -1.717 10.144 3.273 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -2.568 11.259 2.223 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -4.666 9.742 3.090 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -3.603 9.601 4.476 1.00 0.00 H new ATOM 0 HE ARG A 9 -5.136 11.916 3.726 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -1.996 10.967 5.049 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -1.790 12.476 5.944 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -4.858 13.846 4.883 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -3.401 14.096 5.850 1.00 0.00 H new ATOM 170 N ASP A 10 -4.884 9.740 -0.799 1.00 0.00 N ATOM 171 CA ASP A 10 -6.218 10.226 -1.103 1.00 0.00 C ATOM 172 C ASP A 10 -7.243 9.186 -0.662 1.00 0.00 C ATOM 173 O ASP A 10 -7.305 8.051 -1.186 1.00 0.00 O ATOM 174 CB ASP A 10 -6.359 10.507 -2.602 1.00 0.00 C ATOM 175 CG ASP A 10 -7.468 11.497 -2.900 1.00 0.00 C ATOM 176 OD1 ASP A 10 -7.424 12.621 -2.357 1.00 0.00 O ATOM 177 OD2 ASP A 10 -8.383 11.146 -3.677 1.00 0.00 O ATOM 0 H ASP A 10 -4.681 8.814 -1.175 1.00 0.00 H new ATOM 0 HA ASP A 10 -6.391 11.158 -0.566 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -5.416 10.895 -2.987 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -6.558 9.573 -3.127 1.00 0.00 H new ATOM 182 N ASN A 11 -8.073 9.543 0.299 1.00 0.00 N ATOM 183 CA ASN A 11 -9.047 8.585 0.738 1.00 0.00 C ATOM 184 C ASN A 11 -10.458 9.004 0.348 1.00 0.00 C ATOM 185 O ASN A 11 -11.002 9.970 0.882 1.00 0.00 O ATOM 186 CB ASN A 11 -8.966 8.436 2.259 1.00 0.00 C ATOM 187 CG ASN A 11 -9.090 9.763 2.979 1.00 0.00 C ATOM 188 OD1 ASN A 11 -10.191 10.197 3.318 1.00 0.00 O ATOM 189 ND2 ASN A 11 -7.958 10.417 3.215 1.00 0.00 N ATOM 0 H ASN A 11 -8.090 10.449 0.768 1.00 0.00 H new ATOM 0 HA ASN A 11 -8.828 7.634 0.252 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -9.757 7.767 2.598 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -8.018 7.969 2.525 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.979 11.317 3.695 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -7.067 10.019 2.916 1.00 0.00 H new ATOM 196 N PRO A 12 -11.080 8.250 -0.568 1.00 0.00 N ATOM 197 CA PRO A 12 -12.425 8.478 -1.021 1.00 0.00 C ATOM 198 C PRO A 12 -13.338 7.417 -0.408 1.00 0.00 C ATOM 199 O PRO A 12 -13.470 7.345 0.814 1.00 0.00 O ATOM 200 CB PRO A 12 -12.243 8.286 -2.523 1.00 0.00 C ATOM 201 CG PRO A 12 -11.246 7.163 -2.622 1.00 0.00 C ATOM 202 CD PRO A 12 -10.525 7.097 -1.285 1.00 0.00 C ATOM 0 HA PRO A 12 -12.873 9.436 -0.758 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -13.184 8.030 -3.011 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -11.873 9.193 -3.001 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -11.747 6.219 -2.838 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -10.541 7.343 -3.433 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -10.723 6.161 -0.763 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -9.444 7.174 -1.403 1.00 0.00 H new ATOM 210 N ILE A 13 -13.926 6.566 -1.238 1.00 0.00 N ATOM 211 CA ILE A 13 -14.767 5.495 -0.740 1.00 0.00 C ATOM 212 C ILE A 13 -13.920 4.409 -0.073 1.00 0.00 C ATOM 213 O ILE A 13 -14.303 3.836 0.949 1.00 0.00 O ATOM 214 CB ILE A 13 -15.560 4.835 -1.897 1.00 0.00 C ATOM 215 CG1 ILE A 13 -14.640 3.888 -2.686 1.00 0.00 C ATOM 216 CG2 ILE A 13 -16.158 5.899 -2.807 1.00 0.00 C ATOM 217 CD1 ILE A 13 -15.230 3.352 -3.971 1.00 0.00 C ATOM 0 H ILE A 13 -13.835 6.599 -2.253 1.00 0.00 H new ATOM 0 HA ILE A 13 -15.455 5.934 -0.017 1.00 0.00 H new ATOM 0 HB ILE A 13 -16.381 4.252 -1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -13.715 4.415 -2.920 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.374 3.046 -2.046 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.711 5.419 -3.614 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.833 6.533 -2.231 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -15.359 6.509 -3.228 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.509 2.695 -4.456 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -16.139 2.792 -3.749 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.469 4.182 -4.636 1.00 0.00 H new ATOM 229 N LEU A 14 -12.794 4.088 -0.716 1.00 0.00 N ATOM 230 CA LEU A 14 -11.912 3.020 -0.256 1.00 0.00 C ATOM 231 C LEU A 14 -10.579 3.474 0.353 1.00 0.00 C ATOM 232 O LEU A 14 -9.676 2.652 0.491 1.00 0.00 O ATOM 233 CB LEU A 14 -11.679 2.028 -1.397 1.00 0.00 C ATOM 234 CG LEU A 14 -10.683 2.448 -2.486 1.00 0.00 C ATOM 235 CD1 LEU A 14 -10.628 3.962 -2.662 1.00 0.00 C ATOM 236 CD2 LEU A 14 -9.305 1.894 -2.166 1.00 0.00 C ATOM 0 H LEU A 14 -12.473 4.558 -1.562 1.00 0.00 H new ATOM 0 HA LEU A 14 -12.434 2.545 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.334 1.088 -0.965 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -12.638 1.827 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.029 2.032 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.910 4.212 -3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -11.614 4.332 -2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.321 4.426 -1.725 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.602 2.196 -2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.971 2.282 -1.204 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.352 0.806 -2.121 1.00 0.00 H new ATOM 248 N LYS A 15 -10.447 4.738 0.756 1.00 0.00 N ATOM 249 CA LYS A 15 -9.205 5.193 1.401 1.00 0.00 C ATOM 250 C LYS A 15 -7.931 4.764 0.646 1.00 0.00 C ATOM 251 O LYS A 15 -7.064 4.110 1.226 1.00 0.00 O ATOM 252 CB LYS A 15 -9.170 4.714 2.854 1.00 0.00 C ATOM 253 CG LYS A 15 -9.138 3.203 3.031 1.00 0.00 C ATOM 254 CD LYS A 15 -10.546 2.619 3.059 1.00 0.00 C ATOM 255 CE LYS A 15 -10.942 2.180 4.459 1.00 0.00 C ATOM 256 NZ LYS A 15 -11.652 3.259 5.200 1.00 0.00 N ATOM 0 H LYS A 15 -11.165 5.455 0.653 1.00 0.00 H new ATOM 0 HA LYS A 15 -9.211 6.283 1.375 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -8.293 5.141 3.341 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -10.045 5.107 3.372 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -8.571 2.751 2.217 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -8.620 2.954 3.957 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -11.256 3.362 2.696 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -10.601 1.767 2.381 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -11.583 1.301 4.396 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -10.051 1.885 5.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -11.905 2.919 6.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -11.031 4.089 5.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -12.516 3.523 4.685 1.00 0.00 H new ATOM 270 N ARG A 16 -7.823 5.096 -0.649 1.00 0.00 N ATOM 271 CA ARG A 16 -6.657 4.687 -1.442 1.00 0.00 C ATOM 272 C ARG A 16 -5.588 5.766 -1.460 1.00 0.00 C ATOM 273 O ARG A 16 -5.889 6.942 -1.640 1.00 0.00 O ATOM 274 CB ARG A 16 -7.077 4.373 -2.879 1.00 0.00 C ATOM 275 CG ARG A 16 -5.988 3.700 -3.699 1.00 0.00 C ATOM 276 CD ARG A 16 -5.860 4.322 -5.081 1.00 0.00 C ATOM 277 NE ARG A 16 -5.878 3.314 -6.138 1.00 0.00 N ATOM 278 CZ ARG A 16 -5.543 3.561 -7.403 1.00 0.00 C ATOM 279 NH1 ARG A 16 -5.169 4.778 -7.773 1.00 0.00 N ATOM 280 NH2 ARG A 16 -5.582 2.586 -8.301 1.00 0.00 N ATOM 0 H ARG A 16 -8.518 5.638 -1.162 1.00 0.00 H new ATOM 0 HA ARG A 16 -6.241 3.795 -0.974 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -7.956 3.728 -2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -7.372 5.299 -3.373 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -5.036 3.779 -3.174 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.210 2.637 -3.797 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -6.676 5.027 -5.238 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -4.932 4.891 -5.138 1.00 0.00 H new ATOM 0 HE ARG A 16 -6.164 2.366 -5.893 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -5.137 5.532 -7.087 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -4.914 4.960 -8.744 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -5.868 1.647 -8.023 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.326 2.775 -9.270 1.00 0.00 H new ATOM 294 N LYS A 17 -4.329 5.379 -1.287 1.00 0.00 N ATOM 295 CA LYS A 17 -3.267 6.382 -1.304 1.00 0.00 C ATOM 296 C LYS A 17 -2.292 6.163 -2.464 1.00 0.00 C ATOM 297 O LYS A 17 -2.208 5.044 -3.005 1.00 0.00 O ATOM 298 CB LYS A 17 -2.589 6.455 0.069 1.00 0.00 C ATOM 299 CG LYS A 17 -1.728 5.258 0.420 1.00 0.00 C ATOM 300 CD LYS A 17 -0.408 5.286 -0.326 1.00 0.00 C ATOM 301 CE LYS A 17 -0.351 4.188 -1.367 1.00 0.00 C ATOM 302 NZ LYS A 17 -0.043 4.694 -2.714 1.00 0.00 N ATOM 0 H LYS A 17 -4.024 4.417 -1.139 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.708 7.361 -1.491 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -1.971 7.352 0.106 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -3.359 6.567 0.833 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -1.540 5.246 1.494 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -2.264 4.340 0.179 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.278 6.255 -0.807 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.415 5.167 0.379 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.404 3.458 -1.077 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -1.307 3.666 -1.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -0.904 4.674 -3.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 0.306 5.671 -2.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 0.686 4.095 -3.151 1.00 0.00 H new ATOM 316 N GLU A 18 -1.575 7.257 -2.841 1.00 0.00 N ATOM 317 CA GLU A 18 -0.608 7.260 -3.946 1.00 0.00 C ATOM 318 C GLU A 18 0.690 7.879 -3.452 1.00 0.00 C ATOM 319 O GLU A 18 0.754 9.074 -3.180 1.00 0.00 O ATOM 320 CB GLU A 18 -1.136 8.050 -5.149 1.00 0.00 C ATOM 321 CG GLU A 18 -2.593 8.473 -5.032 1.00 0.00 C ATOM 322 CD GLU A 18 -2.983 9.510 -6.067 1.00 0.00 C ATOM 323 OE1 GLU A 18 -2.204 10.466 -6.272 1.00 0.00 O ATOM 324 OE2 GLU A 18 -4.066 9.368 -6.673 1.00 0.00 O ATOM 0 H GLU A 18 -1.661 8.161 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.441 6.233 -4.272 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.521 8.940 -5.282 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.017 7.444 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.232 7.597 -5.142 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.772 8.875 -4.035 1.00 0.00 H new ATOM 331 N ILE A 19 1.699 7.057 -3.294 1.00 0.00 N ATOM 332 CA ILE A 19 2.974 7.504 -2.774 1.00 0.00 C ATOM 333 C ILE A 19 4.127 7.021 -3.622 1.00 0.00 C ATOM 334 O ILE A 19 4.071 5.949 -4.219 1.00 0.00 O ATOM 335 CB ILE A 19 3.192 7.050 -1.314 1.00 0.00 C ATOM 336 CG1 ILE A 19 3.659 5.622 -1.257 1.00 0.00 C ATOM 337 CG2 ILE A 19 1.919 7.204 -0.492 1.00 0.00 C ATOM 338 CD1 ILE A 19 2.742 4.712 -2.002 1.00 0.00 C ATOM 0 H ILE A 19 1.663 6.063 -3.520 1.00 0.00 H new ATOM 0 HA ILE A 19 2.946 8.593 -2.803 1.00 0.00 H new ATOM 0 HB ILE A 19 3.963 7.692 -0.888 1.00 0.00 H new ATOM 0 HG12 ILE A 19 4.663 5.550 -1.676 1.00 0.00 H new ATOM 0 HG13 ILE A 19 3.724 5.302 -0.217 1.00 0.00 H new ATOM 0 HG21 ILE A 19 2.105 6.876 0.531 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.613 8.250 -0.488 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.127 6.596 -0.930 1.00 0.00 H new ATOM 0 HD11 ILE A 19 3.113 3.689 -1.938 1.00 0.00 H new ATOM 0 HD12 ILE A 19 1.744 4.764 -1.566 1.00 0.00 H new ATOM 0 HD13 ILE A 19 2.697 5.017 -3.048 1.00 0.00 H new ATOM 350 N LYS A 20 5.173 7.811 -3.665 1.00 0.00 N ATOM 351 CA LYS A 20 6.349 7.440 -4.439 1.00 0.00 C ATOM 352 C LYS A 20 7.372 6.798 -3.503 1.00 0.00 C ATOM 353 O LYS A 20 7.567 7.261 -2.379 1.00 0.00 O ATOM 354 CB LYS A 20 6.952 8.673 -5.091 1.00 0.00 C ATOM 355 CG LYS A 20 8.079 9.257 -4.273 1.00 0.00 C ATOM 356 CD LYS A 20 9.395 8.572 -4.599 1.00 0.00 C ATOM 357 CE LYS A 20 10.555 9.557 -4.624 1.00 0.00 C ATOM 358 NZ LYS A 20 11.501 9.326 -3.497 1.00 0.00 N ATOM 0 H LYS A 20 5.241 8.707 -3.181 1.00 0.00 H new ATOM 0 HA LYS A 20 6.067 6.734 -5.220 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.322 8.413 -6.083 1.00 0.00 H new ATOM 0 HB3 LYS A 20 6.176 9.426 -5.227 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.162 10.326 -4.471 1.00 0.00 H new ATOM 0 HG3 LYS A 20 7.859 9.145 -3.211 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.593 7.796 -3.860 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.317 8.078 -5.567 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.088 9.467 -5.570 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.169 10.575 -4.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 12.277 10.016 -3.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.998 9.437 -2.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.889 8.363 -3.561 1.00 0.00 H new ATOM 372 N TYR A 21 7.978 5.698 -3.931 1.00 0.00 N ATOM 373 CA TYR A 21 8.921 4.997 -3.066 1.00 0.00 C ATOM 374 C TYR A 21 10.171 4.460 -3.778 1.00 0.00 C ATOM 375 O TYR A 21 10.120 4.032 -4.931 1.00 0.00 O ATOM 376 CB TYR A 21 8.168 3.836 -2.415 1.00 0.00 C ATOM 377 CG TYR A 21 8.264 2.541 -3.193 1.00 0.00 C ATOM 378 CD1 TYR A 21 7.919 2.489 -4.539 1.00 0.00 C ATOM 379 CD2 TYR A 21 8.697 1.376 -2.584 1.00 0.00 C ATOM 380 CE1 TYR A 21 8.003 1.310 -5.252 1.00 0.00 C ATOM 381 CE2 TYR A 21 8.786 0.190 -3.289 1.00 0.00 C ATOM 382 CZ TYR A 21 8.439 0.162 -4.622 1.00 0.00 C ATOM 383 OH TYR A 21 8.524 -1.016 -5.327 1.00 0.00 O ATOM 0 H TYR A 21 7.839 5.278 -4.850 1.00 0.00 H new ATOM 0 HA TYR A 21 9.294 5.720 -2.340 1.00 0.00 H new ATOM 0 HB2 TYR A 21 8.560 3.677 -1.411 1.00 0.00 H new ATOM 0 HB3 TYR A 21 7.118 4.109 -2.308 1.00 0.00 H new ATOM 0 HD1 TYR A 21 7.580 3.386 -5.035 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.970 1.394 -1.539 1.00 0.00 H new ATOM 0 HE1 TYR A 21 7.729 1.286 -6.296 1.00 0.00 H new ATOM 0 HE2 TYR A 21 9.126 -0.710 -2.797 1.00 0.00 H new ATOM 0 HH TYR A 21 7.788 -1.065 -5.972 1.00 0.00 H new ATOM 393 N VAL A 22 11.260 4.389 -3.012 1.00 0.00 N ATOM 394 CA VAL A 22 12.515 3.789 -3.476 1.00 0.00 C ATOM 395 C VAL A 22 12.992 2.843 -2.381 1.00 0.00 C ATOM 396 O VAL A 22 13.042 3.216 -1.212 1.00 0.00 O ATOM 397 CB VAL A 22 13.650 4.808 -3.827 1.00 0.00 C ATOM 398 CG1 VAL A 22 14.679 4.905 -2.710 1.00 0.00 C ATOM 399 CG2 VAL A 22 14.361 4.403 -5.119 1.00 0.00 C ATOM 0 H VAL A 22 11.299 4.744 -2.056 1.00 0.00 H new ATOM 0 HA VAL A 22 12.304 3.280 -4.416 1.00 0.00 H new ATOM 0 HB VAL A 22 13.175 5.781 -3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 22 15.452 5.621 -2.988 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.191 5.236 -1.793 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.132 3.927 -2.547 1.00 0.00 H new ATOM 0 HG21 VAL A 22 15.146 5.125 -5.344 1.00 0.00 H new ATOM 0 HG22 VAL A 22 14.802 3.414 -4.997 1.00 0.00 H new ATOM 0 HG23 VAL A 22 13.642 4.381 -5.938 1.00 0.00 H new ATOM 409 N LEU A 23 13.336 1.628 -2.749 1.00 0.00 N ATOM 410 CA LEU A 23 13.796 0.663 -1.812 1.00 0.00 C ATOM 411 C LEU A 23 15.268 0.484 -2.054 1.00 0.00 C ATOM 412 O LEU A 23 15.684 0.234 -3.187 1.00 0.00 O ATOM 413 CB LEU A 23 13.053 -0.669 -2.027 1.00 0.00 C ATOM 414 CG LEU A 23 13.330 -1.772 -0.990 1.00 0.00 C ATOM 415 CD1 LEU A 23 12.096 -2.030 -0.137 1.00 0.00 C ATOM 416 CD2 LEU A 23 13.766 -3.062 -1.674 1.00 0.00 C ATOM 0 H LEU A 23 13.300 1.294 -3.712 1.00 0.00 H new ATOM 0 HA LEU A 23 13.611 0.988 -0.788 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.982 -0.467 -2.036 1.00 0.00 H new ATOM 0 HB3 LEU A 23 13.313 -1.052 -3.014 1.00 0.00 H new ATOM 0 HG LEU A 23 14.139 -1.428 -0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.313 -2.813 0.590 1.00 0.00 H new ATOM 0 HD12 LEU A 23 11.818 -1.116 0.387 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.272 -2.346 -0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 23 13.956 -3.827 -0.921 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.978 -3.402 -2.346 1.00 0.00 H new ATOM 0 HD23 LEU A 23 14.676 -2.881 -2.245 1.00 0.00 H new ATOM 428 N LYS A 24 16.063 0.606 -1.020 1.00 0.00 N ATOM 429 CA LYS A 24 17.480 0.445 -1.204 1.00 0.00 C ATOM 430 C LYS A 24 17.838 -0.937 -0.759 1.00 0.00 C ATOM 431 O LYS A 24 17.596 -1.329 0.370 1.00 0.00 O ATOM 432 CB LYS A 24 18.253 1.485 -0.392 1.00 0.00 C ATOM 433 CG LYS A 24 17.677 2.888 -0.504 1.00 0.00 C ATOM 434 CD LYS A 24 18.415 3.867 0.392 1.00 0.00 C ATOM 435 CE LYS A 24 18.319 5.287 -0.142 1.00 0.00 C ATOM 436 NZ LYS A 24 19.522 5.667 -0.932 1.00 0.00 N ATOM 0 H LYS A 24 15.762 0.811 -0.067 1.00 0.00 H new ATOM 0 HA LYS A 24 17.743 0.590 -2.252 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.259 1.185 0.656 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.290 1.498 -0.726 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.736 3.225 -1.539 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.621 2.871 -0.234 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.999 3.826 1.399 1.00 0.00 H new ATOM 0 HD3 LYS A 24 19.462 3.575 0.468 1.00 0.00 H new ATOM 0 HE2 LYS A 24 17.431 5.380 -0.767 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.198 5.980 0.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.416 6.642 -1.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 20.367 5.603 -0.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.624 5.022 -1.741 1.00 0.00 H new ATOM 450 N PHE A 25 18.374 -1.691 -1.683 1.00 0.00 N ATOM 451 CA PHE A 25 18.700 -3.055 -1.413 1.00 0.00 C ATOM 452 C PHE A 25 20.192 -3.301 -1.431 1.00 0.00 C ATOM 453 O PHE A 25 20.907 -2.855 -2.328 1.00 0.00 O ATOM 454 CB PHE A 25 17.979 -3.932 -2.429 1.00 0.00 C ATOM 455 CG PHE A 25 18.143 -3.506 -3.863 1.00 0.00 C ATOM 456 CD1 PHE A 25 19.245 -3.917 -4.594 1.00 0.00 C ATOM 457 CD2 PHE A 25 17.190 -2.711 -4.483 1.00 0.00 C ATOM 458 CE1 PHE A 25 19.398 -3.544 -5.915 1.00 0.00 C ATOM 459 CE2 PHE A 25 17.339 -2.335 -5.805 1.00 0.00 C ATOM 460 CZ PHE A 25 18.444 -2.752 -6.522 1.00 0.00 C ATOM 0 H PHE A 25 18.592 -1.377 -2.629 1.00 0.00 H new ATOM 0 HA PHE A 25 18.369 -3.307 -0.405 1.00 0.00 H new ATOM 0 HB2 PHE A 25 18.340 -4.955 -2.326 1.00 0.00 H new ATOM 0 HB3 PHE A 25 16.916 -3.944 -2.188 1.00 0.00 H new ATOM 0 HD1 PHE A 25 19.995 -4.537 -4.125 1.00 0.00 H new ATOM 0 HD2 PHE A 25 16.324 -2.383 -3.928 1.00 0.00 H new ATOM 0 HE1 PHE A 25 20.263 -3.872 -6.472 1.00 0.00 H new ATOM 0 HE2 PHE A 25 16.591 -1.715 -6.277 1.00 0.00 H new ATOM 0 HZ PHE A 25 18.561 -2.459 -7.555 1.00 0.00 H new ATOM 470 N ASP A 26 20.644 -4.019 -0.417 1.00 0.00 N ATOM 471 CA ASP A 26 22.058 -4.344 -0.280 1.00 0.00 C ATOM 472 C ASP A 26 22.411 -5.605 -1.068 1.00 0.00 C ATOM 473 O ASP A 26 21.711 -6.614 -0.992 1.00 0.00 O ATOM 474 CB ASP A 26 22.406 -4.518 1.197 1.00 0.00 C ATOM 475 CG ASP A 26 21.768 -5.752 1.809 1.00 0.00 C ATOM 476 OD1 ASP A 26 20.630 -6.087 1.415 1.00 0.00 O ATOM 477 OD2 ASP A 26 22.403 -6.380 2.680 1.00 0.00 O ATOM 0 H ASP A 26 20.052 -4.390 0.327 1.00 0.00 H new ATOM 0 HA ASP A 26 22.645 -3.522 -0.690 1.00 0.00 H new ATOM 0 HB2 ASP A 26 23.489 -4.582 1.306 1.00 0.00 H new ATOM 0 HB3 ASP A 26 22.082 -3.635 1.749 1.00 0.00 H new ATOM 482 N SER A 27 23.500 -5.533 -1.828 1.00 0.00 N ATOM 483 CA SER A 27 23.950 -6.660 -2.638 1.00 0.00 C ATOM 484 C SER A 27 24.209 -7.892 -1.774 1.00 0.00 C ATOM 485 O SER A 27 24.278 -7.802 -0.549 1.00 0.00 O ATOM 486 CB SER A 27 25.218 -6.285 -3.407 1.00 0.00 C ATOM 487 OG SER A 27 25.037 -6.454 -4.804 1.00 0.00 O ATOM 0 H SER A 27 24.089 -4.703 -1.900 1.00 0.00 H new ATOM 0 HA SER A 27 23.158 -6.902 -3.347 1.00 0.00 H new ATOM 0 HB2 SER A 27 25.483 -5.249 -3.194 1.00 0.00 H new ATOM 0 HB3 SER A 27 26.049 -6.903 -3.067 1.00 0.00 H new ATOM 0 HG SER A 27 25.861 -6.206 -5.273 1.00 0.00 H new ATOM 493 N SER A 28 24.352 -9.044 -2.427 1.00 0.00 N ATOM 494 CA SER A 28 24.603 -10.299 -1.727 1.00 0.00 C ATOM 495 C SER A 28 23.532 -10.564 -0.671 1.00 0.00 C ATOM 496 O SER A 28 23.764 -11.296 0.292 1.00 0.00 O ATOM 497 CB SER A 28 25.985 -10.273 -1.071 1.00 0.00 C ATOM 498 OG SER A 28 26.602 -11.547 -1.129 1.00 0.00 O ATOM 0 H SER A 28 24.298 -9.132 -3.442 1.00 0.00 H new ATOM 0 HA SER A 28 24.569 -11.105 -2.460 1.00 0.00 H new ATOM 0 HB2 SER A 28 26.615 -9.538 -1.572 1.00 0.00 H new ATOM 0 HB3 SER A 28 25.892 -9.958 -0.032 1.00 0.00 H new ATOM 0 HG SER A 28 27.484 -11.503 -0.705 1.00 0.00 H new ATOM 504 N ARG A 29 22.362 -9.962 -0.856 1.00 0.00 N ATOM 505 CA ARG A 29 21.260 -10.130 0.082 1.00 0.00 C ATOM 506 C ARG A 29 20.022 -10.684 -0.614 1.00 0.00 C ATOM 507 O ARG A 29 19.849 -10.518 -1.822 1.00 0.00 O ATOM 508 CB ARG A 29 20.927 -8.797 0.751 1.00 0.00 C ATOM 509 CG ARG A 29 20.018 -8.935 1.965 1.00 0.00 C ATOM 510 CD ARG A 29 18.636 -8.337 1.724 1.00 0.00 C ATOM 511 NE ARG A 29 18.243 -8.357 0.314 1.00 0.00 N ATOM 512 CZ ARG A 29 17.939 -7.273 -0.397 1.00 0.00 C ATOM 513 NH1 ARG A 29 18.004 -6.066 0.150 1.00 0.00 N ATOM 514 NH2 ARG A 29 17.573 -7.398 -1.665 1.00 0.00 N ATOM 0 H ARG A 29 22.153 -9.353 -1.647 1.00 0.00 H new ATOM 0 HA ARG A 29 21.574 -10.846 0.842 1.00 0.00 H new ATOM 0 HB2 ARG A 29 21.854 -8.311 1.055 1.00 0.00 H new ATOM 0 HB3 ARG A 29 20.449 -8.143 0.022 1.00 0.00 H new ATOM 0 HG2 ARG A 29 19.916 -9.989 2.221 1.00 0.00 H new ATOM 0 HG3 ARG A 29 20.480 -8.442 2.820 1.00 0.00 H new ATOM 0 HD2 ARG A 29 17.900 -8.889 2.309 1.00 0.00 H new ATOM 0 HD3 ARG A 29 18.623 -7.308 2.085 1.00 0.00 H new ATOM 0 HE ARG A 29 18.199 -9.262 -0.155 1.00 0.00 H new ATOM 0 HH11 ARG A 29 18.289 -5.962 1.124 1.00 0.00 H new ATOM 0 HH12 ARG A 29 17.769 -5.242 -0.403 1.00 0.00 H new ATOM 0 HH21 ARG A 29 17.525 -8.323 -2.093 1.00 0.00 H new ATOM 0 HH22 ARG A 29 17.339 -6.570 -2.212 1.00 0.00 H new ATOM 528 N THR A 30 19.164 -11.339 0.159 1.00 0.00 N ATOM 529 CA THR A 30 17.937 -11.918 -0.372 1.00 0.00 C ATOM 530 C THR A 30 16.724 -11.063 0.008 1.00 0.00 C ATOM 531 O THR A 30 16.506 -10.782 1.186 1.00 0.00 O ATOM 532 CB THR A 30 17.779 -13.348 0.148 1.00 0.00 C ATOM 533 OG1 THR A 30 17.010 -14.128 -0.748 1.00 0.00 O ATOM 534 CG2 THR A 30 17.124 -13.435 1.514 1.00 0.00 C ATOM 0 H THR A 30 19.297 -11.483 1.160 1.00 0.00 H new ATOM 0 HA THR A 30 17.997 -11.942 -1.460 1.00 0.00 H new ATOM 0 HB THR A 30 18.797 -13.729 0.233 1.00 0.00 H new ATOM 0 HG1 THR A 30 16.923 -15.039 -0.397 1.00 0.00 H new ATOM 0 HG21 THR A 30 17.047 -14.480 1.815 1.00 0.00 H new ATOM 0 HG22 THR A 30 17.727 -12.892 2.242 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.127 -12.996 1.468 1.00 0.00 H new ATOM 542 N PRO A 31 15.919 -10.634 -0.983 1.00 0.00 N ATOM 543 CA PRO A 31 14.733 -9.808 -0.731 1.00 0.00 C ATOM 544 C PRO A 31 13.777 -10.466 0.256 1.00 0.00 C ATOM 545 O PRO A 31 13.590 -11.682 0.235 1.00 0.00 O ATOM 546 CB PRO A 31 14.074 -9.671 -2.112 1.00 0.00 C ATOM 547 CG PRO A 31 14.706 -10.723 -2.958 1.00 0.00 C ATOM 548 CD PRO A 31 16.091 -10.916 -2.415 1.00 0.00 C ATOM 0 HA PRO A 31 14.996 -8.849 -0.283 1.00 0.00 H new ATOM 0 HB2 PRO A 31 12.995 -9.813 -2.048 1.00 0.00 H new ATOM 0 HB3 PRO A 31 14.240 -8.678 -2.530 1.00 0.00 H new ATOM 0 HG2 PRO A 31 14.137 -11.652 -2.915 1.00 0.00 H new ATOM 0 HG3 PRO A 31 14.736 -10.416 -4.004 1.00 0.00 H new ATOM 0 HD2 PRO A 31 16.456 -11.929 -2.587 1.00 0.00 H new ATOM 0 HD3 PRO A 31 16.806 -10.236 -2.879 1.00 0.00 H new ATOM 556 N SER A 32 13.173 -9.658 1.122 1.00 0.00 N ATOM 557 CA SER A 32 12.239 -10.179 2.113 1.00 0.00 C ATOM 558 C SER A 32 10.810 -9.755 1.793 1.00 0.00 C ATOM 559 O SER A 32 10.589 -8.715 1.178 1.00 0.00 O ATOM 560 CB SER A 32 12.626 -9.655 3.496 1.00 0.00 C ATOM 561 OG SER A 32 12.288 -10.585 4.511 1.00 0.00 O ATOM 0 H SER A 32 13.312 -8.648 1.158 1.00 0.00 H new ATOM 0 HA SER A 32 12.288 -11.268 2.096 1.00 0.00 H new ATOM 0 HB2 SER A 32 13.697 -9.455 3.525 1.00 0.00 H new ATOM 0 HB3 SER A 32 12.120 -8.708 3.684 1.00 0.00 H new ATOM 0 HG SER A 32 12.548 -10.225 5.384 1.00 0.00 H new ATOM 567 N ARG A 33 9.840 -10.557 2.233 1.00 0.00 N ATOM 568 CA ARG A 33 8.434 -10.235 2.006 1.00 0.00 C ATOM 569 C ARG A 33 7.984 -9.081 2.900 1.00 0.00 C ATOM 570 O ARG A 33 7.356 -8.131 2.437 1.00 0.00 O ATOM 571 CB ARG A 33 7.539 -11.470 2.203 1.00 0.00 C ATOM 572 CG ARG A 33 7.505 -12.023 3.621 1.00 0.00 C ATOM 573 CD ARG A 33 8.642 -12.999 3.876 1.00 0.00 C ATOM 574 NE ARG A 33 9.515 -12.552 4.958 1.00 0.00 N ATOM 575 CZ ARG A 33 10.548 -13.258 5.418 1.00 0.00 C ATOM 576 NH1 ARG A 33 10.840 -14.440 4.890 1.00 0.00 N ATOM 577 NH2 ARG A 33 11.288 -12.779 6.407 1.00 0.00 N ATOM 0 H ARG A 33 10.001 -11.425 2.743 1.00 0.00 H new ATOM 0 HA ARG A 33 8.331 -9.915 0.969 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.522 -11.214 1.905 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.880 -12.257 1.531 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.566 -11.200 4.333 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.552 -12.523 3.793 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.231 -13.978 4.123 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.227 -13.120 2.964 1.00 0.00 H new ATOM 0 HE ARG A 33 9.323 -11.647 5.387 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.273 -14.812 4.128 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.632 -14.976 5.246 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.067 -11.871 6.816 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.079 -13.318 6.760 1.00 0.00 H new ATOM 591 N GLU A 34 8.317 -9.178 4.185 1.00 0.00 N ATOM 592 CA GLU A 34 7.962 -8.156 5.165 1.00 0.00 C ATOM 593 C GLU A 34 8.828 -6.915 5.009 1.00 0.00 C ATOM 594 O GLU A 34 8.325 -5.793 4.984 1.00 0.00 O ATOM 595 CB GLU A 34 8.103 -8.717 6.583 1.00 0.00 C ATOM 596 CG GLU A 34 6.777 -9.082 7.228 1.00 0.00 C ATOM 597 CD GLU A 34 6.396 -10.532 6.998 1.00 0.00 C ATOM 598 OE1 GLU A 34 7.306 -11.385 6.942 1.00 0.00 O ATOM 599 OE2 GLU A 34 5.186 -10.814 6.872 1.00 0.00 O ATOM 0 H GLU A 34 8.838 -9.964 4.574 1.00 0.00 H new ATOM 0 HA GLU A 34 6.925 -7.869 4.991 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.738 -9.602 6.553 1.00 0.00 H new ATOM 0 HB3 GLU A 34 8.610 -7.981 7.207 1.00 0.00 H new ATOM 0 HG2 GLU A 34 6.834 -8.891 8.300 1.00 0.00 H new ATOM 0 HG3 GLU A 34 5.994 -8.437 6.830 1.00 0.00 H new ATOM 606 N GLU A 35 10.136 -7.120 4.928 1.00 0.00 N ATOM 607 CA GLU A 35 11.071 -6.012 4.808 1.00 0.00 C ATOM 608 C GLU A 35 10.776 -5.149 3.588 1.00 0.00 C ATOM 609 O GLU A 35 10.678 -3.935 3.701 1.00 0.00 O ATOM 610 CB GLU A 35 12.508 -6.535 4.737 1.00 0.00 C ATOM 611 CG GLU A 35 13.512 -5.655 5.462 1.00 0.00 C ATOM 612 CD GLU A 35 13.663 -6.024 6.924 1.00 0.00 C ATOM 613 OE1 GLU A 35 13.307 -7.165 7.287 1.00 0.00 O ATOM 614 OE2 GLU A 35 14.136 -5.173 7.707 1.00 0.00 O ATOM 0 H GLU A 35 10.572 -8.042 4.943 1.00 0.00 H new ATOM 0 HA GLU A 35 10.952 -5.390 5.695 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.542 -7.538 5.163 1.00 0.00 H new ATOM 0 HB3 GLU A 35 12.803 -6.623 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.481 -5.734 4.969 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.199 -4.614 5.385 1.00 0.00 H new ATOM 621 N ILE A 36 10.635 -5.765 2.423 1.00 0.00 N ATOM 622 CA ILE A 36 10.360 -5.005 1.206 1.00 0.00 C ATOM 623 C ILE A 36 8.971 -4.356 1.252 1.00 0.00 C ATOM 624 O ILE A 36 8.832 -3.155 1.064 1.00 0.00 O ATOM 625 CB ILE A 36 10.515 -5.895 -0.061 1.00 0.00 C ATOM 626 CG1 ILE A 36 10.795 -5.037 -1.298 1.00 0.00 C ATOM 627 CG2 ILE A 36 9.292 -6.775 -0.297 1.00 0.00 C ATOM 628 CD1 ILE A 36 9.599 -4.242 -1.778 1.00 0.00 C ATOM 0 H ILE A 36 10.705 -6.774 2.292 1.00 0.00 H new ATOM 0 HA ILE A 36 11.098 -4.205 1.148 1.00 0.00 H new ATOM 0 HB ILE A 36 11.366 -6.553 0.115 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.610 -4.349 -1.074 1.00 0.00 H new ATOM 0 HG13 ILE A 36 11.137 -5.683 -2.106 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.445 -7.378 -1.192 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.144 -7.430 0.562 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.412 -6.146 -0.430 1.00 0.00 H new ATOM 0 HD11 ILE A 36 9.878 -3.661 -2.657 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.789 -4.924 -2.036 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.269 -3.568 -0.987 1.00 0.00 H new ATOM 640 N LYS A 37 7.959 -5.167 1.495 1.00 0.00 N ATOM 641 CA LYS A 37 6.559 -4.708 1.552 1.00 0.00 C ATOM 642 C LYS A 37 6.248 -3.846 2.746 1.00 0.00 C ATOM 643 O LYS A 37 5.742 -2.740 2.592 1.00 0.00 O ATOM 644 CB LYS A 37 5.597 -5.895 1.508 1.00 0.00 C ATOM 645 CG LYS A 37 5.636 -6.667 0.200 1.00 0.00 C ATOM 646 CD LYS A 37 5.201 -8.113 0.394 1.00 0.00 C ATOM 647 CE LYS A 37 3.765 -8.330 -0.055 1.00 0.00 C ATOM 648 NZ LYS A 37 2.952 -9.001 0.998 1.00 0.00 N ATOM 0 H LYS A 37 8.071 -6.167 1.661 1.00 0.00 H new ATOM 0 HA LYS A 37 6.421 -4.082 0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.834 -6.574 2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 37 4.582 -5.535 1.677 1.00 0.00 H new ATOM 0 HG2 LYS A 37 4.984 -6.184 -0.528 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.646 -6.641 -0.209 1.00 0.00 H new ATOM 0 HD2 LYS A 37 5.862 -8.771 -0.169 1.00 0.00 H new ATOM 0 HD3 LYS A 37 5.299 -8.385 1.445 1.00 0.00 H new ATOM 0 HE2 LYS A 37 3.314 -7.370 -0.306 1.00 0.00 H new ATOM 0 HE3 LYS A 37 3.755 -8.934 -0.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 1.979 -9.132 0.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 3.368 -9.928 1.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 2.940 -8.412 1.855 1.00 0.00 H new ATOM 662 N GLU A 38 6.518 -4.319 3.925 1.00 0.00 N ATOM 663 CA GLU A 38 6.211 -3.515 5.072 1.00 0.00 C ATOM 664 C GLU A 38 7.019 -2.221 5.052 1.00 0.00 C ATOM 665 O GLU A 38 6.458 -1.136 5.137 1.00 0.00 O ATOM 666 CB GLU A 38 6.465 -4.285 6.339 1.00 0.00 C ATOM 667 CG GLU A 38 5.699 -5.594 6.428 1.00 0.00 C ATOM 668 CD GLU A 38 5.734 -6.195 7.819 1.00 0.00 C ATOM 669 OE1 GLU A 38 6.846 -6.393 8.353 1.00 0.00 O ATOM 670 OE2 GLU A 38 4.649 -6.471 8.376 1.00 0.00 O ATOM 0 H GLU A 38 6.937 -5.229 4.118 1.00 0.00 H new ATOM 0 HA GLU A 38 5.153 -3.255 5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.532 -4.494 6.418 1.00 0.00 H new ATOM 0 HB3 GLU A 38 6.198 -3.661 7.192 1.00 0.00 H new ATOM 0 HG2 GLU A 38 4.663 -5.425 6.135 1.00 0.00 H new ATOM 0 HG3 GLU A 38 6.119 -6.306 5.718 1.00 0.00 H new ATOM 677 N LEU A 39 8.333 -2.317 4.916 1.00 0.00 N ATOM 678 CA LEU A 39 9.148 -1.113 4.887 1.00 0.00 C ATOM 679 C LEU A 39 8.644 -0.142 3.818 1.00 0.00 C ATOM 680 O LEU A 39 8.725 1.071 4.001 1.00 0.00 O ATOM 681 CB LEU A 39 10.626 -1.465 4.686 1.00 0.00 C ATOM 682 CG LEU A 39 11.447 -0.451 3.904 1.00 0.00 C ATOM 683 CD1 LEU A 39 12.896 -0.457 4.368 1.00 0.00 C ATOM 684 CD2 LEU A 39 11.356 -0.748 2.419 1.00 0.00 C ATOM 0 H LEU A 39 8.847 -3.193 4.826 1.00 0.00 H new ATOM 0 HA LEU A 39 9.059 -0.610 5.850 1.00 0.00 H new ATOM 0 HB2 LEU A 39 11.085 -1.598 5.666 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.685 -2.425 4.173 1.00 0.00 H new ATOM 0 HG LEU A 39 11.042 0.544 4.088 1.00 0.00 H new ATOM 0 HD11 LEU A 39 13.465 0.276 3.795 1.00 0.00 H new ATOM 0 HD12 LEU A 39 12.940 -0.203 5.427 1.00 0.00 H new ATOM 0 HD13 LEU A 39 13.323 -1.448 4.215 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.946 -0.018 1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.741 -1.749 2.224 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.315 -0.691 2.100 1.00 0.00 H new ATOM 696 N ILE A 40 8.096 -0.668 2.722 1.00 0.00 N ATOM 697 CA ILE A 40 7.566 0.200 1.676 1.00 0.00 C ATOM 698 C ILE A 40 6.214 0.796 2.066 1.00 0.00 C ATOM 699 O ILE A 40 6.065 2.007 2.031 1.00 0.00 O ATOM 700 CB ILE A 40 7.514 -0.478 0.291 1.00 0.00 C ATOM 701 CG1 ILE A 40 6.559 -1.651 0.274 1.00 0.00 C ATOM 702 CG2 ILE A 40 8.912 -0.930 -0.112 1.00 0.00 C ATOM 703 CD1 ILE A 40 6.607 -2.412 -1.027 1.00 0.00 C ATOM 0 H ILE A 40 8.009 -1.668 2.539 1.00 0.00 H new ATOM 0 HA ILE A 40 8.275 1.023 1.581 1.00 0.00 H new ATOM 0 HB ILE A 40 7.144 0.253 -0.428 1.00 0.00 H new ATOM 0 HG12 ILE A 40 6.801 -2.325 1.095 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.544 -1.292 0.445 1.00 0.00 H new ATOM 0 HG21 ILE A 40 8.872 -1.408 -1.091 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.575 -0.066 -0.158 1.00 0.00 H new ATOM 0 HG23 ILE A 40 9.291 -1.640 0.623 1.00 0.00 H new ATOM 0 HD11 ILE A 40 5.904 -3.244 -0.988 1.00 0.00 H new ATOM 0 HD12 ILE A 40 6.338 -1.747 -1.848 1.00 0.00 H new ATOM 0 HD13 ILE A 40 7.614 -2.796 -1.187 1.00 0.00 H new ATOM 715 N ALA A 41 5.241 -0.032 2.457 1.00 0.00 N ATOM 716 CA ALA A 41 3.915 0.478 2.858 1.00 0.00 C ATOM 717 C ALA A 41 3.986 1.364 4.085 1.00 0.00 C ATOM 718 O ALA A 41 3.412 2.463 4.142 1.00 0.00 O ATOM 719 CB ALA A 41 2.970 -0.656 3.192 1.00 0.00 C ATOM 0 H ALA A 41 5.338 -1.046 2.506 1.00 0.00 H new ATOM 0 HA ALA A 41 3.554 1.052 2.004 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.002 -0.249 3.484 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.846 -1.296 2.318 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.380 -1.241 4.015 1.00 0.00 H new ATOM 725 N LYS A 42 4.664 0.853 5.083 1.00 0.00 N ATOM 726 CA LYS A 42 4.780 1.539 6.340 1.00 0.00 C ATOM 727 C LYS A 42 5.317 2.936 6.107 1.00 0.00 C ATOM 728 O LYS A 42 4.661 3.917 6.475 1.00 0.00 O ATOM 729 CB LYS A 42 5.636 0.674 7.264 1.00 0.00 C ATOM 730 CG LYS A 42 5.126 -0.775 7.292 1.00 0.00 C ATOM 731 CD LYS A 42 5.720 -1.583 8.432 1.00 0.00 C ATOM 732 CE LYS A 42 4.836 -2.780 8.768 1.00 0.00 C ATOM 733 NZ LYS A 42 4.033 -2.551 10.002 1.00 0.00 N ATOM 0 H LYS A 42 5.147 -0.045 5.045 1.00 0.00 H new ATOM 0 HA LYS A 42 3.816 1.679 6.830 1.00 0.00 H new ATOM 0 HB2 LYS A 42 6.673 0.692 6.927 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.621 1.088 8.272 1.00 0.00 H new ATOM 0 HG2 LYS A 42 4.040 -0.772 7.382 1.00 0.00 H new ATOM 0 HG3 LYS A 42 5.366 -1.259 6.345 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.717 -1.928 8.158 1.00 0.00 H new ATOM 0 HD3 LYS A 42 5.832 -0.950 9.312 1.00 0.00 H new ATOM 0 HE2 LYS A 42 4.166 -2.982 7.932 1.00 0.00 H new ATOM 0 HE3 LYS A 42 5.458 -3.665 8.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 3.775 -3.466 10.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.594 -2.002 10.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 3.169 -2.025 9.761 1.00 0.00 H new ATOM 747 N HIS A 43 6.425 3.032 5.381 1.00 0.00 N ATOM 748 CA HIS A 43 6.969 4.327 5.002 1.00 0.00 C ATOM 749 C HIS A 43 5.962 5.025 4.126 1.00 0.00 C ATOM 750 O HIS A 43 5.670 6.205 4.285 1.00 0.00 O ATOM 751 CB HIS A 43 8.235 4.157 4.189 1.00 0.00 C ATOM 752 CG HIS A 43 9.495 4.207 4.998 1.00 0.00 C ATOM 753 ND1 HIS A 43 10.109 5.387 5.361 1.00 0.00 N ATOM 754 CD2 HIS A 43 10.256 3.214 5.514 1.00 0.00 C ATOM 755 CE1 HIS A 43 11.193 5.117 6.067 1.00 0.00 C ATOM 756 NE2 HIS A 43 11.305 3.806 6.174 1.00 0.00 N ATOM 0 H HIS A 43 6.961 2.232 5.045 1.00 0.00 H new ATOM 0 HA HIS A 43 7.187 4.895 5.906 1.00 0.00 H new ATOM 0 HB2 HIS A 43 8.191 3.203 3.664 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.273 4.937 3.429 1.00 0.00 H new ATOM 0 HD2 HIS A 43 10.073 2.154 5.424 1.00 0.00 H new ATOM 0 HE1 HIS A 43 11.872 5.845 6.485 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.050 3.313 6.667 1.00 0.00 H new ATOM 765 N GLU A 44 5.426 4.241 3.201 1.00 0.00 N ATOM 766 CA GLU A 44 4.425 4.689 2.254 1.00 0.00 C ATOM 767 C GLU A 44 3.356 5.521 2.931 1.00 0.00 C ATOM 768 O GLU A 44 2.596 6.231 2.275 1.00 0.00 O ATOM 769 CB GLU A 44 3.816 3.489 1.571 1.00 0.00 C ATOM 770 CG GLU A 44 4.327 3.275 0.156 1.00 0.00 C ATOM 771 CD GLU A 44 4.910 1.909 -0.104 1.00 0.00 C ATOM 772 OE1 GLU A 44 4.173 0.908 0.001 1.00 0.00 O ATOM 773 OE2 GLU A 44 6.111 1.843 -0.428 1.00 0.00 O ATOM 0 H GLU A 44 5.682 3.260 3.089 1.00 0.00 H new ATOM 0 HA GLU A 44 4.905 5.326 1.511 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.025 2.598 2.163 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.733 3.607 1.544 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.506 3.443 -0.541 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.087 4.026 -0.059 1.00 0.00 H new ATOM 780 N GLY A 45 3.287 5.412 4.243 1.00 0.00 N ATOM 781 CA GLY A 45 2.299 6.145 4.980 1.00 0.00 C ATOM 782 C GLY A 45 1.166 5.218 5.317 1.00 0.00 C ATOM 783 O GLY A 45 0.011 5.632 5.416 1.00 0.00 O ATOM 0 H GLY A 45 3.901 4.826 4.809 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.735 6.556 5.891 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.936 6.988 4.391 1.00 0.00 H new ATOM 787 N VAL A 46 1.497 3.927 5.401 1.00 0.00 N ATOM 788 CA VAL A 46 0.483 2.908 5.626 1.00 0.00 C ATOM 789 C VAL A 46 1.012 1.651 6.315 1.00 0.00 C ATOM 790 O VAL A 46 2.209 1.461 6.440 1.00 0.00 O ATOM 791 CB VAL A 46 -0.162 2.536 4.285 1.00 0.00 C ATOM 792 CG1 VAL A 46 -1.364 3.437 4.021 1.00 0.00 C ATOM 793 CG2 VAL A 46 0.855 2.641 3.141 1.00 0.00 C ATOM 0 H VAL A 46 2.449 3.571 5.317 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.251 3.338 6.307 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.501 1.501 4.336 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -1.818 3.168 3.067 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -2.095 3.311 4.819 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -1.039 4.477 3.988 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.374 2.372 2.201 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.228 3.663 3.079 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.687 1.962 3.330 1.00 0.00 H new ATOM 803 N ASP A 47 0.097 0.789 6.754 1.00 0.00 N ATOM 804 CA ASP A 47 0.463 -0.461 7.430 1.00 0.00 C ATOM 805 C ASP A 47 0.853 -1.565 6.440 1.00 0.00 C ATOM 806 O ASP A 47 0.868 -1.361 5.226 1.00 0.00 O ATOM 807 CB ASP A 47 -0.702 -0.948 8.287 1.00 0.00 C ATOM 808 CG ASP A 47 -1.377 0.175 9.050 1.00 0.00 C ATOM 809 OD1 ASP A 47 -0.660 1.050 9.577 1.00 0.00 O ATOM 810 OD2 ASP A 47 -2.625 0.179 9.119 1.00 0.00 O ATOM 0 H ASP A 47 -0.908 0.931 6.655 1.00 0.00 H new ATOM 0 HA ASP A 47 1.331 -0.247 8.053 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -1.436 -1.441 7.649 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -0.341 -1.696 8.993 1.00 0.00 H new ATOM 815 N LYS A 48 1.165 -2.743 6.990 1.00 0.00 N ATOM 816 CA LYS A 48 1.564 -3.915 6.209 1.00 0.00 C ATOM 817 C LYS A 48 0.408 -4.475 5.381 1.00 0.00 C ATOM 818 O LYS A 48 0.621 -5.114 4.354 1.00 0.00 O ATOM 819 CB LYS A 48 2.108 -5.004 7.137 1.00 0.00 C ATOM 820 CG LYS A 48 1.061 -5.590 8.073 1.00 0.00 C ATOM 821 CD LYS A 48 1.043 -4.871 9.411 1.00 0.00 C ATOM 822 CE LYS A 48 0.602 -5.794 10.536 1.00 0.00 C ATOM 823 NZ LYS A 48 0.901 -5.220 11.876 1.00 0.00 N ATOM 0 H LYS A 48 1.147 -2.910 7.996 1.00 0.00 H new ATOM 0 HA LYS A 48 2.343 -3.594 5.517 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.531 -5.806 6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.922 -4.589 7.731 1.00 0.00 H new ATOM 0 HG2 LYS A 48 0.077 -5.521 7.609 1.00 0.00 H new ATOM 0 HG3 LYS A 48 1.265 -6.649 8.231 1.00 0.00 H new ATOM 0 HD2 LYS A 48 2.037 -4.481 9.628 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.370 -4.016 9.356 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.468 -5.982 10.453 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.104 -6.756 10.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.585 -5.880 12.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.925 -5.064 11.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.402 -4.314 11.985 1.00 0.00 H new ATOM 837 N GLU A 49 -0.815 -4.257 5.835 1.00 0.00 N ATOM 838 CA GLU A 49 -1.983 -4.758 5.118 1.00 0.00 C ATOM 839 C GLU A 49 -2.217 -3.934 3.853 1.00 0.00 C ATOM 840 O GLU A 49 -2.554 -4.464 2.802 1.00 0.00 O ATOM 841 CB GLU A 49 -3.212 -4.704 6.019 1.00 0.00 C ATOM 842 CG GLU A 49 -3.684 -6.068 6.491 1.00 0.00 C ATOM 843 CD GLU A 49 -3.912 -7.035 5.344 1.00 0.00 C ATOM 844 OE1 GLU A 49 -4.972 -6.941 4.689 1.00 0.00 O ATOM 845 OE2 GLU A 49 -3.030 -7.886 5.100 1.00 0.00 O ATOM 0 H GLU A 49 -1.027 -3.741 6.689 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.804 -5.794 4.831 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.987 -4.086 6.889 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.024 -4.214 5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.945 -6.488 7.174 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.610 -5.953 7.054 1.00 0.00 H new ATOM 852 N LEU A 50 -2.054 -2.630 3.997 1.00 0.00 N ATOM 853 CA LEU A 50 -2.248 -1.662 2.944 1.00 0.00 C ATOM 854 C LEU A 50 -1.111 -1.625 1.925 1.00 0.00 C ATOM 855 O LEU A 50 -0.973 -0.632 1.233 1.00 0.00 O ATOM 856 CB LEU A 50 -2.377 -0.265 3.588 1.00 0.00 C ATOM 857 CG LEU A 50 -2.756 -0.214 5.082 1.00 0.00 C ATOM 858 CD1 LEU A 50 -3.115 1.207 5.489 1.00 0.00 C ATOM 859 CD2 LEU A 50 -3.907 -1.162 5.414 1.00 0.00 C ATOM 0 H LEU A 50 -1.774 -2.207 4.882 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.147 -1.954 2.402 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.427 0.255 3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.125 0.297 3.030 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.885 -0.543 5.649 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.380 1.227 6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.261 1.862 5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.962 1.552 4.896 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.140 -1.093 6.477 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.786 -0.886 4.831 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.618 -2.185 5.172 1.00 0.00 H new ATOM 871 N VAL A 51 -0.285 -2.668 1.814 1.00 0.00 N ATOM 872 CA VAL A 51 0.816 -2.589 0.850 1.00 0.00 C ATOM 873 C VAL A 51 0.554 -3.301 -0.480 1.00 0.00 C ATOM 874 O VAL A 51 0.542 -4.530 -0.551 1.00 0.00 O ATOM 875 CB VAL A 51 2.097 -3.220 1.437 1.00 0.00 C ATOM 876 CG1 VAL A 51 3.322 -2.439 1.009 1.00 0.00 C ATOM 877 CG2 VAL A 51 2.016 -3.334 2.957 1.00 0.00 C ATOM 0 H VAL A 51 -0.348 -3.535 2.348 1.00 0.00 H new ATOM 0 HA VAL A 51 0.923 -1.522 0.655 1.00 0.00 H new ATOM 0 HB VAL A 51 2.185 -4.232 1.041 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.214 -2.900 1.433 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.394 -2.442 -0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.241 -1.412 1.364 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.934 -3.782 3.338 1.00 0.00 H new ATOM 0 HG22 VAL A 51 1.890 -2.342 3.390 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.166 -3.960 3.230 1.00 0.00 H new ATOM 887 N ILE A 52 0.473 -2.505 -1.549 1.00 0.00 N ATOM 888 CA ILE A 52 0.362 -3.024 -2.908 1.00 0.00 C ATOM 889 C ILE A 52 1.341 -2.275 -3.815 1.00 0.00 C ATOM 890 O ILE A 52 1.075 -1.128 -4.174 1.00 0.00 O ATOM 891 CB ILE A 52 -1.069 -2.931 -3.490 1.00 0.00 C ATOM 892 CG1 ILE A 52 -1.763 -1.642 -3.040 1.00 0.00 C ATOM 893 CG2 ILE A 52 -1.876 -4.164 -3.096 1.00 0.00 C ATOM 894 CD1 ILE A 52 -3.255 -1.620 -3.298 1.00 0.00 C ATOM 0 H ILE A 52 0.483 -1.487 -1.494 1.00 0.00 H new ATOM 0 HA ILE A 52 0.607 -4.085 -2.864 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.002 -2.900 -4.577 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.588 -1.501 -1.973 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.304 -0.797 -3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.881 -4.089 -3.510 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.389 -5.058 -3.486 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -1.935 -4.228 -2.010 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.670 -0.674 -2.951 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.441 -1.728 -4.367 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -3.729 -2.443 -2.763 1.00 0.00 H new ATOM 906 N VAL A 53 2.453 -2.883 -4.212 1.00 0.00 N ATOM 907 CA VAL A 53 3.389 -2.176 -5.089 1.00 0.00 C ATOM 908 C VAL A 53 3.863 -3.060 -6.247 1.00 0.00 C ATOM 909 O VAL A 53 4.538 -4.071 -6.043 1.00 0.00 O ATOM 910 CB VAL A 53 4.599 -1.586 -4.306 1.00 0.00 C ATOM 911 CG1 VAL A 53 4.204 -1.160 -2.897 1.00 0.00 C ATOM 912 CG2 VAL A 53 5.762 -2.556 -4.240 1.00 0.00 C ATOM 0 H VAL A 53 2.726 -3.831 -3.954 1.00 0.00 H new ATOM 0 HA VAL A 53 2.838 -1.337 -5.515 1.00 0.00 H new ATOM 0 HB VAL A 53 4.920 -0.704 -4.861 1.00 0.00 H new ATOM 0 HG11 VAL A 53 5.075 -0.754 -2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.426 -0.398 -2.952 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.828 -2.023 -2.348 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.583 -2.102 -3.685 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.445 -3.470 -3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.095 -2.794 -5.250 1.00 0.00 H new ATOM 922 N ASP A 54 3.486 -2.668 -7.463 1.00 0.00 N ATOM 923 CA ASP A 54 3.847 -3.408 -8.672 1.00 0.00 C ATOM 924 C ASP A 54 4.761 -2.598 -9.597 1.00 0.00 C ATOM 925 O ASP A 54 4.749 -1.367 -9.579 1.00 0.00 O ATOM 926 CB ASP A 54 2.587 -3.823 -9.434 1.00 0.00 C ATOM 927 CG ASP A 54 1.863 -4.975 -8.768 1.00 0.00 C ATOM 928 OD1 ASP A 54 2.259 -6.138 -8.998 1.00 0.00 O ATOM 929 OD2 ASP A 54 0.900 -4.716 -8.014 1.00 0.00 O ATOM 0 H ASP A 54 2.925 -1.834 -7.638 1.00 0.00 H new ATOM 0 HA ASP A 54 4.397 -4.293 -8.353 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.914 -2.969 -9.510 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.858 -4.107 -10.451 1.00 0.00 H new ATOM 934 N ASN A 55 5.525 -3.309 -10.428 1.00 0.00 N ATOM 935 CA ASN A 55 6.426 -2.688 -11.405 1.00 0.00 C ATOM 936 C ASN A 55 7.654 -2.036 -10.755 1.00 0.00 C ATOM 937 O ASN A 55 8.662 -2.706 -10.535 1.00 0.00 O ATOM 938 CB ASN A 55 5.664 -1.673 -12.266 1.00 0.00 C ATOM 939 CG ASN A 55 6.545 -1.021 -13.314 1.00 0.00 C ATOM 940 OD1 ASN A 55 7.348 -0.141 -13.006 1.00 0.00 O ATOM 941 ND2 ASN A 55 6.399 -1.453 -14.562 1.00 0.00 N ATOM 0 H ASN A 55 5.538 -4.329 -10.444 1.00 0.00 H new ATOM 0 HA ASN A 55 6.801 -3.489 -12.042 1.00 0.00 H new ATOM 0 HB2 ASN A 55 4.830 -2.173 -12.758 1.00 0.00 H new ATOM 0 HB3 ASN A 55 5.239 -0.902 -11.623 1.00 0.00 H new ATOM 0 HD21 ASN A 55 6.965 -1.053 -15.310 1.00 0.00 H new ATOM 0 HD22 ASN A 55 5.721 -2.185 -14.772 1.00 0.00 H new ATOM 948 N ASN A 56 7.572 -0.727 -10.477 1.00 0.00 N ATOM 949 CA ASN A 56 8.683 0.023 -9.877 1.00 0.00 C ATOM 950 C ASN A 56 9.601 0.598 -10.962 1.00 0.00 C ATOM 951 O ASN A 56 10.322 -0.141 -11.631 1.00 0.00 O ATOM 952 CB ASN A 56 9.495 -0.847 -8.911 1.00 0.00 C ATOM 953 CG ASN A 56 8.610 -1.660 -7.982 1.00 0.00 C ATOM 954 OD1 ASN A 56 7.458 -1.305 -7.737 1.00 0.00 O ATOM 955 ND2 ASN A 56 9.146 -2.756 -7.459 1.00 0.00 N ATOM 0 H ASN A 56 6.742 -0.163 -10.660 1.00 0.00 H new ATOM 0 HA ASN A 56 8.248 0.845 -9.309 1.00 0.00 H new ATOM 0 HB2 ASN A 56 10.134 -1.521 -9.482 1.00 0.00 H new ATOM 0 HB3 ASN A 56 10.152 -0.211 -8.318 1.00 0.00 H new ATOM 0 HD21 ASN A 56 8.598 -3.340 -6.827 1.00 0.00 H new ATOM 0 HD22 ASN A 56 10.106 -3.014 -7.689 1.00 0.00 H new ATOM 962 N LYS A 57 9.571 1.923 -11.124 1.00 0.00 N ATOM 963 CA LYS A 57 10.402 2.598 -12.122 1.00 0.00 C ATOM 964 C LYS A 57 11.846 2.695 -11.629 1.00 0.00 C ATOM 965 O LYS A 57 12.135 3.369 -10.645 1.00 0.00 O ATOM 966 CB LYS A 57 9.842 4.002 -12.421 1.00 0.00 C ATOM 967 CG LYS A 57 10.210 5.061 -11.381 1.00 0.00 C ATOM 968 CD LYS A 57 9.070 6.041 -11.132 1.00 0.00 C ATOM 969 CE LYS A 57 9.441 7.078 -10.077 1.00 0.00 C ATOM 970 NZ LYS A 57 9.217 8.467 -10.564 1.00 0.00 N ATOM 0 H LYS A 57 8.980 2.549 -10.577 1.00 0.00 H new ATOM 0 HA LYS A 57 10.387 2.015 -13.043 1.00 0.00 H new ATOM 0 HB2 LYS A 57 10.206 4.325 -13.396 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.756 3.940 -12.491 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.477 4.571 -10.445 1.00 0.00 H new ATOM 0 HG3 LYS A 57 11.091 5.608 -11.717 1.00 0.00 H new ATOM 0 HD2 LYS A 57 8.813 6.545 -12.064 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.184 5.495 -10.810 1.00 0.00 H new ATOM 0 HE2 LYS A 57 8.850 6.909 -9.177 1.00 0.00 H new ATOM 0 HE3 LYS A 57 10.488 6.955 -9.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 9.481 9.143 -9.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.800 8.637 -11.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 8.213 8.592 -10.806 1.00 0.00 H new ATOM 984 N GLN A 58 12.749 2.008 -12.306 1.00 0.00 N ATOM 985 CA GLN A 58 14.150 2.010 -11.906 1.00 0.00 C ATOM 986 C GLN A 58 14.925 3.155 -12.552 1.00 0.00 C ATOM 987 O GLN A 58 14.853 3.367 -13.763 1.00 0.00 O ATOM 988 CB GLN A 58 14.803 0.675 -12.262 1.00 0.00 C ATOM 989 CG GLN A 58 15.826 0.207 -11.238 1.00 0.00 C ATOM 990 CD GLN A 58 16.340 -1.190 -11.525 1.00 0.00 C ATOM 991 OE1 GLN A 58 17.550 -1.418 -11.583 1.00 0.00 O ATOM 992 NE2 GLN A 58 15.425 -2.134 -11.706 1.00 0.00 N ATOM 0 H GLN A 58 12.542 1.444 -13.130 1.00 0.00 H new ATOM 0 HA GLN A 58 14.181 2.155 -10.826 1.00 0.00 H new ATOM 0 HB2 GLN A 58 14.027 -0.084 -12.362 1.00 0.00 H new ATOM 0 HB3 GLN A 58 15.288 0.765 -13.234 1.00 0.00 H new ATOM 0 HG2 GLN A 58 16.665 0.903 -11.223 1.00 0.00 H new ATOM 0 HG3 GLN A 58 15.377 0.228 -10.245 1.00 0.00 H new ATOM 0 HE21 GLN A 58 14.434 -1.901 -11.649 1.00 0.00 H new ATOM 0 HE22 GLN A 58 15.713 -3.093 -11.902 1.00 0.00 H new ATOM 1001 N LEU A 59 15.695 3.863 -11.733 1.00 0.00 N ATOM 1002 CA LEU A 59 16.528 4.959 -12.206 1.00 0.00 C ATOM 1003 C LEU A 59 17.973 4.615 -11.903 1.00 0.00 C ATOM 1004 O LEU A 59 18.370 4.515 -10.742 1.00 0.00 O ATOM 1005 CB LEU A 59 16.152 6.308 -11.562 1.00 0.00 C ATOM 1006 CG LEU A 59 15.110 6.268 -10.441 1.00 0.00 C ATOM 1007 CD1 LEU A 59 13.781 5.739 -10.956 1.00 0.00 C ATOM 1008 CD2 LEU A 59 15.609 5.436 -9.268 1.00 0.00 C ATOM 0 H LEU A 59 15.758 3.694 -10.729 1.00 0.00 H new ATOM 0 HA LEU A 59 16.372 5.078 -13.278 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.061 6.761 -11.166 1.00 0.00 H new ATOM 0 HB3 LEU A 59 15.783 6.968 -12.347 1.00 0.00 H new ATOM 0 HG LEU A 59 14.952 7.287 -10.088 1.00 0.00 H new ATOM 0 HD11 LEU A 59 13.057 5.720 -10.142 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.415 6.388 -11.752 1.00 0.00 H new ATOM 0 HD13 LEU A 59 13.917 4.730 -11.344 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.852 5.422 -8.484 1.00 0.00 H new ATOM 0 HD22 LEU A 59 15.805 4.417 -9.602 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.528 5.872 -8.877 1.00 0.00 H new ATOM 1020 N THR A 60 18.740 4.386 -12.951 1.00 0.00 N ATOM 1021 CA THR A 60 20.128 3.997 -12.804 1.00 0.00 C ATOM 1022 C THR A 60 20.962 5.037 -12.092 1.00 0.00 C ATOM 1023 O THR A 60 20.507 6.145 -11.807 1.00 0.00 O ATOM 1024 CB THR A 60 20.723 3.680 -14.158 1.00 0.00 C ATOM 1025 OG1 THR A 60 20.362 4.661 -15.115 1.00 0.00 O ATOM 1026 CG2 THR A 60 20.260 2.345 -14.660 1.00 0.00 C ATOM 0 H THR A 60 18.423 4.463 -13.917 1.00 0.00 H new ATOM 0 HA THR A 60 20.143 3.106 -12.177 1.00 0.00 H new ATOM 0 HB THR A 60 21.805 3.667 -14.028 1.00 0.00 H new ATOM 0 HG1 THR A 60 20.760 4.435 -15.981 1.00 0.00 H new ATOM 0 HG21 THR A 60 20.706 2.148 -15.635 1.00 0.00 H new ATOM 0 HG22 THR A 60 20.563 1.568 -13.959 1.00 0.00 H new ATOM 0 HG23 THR A 60 19.174 2.348 -14.752 1.00 0.00 H new ATOM 1034 N GLY A 61 22.192 4.648 -11.797 1.00 0.00 N ATOM 1035 CA GLY A 61 23.102 5.520 -11.104 1.00 0.00 C ATOM 1036 C GLY A 61 23.379 5.032 -9.695 1.00 0.00 C ATOM 1037 O GLY A 61 24.385 5.398 -9.084 1.00 0.00 O ATOM 0 H GLY A 61 22.575 3.732 -12.030 1.00 0.00 H new ATOM 0 HA2 GLY A 61 24.038 5.584 -11.658 1.00 0.00 H new ATOM 0 HA3 GLY A 61 22.685 6.526 -11.066 1.00 0.00 H new ATOM 1041 N LYS A 62 22.483 4.187 -9.188 1.00 0.00 N ATOM 1042 CA LYS A 62 22.617 3.620 -7.850 1.00 0.00 C ATOM 1043 C LYS A 62 22.302 2.123 -7.883 1.00 0.00 C ATOM 1044 O LYS A 62 22.348 1.500 -8.943 1.00 0.00 O ATOM 1045 CB LYS A 62 21.680 4.341 -6.874 1.00 0.00 C ATOM 1046 CG LYS A 62 21.806 5.855 -6.915 1.00 0.00 C ATOM 1047 CD LYS A 62 22.960 6.338 -6.050 1.00 0.00 C ATOM 1048 CE LYS A 62 22.635 6.226 -4.567 1.00 0.00 C ATOM 1049 NZ LYS A 62 21.545 7.156 -4.164 1.00 0.00 N ATOM 0 H LYS A 62 21.650 3.879 -9.690 1.00 0.00 H new ATOM 0 HA LYS A 62 23.643 3.755 -7.509 1.00 0.00 H new ATOM 0 HB2 LYS A 62 20.650 4.064 -7.101 1.00 0.00 H new ATOM 0 HB3 LYS A 62 21.888 3.995 -5.861 1.00 0.00 H new ATOM 0 HG2 LYS A 62 21.959 6.181 -7.944 1.00 0.00 H new ATOM 0 HG3 LYS A 62 20.876 6.309 -6.571 1.00 0.00 H new ATOM 0 HD2 LYS A 62 23.852 5.752 -6.273 1.00 0.00 H new ATOM 0 HD3 LYS A 62 23.190 7.375 -6.295 1.00 0.00 H new ATOM 0 HE2 LYS A 62 22.342 5.202 -4.336 1.00 0.00 H new ATOM 0 HE3 LYS A 62 23.530 6.441 -3.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 21.557 7.278 -3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 21.688 8.078 -4.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 20.627 6.762 -4.455 1.00 0.00 H new ATOM 1063 N HIS A 63 21.982 1.550 -6.725 1.00 0.00 N ATOM 1064 CA HIS A 63 21.664 0.127 -6.642 1.00 0.00 C ATOM 1065 C HIS A 63 20.349 -0.094 -5.903 1.00 0.00 C ATOM 1066 O HIS A 63 20.188 -1.079 -5.185 1.00 0.00 O ATOM 1067 CB HIS A 63 22.792 -0.634 -5.937 1.00 0.00 C ATOM 1068 CG HIS A 63 24.158 -0.087 -6.218 1.00 0.00 C ATOM 1069 ND1 HIS A 63 24.704 0.971 -5.521 1.00 0.00 N ATOM 1070 CD2 HIS A 63 25.092 -0.457 -7.128 1.00 0.00 C ATOM 1071 CE1 HIS A 63 25.911 1.229 -5.990 1.00 0.00 C ATOM 1072 NE2 HIS A 63 26.171 0.375 -6.964 1.00 0.00 N ATOM 0 H HIS A 63 21.936 2.047 -5.835 1.00 0.00 H new ATOM 0 HA HIS A 63 21.560 -0.254 -7.658 1.00 0.00 H new ATOM 0 HB2 HIS A 63 22.616 -0.612 -4.862 1.00 0.00 H new ATOM 0 HB3 HIS A 63 22.759 -1.679 -6.244 1.00 0.00 H new ATOM 0 HD2 HIS A 63 25.004 -1.257 -7.848 1.00 0.00 H new ATOM 0 HE1 HIS A 63 26.573 2.006 -5.637 1.00 0.00 H new ATOM 0 HE2 HIS A 63 27.034 0.340 -7.506 1.00 0.00 H new ATOM 1081 N GLU A 64 19.422 0.843 -6.064 1.00 0.00 N ATOM 1082 CA GLU A 64 18.141 0.786 -5.413 1.00 0.00 C ATOM 1083 C GLU A 64 17.040 0.953 -6.443 1.00 10.00 C ATOM 1084 O GLU A 64 17.290 1.453 -7.541 1.00 10.00 O ATOM 1085 CB GLU A 64 18.103 1.832 -4.321 1.00 0.00 C ATOM 1086 CG GLU A 64 19.266 1.650 -3.361 1.00 0.00 C ATOM 1087 CD GLU A 64 20.491 2.448 -3.761 1.00 0.00 C ATOM 1088 OE1 GLU A 64 20.458 3.688 -3.636 1.00 0.00 O ATOM 1089 OE2 GLU A 64 21.484 1.830 -4.200 1.00 0.00 O ATOM 0 H GLU A 64 19.549 1.664 -6.656 1.00 0.00 H new ATOM 0 HA GLU A 64 17.980 -0.183 -4.941 1.00 0.00 H new ATOM 0 HB2 GLU A 64 18.142 2.828 -4.763 1.00 0.00 H new ATOM 0 HB3 GLU A 64 17.161 1.762 -3.776 1.00 0.00 H new ATOM 0 HG2 GLU A 64 18.955 1.949 -2.360 1.00 0.00 H new ATOM 0 HG3 GLU A 64 19.527 0.593 -3.311 1.00 0.00 H new ATOM 1096 N ILE A 65 15.844 0.482 -6.132 1.00 10.00 N ATOM 1097 CA ILE A 65 14.759 0.538 -7.096 1.00 0.00 C ATOM 1098 C ILE A 65 13.687 1.516 -6.654 1.00 0.00 C ATOM 1099 O ILE A 65 13.289 1.564 -5.490 1.00 0.00 O ATOM 1100 CB ILE A 65 14.127 -0.857 -7.289 1.00 0.00 C ATOM 1101 CG1 ILE A 65 13.490 -0.975 -8.676 1.00 0.00 C ATOM 1102 CG2 ILE A 65 13.101 -1.135 -6.201 1.00 0.00 C ATOM 1103 CD1 ILE A 65 12.496 -2.111 -8.791 1.00 0.00 C ATOM 0 H ILE A 65 15.602 0.063 -5.234 1.00 10.00 H new ATOM 0 HA ILE A 65 15.180 0.877 -8.042 1.00 0.00 H new ATOM 0 HB ILE A 65 14.917 -1.604 -7.213 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.988 -0.038 -8.917 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.277 -1.115 -9.417 1.00 0.00 H new ATOM 0 HG21 ILE A 65 12.667 -2.123 -6.354 1.00 0.00 H new ATOM 0 HG22 ILE A 65 13.586 -1.099 -5.226 1.00 0.00 H new ATOM 0 HG23 ILE A 65 12.314 -0.382 -6.242 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.085 -2.134 -9.800 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.998 -3.056 -8.582 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.689 -1.962 -8.074 1.00 0.00 H new ATOM 1115 N GLU A 66 13.276 2.330 -7.617 1.00 0.00 N ATOM 1116 CA GLU A 66 12.298 3.382 -7.408 1.00 0.00 C ATOM 1117 C GLU A 66 11.049 3.132 -8.228 1.00 0.00 C ATOM 1118 O GLU A 66 11.039 2.294 -9.125 1.00 0.00 O ATOM 1119 CB GLU A 66 12.917 4.724 -7.805 1.00 0.00 C ATOM 1120 CG GLU A 66 12.308 5.924 -7.106 1.00 0.00 C ATOM 1121 CD GLU A 66 12.574 7.223 -7.841 1.00 0.00 C ATOM 1122 OE1 GLU A 66 13.753 7.503 -8.142 1.00 0.00 O ATOM 1123 OE2 GLU A 66 11.601 7.958 -8.115 1.00 0.00 O ATOM 0 H GLU A 66 13.618 2.275 -8.576 1.00 0.00 H new ATOM 0 HA GLU A 66 12.015 3.396 -6.355 1.00 0.00 H new ATOM 0 HB2 GLU A 66 13.985 4.696 -7.589 1.00 0.00 H new ATOM 0 HB3 GLU A 66 12.813 4.854 -8.882 1.00 0.00 H new ATOM 0 HG2 GLU A 66 11.232 5.778 -7.012 1.00 0.00 H new ATOM 0 HG3 GLU A 66 12.710 5.994 -6.095 1.00 0.00 H new ATOM 1130 N GLY A 67 9.989 3.845 -7.897 1.00 0.00 N ATOM 1131 CA GLY A 67 8.748 3.687 -8.607 1.00 0.00 C ATOM 1132 C GLY A 67 7.608 4.347 -7.894 1.00 0.00 C ATOM 1133 O GLY A 67 7.803 5.303 -7.141 1.00 0.00 O ATOM 0 H GLY A 67 9.968 4.533 -7.145 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.845 4.111 -9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.533 2.626 -8.730 1.00 0.00 H new ATOM 1137 N TYR A 68 6.420 3.820 -8.096 1.00 0.00 N ATOM 1138 CA TYR A 68 5.258 4.354 -7.436 1.00 0.00 C ATOM 1139 C TYR A 68 4.591 3.245 -6.659 1.00 0.00 C ATOM 1140 O TYR A 68 4.411 2.133 -7.156 1.00 0.00 O ATOM 1141 CB TYR A 68 4.286 4.956 -8.453 1.00 0.00 C ATOM 1142 CG TYR A 68 3.995 6.422 -8.224 1.00 0.00 C ATOM 1143 CD1 TYR A 68 5.022 7.357 -8.191 1.00 0.00 C ATOM 1144 CD2 TYR A 68 2.693 6.872 -8.043 1.00 0.00 C ATOM 1145 CE1 TYR A 68 4.761 8.698 -7.983 1.00 0.00 C ATOM 1146 CE2 TYR A 68 2.424 8.211 -7.837 1.00 0.00 C ATOM 1147 CZ TYR A 68 3.459 9.120 -7.807 1.00 0.00 C ATOM 1148 OH TYR A 68 3.194 10.455 -7.603 1.00 0.00 O ATOM 0 H TYR A 68 6.238 3.026 -8.710 1.00 0.00 H new ATOM 0 HA TYR A 68 5.559 5.150 -6.756 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.697 4.829 -9.454 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.349 4.400 -8.420 1.00 0.00 H new ATOM 0 HD1 TYR A 68 6.042 7.030 -8.330 1.00 0.00 H new ATOM 0 HD2 TYR A 68 1.878 6.163 -8.064 1.00 0.00 H new ATOM 0 HE1 TYR A 68 5.571 9.412 -7.958 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.406 8.544 -7.700 1.00 0.00 H new ATOM 0 HH TYR A 68 2.228 10.585 -7.498 1.00 0.00 H new ATOM 1158 N THR A 69 4.255 3.551 -5.429 1.00 0.00 N ATOM 1159 CA THR A 69 3.634 2.589 -4.551 1.00 0.00 C ATOM 1160 C THR A 69 2.141 2.876 -4.409 1.00 0.00 C ATOM 1161 O THR A 69 1.720 4.030 -4.368 1.00 0.00 O ATOM 1162 CB THR A 69 4.358 2.628 -3.193 1.00 0.00 C ATOM 1163 OG1 THR A 69 5.076 3.840 -3.048 1.00 0.00 O ATOM 1164 CG2 THR A 69 5.347 1.508 -3.013 1.00 0.00 C ATOM 0 H THR A 69 4.403 4.469 -5.010 1.00 0.00 H new ATOM 0 HA THR A 69 3.722 1.586 -4.969 1.00 0.00 H new ATOM 0 HB THR A 69 3.571 2.530 -2.445 1.00 0.00 H new ATOM 0 HG1 THR A 69 5.841 3.842 -3.660 1.00 0.00 H new ATOM 0 HG21 THR A 69 5.821 1.595 -2.036 1.00 0.00 H new ATOM 0 HG22 THR A 69 4.829 0.551 -3.081 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.108 1.566 -3.792 1.00 0.00 H new ATOM 1172 N LYS A 70 1.348 1.818 -4.334 1.00 0.00 N ATOM 1173 CA LYS A 70 -0.098 1.936 -4.175 1.00 0.00 C ATOM 1174 C LYS A 70 -0.471 1.258 -2.870 1.00 0.00 C ATOM 1175 O LYS A 70 0.127 0.241 -2.521 1.00 0.00 O ATOM 1176 CB LYS A 70 -0.827 1.288 -5.355 1.00 0.00 C ATOM 1177 CG LYS A 70 -2.013 2.097 -5.858 1.00 0.00 C ATOM 1178 CD LYS A 70 -2.872 1.287 -6.815 1.00 0.00 C ATOM 1179 CE LYS A 70 -3.870 0.418 -6.067 1.00 0.00 C ATOM 1180 NZ LYS A 70 -4.189 -0.831 -6.812 1.00 0.00 N ATOM 0 H LYS A 70 1.684 0.856 -4.381 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.394 2.985 -4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.121 1.146 -6.174 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.173 0.298 -5.058 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.618 2.424 -5.012 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -1.655 2.996 -6.360 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.405 1.960 -7.486 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.234 0.658 -7.436 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.466 0.163 -5.087 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.787 0.983 -5.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.873 -1.395 -6.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.598 -0.589 -7.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.319 -1.383 -6.953 1.00 0.00 H new ATOM 1194 N ILE A 71 -1.400 1.820 -2.108 1.00 0.00 N ATOM 1195 CA ILE A 71 -1.725 1.197 -0.821 1.00 0.00 C ATOM 1196 C ILE A 71 -3.212 1.097 -0.526 1.00 0.00 C ATOM 1197 O ILE A 71 -3.992 2.014 -0.841 1.00 0.00 O ATOM 1198 CB ILE A 71 -0.981 1.890 0.342 1.00 0.00 C ATOM 1199 CG1 ILE A 71 0.397 1.240 0.519 1.00 0.00 C ATOM 1200 CG2 ILE A 71 -1.779 1.835 1.635 1.00 0.00 C ATOM 1201 CD1 ILE A 71 1.554 2.168 0.245 1.00 0.00 C ATOM 0 H ILE A 71 -1.923 2.665 -2.338 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.374 0.169 -0.909 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.856 2.944 0.095 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.481 0.863 1.538 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.469 0.380 -0.146 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.221 2.333 2.428 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -2.736 2.337 1.494 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.953 0.795 1.912 1.00 0.00 H new ATOM 0 HD11 ILE A 71 2.492 1.633 0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 71 1.498 2.526 -0.783 1.00 0.00 H new ATOM 0 HD13 ILE A 71 1.509 3.017 0.928 1.00 0.00 H new ATOM 1213 N TYR A 72 -3.577 -0.023 0.138 1.00 0.00 N ATOM 1214 CA TYR A 72 -4.969 -0.253 0.538 1.00 0.00 C ATOM 1215 C TYR A 72 -5.150 -0.210 2.066 1.00 0.00 C ATOM 1216 O TYR A 72 -4.652 -1.067 2.826 1.00 0.00 O ATOM 1217 CB TYR A 72 -5.550 -1.548 -0.050 1.00 0.00 C ATOM 1218 CG TYR A 72 -4.732 -2.805 0.159 1.00 0.00 C ATOM 1219 CD1 TYR A 72 -3.453 -2.928 -0.362 1.00 0.00 C ATOM 1220 CD2 TYR A 72 -5.265 -3.888 0.850 1.00 0.00 C ATOM 1221 CE1 TYR A 72 -2.723 -4.089 -0.194 1.00 0.00 C ATOM 1222 CE2 TYR A 72 -4.544 -5.053 1.017 1.00 0.00 C ATOM 1223 CZ TYR A 72 -3.273 -5.149 0.493 1.00 0.00 C ATOM 1224 OH TYR A 72 -2.552 -6.309 0.655 1.00 0.00 O ATOM 0 H TYR A 72 -2.932 -0.768 0.402 1.00 0.00 H new ATOM 0 HA TYR A 72 -5.539 0.574 0.114 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.538 -1.707 0.382 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.690 -1.405 -1.121 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -3.020 -2.103 -0.908 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -6.260 -3.816 1.263 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -1.725 -4.165 -0.600 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -4.974 -5.885 1.555 1.00 0.00 H new ATOM 0 HH TYR A 72 -2.142 -6.318 1.545 1.00 0.00 H new ATOM 1234 N ALA A 73 -5.860 0.838 2.484 1.00 0.00 N ATOM 1235 CA ALA A 73 -6.157 1.122 3.885 1.00 0.00 C ATOM 1236 C ALA A 73 -7.455 0.462 4.355 1.00 0.00 C ATOM 1237 O ALA A 73 -7.829 0.590 5.519 1.00 0.00 O ATOM 1238 CB ALA A 73 -6.223 2.624 4.102 1.00 0.00 C ATOM 0 H ALA A 73 -6.253 1.527 1.843 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.350 0.697 4.482 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.445 2.831 5.149 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -5.265 3.072 3.839 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -7.007 3.048 3.474 1.00 0.00 H new ATOM 1244 N ASP A 74 -8.166 -0.188 3.438 1.00 0.00 N ATOM 1245 CA ASP A 74 -9.455 -0.810 3.751 1.00 0.00 C ATOM 1246 C ASP A 74 -9.317 -2.082 4.595 1.00 0.00 C ATOM 1247 O ASP A 74 -10.321 -2.697 4.957 1.00 0.00 O ATOM 1248 CB ASP A 74 -10.206 -1.133 2.458 1.00 0.00 C ATOM 1249 CG ASP A 74 -9.472 -2.145 1.600 1.00 0.00 C ATOM 1250 OD1 ASP A 74 -9.237 -3.273 2.082 1.00 0.00 O ATOM 1251 OD2 ASP A 74 -9.132 -1.809 0.447 1.00 0.00 O ATOM 0 H ASP A 74 -7.872 -0.299 2.468 1.00 0.00 H new ATOM 0 HA ASP A 74 -10.015 -0.089 4.346 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -11.196 -1.518 2.703 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -10.353 -0.216 1.888 1.00 0.00 H new ATOM 1256 N LYS A 75 -8.083 -2.479 4.908 1.00 0.00 N ATOM 1257 CA LYS A 75 -7.847 -3.682 5.712 1.00 0.00 C ATOM 1258 C LYS A 75 -8.837 -3.777 6.883 1.00 0.00 C ATOM 1259 O LYS A 75 -9.473 -4.809 7.076 1.00 0.00 O ATOM 1260 CB LYS A 75 -6.396 -3.694 6.231 1.00 0.00 C ATOM 1261 CG LYS A 75 -6.237 -4.120 7.691 1.00 0.00 C ATOM 1262 CD LYS A 75 -4.902 -3.676 8.265 1.00 0.00 C ATOM 1263 CE LYS A 75 -5.068 -3.025 9.629 1.00 0.00 C ATOM 1264 NZ LYS A 75 -3.795 -2.431 10.121 1.00 0.00 N ATOM 0 H LYS A 75 -7.236 -1.990 4.620 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.005 -4.552 5.074 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -5.808 -4.366 5.606 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.975 -2.696 6.111 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.047 -3.695 8.284 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.322 -5.204 7.765 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.238 -4.536 8.350 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.427 -2.973 7.581 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.831 -2.249 9.570 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.422 -3.767 10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.871 -2.243 11.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.013 -3.094 9.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.610 -1.540 9.618 1.00 0.00 H new ATOM 1278 N PRO A 76 -8.980 -2.698 7.678 1.00 0.00 N ATOM 1279 CA PRO A 76 -9.897 -2.679 8.822 1.00 0.00 C ATOM 1280 C PRO A 76 -11.251 -3.290 8.487 1.00 0.00 C ATOM 1281 O PRO A 76 -11.863 -3.963 9.317 1.00 0.00 O ATOM 1282 CB PRO A 76 -10.035 -1.188 9.126 1.00 0.00 C ATOM 1283 CG PRO A 76 -8.726 -0.609 8.711 1.00 0.00 C ATOM 1284 CD PRO A 76 -8.265 -1.418 7.528 1.00 0.00 C ATOM 0 HA PRO A 76 -9.526 -3.267 9.661 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.861 -0.743 8.572 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.230 -1.013 10.184 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.832 0.443 8.446 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.002 -0.661 9.524 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.514 -0.928 6.587 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -7.184 -1.560 7.537 1.00 0.00 H new ATOM 1292 N SER A 77 -11.704 -3.067 7.259 1.00 0.00 N ATOM 1293 CA SER A 77 -12.977 -3.610 6.806 1.00 0.00 C ATOM 1294 C SER A 77 -12.831 -5.097 6.505 1.00 0.00 C ATOM 1295 O SER A 77 -13.726 -5.893 6.790 1.00 0.00 O ATOM 1296 CB SER A 77 -13.465 -2.865 5.563 1.00 0.00 C ATOM 1297 OG SER A 77 -14.331 -1.801 5.914 1.00 0.00 O ATOM 0 H SER A 77 -11.208 -2.514 6.560 1.00 0.00 H new ATOM 0 HA SER A 77 -13.714 -3.479 7.598 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.610 -2.475 5.010 1.00 0.00 H new ATOM 0 HB3 SER A 77 -13.984 -3.557 4.901 1.00 0.00 H new ATOM 0 HG SER A 77 -14.628 -1.339 5.102 1.00 0.00 H new ATOM 1303 N ALA A 78 -11.688 -5.462 5.932 1.00 0.00 N ATOM 1304 CA ALA A 78 -11.409 -6.853 5.594 1.00 0.00 C ATOM 1305 C ALA A 78 -11.141 -7.676 6.853 1.00 0.00 C ATOM 1306 O ALA A 78 -11.748 -8.726 7.061 1.00 0.00 O ATOM 1307 CB ALA A 78 -10.224 -6.939 4.643 1.00 0.00 C ATOM 0 H ALA A 78 -10.939 -4.812 5.692 1.00 0.00 H new ATOM 0 HA ALA A 78 -12.287 -7.266 5.098 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -10.028 -7.983 4.400 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.450 -6.390 3.729 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.344 -6.506 5.118 1.00 0.00 H new ATOM 1313 N MET A 79 -10.228 -7.188 7.689 1.00 0.00 N ATOM 1314 CA MET A 79 -9.876 -7.871 8.930 1.00 0.00 C ATOM 1315 C MET A 79 -11.125 -8.215 9.738 1.00 0.00 C ATOM 1316 O MET A 79 -11.183 -9.254 10.397 1.00 0.00 O ATOM 1317 CB MET A 79 -8.939 -7.000 9.768 1.00 0.00 C ATOM 1318 CG MET A 79 -8.028 -7.796 10.690 1.00 0.00 C ATOM 1319 SD MET A 79 -8.657 -7.889 12.376 1.00 0.00 S ATOM 1320 CE MET A 79 -7.129 -7.939 13.307 1.00 0.00 C ATOM 0 H MET A 79 -9.718 -6.320 7.528 1.00 0.00 H new ATOM 0 HA MET A 79 -9.366 -8.799 8.671 1.00 0.00 H new ATOM 0 HB2 MET A 79 -8.326 -6.394 9.101 1.00 0.00 H new ATOM 0 HB3 MET A 79 -9.535 -6.311 10.366 1.00 0.00 H new ATOM 0 HG2 MET A 79 -7.909 -8.805 10.295 1.00 0.00 H new ATOM 0 HG3 MET A 79 -7.039 -7.339 10.700 1.00 0.00 H new ATOM 0 HE1 MET A 79 -7.354 -7.998 14.372 1.00 0.00 H new ATOM 0 HE2 MET A 79 -6.550 -8.813 13.010 1.00 0.00 H new ATOM 0 HE3 MET A 79 -6.551 -7.036 13.107 1.00 0.00 H new ATOM 1330 N LEU A 80 -12.122 -7.338 9.678 1.00 0.00 N ATOM 1331 CA LEU A 80 -13.371 -7.554 10.402 1.00 0.00 C ATOM 1332 C LEU A 80 -14.014 -8.871 9.982 1.00 0.00 C ATOM 1333 O LEU A 80 -14.698 -9.522 10.773 1.00 0.00 O ATOM 1334 CB LEU A 80 -14.339 -6.395 10.148 1.00 0.00 C ATOM 1335 CG LEU A 80 -15.489 -6.279 11.151 1.00 0.00 C ATOM 1336 CD1 LEU A 80 -16.464 -7.432 10.983 1.00 0.00 C ATOM 1337 CD2 LEU A 80 -14.952 -6.235 12.574 1.00 0.00 C ATOM 0 H LEU A 80 -12.090 -6.474 9.138 1.00 0.00 H new ATOM 0 HA LEU A 80 -13.146 -7.601 11.467 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -13.775 -5.462 10.156 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.759 -6.505 9.148 1.00 0.00 H new ATOM 0 HG LEU A 80 -16.023 -5.349 10.956 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -17.274 -7.331 11.705 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -16.874 -7.418 9.973 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -15.944 -8.375 11.150 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -15.783 -6.152 13.274 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -14.393 -7.148 12.780 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -14.294 -5.373 12.688 1.00 0.00 H new ATOM 1349 N TYR A 81 -13.784 -9.263 8.732 1.00 0.00 N ATOM 1350 CA TYR A 81 -14.333 -10.505 8.206 1.00 0.00 C ATOM 1351 C TYR A 81 -13.530 -11.704 8.702 1.00 0.00 C ATOM 1352 O TYR A 81 -14.063 -12.803 8.850 1.00 0.00 O ATOM 1353 CB TYR A 81 -14.335 -10.478 6.676 1.00 0.00 C ATOM 1354 CG TYR A 81 -15.661 -10.067 6.076 1.00 0.00 C ATOM 1355 CD1 TYR A 81 -16.289 -8.890 6.468 1.00 0.00 C ATOM 1356 CD2 TYR A 81 -16.285 -10.856 5.117 1.00 0.00 C ATOM 1357 CE1 TYR A 81 -17.500 -8.513 5.923 1.00 0.00 C ATOM 1358 CE2 TYR A 81 -17.497 -10.484 4.566 1.00 0.00 C ATOM 1359 CZ TYR A 81 -18.099 -9.312 4.971 1.00 0.00 C ATOM 1360 OH TYR A 81 -19.306 -8.940 4.425 1.00 0.00 O ATOM 0 H TYR A 81 -13.220 -8.736 8.065 1.00 0.00 H new ATOM 0 HA TYR A 81 -15.359 -10.601 8.563 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -13.562 -9.790 6.333 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -14.069 -11.467 6.304 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -15.822 -8.261 7.211 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -15.815 -11.774 4.797 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -17.976 -7.597 6.240 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -17.970 -11.108 3.822 1.00 0.00 H new ATOM 0 HH TYR A 81 -19.589 -9.611 3.770 1.00 0.00 H new ATOM 1370 N GLU A 82 -12.242 -11.481 8.955 1.00 0.00 N ATOM 1371 CA GLU A 82 -11.361 -12.540 9.434 1.00 0.00 C ATOM 1372 C GLU A 82 -11.219 -13.643 8.385 1.00 0.00 C ATOM 1373 O GLU A 82 -12.192 -14.317 8.053 1.00 0.00 O ATOM 1374 CB GLU A 82 -11.897 -13.127 10.741 1.00 0.00 C ATOM 1375 CG GLU A 82 -12.117 -12.090 11.830 1.00 0.00 C ATOM 1376 CD GLU A 82 -11.454 -12.468 13.140 1.00 0.00 C ATOM 1377 OE1 GLU A 82 -10.207 -12.544 13.176 1.00 0.00 O ATOM 1378 OE2 GLU A 82 -12.180 -12.688 14.132 1.00 0.00 O ATOM 0 H GLU A 82 -11.787 -10.576 8.836 1.00 0.00 H new ATOM 0 HA GLU A 82 -10.377 -12.107 9.617 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.839 -13.637 10.541 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.198 -13.880 11.104 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.728 -11.129 11.495 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.187 -11.961 11.993 1.00 0.00 H new ATOM 1385 N PRO A 83 -10.000 -13.844 7.848 1.00 0.00 N ATOM 1386 CA PRO A 83 -9.749 -14.875 6.836 1.00 0.00 C ATOM 1387 C PRO A 83 -10.272 -16.241 7.261 1.00 0.00 C ATOM 1388 O PRO A 83 -10.624 -17.073 6.423 1.00 0.00 O ATOM 1389 CB PRO A 83 -8.224 -14.896 6.722 1.00 0.00 C ATOM 1390 CG PRO A 83 -7.794 -13.532 7.135 1.00 0.00 C ATOM 1391 CD PRO A 83 -8.778 -13.088 8.183 1.00 0.00 C ATOM 0 HA PRO A 83 -10.256 -14.657 5.896 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -7.789 -15.660 7.367 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -7.906 -15.120 5.704 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -6.779 -13.546 7.533 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -7.793 -12.849 6.286 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -8.426 -13.319 9.188 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -8.948 -12.012 8.144 1.00 0.00 H new ATOM 1399 N ASP A 84 -10.324 -16.467 8.570 1.00 0.00 N ATOM 1400 CA ASP A 84 -10.807 -17.733 9.110 1.00 0.00 C ATOM 1401 C ASP A 84 -12.251 -17.612 9.594 1.00 0.00 C ATOM 1402 O ASP A 84 -12.752 -18.491 10.296 1.00 0.00 O ATOM 1403 CB ASP A 84 -9.910 -18.195 10.260 1.00 0.00 C ATOM 1404 CG ASP A 84 -9.830 -17.173 11.377 1.00 0.00 C ATOM 1405 OD1 ASP A 84 -10.004 -15.969 11.095 1.00 0.00 O ATOM 1406 OD2 ASP A 84 -9.592 -17.578 12.535 1.00 0.00 O ATOM 0 H ASP A 84 -10.037 -15.790 9.277 1.00 0.00 H new ATOM 0 HA ASP A 84 -10.775 -18.472 8.310 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -10.290 -19.136 10.658 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -8.908 -18.392 9.879 1.00 0.00 H new ATOM 1411 N TYR A 85 -12.915 -16.518 9.215 1.00 0.00 N ATOM 1412 CA TYR A 85 -14.303 -16.276 9.608 1.00 0.00 C ATOM 1413 C TYR A 85 -14.517 -16.537 11.098 1.00 0.00 C ATOM 1414 O TYR A 85 -13.563 -16.767 11.843 1.00 0.00 O ATOM 1415 CB TYR A 85 -15.254 -17.147 8.779 1.00 0.00 C ATOM 1416 CG TYR A 85 -15.128 -18.627 9.059 1.00 0.00 C ATOM 1417 CD1 TYR A 85 -15.813 -19.216 10.115 1.00 0.00 C ATOM 1418 CD2 TYR A 85 -14.324 -19.437 8.266 1.00 0.00 C ATOM 1419 CE1 TYR A 85 -15.700 -20.567 10.373 1.00 0.00 C ATOM 1420 CE2 TYR A 85 -14.207 -20.792 8.518 1.00 0.00 C ATOM 1421 CZ TYR A 85 -14.896 -21.352 9.572 1.00 0.00 C ATOM 1422 OH TYR A 85 -14.780 -22.697 9.826 1.00 0.00 O ATOM 0 H TYR A 85 -12.511 -15.783 8.634 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.522 -15.226 9.415 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.280 -16.836 8.975 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -15.064 -16.970 7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -16.444 -18.606 10.744 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.782 -19.001 7.440 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -16.239 -21.008 11.199 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -13.579 -21.408 7.892 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.177 -23.103 9.169 1.00 0.00 H new ATOM 1432 N GLU A 86 -15.774 -16.496 11.528 1.00 0.00 N ATOM 1433 CA GLU A 86 -16.115 -16.728 12.928 1.00 0.00 C ATOM 1434 C GLU A 86 -15.383 -15.744 13.838 1.00 0.00 C ATOM 1435 O GLU A 86 -14.381 -16.091 14.465 1.00 0.00 O ATOM 1436 CB GLU A 86 -15.775 -18.168 13.323 1.00 0.00 C ATOM 1437 CG GLU A 86 -16.996 -19.007 13.663 1.00 0.00 C ATOM 1438 CD GLU A 86 -16.759 -19.923 14.848 1.00 0.00 C ATOM 1439 OE1 GLU A 86 -16.761 -19.425 15.994 1.00 0.00 O ATOM 1440 OE2 GLU A 86 -16.571 -21.139 14.631 1.00 0.00 O ATOM 0 H GLU A 86 -16.575 -16.304 10.926 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.187 -16.571 13.049 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.234 -18.643 12.505 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.104 -18.152 14.182 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -17.837 -18.348 13.880 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -17.275 -19.605 12.796 1.00 0.00 H new ATOM 1447 N LEU A 87 -15.892 -14.518 13.909 1.00 0.00 N ATOM 1448 CA LEU A 87 -15.290 -13.489 14.745 1.00 0.00 C ATOM 1449 C LEU A 87 -15.785 -13.603 16.183 1.00 0.00 C ATOM 1450 O LEU A 87 -15.094 -13.205 17.117 1.00 0.00 O ATOM 1451 CB LEU A 87 -15.612 -12.100 14.190 1.00 0.00 C ATOM 1452 CG LEU A 87 -14.843 -10.948 14.844 1.00 0.00 C ATOM 1453 CD1 LEU A 87 -13.993 -10.217 13.816 1.00 0.00 C ATOM 1454 CD2 LEU A 87 -15.802 -9.983 15.526 1.00 0.00 C ATOM 0 H LEU A 87 -16.720 -14.214 13.397 1.00 0.00 H new ATOM 0 HA LEU A 87 -14.210 -13.633 14.738 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -15.403 -12.095 13.120 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -16.680 -11.917 14.307 1.00 0.00 H new ATOM 0 HG LEU A 87 -14.180 -11.367 15.601 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.455 -9.403 14.301 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -13.278 -10.912 13.375 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -14.636 -9.812 13.034 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -15.237 -9.172 15.985 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -16.492 -9.573 14.788 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -16.365 -10.512 16.294 1.00 0.00 H new ATOM 1466 N ILE A 88 -16.995 -14.146 16.343 1.00 0.00 N ATOM 1467 CA ILE A 88 -17.614 -14.321 17.659 1.00 0.00 C ATOM 1468 C ILE A 88 -18.268 -13.033 18.151 1.00 0.00 C ATOM 1469 O ILE A 88 -19.280 -13.073 18.851 1.00 0.00 O ATOM 1470 CB ILE A 88 -16.606 -14.808 18.724 1.00 0.00 C ATOM 1471 CG1 ILE A 88 -16.048 -16.181 18.342 1.00 0.00 C ATOM 1472 CG2 ILE A 88 -17.266 -14.861 20.096 1.00 0.00 C ATOM 1473 CD1 ILE A 88 -14.569 -16.332 18.624 1.00 0.00 C ATOM 0 H ILE A 88 -17.570 -14.475 15.568 1.00 0.00 H new ATOM 0 HA ILE A 88 -18.378 -15.087 17.525 1.00 0.00 H new ATOM 0 HB ILE A 88 -15.778 -14.100 18.768 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -16.594 -16.951 18.887 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -16.227 -16.355 17.281 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -16.543 -15.206 20.835 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -17.617 -13.866 20.369 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -18.111 -15.549 20.067 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -14.242 -17.329 18.329 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -14.013 -15.585 18.058 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -14.385 -16.191 19.689 1.00 0.00 H new ATOM 1485 N ARG A 89 -17.687 -11.892 17.798 1.00 0.00 N ATOM 1486 CA ARG A 89 -18.224 -10.609 18.227 1.00 0.00 C ATOM 1487 C ARG A 89 -18.973 -9.924 17.087 1.00 0.00 C ATOM 1488 O ARG A 89 -19.239 -10.530 16.049 1.00 0.00 O ATOM 1489 CB ARG A 89 -17.098 -9.706 18.735 1.00 0.00 C ATOM 1490 CG ARG A 89 -17.167 -9.434 20.230 1.00 0.00 C ATOM 1491 CD ARG A 89 -17.465 -7.972 20.521 1.00 0.00 C ATOM 1492 NE ARG A 89 -18.318 -7.810 21.695 1.00 0.00 N ATOM 1493 CZ ARG A 89 -19.577 -8.239 21.762 1.00 0.00 C ATOM 1494 NH1 ARG A 89 -20.130 -8.856 20.725 1.00 0.00 N ATOM 1495 NH2 ARG A 89 -20.284 -8.047 22.868 1.00 0.00 N ATOM 0 H ARG A 89 -16.849 -11.830 17.219 1.00 0.00 H new ATOM 0 HA ARG A 89 -18.927 -10.789 19.040 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.139 -10.168 18.502 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -17.134 -8.758 18.199 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -17.939 -10.059 20.679 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.221 -9.712 20.695 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -16.529 -7.435 20.676 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -17.951 -7.522 19.655 1.00 0.00 H new ATOM 0 HE ARG A 89 -17.927 -7.341 22.512 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -19.590 -9.003 19.872 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -21.095 -9.183 20.781 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -19.863 -7.571 23.666 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -21.248 -8.375 22.920 1.00 0.00 H new ATOM 1509 N ASN A 90 -19.311 -8.653 17.289 1.00 0.00 N ATOM 1510 CA ASN A 90 -20.027 -7.882 16.280 1.00 0.00 C ATOM 1511 C ASN A 90 -19.083 -6.929 15.555 1.00 0.00 C ATOM 1512 O ASN A 90 -19.060 -6.876 14.325 1.00 0.00 O ATOM 1513 CB ASN A 90 -21.170 -7.095 16.925 1.00 0.00 C ATOM 1514 CG ASN A 90 -22.490 -7.839 16.864 1.00 0.00 C ATOM 1515 OD1 ASN A 90 -23.489 -7.313 16.373 1.00 0.00 O ATOM 1516 ND2 ASN A 90 -22.501 -9.068 17.366 1.00 0.00 N ATOM 0 H ASN A 90 -19.100 -8.136 18.143 1.00 0.00 H new ATOM 0 HA ASN A 90 -20.442 -8.579 15.552 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -20.922 -6.886 17.965 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -21.274 -6.133 16.423 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -23.361 -9.616 17.354 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -21.649 -9.464 17.763 1.00 0.00 H new ATOM 1523 N GLY A 91 -18.303 -6.178 16.327 1.00 0.00 N ATOM 1524 CA GLY A 91 -17.365 -5.238 15.742 1.00 0.00 C ATOM 1525 C GLY A 91 -17.764 -3.794 15.983 1.00 0.00 C ATOM 1526 O GLY A 91 -17.765 -3.324 17.121 1.00 0.00 O ATOM 0 H GLY A 91 -18.304 -6.204 17.347 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -16.373 -5.412 16.159 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -17.296 -5.418 14.669 1.00 0.00 H new ATOM 1530 N LEU A 92 -18.100 -3.088 14.908 1.00 0.00 N ATOM 1531 CA LEU A 92 -18.501 -1.690 15.005 1.00 0.00 C ATOM 1532 C LEU A 92 -20.020 -1.560 15.037 1.00 0.00 C ATOM 1533 O LEU A 92 -20.740 -2.517 14.758 1.00 0.00 O ATOM 1534 CB LEU A 92 -17.932 -0.895 13.826 1.00 0.00 C ATOM 1535 CG LEU A 92 -17.757 0.605 14.073 1.00 0.00 C ATOM 1536 CD1 LEU A 92 -16.984 0.852 15.359 1.00 0.00 C ATOM 1537 CD2 LEU A 92 -17.053 1.259 12.893 1.00 0.00 C ATOM 0 H LEU A 92 -18.102 -3.462 13.959 1.00 0.00 H new ATOM 0 HA LEU A 92 -18.102 -1.285 15.935 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.964 -1.318 13.557 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -18.589 -1.031 12.967 1.00 0.00 H new ATOM 0 HG LEU A 92 -18.745 1.053 14.178 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.871 1.925 15.515 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -17.527 0.418 16.199 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -15.999 0.390 15.286 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -16.936 2.326 13.085 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -16.071 0.805 12.758 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -17.646 1.115 11.990 1.00 0.00 H new ATOM 1549 N LYS A 93 -20.500 -0.368 15.381 1.00 0.00 N ATOM 1550 CA LYS A 93 -21.937 -0.109 15.452 1.00 0.00 C ATOM 1551 C LYS A 93 -22.646 -0.595 14.192 1.00 0.00 C ATOM 1552 O LYS A 93 -23.774 -1.088 14.252 1.00 0.00 O ATOM 1553 CB LYS A 93 -22.192 1.388 15.654 1.00 0.00 C ATOM 1554 CG LYS A 93 -23.025 1.704 16.884 1.00 0.00 C ATOM 1555 CD LYS A 93 -22.146 1.988 18.092 1.00 0.00 C ATOM 1556 CE LYS A 93 -21.993 3.482 18.331 1.00 0.00 C ATOM 1557 NZ LYS A 93 -21.208 4.140 17.250 1.00 0.00 N ATOM 0 H LYS A 93 -19.916 0.435 15.615 1.00 0.00 H new ATOM 0 HA LYS A 93 -22.339 -0.660 16.302 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -21.235 1.903 15.732 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -22.696 1.784 14.773 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -23.660 2.567 16.683 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -23.686 0.866 17.103 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -22.578 1.519 18.976 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -21.164 1.540 17.942 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -22.979 3.942 18.395 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -21.501 3.648 19.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -21.126 5.157 17.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -20.258 3.719 17.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -21.690 4.004 16.339 1.00 0.00 H new ATOM 1571 N GLN A 94 -21.980 -0.454 13.051 1.00 0.00 N ATOM 1572 CA GLN A 94 -22.545 -0.880 11.774 1.00 0.00 C ATOM 1573 C GLN A 94 -23.865 -0.165 11.491 1.00 0.00 C ATOM 1574 O GLN A 94 -24.678 -0.637 10.697 1.00 0.00 O ATOM 1575 CB GLN A 94 -22.756 -2.395 11.768 1.00 0.00 C ATOM 1576 CG GLN A 94 -21.715 -3.151 10.961 1.00 0.00 C ATOM 1577 CD GLN A 94 -20.843 -4.046 11.821 1.00 0.00 C ATOM 1578 OE1 GLN A 94 -21.337 -4.749 12.703 1.00 0.00 O ATOM 1579 NE2 GLN A 94 -19.540 -4.025 11.568 1.00 0.00 N ATOM 0 H GLN A 94 -21.047 -0.048 12.984 1.00 0.00 H new ATOM 0 HA GLN A 94 -21.839 -0.615 10.987 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -22.742 -2.759 12.795 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -23.745 -2.614 11.365 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -22.216 -3.756 10.206 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -21.084 -2.438 10.431 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -19.174 -3.427 10.827 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -18.905 -4.607 12.114 1.00 0.00 H new ATOM 1588 N LYS A 95 -24.074 0.976 12.145 1.00 0.00 N ATOM 1589 CA LYS A 95 -25.296 1.754 11.959 1.00 0.00 C ATOM 1590 C LYS A 95 -26.535 0.889 12.166 1.00 0.00 C ATOM 1591 O LYS A 95 -27.487 0.953 11.387 1.00 0.00 O ATOM 1592 CB LYS A 95 -25.319 2.378 10.563 1.00 0.00 C ATOM 1593 CG LYS A 95 -26.252 3.574 10.448 1.00 0.00 C ATOM 1594 CD LYS A 95 -26.946 3.610 9.095 1.00 0.00 C ATOM 1595 CE LYS A 95 -27.977 2.502 8.968 1.00 0.00 C ATOM 1596 NZ LYS A 95 -28.965 2.784 7.890 1.00 0.00 N ATOM 0 H LYS A 95 -23.413 1.382 12.808 1.00 0.00 H new ATOM 0 HA LYS A 95 -25.307 2.548 12.705 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -24.309 2.688 10.296 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -25.622 1.620 9.840 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -26.999 3.532 11.241 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -25.686 4.494 10.592 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -27.431 4.577 8.959 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -26.205 3.511 8.302 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -27.472 1.559 8.760 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -28.500 2.382 9.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -29.651 2.004 7.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -29.465 3.671 8.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -28.470 2.874 6.980 1.00 0.00 H new ATOM 1610 N GLU A 96 -26.519 0.083 13.224 1.00 0.00 N ATOM 1611 CA GLU A 96 -27.643 -0.792 13.533 1.00 0.00 C ATOM 1612 C GLU A 96 -27.361 -1.625 14.779 1.00 0.00 C ATOM 1613 O GLU A 96 -28.248 -1.849 15.601 1.00 0.00 O ATOM 1614 CB GLU A 96 -27.942 -1.711 12.348 1.00 0.00 C ATOM 1615 CG GLU A 96 -26.713 -2.407 11.789 1.00 0.00 C ATOM 1616 CD GLU A 96 -26.739 -3.907 12.010 1.00 0.00 C ATOM 1617 OE1 GLU A 96 -27.789 -4.528 11.742 1.00 0.00 O ATOM 1618 OE2 GLU A 96 -25.710 -4.460 12.450 1.00 0.00 O ATOM 0 H GLU A 96 -25.741 0.018 13.880 1.00 0.00 H new ATOM 0 HA GLU A 96 -28.514 -0.166 13.728 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -28.666 -2.465 12.658 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -28.410 -1.127 11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -26.639 -2.202 10.721 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -25.821 -1.990 12.256 1.00 0.00 H new ATOM 1625 N ALA A 97 -26.120 -2.081 14.912 1.00 0.00 N ATOM 1626 CA ALA A 97 -25.721 -2.889 16.057 1.00 0.00 C ATOM 1627 C ALA A 97 -25.453 -2.015 17.278 1.00 0.00 C ATOM 1628 O ALA A 97 -24.548 -1.182 17.268 1.00 0.00 O ATOM 1629 CB ALA A 97 -24.490 -3.717 15.717 1.00 0.00 C ATOM 0 H ALA A 97 -25.373 -1.904 14.240 1.00 0.00 H new ATOM 0 HA ALA A 97 -26.543 -3.564 16.298 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -24.204 -4.315 16.582 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -24.715 -4.376 14.878 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -23.668 -3.054 15.447 1.00 0.00 H new ATOM 1635 N LYS A 98 -26.246 -2.213 18.327 1.00 0.00 N ATOM 1636 CA LYS A 98 -26.094 -1.443 19.556 1.00 0.00 C ATOM 1637 C LYS A 98 -26.310 0.046 19.294 1.00 0.00 C ATOM 1638 O LYS A 98 -25.353 0.810 19.173 1.00 0.00 O ATOM 1639 CB LYS A 98 -24.706 -1.671 20.158 1.00 0.00 C ATOM 1640 CG LYS A 98 -24.627 -2.896 21.055 1.00 0.00 C ATOM 1641 CD LYS A 98 -23.517 -3.839 20.618 1.00 0.00 C ATOM 1642 CE LYS A 98 -23.939 -5.295 20.748 1.00 0.00 C ATOM 1643 NZ LYS A 98 -23.074 -6.197 19.938 1.00 0.00 N ATOM 0 H LYS A 98 -27.000 -2.900 18.350 1.00 0.00 H new ATOM 0 HA LYS A 98 -26.849 -1.783 20.265 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -23.981 -1.775 19.351 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -24.419 -0.791 20.733 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -24.455 -2.583 22.085 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -25.581 -3.423 21.037 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -23.246 -3.629 19.583 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -22.628 -3.661 21.223 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -23.895 -5.594 21.795 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -24.976 -5.403 20.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -23.394 -7.180 20.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -23.135 -5.928 18.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -22.088 -6.114 20.259 1.00 0.00 H new TER 1657 LYS A 98