USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1070 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 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 123 HIS : no HD1:sc= -14! C(o=-14!,f=-10!) USER MOD Set 2.1: A 88 GLN : amide:sc= -1.4 X(o=-2.3,f=-2.5) USER MOD Set 2.2: A 89 GLN : amide:sc= -0.895! C(o=-2.3!,f=-3.6!) USER MOD Single : A 1 SER N :NH3+ -114:sc= 0 (180deg=-0.0433) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= -0.0362 X(o=-0.036,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= -0.144 USER MOD Single : A 10 ASN : amide:sc= -2.36! C(o=-2.4!,f=-3.6!) USER MOD Single : A 11 ASN : amide:sc= -4.27! C(o=-4.3!,f=-2.4!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl -126:sc= -6.38! (180deg=-9.36!) USER MOD Single : A 18 GLN : amide:sc= -0.0226 K(o=-0.023,f=-1.5!) USER MOD Single : A 20 LYS NZ :NH3+ -100:sc= -0.0205 (180deg=-0.0947) USER MOD Single : A 24 SER OG : rot 41:sc= 0.6 USER MOD Single : A 28 SER OG : rot -102:sc= -0.486 USER MOD Single : A 34 TYR OH : rot 30:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.218 K(o=-0.22,f=-1.9!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= -1.81 USER MOD Single : A 43 MET CE :methyl -159:sc=-0.00573 (180deg=-0.575) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 THR OG1 : rot 140:sc= -0.15 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -9.81! C(o=-9.8!,f=-19!) USER MOD Single : A 69 HIS : no HD1:sc= -6.08! C(o=-6.1!,f=-3.1!) USER MOD Single : A 70 HIS : no HD1:sc= -1.49 K(o=-1.5,f=-2.1) USER MOD Single : A 72 ASN : amide:sc=-0.000374 K(o=-0.00037,f=-1.3) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -112:sc= -12.1! (180deg=-22.9!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= -3.36! C(o=-3.4!,f=-7!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -133:sc= -0.0888 (180deg=-0.526) USER MOD Single : A 95 HIS : no HD1:sc= -5.62! C(o=-5.6!,f=-5.9!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 170:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.516 K(o=-0.52,f=-11!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl 172:sc= 0 (180deg=-0.112) USER MOD Single : A 110 LYS NZ :NH3+ 139:sc= -1.22 (180deg=-2.33!) USER MOD Single : A 111 THR OG1 : rot -110:sc= -0.572 USER MOD Single : A 116 MET CE :methyl -120:sc= -7.88! (180deg=-11!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -2.51! K(o=-2.5!,f=-1.2) USER MOD Single : A 130 ASN : amide:sc= -0.0132 X(o=-0.013,f=0.2) USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -8.076 -11.025 -18.359 1.00 0.00 N ATOM 2 CA SER A 1 -8.676 -10.744 -17.067 1.00 0.00 C ATOM 3 C SER A 1 -7.690 -11.078 -15.947 1.00 0.00 C ATOM 4 O SER A 1 -7.690 -12.191 -15.424 1.00 0.00 O ATOM 5 CB SER A 1 -9.976 -11.529 -16.880 1.00 0.00 C ATOM 6 OG SER A 1 -11.100 -10.837 -17.416 1.00 0.00 O ATOM 0 H1 SER A 1 -7.946 -10.136 -18.882 1.00 0.00 H new ATOM 0 H2 SER A 1 -7.153 -11.484 -18.221 1.00 0.00 H new ATOM 0 H3 SER A 1 -8.699 -11.657 -18.901 1.00 0.00 H new ATOM 0 HA SER A 1 -8.915 -9.681 -17.027 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.885 -12.502 -17.364 1.00 0.00 H new ATOM 0 HB3 SER A 1 -10.138 -11.715 -15.818 1.00 0.00 H new ATOM 0 HG SER A 1 -11.910 -11.372 -17.278 1.00 0.00 H new ATOM 12 N PRO A 2 -6.848 -10.066 -15.602 1.00 0.00 N ATOM 13 CA PRO A 2 -5.857 -10.240 -14.552 1.00 0.00 C ATOM 14 C PRO A 2 -6.513 -10.216 -13.170 1.00 0.00 C ATOM 15 O PRO A 2 -7.730 -10.337 -13.054 1.00 0.00 O ATOM 16 CB PRO A 2 -4.861 -9.112 -14.760 1.00 0.00 C ATOM 17 CG PRO A 2 -5.574 -8.080 -15.617 1.00 0.00 C ATOM 18 CD PRO A 2 -6.818 -8.734 -16.197 1.00 0.00 C ATOM 0 HA PRO A 2 -5.356 -11.207 -14.601 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -4.553 -8.682 -13.807 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -3.959 -9.474 -15.253 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.844 -7.209 -15.020 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -4.920 -7.729 -16.415 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.716 -8.168 -15.947 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -6.767 -8.787 -17.285 1.00 0.00 H new ATOM 26 N GLU A 3 -5.674 -10.056 -12.156 1.00 0.00 N ATOM 27 CA GLU A 3 -6.156 -10.014 -10.787 1.00 0.00 C ATOM 28 C GLU A 3 -7.225 -8.930 -10.634 1.00 0.00 C ATOM 29 O GLU A 3 -8.079 -9.014 -9.752 1.00 0.00 O ATOM 30 CB GLU A 3 -5.003 -9.785 -9.806 1.00 0.00 C ATOM 31 CG GLU A 3 -3.935 -10.872 -9.954 1.00 0.00 C ATOM 32 CD GLU A 3 -4.207 -12.041 -9.006 1.00 0.00 C ATOM 33 OE1 GLU A 3 -3.994 -11.845 -7.790 1.00 0.00 O ATOM 34 OE2 GLU A 3 -4.620 -13.102 -9.518 1.00 0.00 O ATOM 0 H GLU A 3 -4.664 -9.954 -12.256 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.606 -10.979 -10.552 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -4.558 -8.806 -9.984 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -5.384 -9.781 -8.785 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.916 -11.231 -10.983 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.951 -10.451 -9.745 1.00 0.00 H new ATOM 41 N ILE A 4 -7.146 -7.938 -11.509 1.00 0.00 N ATOM 42 CA ILE A 4 -8.099 -6.840 -11.483 1.00 0.00 C ATOM 43 C ILE A 4 -9.520 -7.401 -11.540 1.00 0.00 C ATOM 44 O ILE A 4 -10.428 -6.871 -10.900 1.00 0.00 O ATOM 45 CB ILE A 4 -7.789 -5.836 -12.595 1.00 0.00 C ATOM 46 CG1 ILE A 4 -6.283 -5.587 -12.706 1.00 0.00 C ATOM 47 CG2 ILE A 4 -8.572 -4.537 -12.395 1.00 0.00 C ATOM 48 CD1 ILE A 4 -5.661 -5.360 -11.326 1.00 0.00 C ATOM 0 H ILE A 4 -6.438 -7.871 -12.240 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.014 -6.284 -10.549 1.00 0.00 H new ATOM 0 HB ILE A 4 -8.114 -6.265 -13.543 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.805 -6.439 -13.189 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -6.100 -4.718 -13.339 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -8.333 -3.841 -13.199 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -9.641 -4.751 -12.406 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.301 -4.092 -11.438 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.590 -5.186 -11.434 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -6.125 -4.493 -10.856 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -5.824 -6.240 -10.704 1.00 0.00 H new ATOM 60 N MET A 5 -9.671 -8.468 -12.312 1.00 0.00 N ATOM 61 CA MET A 5 -10.967 -9.107 -12.460 1.00 0.00 C ATOM 62 C MET A 5 -11.559 -9.471 -11.095 1.00 0.00 C ATOM 63 O MET A 5 -12.777 -9.491 -10.929 1.00 0.00 O ATOM 64 CB MET A 5 -10.819 -10.373 -13.305 1.00 0.00 C ATOM 65 CG MET A 5 -10.310 -11.542 -12.459 1.00 0.00 C ATOM 66 SD MET A 5 -10.021 -12.966 -13.496 1.00 0.00 S ATOM 67 CE MET A 5 -11.491 -13.914 -13.138 1.00 0.00 C ATOM 0 H MET A 5 -8.917 -8.906 -12.841 1.00 0.00 H new ATOM 0 HA MET A 5 -11.641 -8.407 -12.953 1.00 0.00 H new ATOM 0 HB2 MET A 5 -11.780 -10.632 -13.749 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.128 -10.187 -14.127 1.00 0.00 H new ATOM 0 HG2 MET A 5 -9.388 -11.259 -11.950 1.00 0.00 H new ATOM 0 HG3 MET A 5 -11.039 -11.787 -11.686 1.00 0.00 H new ATOM 0 HE1 MET A 5 -11.472 -14.843 -13.707 1.00 0.00 H new ATOM 0 HE2 MET A 5 -11.526 -14.142 -12.073 1.00 0.00 H new ATOM 0 HE3 MET A 5 -12.373 -13.336 -13.415 1.00 0.00 H new ATOM 77 N LYS A 6 -10.667 -9.750 -10.155 1.00 0.00 N ATOM 78 CA LYS A 6 -11.087 -10.111 -8.812 1.00 0.00 C ATOM 79 C LYS A 6 -10.738 -8.975 -7.851 1.00 0.00 C ATOM 80 O LYS A 6 -9.572 -8.784 -7.505 1.00 0.00 O ATOM 81 CB LYS A 6 -10.490 -11.462 -8.411 1.00 0.00 C ATOM 82 CG LYS A 6 -11.443 -12.231 -7.493 1.00 0.00 C ATOM 83 CD LYS A 6 -10.708 -12.763 -6.262 1.00 0.00 C ATOM 84 CE LYS A 6 -10.703 -11.727 -5.137 1.00 0.00 C ATOM 85 NZ LYS A 6 -10.396 -12.371 -3.839 1.00 0.00 N ATOM 0 H LYS A 6 -9.657 -9.733 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.168 -10.241 -8.772 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.284 -12.052 -9.304 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.537 -11.307 -7.905 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -12.258 -11.578 -7.180 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.891 -13.060 -8.040 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.187 -13.679 -5.916 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.683 -13.020 -6.529 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.964 -10.954 -5.350 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.674 -11.234 -5.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.397 -11.653 -3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.116 -13.092 -3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.460 -12.821 -3.887 1.00 0.00 H new ATOM 99 N ASN A 7 -11.768 -8.247 -7.443 1.00 0.00 N ATOM 100 CA ASN A 7 -11.584 -7.134 -6.528 1.00 0.00 C ATOM 101 C ASN A 7 -12.389 -7.391 -5.253 1.00 0.00 C ATOM 102 O ASN A 7 -13.521 -7.870 -5.314 1.00 0.00 O ATOM 103 CB ASN A 7 -12.082 -5.827 -7.145 1.00 0.00 C ATOM 104 CG ASN A 7 -11.165 -4.660 -6.771 1.00 0.00 C ATOM 105 OD1 ASN A 7 -10.083 -4.490 -7.308 1.00 0.00 O ATOM 106 ND2 ASN A 7 -11.657 -3.869 -5.823 1.00 0.00 N ATOM 0 H ASN A 7 -12.734 -8.407 -7.730 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.519 -7.048 -6.310 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.126 -5.926 -8.230 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.096 -5.622 -6.802 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -11.121 -3.062 -5.503 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -12.570 -4.069 -5.415 1.00 0.00 H new ATOM 113 N LEU A 8 -11.772 -7.062 -4.127 1.00 0.00 N ATOM 114 CA LEU A 8 -12.418 -7.251 -2.838 1.00 0.00 C ATOM 115 C LEU A 8 -13.643 -6.338 -2.746 1.00 0.00 C ATOM 116 O LEU A 8 -14.079 -5.777 -3.750 1.00 0.00 O ATOM 117 CB LEU A 8 -11.413 -7.047 -1.701 1.00 0.00 C ATOM 118 CG LEU A 8 -10.723 -5.684 -1.652 1.00 0.00 C ATOM 119 CD1 LEU A 8 -9.318 -5.757 -2.254 1.00 0.00 C ATOM 120 CD2 LEU A 8 -11.581 -4.611 -2.326 1.00 0.00 C ATOM 0 H LEU A 8 -10.833 -6.666 -4.080 1.00 0.00 H new ATOM 0 HA LEU A 8 -12.776 -8.276 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.929 -7.205 -0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -10.646 -7.818 -1.778 1.00 0.00 H new ATOM 0 HG LEU A 8 -10.610 -5.396 -0.607 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -8.850 -4.774 -2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.718 -6.472 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -9.384 -6.077 -3.294 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -11.067 -3.651 -2.277 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -11.748 -4.881 -3.369 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -12.540 -4.536 -1.813 1.00 0.00 H new ATOM 132 N SER A 9 -14.162 -6.218 -1.533 1.00 0.00 N ATOM 133 CA SER A 9 -15.328 -5.383 -1.298 1.00 0.00 C ATOM 134 C SER A 9 -15.028 -3.939 -1.703 1.00 0.00 C ATOM 135 O SER A 9 -15.020 -3.613 -2.890 1.00 0.00 O ATOM 136 CB SER A 9 -15.760 -5.444 0.168 1.00 0.00 C ATOM 137 OG SER A 9 -16.813 -4.525 0.451 1.00 0.00 O ATOM 0 H SER A 9 -13.797 -6.685 -0.703 1.00 0.00 H new ATOM 0 HA SER A 9 -16.149 -5.761 -1.908 1.00 0.00 H new ATOM 0 HB2 SER A 9 -16.087 -6.456 0.408 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.905 -5.225 0.808 1.00 0.00 H new ATOM 0 HG SER A 9 -17.063 -4.595 1.396 1.00 0.00 H new ATOM 143 N ASN A 10 -14.787 -3.112 -0.697 1.00 0.00 N ATOM 144 CA ASN A 10 -14.487 -1.711 -0.934 1.00 0.00 C ATOM 145 C ASN A 10 -13.160 -1.357 -0.260 1.00 0.00 C ATOM 146 O ASN A 10 -12.456 -0.454 -0.707 1.00 0.00 O ATOM 147 CB ASN A 10 -15.573 -0.808 -0.345 1.00 0.00 C ATOM 148 CG ASN A 10 -16.437 -0.197 -1.450 1.00 0.00 C ATOM 149 OD1 ASN A 10 -16.459 -0.655 -2.581 1.00 0.00 O ATOM 150 ND2 ASN A 10 -17.145 0.858 -1.061 1.00 0.00 N ATOM 0 H ASN A 10 -14.793 -3.386 0.285 1.00 0.00 H new ATOM 0 HA ASN A 10 -14.434 -1.555 -2.011 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -16.200 -1.384 0.335 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.112 -0.014 0.242 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.754 1.337 -1.725 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -17.080 1.189 -0.099 1.00 0.00 H new ATOM 157 N ASN A 11 -12.860 -2.087 0.805 1.00 0.00 N ATOM 158 CA ASN A 11 -11.632 -1.860 1.546 1.00 0.00 C ATOM 159 C ASN A 11 -10.574 -1.279 0.605 1.00 0.00 C ATOM 160 O ASN A 11 -9.819 -0.387 0.989 1.00 0.00 O ATOM 161 CB ASN A 11 -11.085 -3.170 2.119 1.00 0.00 C ATOM 162 CG ASN A 11 -12.219 -4.055 2.638 1.00 0.00 C ATOM 163 OD1 ASN A 11 -12.196 -5.270 2.519 1.00 0.00 O ATOM 164 ND2 ASN A 11 -13.209 -3.384 3.218 1.00 0.00 N ATOM 0 H ASN A 11 -13.447 -2.836 1.172 1.00 0.00 H new ATOM 0 HA ASN A 11 -11.853 -1.172 2.362 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -10.526 -3.703 1.350 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.387 -2.954 2.928 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -14.012 -3.886 3.597 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -13.165 -2.367 3.285 1.00 0.00 H new ATOM 171 N PHE A 12 -10.554 -1.806 -0.610 1.00 0.00 N ATOM 172 CA PHE A 12 -9.603 -1.352 -1.609 1.00 0.00 C ATOM 173 C PHE A 12 -10.295 -0.509 -2.683 1.00 0.00 C ATOM 174 O PHE A 12 -10.009 0.678 -2.826 1.00 0.00 O ATOM 175 CB PHE A 12 -9.007 -2.600 -2.263 1.00 0.00 C ATOM 176 CG PHE A 12 -7.495 -2.526 -2.484 1.00 0.00 C ATOM 177 CD1 PHE A 12 -6.643 -2.789 -1.458 1.00 0.00 C ATOM 178 CD2 PHE A 12 -7.004 -2.195 -3.709 1.00 0.00 C ATOM 179 CE1 PHE A 12 -5.240 -2.720 -1.665 1.00 0.00 C ATOM 180 CE2 PHE A 12 -5.601 -2.126 -3.916 1.00 0.00 C ATOM 181 CZ PHE A 12 -4.748 -2.390 -2.889 1.00 0.00 C ATOM 0 H PHE A 12 -11.183 -2.545 -0.925 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.837 -0.735 -1.138 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.231 -3.466 -1.640 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -9.496 -2.763 -3.223 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -7.033 -3.050 -0.485 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -7.681 -1.985 -4.524 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -4.563 -2.930 -0.850 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -5.211 -1.864 -4.888 1.00 0.00 H new ATOM 0 HZ PHE A 12 -3.681 -2.337 -3.046 1.00 0.00 H new ATOM 191 N GLY A 13 -11.193 -1.158 -3.410 1.00 0.00 N ATOM 192 CA GLY A 13 -11.928 -0.484 -4.467 1.00 0.00 C ATOM 193 C GLY A 13 -12.377 0.910 -4.019 1.00 0.00 C ATOM 194 O GLY A 13 -12.437 1.835 -4.828 1.00 0.00 O ATOM 0 H GLY A 13 -11.428 -2.143 -3.288 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.301 -0.400 -5.355 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.798 -1.078 -4.746 1.00 0.00 H new ATOM 198 N LYS A 14 -12.679 1.015 -2.734 1.00 0.00 N ATOM 199 CA LYS A 14 -13.119 2.280 -2.170 1.00 0.00 C ATOM 200 C LYS A 14 -11.915 3.212 -2.019 1.00 0.00 C ATOM 201 O LYS A 14 -11.929 4.335 -2.523 1.00 0.00 O ATOM 202 CB LYS A 14 -13.884 2.048 -0.865 1.00 0.00 C ATOM 203 CG LYS A 14 -14.337 3.374 -0.251 1.00 0.00 C ATOM 204 CD LYS A 14 -13.447 3.763 0.931 1.00 0.00 C ATOM 205 CE LYS A 14 -13.995 3.195 2.240 1.00 0.00 C ATOM 206 NZ LYS A 14 -14.582 4.273 3.068 1.00 0.00 N ATOM 0 H LYS A 14 -12.628 0.245 -2.067 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.822 2.772 -2.842 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.752 1.416 -1.055 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.250 1.514 -0.158 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -14.307 4.158 -1.007 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.372 3.291 0.080 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.435 3.394 0.766 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.383 4.849 1.000 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.751 2.439 2.027 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.196 2.700 2.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.949 3.870 3.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.851 4.980 3.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.358 4.728 2.546 1.00 0.00 H new ATOM 220 N ALA A 15 -10.903 2.714 -1.325 1.00 0.00 N ATOM 221 CA ALA A 15 -9.694 3.489 -1.103 1.00 0.00 C ATOM 222 C ALA A 15 -9.060 3.834 -2.451 1.00 0.00 C ATOM 223 O ALA A 15 -8.627 4.966 -2.666 1.00 0.00 O ATOM 224 CB ALA A 15 -8.745 2.704 -0.194 1.00 0.00 C ATOM 0 H ALA A 15 -10.895 1.783 -0.909 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.926 4.427 -0.599 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.838 3.285 -0.027 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.233 2.511 0.761 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -8.487 1.757 -0.668 1.00 0.00 H new ATOM 230 N MET A 16 -9.022 2.838 -3.324 1.00 0.00 N ATOM 231 CA MET A 16 -8.447 3.022 -4.645 1.00 0.00 C ATOM 232 C MET A 16 -9.239 4.055 -5.448 1.00 0.00 C ATOM 233 O MET A 16 -8.659 4.853 -6.185 1.00 0.00 O ATOM 234 CB MET A 16 -8.445 1.687 -5.391 1.00 0.00 C ATOM 235 CG MET A 16 -7.215 0.855 -5.026 1.00 0.00 C ATOM 236 SD MET A 16 -7.094 0.690 -3.252 1.00 0.00 S ATOM 237 CE MET A 16 -6.167 2.167 -2.866 1.00 0.00 C ATOM 0 H MET A 16 -9.380 1.901 -3.142 1.00 0.00 H new ATOM 0 HA MET A 16 -7.426 3.385 -4.529 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.350 1.130 -5.148 1.00 0.00 H new ATOM 0 HB3 MET A 16 -8.460 1.867 -6.466 1.00 0.00 H new ATOM 0 HG2 MET A 16 -7.282 -0.130 -5.487 1.00 0.00 H new ATOM 0 HG3 MET A 16 -6.315 1.330 -5.418 1.00 0.00 H new ATOM 0 HE1 MET A 16 -5.281 1.900 -2.289 1.00 0.00 H new ATOM 0 HE2 MET A 16 -5.863 2.658 -3.791 1.00 0.00 H new ATOM 0 HE3 MET A 16 -6.790 2.845 -2.282 1.00 0.00 H new ATOM 247 N ASP A 17 -10.552 4.010 -5.280 1.00 0.00 N ATOM 248 CA ASP A 17 -11.429 4.932 -5.980 1.00 0.00 C ATOM 249 C ASP A 17 -11.226 6.343 -5.425 1.00 0.00 C ATOM 250 O ASP A 17 -11.146 7.308 -6.185 1.00 0.00 O ATOM 251 CB ASP A 17 -12.898 4.553 -5.782 1.00 0.00 C ATOM 252 CG ASP A 17 -13.905 5.505 -6.430 1.00 0.00 C ATOM 253 OD1 ASP A 17 -13.802 6.718 -6.149 1.00 0.00 O ATOM 254 OD2 ASP A 17 -14.754 4.998 -7.195 1.00 0.00 O ATOM 0 H ASP A 17 -11.030 3.348 -4.668 1.00 0.00 H new ATOM 0 HA ASP A 17 -11.185 4.889 -7.042 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -13.057 3.552 -6.184 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.104 4.504 -4.713 1.00 0.00 H new ATOM 259 N GLN A 18 -11.147 6.420 -4.104 1.00 0.00 N ATOM 260 CA GLN A 18 -10.955 7.697 -3.438 1.00 0.00 C ATOM 261 C GLN A 18 -9.534 8.212 -3.677 1.00 0.00 C ATOM 262 O GLN A 18 -9.319 9.415 -3.805 1.00 0.00 O ATOM 263 CB GLN A 18 -11.254 7.586 -1.943 1.00 0.00 C ATOM 264 CG GLN A 18 -12.709 7.951 -1.644 1.00 0.00 C ATOM 265 CD GLN A 18 -12.932 8.141 -0.143 1.00 0.00 C ATOM 266 OE1 GLN A 18 -12.006 8.331 0.629 1.00 0.00 O ATOM 267 NE2 GLN A 18 -14.208 8.080 0.228 1.00 0.00 N ATOM 0 H GLN A 18 -11.213 5.618 -3.477 1.00 0.00 H new ATOM 0 HA GLN A 18 -11.657 8.415 -3.862 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -11.054 6.570 -1.603 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.589 8.245 -1.386 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.973 8.867 -2.173 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -13.368 7.166 -2.016 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.935 7.918 -0.469 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -14.460 8.195 1.210 1.00 0.00 H new ATOM 276 N CYS A 19 -8.601 7.273 -3.730 1.00 0.00 N ATOM 277 CA CYS A 19 -7.207 7.616 -3.952 1.00 0.00 C ATOM 278 C CYS A 19 -7.079 8.230 -5.348 1.00 0.00 C ATOM 279 O CYS A 19 -6.275 9.137 -5.560 1.00 0.00 O ATOM 280 CB CYS A 19 -6.291 6.404 -3.776 1.00 0.00 C ATOM 281 SG CYS A 19 -5.430 6.321 -2.163 1.00 0.00 S ATOM 0 H CYS A 19 -8.783 6.275 -3.623 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.886 8.343 -3.206 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -6.883 5.497 -3.903 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.545 6.412 -4.570 1.00 0.00 H new ATOM 286 N LYS A 20 -7.883 7.710 -6.265 1.00 0.00 N ATOM 287 CA LYS A 20 -7.870 8.194 -7.634 1.00 0.00 C ATOM 288 C LYS A 20 -8.378 9.638 -7.663 1.00 0.00 C ATOM 289 O LYS A 20 -8.336 10.292 -8.704 1.00 0.00 O ATOM 290 CB LYS A 20 -8.652 7.248 -8.546 1.00 0.00 C ATOM 291 CG LYS A 20 -7.920 7.035 -9.872 1.00 0.00 C ATOM 292 CD LYS A 20 -8.848 6.414 -10.918 1.00 0.00 C ATOM 293 CE LYS A 20 -9.500 7.495 -11.783 1.00 0.00 C ATOM 294 NZ LYS A 20 -10.882 7.759 -11.329 1.00 0.00 N ATOM 0 H LYS A 20 -8.548 6.958 -6.085 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.853 8.205 -8.025 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.793 6.290 -8.046 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.644 7.658 -8.736 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.540 7.988 -10.239 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.058 6.387 -9.715 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.283 5.729 -11.550 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -9.620 5.826 -10.421 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.913 8.412 -11.733 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.508 7.179 -12.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.552 7.258 -11.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.996 7.424 -10.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.071 8.781 -11.369 1.00 0.00 H new ATOM 308 N ASP A 21 -8.846 10.091 -6.510 1.00 0.00 N ATOM 309 CA ASP A 21 -9.364 11.443 -6.392 1.00 0.00 C ATOM 310 C ASP A 21 -8.429 12.265 -5.503 1.00 0.00 C ATOM 311 O ASP A 21 -7.763 13.184 -5.978 1.00 0.00 O ATOM 312 CB ASP A 21 -10.752 11.448 -5.748 1.00 0.00 C ATOM 313 CG ASP A 21 -11.793 12.312 -6.464 1.00 0.00 C ATOM 314 OD1 ASP A 21 -11.363 13.214 -7.216 1.00 0.00 O ATOM 315 OD2 ASP A 21 -12.995 12.051 -6.244 1.00 0.00 O ATOM 0 H ASP A 21 -8.877 9.546 -5.649 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.430 11.867 -7.394 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -11.120 10.423 -5.705 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.658 11.796 -4.719 1.00 0.00 H new ATOM 320 N GLU A 22 -8.408 11.906 -4.228 1.00 0.00 N ATOM 321 CA GLU A 22 -7.565 12.599 -3.268 1.00 0.00 C ATOM 322 C GLU A 22 -6.138 12.723 -3.808 1.00 0.00 C ATOM 323 O GLU A 22 -5.522 13.782 -3.704 1.00 0.00 O ATOM 324 CB GLU A 22 -7.578 11.889 -1.913 1.00 0.00 C ATOM 325 CG GLU A 22 -7.279 10.397 -2.072 1.00 0.00 C ATOM 326 CD GLU A 22 -8.199 9.556 -1.186 1.00 0.00 C ATOM 327 OE1 GLU A 22 -9.349 9.999 -0.979 1.00 0.00 O ATOM 328 OE2 GLU A 22 -7.732 8.487 -0.736 1.00 0.00 O ATOM 0 H GLU A 22 -8.962 11.144 -3.837 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.966 13.602 -3.119 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.839 12.343 -1.253 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.551 12.020 -1.439 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.407 10.106 -3.115 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.239 10.201 -1.812 1.00 0.00 H new ATOM 335 N LEU A 23 -5.655 11.625 -4.370 1.00 0.00 N ATOM 336 CA LEU A 23 -4.312 11.599 -4.926 1.00 0.00 C ATOM 337 C LEU A 23 -4.386 11.826 -6.437 1.00 0.00 C ATOM 338 O LEU A 23 -3.365 12.048 -7.085 1.00 0.00 O ATOM 339 CB LEU A 23 -3.596 10.305 -4.532 1.00 0.00 C ATOM 340 CG LEU A 23 -3.353 10.102 -3.037 1.00 0.00 C ATOM 341 CD1 LEU A 23 -2.923 8.663 -2.741 1.00 0.00 C ATOM 342 CD2 LEU A 23 -2.345 11.121 -2.501 1.00 0.00 C ATOM 0 H LEU A 23 -6.168 10.748 -4.453 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.711 12.408 -4.511 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.180 9.463 -4.903 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.634 10.275 -5.044 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.294 10.272 -2.513 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.757 8.546 -1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.705 7.976 -3.064 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.001 8.441 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.191 10.954 -1.435 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.397 11.007 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.728 12.129 -2.658 1.00 0.00 H new ATOM 354 N SER A 24 -5.604 11.764 -6.955 1.00 0.00 N ATOM 355 CA SER A 24 -5.823 11.961 -8.377 1.00 0.00 C ATOM 356 C SER A 24 -4.875 11.070 -9.182 1.00 0.00 C ATOM 357 O SER A 24 -4.647 11.309 -10.365 1.00 0.00 O ATOM 358 CB SER A 24 -5.632 13.427 -8.767 1.00 0.00 C ATOM 359 OG SER A 24 -6.820 14.191 -8.575 1.00 0.00 O ATOM 0 H SER A 24 -6.449 11.580 -6.415 1.00 0.00 H new ATOM 0 HA SER A 24 -6.852 11.684 -8.605 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.825 13.857 -8.174 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.327 13.487 -9.812 1.00 0.00 H new ATOM 0 HG SER A 24 -7.245 13.928 -7.732 1.00 0.00 H new ATOM 365 N LEU A 25 -4.346 10.060 -8.505 1.00 0.00 N ATOM 366 CA LEU A 25 -3.427 9.132 -9.141 1.00 0.00 C ATOM 367 C LEU A 25 -4.226 8.073 -9.906 1.00 0.00 C ATOM 368 O LEU A 25 -5.436 7.948 -9.719 1.00 0.00 O ATOM 369 CB LEU A 25 -2.458 8.546 -8.113 1.00 0.00 C ATOM 370 CG LEU A 25 -2.957 7.322 -7.342 1.00 0.00 C ATOM 371 CD1 LEU A 25 -4.447 7.448 -7.019 1.00 0.00 C ATOM 372 CD2 LEU A 25 -2.641 6.031 -8.099 1.00 0.00 C ATOM 0 H LEU A 25 -4.537 9.865 -7.522 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.805 9.652 -9.870 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.535 8.276 -8.626 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.207 9.326 -7.394 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.425 7.276 -6.392 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.776 6.565 -6.471 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.613 8.336 -6.410 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.014 7.532 -7.946 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.006 5.176 -7.529 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.128 6.052 -9.074 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.563 5.943 -8.234 1.00 0.00 H new ATOM 384 N PRO A 26 -3.499 7.320 -10.774 1.00 0.00 N ATOM 385 CA PRO A 26 -4.126 6.277 -11.567 1.00 0.00 C ATOM 386 C PRO A 26 -4.439 5.049 -10.708 1.00 0.00 C ATOM 387 O PRO A 26 -3.537 4.445 -10.132 1.00 0.00 O ATOM 388 CB PRO A 26 -3.138 5.984 -12.685 1.00 0.00 C ATOM 389 CG PRO A 26 -1.802 6.537 -12.214 1.00 0.00 C ATOM 390 CD PRO A 26 -2.065 7.442 -11.022 1.00 0.00 C ATOM 0 HA PRO A 26 -5.090 6.581 -11.976 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -3.072 4.913 -12.877 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -3.450 6.457 -13.616 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -1.130 5.725 -11.936 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.315 7.093 -13.015 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.485 7.131 -10.153 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -1.787 8.473 -11.239 1.00 0.00 H new ATOM 398 N ASP A 27 -5.720 4.717 -10.652 1.00 0.00 N ATOM 399 CA ASP A 27 -6.163 3.573 -9.875 1.00 0.00 C ATOM 400 C ASP A 27 -5.624 2.290 -10.512 1.00 0.00 C ATOM 401 O ASP A 27 -5.849 1.195 -9.997 1.00 0.00 O ATOM 402 CB ASP A 27 -7.689 3.482 -9.848 1.00 0.00 C ATOM 403 CG ASP A 27 -8.268 2.633 -8.713 1.00 0.00 C ATOM 404 OD1 ASP A 27 -7.726 1.528 -8.499 1.00 0.00 O ATOM 405 OD2 ASP A 27 -9.238 3.110 -8.086 1.00 0.00 O ATOM 0 H ASP A 27 -6.466 5.221 -11.132 1.00 0.00 H new ATOM 0 HA ASP A 27 -5.791 3.693 -8.857 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -8.096 4.490 -9.771 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -8.030 3.072 -10.798 1.00 0.00 H new ATOM 410 N SER A 28 -4.925 2.467 -11.622 1.00 0.00 N ATOM 411 CA SER A 28 -4.352 1.337 -12.335 1.00 0.00 C ATOM 412 C SER A 28 -3.024 0.931 -11.692 1.00 0.00 C ATOM 413 O SER A 28 -2.726 -0.257 -11.576 1.00 0.00 O ATOM 414 CB SER A 28 -4.146 1.667 -13.815 1.00 0.00 C ATOM 415 OG SER A 28 -3.454 2.898 -13.996 1.00 0.00 O ATOM 0 H SER A 28 -4.742 3.376 -12.046 1.00 0.00 H new ATOM 0 HA SER A 28 -5.050 0.502 -12.270 1.00 0.00 H new ATOM 0 HB2 SER A 28 -3.585 0.863 -14.291 1.00 0.00 H new ATOM 0 HB3 SER A 28 -5.114 1.719 -14.313 1.00 0.00 H new ATOM 0 HG SER A 28 -4.093 3.599 -14.241 1.00 0.00 H new ATOM 421 N VAL A 29 -2.265 1.940 -11.291 1.00 0.00 N ATOM 422 CA VAL A 29 -0.977 1.702 -10.663 1.00 0.00 C ATOM 423 C VAL A 29 -1.187 0.951 -9.346 1.00 0.00 C ATOM 424 O VAL A 29 -0.385 0.092 -8.982 1.00 0.00 O ATOM 425 CB VAL A 29 -0.230 3.026 -10.484 1.00 0.00 C ATOM 426 CG1 VAL A 29 0.072 3.672 -11.837 1.00 0.00 C ATOM 427 CG2 VAL A 29 -1.015 3.980 -9.582 1.00 0.00 C ATOM 0 H VAL A 29 -2.517 2.923 -11.389 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.352 1.075 -11.299 1.00 0.00 H new ATOM 0 HB VAL A 29 0.721 2.812 -9.997 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.603 4.611 -11.681 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.691 2.999 -12.431 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.862 3.866 -12.364 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.463 4.913 -9.471 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.988 4.185 -10.029 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.155 3.522 -8.603 1.00 0.00 H new ATOM 437 N VAL A 30 -2.268 1.303 -8.667 1.00 0.00 N ATOM 438 CA VAL A 30 -2.594 0.673 -7.400 1.00 0.00 C ATOM 439 C VAL A 30 -3.199 -0.708 -7.661 1.00 0.00 C ATOM 440 O VAL A 30 -3.014 -1.632 -6.870 1.00 0.00 O ATOM 441 CB VAL A 30 -3.513 1.584 -6.584 1.00 0.00 C ATOM 442 CG1 VAL A 30 -2.705 2.626 -5.807 1.00 0.00 C ATOM 443 CG2 VAL A 30 -4.556 2.254 -7.479 1.00 0.00 C ATOM 0 H VAL A 30 -2.930 2.017 -8.971 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.693 0.525 -6.805 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.042 0.964 -5.860 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -3.383 3.260 -5.236 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -2.020 2.121 -5.126 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.136 3.240 -6.505 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.196 2.896 -6.874 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.053 2.854 -8.237 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.163 1.490 -7.965 1.00 0.00 H new ATOM 453 N ALA A 31 -3.913 -0.805 -8.775 1.00 0.00 N ATOM 454 CA ALA A 31 -4.546 -2.058 -9.150 1.00 0.00 C ATOM 455 C ALA A 31 -3.467 -3.078 -9.521 1.00 0.00 C ATOM 456 O ALA A 31 -3.734 -4.278 -9.569 1.00 0.00 O ATOM 457 CB ALA A 31 -5.531 -1.808 -10.294 1.00 0.00 C ATOM 0 H ALA A 31 -4.066 -0.037 -9.428 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.113 -2.468 -8.314 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -6.007 -2.747 -10.576 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -6.293 -1.099 -9.970 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.996 -1.400 -11.152 1.00 0.00 H new ATOM 463 N ASP A 32 -2.272 -2.564 -9.773 1.00 0.00 N ATOM 464 CA ASP A 32 -1.153 -3.416 -10.138 1.00 0.00 C ATOM 465 C ASP A 32 -0.611 -4.104 -8.884 1.00 0.00 C ATOM 466 O ASP A 32 0.056 -5.133 -8.974 1.00 0.00 O ATOM 467 CB ASP A 32 -0.019 -2.599 -10.758 1.00 0.00 C ATOM 468 CG ASP A 32 0.844 -3.355 -11.771 1.00 0.00 C ATOM 469 OD1 ASP A 32 1.258 -4.485 -11.433 1.00 0.00 O ATOM 470 OD2 ASP A 32 1.070 -2.785 -12.860 1.00 0.00 O ATOM 0 H ASP A 32 -2.054 -1.568 -9.732 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.508 -4.148 -10.864 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.447 -1.725 -11.249 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.624 -2.232 -9.958 1.00 0.00 H new ATOM 475 N LEU A 33 -0.917 -3.507 -7.741 1.00 0.00 N ATOM 476 CA LEU A 33 -0.469 -4.049 -6.470 1.00 0.00 C ATOM 477 C LEU A 33 -0.942 -5.499 -6.343 1.00 0.00 C ATOM 478 O LEU A 33 -0.148 -6.391 -6.049 1.00 0.00 O ATOM 479 CB LEU A 33 -0.921 -3.152 -5.316 1.00 0.00 C ATOM 480 CG LEU A 33 -0.165 -1.830 -5.158 1.00 0.00 C ATOM 481 CD1 LEU A 33 0.255 -1.274 -6.520 1.00 0.00 C ATOM 482 CD2 LEU A 33 -0.990 -0.821 -4.356 1.00 0.00 C ATOM 0 H LEU A 33 -1.470 -2.653 -7.669 1.00 0.00 H new ATOM 0 HA LEU A 33 0.620 -4.063 -6.425 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.980 -2.929 -5.449 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.828 -3.714 -4.387 1.00 0.00 H new ATOM 0 HG LEU A 33 0.747 -2.022 -4.593 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.790 -0.335 -6.380 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.905 -1.991 -7.021 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.631 -1.099 -7.131 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.431 0.110 -4.258 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.930 -0.627 -4.873 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -1.197 -1.226 -3.366 1.00 0.00 H new ATOM 494 N TYR A 34 -2.232 -5.688 -6.571 1.00 0.00 N ATOM 495 CA TYR A 34 -2.820 -7.014 -6.487 1.00 0.00 C ATOM 496 C TYR A 34 -2.167 -7.970 -7.487 1.00 0.00 C ATOM 497 O TYR A 34 -2.228 -9.186 -7.320 1.00 0.00 O ATOM 498 CB TYR A 34 -4.297 -6.846 -6.850 1.00 0.00 C ATOM 499 CG TYR A 34 -5.233 -7.805 -6.113 1.00 0.00 C ATOM 500 CD1 TYR A 34 -5.088 -8.005 -4.756 1.00 0.00 C ATOM 501 CD2 TYR A 34 -6.225 -8.470 -6.804 1.00 0.00 C ATOM 502 CE1 TYR A 34 -5.968 -8.907 -4.061 1.00 0.00 C ATOM 503 CE2 TYR A 34 -7.107 -9.373 -6.111 1.00 0.00 C ATOM 504 CZ TYR A 34 -6.935 -9.546 -4.773 1.00 0.00 C ATOM 505 OH TYR A 34 -7.768 -10.400 -4.117 1.00 0.00 O ATOM 0 H TYR A 34 -2.887 -4.945 -6.814 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.680 -7.432 -5.490 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.599 -5.821 -6.633 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -4.415 -6.993 -7.924 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -4.313 -7.484 -4.214 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -6.340 -8.313 -7.866 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.863 -9.073 -2.999 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.886 -9.900 -6.641 1.00 0.00 H new ATOM 0 HH TYR A 34 -7.878 -10.102 -3.190 1.00 0.00 H new ATOM 515 N ASN A 35 -1.557 -7.380 -8.506 1.00 0.00 N ATOM 516 CA ASN A 35 -0.893 -8.163 -9.534 1.00 0.00 C ATOM 517 C ASN A 35 0.432 -8.696 -8.986 1.00 0.00 C ATOM 518 O ASN A 35 0.604 -9.905 -8.835 1.00 0.00 O ATOM 519 CB ASN A 35 -0.586 -7.309 -10.766 1.00 0.00 C ATOM 520 CG ASN A 35 -0.702 -8.134 -12.049 1.00 0.00 C ATOM 521 OD1 ASN A 35 -1.421 -9.117 -12.123 1.00 0.00 O ATOM 522 ND2 ASN A 35 0.044 -7.682 -13.052 1.00 0.00 N ATOM 0 H ASN A 35 -1.509 -6.370 -8.641 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.558 -8.979 -9.818 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.275 -6.465 -10.809 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.419 -6.896 -10.685 1.00 0.00 H new ATOM 0 HD21 ASN A 35 0.037 -8.164 -13.951 1.00 0.00 H new ATOM 0 HD22 ASN A 35 0.624 -6.853 -12.923 1.00 0.00 H new ATOM 529 N PHE A 36 1.335 -7.771 -8.706 1.00 0.00 N ATOM 530 CA PHE A 36 2.640 -8.132 -8.177 1.00 0.00 C ATOM 531 C PHE A 36 3.631 -6.974 -8.322 1.00 0.00 C ATOM 532 O PHE A 36 4.761 -7.171 -8.764 1.00 0.00 O ATOM 533 CB PHE A 36 3.141 -9.321 -8.999 1.00 0.00 C ATOM 534 CG PHE A 36 3.036 -10.665 -8.276 1.00 0.00 C ATOM 535 CD1 PHE A 36 3.473 -10.783 -6.993 1.00 0.00 C ATOM 536 CD2 PHE A 36 2.508 -11.742 -8.916 1.00 0.00 C ATOM 537 CE1 PHE A 36 3.375 -12.031 -6.323 1.00 0.00 C ATOM 538 CE2 PHE A 36 2.410 -12.989 -8.245 1.00 0.00 C ATOM 539 CZ PHE A 36 2.846 -13.108 -6.963 1.00 0.00 C ATOM 0 H PHE A 36 1.190 -6.770 -8.835 1.00 0.00 H new ATOM 0 HA PHE A 36 2.558 -8.374 -7.117 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.572 -9.374 -9.927 1.00 0.00 H new ATOM 0 HB3 PHE A 36 4.182 -9.148 -9.273 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.894 -9.928 -6.485 1.00 0.00 H new ATOM 0 HD2 PHE A 36 2.163 -11.649 -9.935 1.00 0.00 H new ATOM 0 HE1 PHE A 36 3.721 -12.125 -5.304 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.989 -13.844 -8.753 1.00 0.00 H new ATOM 0 HZ PHE A 36 2.772 -14.057 -6.453 1.00 0.00 H new ATOM 549 N TRP A 37 3.169 -5.793 -7.940 1.00 0.00 N ATOM 550 CA TRP A 37 3.999 -4.603 -8.021 1.00 0.00 C ATOM 551 C TRP A 37 4.732 -4.446 -6.687 1.00 0.00 C ATOM 552 O TRP A 37 5.314 -3.396 -6.414 1.00 0.00 O ATOM 553 CB TRP A 37 3.165 -3.375 -8.393 1.00 0.00 C ATOM 554 CG TRP A 37 3.181 -2.269 -7.337 1.00 0.00 C ATOM 555 CD1 TRP A 37 3.412 -0.961 -7.515 1.00 0.00 C ATOM 556 CD2 TRP A 37 2.944 -2.427 -5.922 1.00 0.00 C ATOM 557 NE1 TRP A 37 3.343 -0.268 -6.324 1.00 0.00 N ATOM 558 CE2 TRP A 37 3.049 -1.188 -5.325 1.00 0.00 C ATOM 559 CE3 TRP A 37 2.651 -3.579 -5.172 1.00 0.00 C ATOM 560 CZ2 TRP A 37 2.875 -0.982 -3.950 1.00 0.00 C ATOM 561 CZ3 TRP A 37 2.480 -3.357 -3.801 1.00 0.00 C ATOM 562 CH2 TRP A 37 2.583 -2.116 -3.184 1.00 0.00 C ATOM 0 H TRP A 37 2.230 -5.634 -7.573 1.00 0.00 H new ATOM 0 HA TRP A 37 4.739 -4.703 -8.815 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.535 -2.969 -9.335 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.134 -3.686 -8.563 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.625 -0.506 -8.471 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.482 0.735 -6.200 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.565 -4.558 -5.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.962 -0.001 -3.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.252 -4.210 -3.179 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.438 -2.027 -2.117 1.00 0.00 H new ATOM 573 N LYS A 38 4.680 -5.504 -5.892 1.00 0.00 N ATOM 574 CA LYS A 38 5.331 -5.496 -4.594 1.00 0.00 C ATOM 575 C LYS A 38 6.732 -4.897 -4.733 1.00 0.00 C ATOM 576 O LYS A 38 7.072 -3.935 -4.047 1.00 0.00 O ATOM 577 CB LYS A 38 5.320 -6.898 -3.979 1.00 0.00 C ATOM 578 CG LYS A 38 4.599 -6.901 -2.630 1.00 0.00 C ATOM 579 CD LYS A 38 4.125 -8.309 -2.265 1.00 0.00 C ATOM 580 CE LYS A 38 2.646 -8.495 -2.608 1.00 0.00 C ATOM 581 NZ LYS A 38 2.063 -9.597 -1.809 1.00 0.00 N ATOM 0 H LYS A 38 4.197 -6.373 -6.122 1.00 0.00 H new ATOM 0 HA LYS A 38 4.781 -4.863 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.828 -7.593 -4.659 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.343 -7.250 -3.849 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.268 -6.526 -1.855 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.745 -6.224 -2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.722 -9.048 -2.800 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.280 -8.484 -1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.103 -7.570 -2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.537 -8.712 -3.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.059 -9.710 -2.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.571 -10.481 -2.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.149 -9.375 -0.797 1.00 0.00 H new ATOM 595 N ASP A 39 7.509 -5.493 -5.627 1.00 0.00 N ATOM 596 CA ASP A 39 8.865 -5.031 -5.866 1.00 0.00 C ATOM 597 C ASP A 39 8.822 -3.623 -6.462 1.00 0.00 C ATOM 598 O ASP A 39 9.752 -2.839 -6.281 1.00 0.00 O ATOM 599 CB ASP A 39 9.591 -5.942 -6.858 1.00 0.00 C ATOM 600 CG ASP A 39 9.346 -5.618 -8.333 1.00 0.00 C ATOM 601 OD1 ASP A 39 9.915 -4.604 -8.792 1.00 0.00 O ATOM 602 OD2 ASP A 39 8.597 -6.391 -8.967 1.00 0.00 O ATOM 0 H ASP A 39 7.224 -6.292 -6.194 1.00 0.00 H new ATOM 0 HA ASP A 39 9.396 -5.039 -4.914 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.662 -5.886 -6.662 1.00 0.00 H new ATOM 0 HB3 ASP A 39 9.286 -6.972 -6.672 1.00 0.00 H new ATOM 607 N ASP A 40 7.731 -3.344 -7.162 1.00 0.00 N ATOM 608 CA ASP A 40 7.555 -2.044 -7.786 1.00 0.00 C ATOM 609 C ASP A 40 7.348 -0.986 -6.701 1.00 0.00 C ATOM 610 O ASP A 40 6.215 -0.678 -6.336 1.00 0.00 O ATOM 611 CB ASP A 40 6.325 -2.034 -8.697 1.00 0.00 C ATOM 612 CG ASP A 40 6.259 -0.862 -9.680 1.00 0.00 C ATOM 613 OD1 ASP A 40 6.551 0.268 -9.236 1.00 0.00 O ATOM 614 OD2 ASP A 40 5.921 -1.126 -10.854 1.00 0.00 O ATOM 0 H ASP A 40 6.961 -3.996 -7.310 1.00 0.00 H new ATOM 0 HA ASP A 40 8.445 -1.830 -8.378 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.303 -2.965 -9.263 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.430 -2.018 -8.075 1.00 0.00 H new ATOM 619 N TYR A 41 8.462 -0.457 -6.215 1.00 0.00 N ATOM 620 CA TYR A 41 8.417 0.560 -5.178 1.00 0.00 C ATOM 621 C TYR A 41 8.359 1.962 -5.788 1.00 0.00 C ATOM 622 O TYR A 41 8.484 2.120 -7.001 1.00 0.00 O ATOM 623 CB TYR A 41 9.720 0.414 -4.390 1.00 0.00 C ATOM 624 CG TYR A 41 9.976 1.551 -3.396 1.00 0.00 C ATOM 625 CD1 TYR A 41 9.160 1.701 -2.295 1.00 0.00 C ATOM 626 CD2 TYR A 41 11.023 2.424 -3.604 1.00 0.00 C ATOM 627 CE1 TYR A 41 9.401 2.771 -1.361 1.00 0.00 C ATOM 628 CE2 TYR A 41 11.265 3.495 -2.671 1.00 0.00 C ATOM 629 CZ TYR A 41 10.441 3.615 -1.594 1.00 0.00 C ATOM 630 OH TYR A 41 10.669 4.625 -0.713 1.00 0.00 O ATOM 0 H TYR A 41 9.401 -0.714 -6.520 1.00 0.00 H new ATOM 0 HA TYR A 41 7.533 0.433 -4.553 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.701 -0.532 -3.848 1.00 0.00 H new ATOM 0 HB3 TYR A 41 10.553 0.363 -5.091 1.00 0.00 H new ATOM 0 HD1 TYR A 41 8.340 1.017 -2.133 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.662 2.305 -4.467 1.00 0.00 H new ATOM 0 HE1 TYR A 41 8.769 2.900 -0.495 1.00 0.00 H new ATOM 0 HE2 TYR A 41 12.081 4.186 -2.823 1.00 0.00 H new ATOM 0 HH TYR A 41 11.445 5.147 -1.007 1.00 0.00 H new ATOM 640 N VAL A 42 8.167 2.943 -4.919 1.00 0.00 N ATOM 641 CA VAL A 42 8.090 4.327 -5.357 1.00 0.00 C ATOM 642 C VAL A 42 9.116 4.564 -6.467 1.00 0.00 C ATOM 643 O VAL A 42 8.907 5.403 -7.341 1.00 0.00 O ATOM 644 CB VAL A 42 8.275 5.264 -4.162 1.00 0.00 C ATOM 645 CG1 VAL A 42 8.589 6.687 -4.626 1.00 0.00 C ATOM 646 CG2 VAL A 42 7.044 5.244 -3.253 1.00 0.00 C ATOM 0 H VAL A 42 8.062 2.807 -3.913 1.00 0.00 H new ATOM 0 HA VAL A 42 7.106 4.542 -5.773 1.00 0.00 H new ATOM 0 HB VAL A 42 9.125 4.904 -3.583 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.716 7.333 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 42 9.507 6.684 -5.213 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.768 7.060 -5.238 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.202 5.919 -2.412 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.169 5.567 -3.818 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.883 4.232 -2.881 1.00 0.00 H new ATOM 656 N MET A 43 10.202 3.809 -6.395 1.00 0.00 N ATOM 657 CA MET A 43 11.262 3.925 -7.383 1.00 0.00 C ATOM 658 C MET A 43 10.683 4.124 -8.786 1.00 0.00 C ATOM 659 O MET A 43 11.326 4.723 -9.648 1.00 0.00 O ATOM 660 CB MET A 43 12.124 2.662 -7.361 1.00 0.00 C ATOM 661 CG MET A 43 13.238 2.739 -8.407 1.00 0.00 C ATOM 662 SD MET A 43 14.457 3.947 -7.914 1.00 0.00 S ATOM 663 CE MET A 43 14.537 4.931 -9.402 1.00 0.00 C ATOM 0 H MET A 43 10.371 3.114 -5.668 1.00 0.00 H new ATOM 0 HA MET A 43 11.871 4.794 -7.134 1.00 0.00 H new ATOM 0 HB2 MET A 43 12.559 2.532 -6.370 1.00 0.00 H new ATOM 0 HB3 MET A 43 11.500 1.789 -7.552 1.00 0.00 H new ATOM 0 HG2 MET A 43 13.708 1.762 -8.522 1.00 0.00 H new ATOM 0 HG3 MET A 43 12.819 3.008 -9.377 1.00 0.00 H new ATOM 0 HE1 MET A 43 15.478 5.480 -9.425 1.00 0.00 H new ATOM 0 HE2 MET A 43 14.476 4.279 -10.273 1.00 0.00 H new ATOM 0 HE3 MET A 43 13.706 5.636 -9.417 1.00 0.00 H new ATOM 673 N THR A 44 9.476 3.611 -8.972 1.00 0.00 N ATOM 674 CA THR A 44 8.803 3.724 -10.254 1.00 0.00 C ATOM 675 C THR A 44 7.596 4.655 -10.144 1.00 0.00 C ATOM 676 O THR A 44 7.522 5.668 -10.838 1.00 0.00 O ATOM 677 CB THR A 44 8.441 2.314 -10.725 1.00 0.00 C ATOM 678 OG1 THR A 44 9.616 1.857 -11.390 1.00 0.00 O ATOM 679 CG2 THR A 44 7.372 2.317 -11.819 1.00 0.00 C ATOM 0 H THR A 44 8.946 3.115 -8.255 1.00 0.00 H new ATOM 0 HA THR A 44 9.454 4.175 -11.002 1.00 0.00 H new ATOM 0 HB THR A 44 8.089 1.728 -9.876 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.469 0.948 -11.726 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.153 1.292 -12.116 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.464 2.787 -11.440 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.736 2.875 -12.682 1.00 0.00 H new ATOM 687 N ASP A 45 6.677 4.280 -9.266 1.00 0.00 N ATOM 688 CA ASP A 45 5.475 5.069 -9.054 1.00 0.00 C ATOM 689 C ASP A 45 5.226 5.218 -7.552 1.00 0.00 C ATOM 690 O ASP A 45 4.946 4.237 -6.865 1.00 0.00 O ATOM 691 CB ASP A 45 4.253 4.387 -9.672 1.00 0.00 C ATOM 692 CG ASP A 45 3.024 5.284 -9.830 1.00 0.00 C ATOM 693 OD1 ASP A 45 3.032 6.095 -10.782 1.00 0.00 O ATOM 694 OD2 ASP A 45 2.103 5.139 -8.997 1.00 0.00 O ATOM 0 H ASP A 45 6.741 3.439 -8.692 1.00 0.00 H new ATOM 0 HA ASP A 45 5.622 6.041 -9.525 1.00 0.00 H new ATOM 0 HB2 ASP A 45 4.529 3.999 -10.652 1.00 0.00 H new ATOM 0 HB3 ASP A 45 3.982 3.531 -9.054 1.00 0.00 H new ATOM 699 N ARG A 46 5.336 6.455 -7.086 1.00 0.00 N ATOM 700 CA ARG A 46 5.126 6.744 -5.678 1.00 0.00 C ATOM 701 C ARG A 46 3.631 6.720 -5.348 1.00 0.00 C ATOM 702 O ARG A 46 3.232 6.224 -4.296 1.00 0.00 O ATOM 703 CB ARG A 46 5.700 8.112 -5.306 1.00 0.00 C ATOM 704 CG ARG A 46 5.299 8.508 -3.883 1.00 0.00 C ATOM 705 CD ARG A 46 4.674 9.904 -3.858 1.00 0.00 C ATOM 706 NE ARG A 46 5.690 10.918 -4.218 1.00 0.00 N ATOM 707 CZ ARG A 46 5.604 12.215 -3.891 1.00 0.00 C ATOM 708 NH1 ARG A 46 4.551 12.663 -3.195 1.00 0.00 N ATOM 709 NH2 ARG A 46 6.573 13.065 -4.260 1.00 0.00 N ATOM 0 H ARG A 46 5.568 7.267 -7.659 1.00 0.00 H new ATOM 0 HA ARG A 46 5.642 5.976 -5.101 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.787 8.089 -5.388 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.343 8.863 -6.010 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.590 7.781 -3.485 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.175 8.486 -3.235 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.838 9.950 -4.556 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.273 10.115 -2.867 1.00 0.00 H new ATOM 0 HE ARG A 46 6.506 10.611 -4.748 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.814 12.017 -2.913 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.486 13.650 -2.947 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.376 12.725 -4.790 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.508 14.052 -4.011 1.00 0.00 H new ATOM 723 N LEU A 47 2.846 7.260 -6.269 1.00 0.00 N ATOM 724 CA LEU A 47 1.405 7.307 -6.088 1.00 0.00 C ATOM 725 C LEU A 47 0.907 5.933 -5.634 1.00 0.00 C ATOM 726 O LEU A 47 0.076 5.837 -4.733 1.00 0.00 O ATOM 727 CB LEU A 47 0.724 7.819 -7.359 1.00 0.00 C ATOM 728 CG LEU A 47 1.395 9.009 -8.050 1.00 0.00 C ATOM 729 CD1 LEU A 47 2.032 9.949 -7.024 1.00 0.00 C ATOM 730 CD2 LEU A 47 2.405 8.535 -9.097 1.00 0.00 C ATOM 0 H LEU A 47 3.180 7.668 -7.142 1.00 0.00 H new ATOM 0 HA LEU A 47 1.141 8.016 -5.304 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.666 6.997 -8.072 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -0.300 8.099 -7.111 1.00 0.00 H new ATOM 0 HG LEU A 47 0.628 9.577 -8.576 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.502 10.786 -7.540 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.264 10.325 -6.348 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.785 9.407 -6.452 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.868 9.399 -9.574 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.174 7.932 -8.614 1.00 0.00 H new ATOM 0 HD23 LEU A 47 1.894 7.936 -9.850 1.00 0.00 H new ATOM 742 N ALA A 48 1.437 4.906 -6.280 1.00 0.00 N ATOM 743 CA ALA A 48 1.058 3.540 -5.953 1.00 0.00 C ATOM 744 C ALA A 48 1.418 3.251 -4.495 1.00 0.00 C ATOM 745 O ALA A 48 0.723 2.493 -3.819 1.00 0.00 O ATOM 746 CB ALA A 48 1.739 2.575 -6.925 1.00 0.00 C ATOM 0 H ALA A 48 2.125 4.991 -7.028 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.018 3.404 -6.060 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.455 1.551 -6.680 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.427 2.804 -7.944 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.821 2.681 -6.844 1.00 0.00 H new ATOM 752 N GLY A 49 2.502 3.869 -4.053 1.00 0.00 N ATOM 753 CA GLY A 49 2.963 3.687 -2.686 1.00 0.00 C ATOM 754 C GLY A 49 2.210 4.610 -1.726 1.00 0.00 C ATOM 755 O GLY A 49 1.991 4.260 -0.567 1.00 0.00 O ATOM 0 H GLY A 49 3.075 4.497 -4.616 1.00 0.00 H new ATOM 0 HA2 GLY A 49 2.820 2.649 -2.385 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.032 3.891 -2.629 1.00 0.00 H new ATOM 759 N CYS A 50 1.834 5.769 -2.244 1.00 0.00 N ATOM 760 CA CYS A 50 1.109 6.745 -1.447 1.00 0.00 C ATOM 761 C CYS A 50 -0.356 6.311 -1.373 1.00 0.00 C ATOM 762 O CYS A 50 -0.959 6.331 -0.300 1.00 0.00 O ATOM 763 CB CYS A 50 1.258 8.160 -2.012 1.00 0.00 C ATOM 764 SG CYS A 50 2.527 9.186 -1.186 1.00 0.00 S ATOM 0 H CYS A 50 2.017 6.055 -3.206 1.00 0.00 H new ATOM 0 HA CYS A 50 1.528 6.781 -0.441 1.00 0.00 H new ATOM 0 HB2 CYS A 50 1.502 8.089 -3.072 1.00 0.00 H new ATOM 0 HB3 CYS A 50 0.296 8.668 -1.939 1.00 0.00 H new ATOM 769 N ALA A 51 -0.888 5.931 -2.524 1.00 0.00 N ATOM 770 CA ALA A 51 -2.270 5.493 -2.603 1.00 0.00 C ATOM 771 C ALA A 51 -2.488 4.329 -1.636 1.00 0.00 C ATOM 772 O ALA A 51 -3.454 4.322 -0.873 1.00 0.00 O ATOM 773 CB ALA A 51 -2.608 5.122 -4.049 1.00 0.00 C ATOM 0 H ALA A 51 -0.386 5.917 -3.412 1.00 0.00 H new ATOM 0 HA ALA A 51 -2.944 6.297 -2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -3.646 4.793 -4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.466 5.992 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.953 4.316 -4.380 1.00 0.00 H new ATOM 779 N ILE A 52 -1.575 3.371 -1.699 1.00 0.00 N ATOM 780 CA ILE A 52 -1.655 2.204 -0.837 1.00 0.00 C ATOM 781 C ILE A 52 -1.739 2.656 0.622 1.00 0.00 C ATOM 782 O ILE A 52 -2.524 2.113 1.399 1.00 0.00 O ATOM 783 CB ILE A 52 -0.493 1.249 -1.119 1.00 0.00 C ATOM 784 CG1 ILE A 52 -0.972 -0.203 -1.162 1.00 0.00 C ATOM 785 CG2 ILE A 52 0.638 1.449 -0.108 1.00 0.00 C ATOM 786 CD1 ILE A 52 -1.679 -0.585 0.139 1.00 0.00 C ATOM 0 H ILE A 52 -0.776 3.379 -2.333 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.562 1.637 -1.047 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.091 1.484 -2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.651 -0.341 -2.003 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -0.122 -0.865 -1.326 1.00 0.00 H new ATOM 0 HG21 ILE A 52 1.451 0.758 -0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.005 2.474 -0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.265 1.258 0.898 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -2.010 -1.622 0.082 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.990 -0.469 0.975 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.542 0.063 0.288 1.00 0.00 H new ATOM 798 N ASN A 53 -0.921 3.645 0.950 1.00 0.00 N ATOM 799 CA ASN A 53 -0.893 4.177 2.302 1.00 0.00 C ATOM 800 C ASN A 53 -2.296 4.651 2.687 1.00 0.00 C ATOM 801 O ASN A 53 -2.742 4.433 3.812 1.00 0.00 O ATOM 802 CB ASN A 53 0.055 5.372 2.404 1.00 0.00 C ATOM 803 CG ASN A 53 1.181 5.095 3.403 1.00 0.00 C ATOM 804 OD1 ASN A 53 1.044 5.283 4.600 1.00 0.00 O ATOM 805 ND2 ASN A 53 2.297 4.638 2.843 1.00 0.00 N ATOM 0 H ASN A 53 -0.272 4.092 0.302 1.00 0.00 H new ATOM 0 HA ASN A 53 -0.549 3.387 2.969 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.479 5.589 1.424 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -0.501 6.257 2.714 1.00 0.00 H new ATOM 0 HD21 ASN A 53 3.107 4.422 3.424 1.00 0.00 H new ATOM 0 HD22 ASN A 53 2.343 4.504 1.833 1.00 0.00 H new ATOM 812 N CYS A 54 -2.953 5.291 1.731 1.00 0.00 N ATOM 813 CA CYS A 54 -4.297 5.800 1.955 1.00 0.00 C ATOM 814 C CYS A 54 -5.230 4.606 2.169 1.00 0.00 C ATOM 815 O CYS A 54 -6.229 4.717 2.880 1.00 0.00 O ATOM 816 CB CYS A 54 -4.763 6.691 0.805 1.00 0.00 C ATOM 817 SG CYS A 54 -5.807 5.853 -0.443 1.00 0.00 S ATOM 0 H CYS A 54 -2.580 5.469 0.799 1.00 0.00 H new ATOM 0 HA CYS A 54 -4.308 6.433 2.842 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -5.320 7.532 1.218 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -3.886 7.104 0.306 1.00 0.00 H new ATOM 822 N LEU A 55 -4.873 3.495 1.542 1.00 0.00 N ATOM 823 CA LEU A 55 -5.668 2.285 1.654 1.00 0.00 C ATOM 824 C LEU A 55 -6.131 2.117 3.103 1.00 0.00 C ATOM 825 O LEU A 55 -7.169 1.507 3.360 1.00 0.00 O ATOM 826 CB LEU A 55 -4.890 1.082 1.115 1.00 0.00 C ATOM 827 CG LEU A 55 -5.722 -0.156 0.774 1.00 0.00 C ATOM 828 CD1 LEU A 55 -6.229 -0.842 2.045 1.00 0.00 C ATOM 829 CD2 LEU A 55 -6.865 0.195 -0.181 1.00 0.00 C ATOM 0 H LEU A 55 -4.044 3.408 0.955 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.564 2.359 1.038 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.354 1.393 0.219 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.140 0.799 1.853 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.078 -0.867 0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.817 -1.719 1.775 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.380 -1.149 2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.851 -0.148 2.610 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.440 -0.703 -0.406 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.516 0.934 0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.455 0.604 -1.104 1.00 0.00 H new ATOM 841 N ALA A 56 -5.340 2.667 4.012 1.00 0.00 N ATOM 842 CA ALA A 56 -5.657 2.586 5.428 1.00 0.00 C ATOM 843 C ALA A 56 -6.996 3.278 5.686 1.00 0.00 C ATOM 844 O ALA A 56 -7.576 3.134 6.763 1.00 0.00 O ATOM 845 CB ALA A 56 -4.515 3.201 6.242 1.00 0.00 C ATOM 0 H ALA A 56 -4.480 3.171 3.796 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.758 1.547 5.741 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -4.752 3.141 7.304 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.592 2.655 6.044 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.387 4.245 5.958 1.00 0.00 H new ATOM 851 N THR A 57 -7.450 4.013 4.683 1.00 0.00 N ATOM 852 CA THR A 57 -8.712 4.727 4.788 1.00 0.00 C ATOM 853 C THR A 57 -9.544 4.170 5.944 1.00 0.00 C ATOM 854 O THR A 57 -9.848 4.886 6.897 1.00 0.00 O ATOM 855 CB THR A 57 -9.419 4.640 3.434 1.00 0.00 C ATOM 856 OG1 THR A 57 -9.400 3.251 3.120 1.00 0.00 O ATOM 857 CG2 THR A 57 -8.609 5.289 2.309 1.00 0.00 C ATOM 0 H THR A 57 -6.967 4.130 3.792 1.00 0.00 H new ATOM 0 HA THR A 57 -8.553 5.780 5.020 1.00 0.00 H new ATOM 0 HB THR A 57 -10.395 5.120 3.502 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.257 2.994 2.719 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.155 5.200 1.370 1.00 0.00 H new ATOM 0 HG22 THR A 57 -8.449 6.343 2.537 1.00 0.00 H new ATOM 0 HG23 THR A 57 -7.646 4.787 2.218 1.00 0.00 H new ATOM 865 N LYS A 58 -9.890 2.897 5.824 1.00 0.00 N ATOM 866 CA LYS A 58 -10.682 2.236 6.847 1.00 0.00 C ATOM 867 C LYS A 58 -9.844 1.134 7.501 1.00 0.00 C ATOM 868 O LYS A 58 -9.809 0.005 7.014 1.00 0.00 O ATOM 869 CB LYS A 58 -12.005 1.738 6.264 1.00 0.00 C ATOM 870 CG LYS A 58 -12.947 2.907 5.967 1.00 0.00 C ATOM 871 CD LYS A 58 -13.703 3.336 7.227 1.00 0.00 C ATOM 872 CE LYS A 58 -14.017 4.831 7.196 1.00 0.00 C ATOM 873 NZ LYS A 58 -15.378 5.086 7.717 1.00 0.00 N ATOM 0 H LYS A 58 -9.636 2.305 5.033 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.953 2.941 7.633 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.815 1.177 5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.480 1.052 6.965 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -12.375 3.749 5.577 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -13.658 2.618 5.193 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -14.630 2.768 7.310 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -13.107 3.104 8.110 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -13.285 5.375 7.793 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -13.936 5.204 6.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.575 6.107 7.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -16.074 4.583 7.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.443 4.748 8.698 1.00 0.00 H new ATOM 887 N LEU A 59 -9.191 1.501 8.593 1.00 0.00 N ATOM 888 CA LEU A 59 -8.357 0.558 9.319 1.00 0.00 C ATOM 889 C LEU A 59 -9.207 -0.639 9.753 1.00 0.00 C ATOM 890 O LEU A 59 -8.672 -1.683 10.121 1.00 0.00 O ATOM 891 CB LEU A 59 -7.640 1.255 10.476 1.00 0.00 C ATOM 892 CG LEU A 59 -6.133 1.460 10.306 1.00 0.00 C ATOM 893 CD1 LEU A 59 -5.809 2.028 8.923 1.00 0.00 C ATOM 894 CD2 LEU A 59 -5.568 2.330 11.429 1.00 0.00 C ATOM 0 H LEU A 59 -9.222 2.439 8.993 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.568 0.172 8.673 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -8.104 2.229 10.631 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.807 0.675 11.383 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.646 0.487 10.376 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.732 2.164 8.829 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -6.156 1.336 8.155 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -6.308 2.989 8.798 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.496 2.460 11.284 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.057 3.304 11.415 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.748 1.847 12.389 1.00 0.00 H new ATOM 906 N ASP A 60 -10.517 -0.446 9.696 1.00 0.00 N ATOM 907 CA ASP A 60 -11.445 -1.495 10.080 1.00 0.00 C ATOM 908 C ASP A 60 -11.394 -2.619 9.042 1.00 0.00 C ATOM 909 O ASP A 60 -11.722 -3.766 9.346 1.00 0.00 O ATOM 910 CB ASP A 60 -12.879 -0.968 10.136 1.00 0.00 C ATOM 911 CG ASP A 60 -13.527 -1.002 11.521 1.00 0.00 C ATOM 912 OD1 ASP A 60 -12.861 -1.514 12.446 1.00 0.00 O ATOM 913 OD2 ASP A 60 -14.674 -0.513 11.624 1.00 0.00 O ATOM 0 H ASP A 60 -10.957 0.422 9.390 1.00 0.00 H new ATOM 0 HA ASP A 60 -11.156 -1.857 11.066 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -12.887 0.060 9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.492 -1.553 9.450 1.00 0.00 H new ATOM 918 N VAL A 61 -10.980 -2.250 7.838 1.00 0.00 N ATOM 919 CA VAL A 61 -10.883 -3.214 6.754 1.00 0.00 C ATOM 920 C VAL A 61 -9.585 -4.012 6.901 1.00 0.00 C ATOM 921 O VAL A 61 -9.572 -5.225 6.698 1.00 0.00 O ATOM 922 CB VAL A 61 -10.995 -2.498 5.406 1.00 0.00 C ATOM 923 CG1 VAL A 61 -12.039 -1.380 5.465 1.00 0.00 C ATOM 924 CG2 VAL A 61 -9.636 -1.956 4.959 1.00 0.00 C ATOM 0 H VAL A 61 -10.708 -1.299 7.589 1.00 0.00 H new ATOM 0 HA VAL A 61 -11.708 -3.925 6.800 1.00 0.00 H new ATOM 0 HB VAL A 61 -11.325 -3.226 4.665 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.099 -0.887 4.495 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.011 -1.803 5.718 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.751 -0.653 6.224 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -9.743 -1.452 3.999 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -9.265 -1.249 5.701 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -8.930 -2.781 4.859 1.00 0.00 H new ATOM 934 N VAL A 62 -8.527 -3.298 7.252 1.00 0.00 N ATOM 935 CA VAL A 62 -7.228 -3.923 7.429 1.00 0.00 C ATOM 936 C VAL A 62 -7.162 -4.569 8.815 1.00 0.00 C ATOM 937 O VAL A 62 -6.724 -5.711 8.950 1.00 0.00 O ATOM 938 CB VAL A 62 -6.116 -2.897 7.193 1.00 0.00 C ATOM 939 CG1 VAL A 62 -5.661 -2.908 5.733 1.00 0.00 C ATOM 940 CG2 VAL A 62 -6.562 -1.497 7.619 1.00 0.00 C ATOM 0 H VAL A 62 -8.542 -2.292 7.419 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.082 -4.715 6.694 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.263 -3.179 7.811 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.871 -2.170 5.593 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.283 -3.898 5.477 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.504 -2.664 5.087 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.754 -0.788 7.441 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -7.438 -1.202 7.040 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -6.813 -1.502 8.680 1.00 0.00 H new ATOM 950 N ASP A 63 -7.601 -3.810 9.807 1.00 0.00 N ATOM 951 CA ASP A 63 -7.597 -4.294 11.177 1.00 0.00 C ATOM 952 C ASP A 63 -9.011 -4.196 11.752 1.00 0.00 C ATOM 953 O ASP A 63 -9.481 -3.107 12.076 1.00 0.00 O ATOM 954 CB ASP A 63 -6.670 -3.451 12.057 1.00 0.00 C ATOM 955 CG ASP A 63 -7.073 -1.981 12.198 1.00 0.00 C ATOM 956 OD1 ASP A 63 -6.658 -1.192 11.323 1.00 0.00 O ATOM 957 OD2 ASP A 63 -7.789 -1.680 13.179 1.00 0.00 O ATOM 0 H ASP A 63 -7.962 -2.863 9.690 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.247 -5.326 11.169 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.631 -3.898 13.050 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.662 -3.498 11.646 1.00 0.00 H new ATOM 962 N PRO A 64 -9.668 -5.381 11.865 1.00 0.00 N ATOM 963 CA PRO A 64 -11.020 -5.442 12.394 1.00 0.00 C ATOM 964 C PRO A 64 -11.022 -5.256 13.913 1.00 0.00 C ATOM 965 O PRO A 64 -11.860 -4.536 14.453 1.00 0.00 O ATOM 966 CB PRO A 64 -11.554 -6.796 11.960 1.00 0.00 C ATOM 967 CG PRO A 64 -10.334 -7.632 11.607 1.00 0.00 C ATOM 968 CD PRO A 64 -9.144 -6.693 11.491 1.00 0.00 C ATOM 0 HA PRO A 64 -11.656 -4.641 12.017 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.130 -7.263 12.759 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -12.220 -6.697 11.103 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -10.153 -8.385 12.374 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -10.494 -8.164 10.669 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -8.333 -6.998 12.152 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -8.743 -6.685 10.477 1.00 0.00 H new ATOM 976 N ASP A 65 -10.075 -5.920 14.559 1.00 0.00 N ATOM 977 CA ASP A 65 -9.957 -5.839 16.005 1.00 0.00 C ATOM 978 C ASP A 65 -8.660 -5.114 16.366 1.00 0.00 C ATOM 979 O ASP A 65 -8.328 -4.975 17.542 1.00 0.00 O ATOM 980 CB ASP A 65 -9.911 -7.233 16.633 1.00 0.00 C ATOM 981 CG ASP A 65 -10.495 -7.326 18.045 1.00 0.00 C ATOM 982 OD1 ASP A 65 -11.422 -6.538 18.329 1.00 0.00 O ATOM 983 OD2 ASP A 65 -9.999 -8.182 18.809 1.00 0.00 O ATOM 0 H ASP A 65 -9.382 -6.517 14.107 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.826 -5.302 16.385 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.451 -7.924 15.986 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -8.874 -7.568 16.662 1.00 0.00 H new ATOM 988 N GLY A 66 -7.958 -4.671 15.332 1.00 0.00 N ATOM 989 CA GLY A 66 -6.704 -3.964 15.526 1.00 0.00 C ATOM 990 C GLY A 66 -5.511 -4.865 15.203 1.00 0.00 C ATOM 991 O GLY A 66 -4.494 -4.828 15.894 1.00 0.00 O ATOM 0 H GLY A 66 -8.235 -4.789 14.357 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.679 -3.079 14.890 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -6.634 -3.617 16.557 1.00 0.00 H new ATOM 995 N ASN A 67 -5.675 -5.656 14.152 1.00 0.00 N ATOM 996 CA ASN A 67 -4.623 -6.566 13.729 1.00 0.00 C ATOM 997 C ASN A 67 -3.325 -5.782 13.536 1.00 0.00 C ATOM 998 O ASN A 67 -2.243 -6.276 13.855 1.00 0.00 O ATOM 999 CB ASN A 67 -4.975 -7.233 12.398 1.00 0.00 C ATOM 1000 CG ASN A 67 -4.394 -6.449 11.221 1.00 0.00 C ATOM 1001 OD1 ASN A 67 -5.026 -5.573 10.650 1.00 0.00 O ATOM 1002 ND2 ASN A 67 -3.158 -6.809 10.889 1.00 0.00 N ATOM 0 H ASN A 67 -6.520 -5.686 13.581 1.00 0.00 H new ATOM 0 HA ASN A 67 -4.509 -7.331 14.497 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -4.590 -8.253 12.385 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -6.058 -7.300 12.296 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -2.682 -6.345 10.116 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -2.686 -7.550 11.408 1.00 0.00 H new ATOM 1009 N LEU A 68 -3.471 -4.574 13.014 1.00 0.00 N ATOM 1010 CA LEU A 68 -2.322 -3.717 12.775 1.00 0.00 C ATOM 1011 C LEU A 68 -2.807 -2.304 12.438 1.00 0.00 C ATOM 1012 O LEU A 68 -4.005 -2.032 12.467 1.00 0.00 O ATOM 1013 CB LEU A 68 -1.414 -4.326 11.705 1.00 0.00 C ATOM 1014 CG LEU A 68 -1.713 -3.922 10.260 1.00 0.00 C ATOM 1015 CD1 LEU A 68 -3.133 -3.364 10.129 1.00 0.00 C ATOM 1016 CD2 LEU A 68 -0.663 -2.942 9.735 1.00 0.00 C ATOM 0 H LEU A 68 -4.368 -4.167 12.749 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.710 -3.639 13.674 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.384 -4.051 11.932 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.478 -5.412 11.778 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.658 -4.816 9.638 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -3.320 -3.084 9.092 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.852 -4.124 10.435 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.239 -2.486 10.766 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.900 -2.672 8.706 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.660 -2.045 10.354 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.321 -3.410 9.770 1.00 0.00 H new ATOM 1028 N HIS A 69 -1.849 -1.444 12.127 1.00 0.00 N ATOM 1029 CA HIS A 69 -2.162 -0.066 11.786 1.00 0.00 C ATOM 1030 C HIS A 69 -1.156 0.448 10.753 1.00 0.00 C ATOM 1031 O HIS A 69 0.022 0.617 11.061 1.00 0.00 O ATOM 1032 CB HIS A 69 -2.220 0.804 13.043 1.00 0.00 C ATOM 1033 CG HIS A 69 -3.433 0.556 13.907 1.00 0.00 C ATOM 1034 ND1 HIS A 69 -3.423 0.734 15.280 1.00 0.00 N ATOM 1035 CD2 HIS A 69 -4.689 0.140 13.582 1.00 0.00 C ATOM 1036 CE1 HIS A 69 -4.625 0.438 15.748 1.00 0.00 C ATOM 1037 NE2 HIS A 69 -5.409 0.069 14.694 1.00 0.00 N ATOM 0 H HIS A 69 -0.856 -1.674 12.104 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.152 -0.014 11.333 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -1.322 0.628 13.636 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -2.206 1.853 12.747 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -5.039 -0.093 12.587 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -4.932 0.481 16.783 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -6.387 -0.215 14.752 1.00 0.00 H new ATOM 1046 N HIS A 70 -1.660 0.682 9.551 1.00 0.00 N ATOM 1047 CA HIS A 70 -0.821 1.174 8.471 1.00 0.00 C ATOM 1048 C HIS A 70 0.147 2.228 9.012 1.00 0.00 C ATOM 1049 O HIS A 70 -0.212 3.013 9.889 1.00 0.00 O ATOM 1050 CB HIS A 70 -1.675 1.693 7.312 1.00 0.00 C ATOM 1051 CG HIS A 70 -1.052 1.491 5.952 1.00 0.00 C ATOM 1052 ND1 HIS A 70 0.213 1.953 5.630 1.00 0.00 N ATOM 1053 CD2 HIS A 70 -1.531 0.872 4.835 1.00 0.00 C ATOM 1054 CE1 HIS A 70 0.472 1.622 4.374 1.00 0.00 C ATOM 1055 NE2 HIS A 70 -0.610 0.953 3.882 1.00 0.00 N ATOM 0 H HIS A 70 -2.639 0.540 9.301 1.00 0.00 H new ATOM 0 HA HIS A 70 -0.224 0.356 8.068 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.643 1.192 7.335 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.863 2.756 7.460 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -2.496 0.396 4.741 1.00 0.00 H new ATOM 0 HE1 HIS A 70 1.381 1.843 3.834 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -0.697 0.577 2.938 1.00 0.00 H new ATOM 1064 N GLY A 71 1.354 2.211 8.468 1.00 0.00 N ATOM 1065 CA GLY A 71 2.377 3.156 8.885 1.00 0.00 C ATOM 1066 C GLY A 71 3.049 2.699 10.181 1.00 0.00 C ATOM 1067 O GLY A 71 4.272 2.743 10.299 1.00 0.00 O ATOM 0 H GLY A 71 1.648 1.558 7.742 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.125 3.258 8.099 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.931 4.140 9.030 1.00 0.00 H new ATOM 1071 N ASN A 72 2.219 2.271 11.121 1.00 0.00 N ATOM 1072 CA ASN A 72 2.719 1.806 12.404 1.00 0.00 C ATOM 1073 C ASN A 72 2.109 0.439 12.720 1.00 0.00 C ATOM 1074 O ASN A 72 1.224 0.329 13.567 1.00 0.00 O ATOM 1075 CB ASN A 72 2.328 2.768 13.529 1.00 0.00 C ATOM 1076 CG ASN A 72 3.038 2.403 14.834 1.00 0.00 C ATOM 1077 OD1 ASN A 72 3.992 1.644 14.861 1.00 0.00 O ATOM 1078 ND2 ASN A 72 2.520 2.984 15.912 1.00 0.00 N ATOM 0 H ASN A 72 1.205 2.236 11.020 1.00 0.00 H new ATOM 0 HA ASN A 72 3.805 1.746 12.340 1.00 0.00 H new ATOM 0 HB2 ASN A 72 2.584 3.789 13.245 1.00 0.00 H new ATOM 0 HB3 ASN A 72 1.249 2.740 13.678 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.923 2.804 16.832 1.00 0.00 H new ATOM 0 HD22 ASN A 72 1.720 3.610 15.819 1.00 0.00 H new ATOM 1085 N ALA A 73 2.607 -0.571 12.021 1.00 0.00 N ATOM 1086 CA ALA A 73 2.123 -1.927 12.215 1.00 0.00 C ATOM 1087 C ALA A 73 2.468 -2.388 13.632 1.00 0.00 C ATOM 1088 O ALA A 73 3.612 -2.262 14.067 1.00 0.00 O ATOM 1089 CB ALA A 73 2.717 -2.840 11.140 1.00 0.00 C ATOM 0 H ALA A 73 3.341 -0.477 11.319 1.00 0.00 H new ATOM 0 HA ALA A 73 1.039 -1.968 12.111 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.354 -3.857 11.286 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.416 -2.485 10.154 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.804 -2.829 11.213 1.00 0.00 H new ATOM 1095 N LYS A 74 1.460 -2.916 14.311 1.00 0.00 N ATOM 1096 CA LYS A 74 1.643 -3.398 15.669 1.00 0.00 C ATOM 1097 C LYS A 74 2.666 -4.537 15.668 1.00 0.00 C ATOM 1098 O LYS A 74 3.036 -5.042 14.609 1.00 0.00 O ATOM 1099 CB LYS A 74 0.298 -3.780 16.288 1.00 0.00 C ATOM 1100 CG LYS A 74 0.103 -3.094 17.642 1.00 0.00 C ATOM 1101 CD LYS A 74 -1.143 -3.629 18.353 1.00 0.00 C ATOM 1102 CE LYS A 74 -2.146 -2.505 18.620 1.00 0.00 C ATOM 1103 NZ LYS A 74 -1.750 -1.730 19.818 1.00 0.00 N ATOM 0 H LYS A 74 0.513 -3.020 13.945 1.00 0.00 H new ATOM 0 HA LYS A 74 2.046 -2.608 16.303 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.510 -3.497 15.613 1.00 0.00 H new ATOM 0 HB3 LYS A 74 0.245 -4.861 16.413 1.00 0.00 H new ATOM 0 HG2 LYS A 74 0.981 -3.258 18.267 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.010 -2.017 17.498 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.611 -4.402 17.743 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.856 -4.097 19.295 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.200 -1.845 17.754 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -3.142 -2.925 18.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -2.441 -0.971 19.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -1.721 -2.360 20.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.809 -1.314 19.667 1.00 0.00 H new ATOM 1117 N ASP A 75 3.092 -4.906 16.865 1.00 0.00 N ATOM 1118 CA ASP A 75 4.064 -5.976 17.016 1.00 0.00 C ATOM 1119 C ASP A 75 3.397 -7.315 16.701 1.00 0.00 C ATOM 1120 O ASP A 75 4.027 -8.368 16.797 1.00 0.00 O ATOM 1121 CB ASP A 75 4.597 -6.039 18.450 1.00 0.00 C ATOM 1122 CG ASP A 75 5.927 -5.318 18.678 1.00 0.00 C ATOM 1123 OD1 ASP A 75 6.124 -4.272 18.022 1.00 0.00 O ATOM 1124 OD2 ASP A 75 6.714 -5.828 19.503 1.00 0.00 O ATOM 0 H ASP A 75 2.783 -4.484 17.740 1.00 0.00 H new ATOM 0 HA ASP A 75 4.890 -5.779 16.332 1.00 0.00 H new ATOM 0 HB2 ASP A 75 3.850 -5.611 19.118 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.715 -7.085 18.732 1.00 0.00 H new ATOM 1129 N PHE A 76 2.126 -7.234 16.331 1.00 0.00 N ATOM 1130 CA PHE A 76 1.365 -8.426 16.000 1.00 0.00 C ATOM 1131 C PHE A 76 1.265 -8.611 14.485 1.00 0.00 C ATOM 1132 O PHE A 76 1.147 -9.735 13.998 1.00 0.00 O ATOM 1133 CB PHE A 76 -0.040 -8.232 16.573 1.00 0.00 C ATOM 1134 CG PHE A 76 -0.754 -9.539 16.927 1.00 0.00 C ATOM 1135 CD1 PHE A 76 -0.214 -10.381 17.850 1.00 0.00 C ATOM 1136 CD2 PHE A 76 -1.928 -9.859 16.320 1.00 0.00 C ATOM 1137 CE1 PHE A 76 -0.876 -11.592 18.179 1.00 0.00 C ATOM 1138 CE2 PHE A 76 -2.590 -11.071 16.648 1.00 0.00 C ATOM 1139 CZ PHE A 76 -2.051 -11.913 17.572 1.00 0.00 C ATOM 0 H PHE A 76 1.605 -6.361 16.253 1.00 0.00 H new ATOM 0 HA PHE A 76 1.855 -9.307 16.414 1.00 0.00 H new ATOM 0 HB2 PHE A 76 0.026 -7.612 17.467 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.644 -7.684 15.849 1.00 0.00 H new ATOM 0 HD1 PHE A 76 0.719 -10.127 18.332 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -2.357 -9.191 15.588 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.447 -12.260 18.912 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -3.522 -11.325 16.164 1.00 0.00 H new ATOM 0 HZ PHE A 76 -2.555 -12.835 17.823 1.00 0.00 H new ATOM 1149 N ALA A 77 1.313 -7.490 13.780 1.00 0.00 N ATOM 1150 CA ALA A 77 1.228 -7.513 12.329 1.00 0.00 C ATOM 1151 C ALA A 77 2.304 -8.450 11.775 1.00 0.00 C ATOM 1152 O ALA A 77 2.007 -9.575 11.377 1.00 0.00 O ATOM 1153 CB ALA A 77 1.359 -6.089 11.787 1.00 0.00 C ATOM 0 H ALA A 77 1.410 -6.560 14.187 1.00 0.00 H new ATOM 0 HA ALA A 77 0.260 -7.896 12.007 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.295 -6.107 10.699 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.555 -5.472 12.188 1.00 0.00 H new ATOM 0 HB3 ALA A 77 2.320 -5.672 12.087 1.00 0.00 H new ATOM 1159 N MET A 78 3.531 -7.951 11.769 1.00 0.00 N ATOM 1160 CA MET A 78 4.653 -8.728 11.271 1.00 0.00 C ATOM 1161 C MET A 78 5.085 -9.783 12.291 1.00 0.00 C ATOM 1162 O MET A 78 6.278 -10.021 12.477 1.00 0.00 O ATOM 1163 CB MET A 78 5.829 -7.796 10.972 1.00 0.00 C ATOM 1164 CG MET A 78 6.605 -7.465 12.249 1.00 0.00 C ATOM 1165 SD MET A 78 5.518 -6.697 13.440 1.00 0.00 S ATOM 1166 CE MET A 78 5.542 -7.937 14.724 1.00 0.00 C ATOM 0 H MET A 78 3.773 -7.018 12.101 1.00 0.00 H new ATOM 0 HA MET A 78 4.341 -9.237 10.359 1.00 0.00 H new ATOM 0 HB2 MET A 78 6.495 -8.266 10.249 1.00 0.00 H new ATOM 0 HB3 MET A 78 5.462 -6.876 10.516 1.00 0.00 H new ATOM 0 HG2 MET A 78 7.035 -8.374 12.669 1.00 0.00 H new ATOM 0 HG3 MET A 78 7.435 -6.797 12.018 1.00 0.00 H new ATOM 0 HE1 MET A 78 4.561 -8.407 14.794 1.00 0.00 H new ATOM 0 HE2 MET A 78 6.290 -8.693 14.486 1.00 0.00 H new ATOM 0 HE3 MET A 78 5.789 -7.469 15.677 1.00 0.00 H new ATOM 1176 N LYS A 79 4.092 -10.389 12.925 1.00 0.00 N ATOM 1177 CA LYS A 79 4.353 -11.413 13.921 1.00 0.00 C ATOM 1178 C LYS A 79 3.261 -12.482 13.847 1.00 0.00 C ATOM 1179 O LYS A 79 3.556 -13.665 13.686 1.00 0.00 O ATOM 1180 CB LYS A 79 4.505 -10.785 15.309 1.00 0.00 C ATOM 1181 CG LYS A 79 4.504 -11.858 16.399 1.00 0.00 C ATOM 1182 CD LYS A 79 3.110 -12.018 17.008 1.00 0.00 C ATOM 1183 CE LYS A 79 2.803 -13.490 17.295 1.00 0.00 C ATOM 1184 NZ LYS A 79 3.524 -13.944 18.505 1.00 0.00 N ATOM 0 H LYS A 79 3.104 -10.190 12.768 1.00 0.00 H new ATOM 0 HA LYS A 79 5.301 -11.910 13.715 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.433 -10.216 15.355 1.00 0.00 H new ATOM 0 HB3 LYS A 79 3.691 -10.082 15.485 1.00 0.00 H new ATOM 0 HG2 LYS A 79 4.833 -12.809 15.979 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.217 -11.590 17.179 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.044 -11.442 17.931 1.00 0.00 H new ATOM 0 HD3 LYS A 79 2.362 -11.613 16.326 1.00 0.00 H new ATOM 0 HE2 LYS A 79 1.730 -13.624 17.432 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.094 -14.101 16.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 3.304 -14.944 18.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.548 -13.835 18.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.227 -13.372 19.321 1.00 0.00 H new ATOM 1198 N HIS A 80 2.023 -12.028 13.967 1.00 0.00 N ATOM 1199 CA HIS A 80 0.886 -12.931 13.915 1.00 0.00 C ATOM 1200 C HIS A 80 0.714 -13.457 12.490 1.00 0.00 C ATOM 1201 O HIS A 80 -0.127 -14.319 12.241 1.00 0.00 O ATOM 1202 CB HIS A 80 -0.375 -12.248 14.451 1.00 0.00 C ATOM 1203 CG HIS A 80 -1.097 -11.402 13.430 1.00 0.00 C ATOM 1204 ND1 HIS A 80 -0.446 -10.770 12.384 1.00 0.00 N ATOM 1205 CD2 HIS A 80 -2.420 -11.092 13.304 1.00 0.00 C ATOM 1206 CE1 HIS A 80 -1.347 -10.112 11.668 1.00 0.00 C ATOM 1207 NE2 HIS A 80 -2.568 -10.312 12.240 1.00 0.00 N ATOM 0 H HIS A 80 1.782 -11.046 14.100 1.00 0.00 H new ATOM 0 HA HIS A 80 1.068 -13.789 14.563 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.058 -13.011 14.824 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.103 -11.621 15.300 1.00 0.00 H new ATOM 0 HD1 HIS A 80 0.556 -10.805 12.196 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.212 -11.425 13.959 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -1.148 -9.521 10.786 1.00 0.00 H new ATOM 1216 N GLY A 81 1.523 -12.917 11.591 1.00 0.00 N ATOM 1217 CA GLY A 81 1.471 -13.323 10.196 1.00 0.00 C ATOM 1218 C GLY A 81 2.855 -13.240 9.549 1.00 0.00 C ATOM 1219 O GLY A 81 2.968 -13.107 8.332 1.00 0.00 O ATOM 0 H GLY A 81 2.219 -12.201 11.801 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.093 -14.343 10.124 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.773 -12.685 9.654 1.00 0.00 H new ATOM 1223 N ALA A 82 3.872 -13.324 10.393 1.00 0.00 N ATOM 1224 CA ALA A 82 5.245 -13.261 9.919 1.00 0.00 C ATOM 1225 C ALA A 82 6.049 -14.403 10.545 1.00 0.00 C ATOM 1226 O ALA A 82 5.761 -14.831 11.661 1.00 0.00 O ATOM 1227 CB ALA A 82 5.836 -11.887 10.244 1.00 0.00 C ATOM 0 H ALA A 82 3.774 -13.435 11.402 1.00 0.00 H new ATOM 0 HA ALA A 82 5.283 -13.385 8.837 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.865 -11.840 9.888 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.247 -11.112 9.753 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.817 -11.729 11.322 1.00 0.00 H new ATOM 1233 N ASP A 83 7.041 -14.865 9.796 1.00 0.00 N ATOM 1234 CA ASP A 83 7.888 -15.948 10.263 1.00 0.00 C ATOM 1235 C ASP A 83 8.760 -15.449 11.417 1.00 0.00 C ATOM 1236 O ASP A 83 9.227 -14.311 11.397 1.00 0.00 O ATOM 1237 CB ASP A 83 8.814 -16.443 9.149 1.00 0.00 C ATOM 1238 CG ASP A 83 8.301 -17.658 8.374 1.00 0.00 C ATOM 1239 OD1 ASP A 83 7.205 -18.140 8.733 1.00 0.00 O ATOM 1240 OD2 ASP A 83 9.018 -18.079 7.439 1.00 0.00 O ATOM 0 H ASP A 83 7.276 -14.508 8.870 1.00 0.00 H new ATOM 0 HA ASP A 83 7.242 -16.765 10.585 1.00 0.00 H new ATOM 0 HB2 ASP A 83 8.981 -15.627 8.446 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.782 -16.691 9.585 1.00 0.00 H new ATOM 1245 N GLU A 84 8.955 -16.324 12.392 1.00 0.00 N ATOM 1246 CA GLU A 84 9.763 -15.985 13.551 1.00 0.00 C ATOM 1247 C GLU A 84 11.033 -15.251 13.116 1.00 0.00 C ATOM 1248 O GLU A 84 11.502 -14.351 13.810 1.00 0.00 O ATOM 1249 CB GLU A 84 10.103 -17.235 14.365 1.00 0.00 C ATOM 1250 CG GLU A 84 9.379 -17.224 15.713 1.00 0.00 C ATOM 1251 CD GLU A 84 9.551 -18.561 16.438 1.00 0.00 C ATOM 1252 OE1 GLU A 84 9.406 -19.598 15.757 1.00 0.00 O ATOM 1253 OE2 GLU A 84 9.822 -18.514 17.658 1.00 0.00 O ATOM 0 H GLU A 84 8.567 -17.267 12.403 1.00 0.00 H new ATOM 0 HA GLU A 84 9.185 -15.320 14.192 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.822 -18.126 13.804 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.180 -17.287 14.527 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.769 -16.417 16.333 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.319 -17.023 15.559 1.00 0.00 H new ATOM 1260 N THR A 85 11.554 -15.664 11.970 1.00 0.00 N ATOM 1261 CA THR A 85 12.761 -15.058 11.434 1.00 0.00 C ATOM 1262 C THR A 85 12.425 -13.754 10.706 1.00 0.00 C ATOM 1263 O THR A 85 13.110 -12.749 10.878 1.00 0.00 O ATOM 1264 CB THR A 85 13.454 -16.090 10.543 1.00 0.00 C ATOM 1265 OG1 THR A 85 14.757 -15.552 10.336 1.00 0.00 O ATOM 1266 CG2 THR A 85 12.849 -16.152 9.139 1.00 0.00 C ATOM 0 H THR A 85 11.162 -16.412 11.397 1.00 0.00 H new ATOM 0 HA THR A 85 13.451 -14.781 12.231 1.00 0.00 H new ATOM 0 HB THR A 85 13.390 -17.073 11.010 1.00 0.00 H new ATOM 0 HG1 THR A 85 15.276 -16.160 9.769 1.00 0.00 H new ATOM 0 HG21 THR A 85 13.377 -16.900 8.548 1.00 0.00 H new ATOM 0 HG22 THR A 85 11.795 -16.422 9.208 1.00 0.00 H new ATOM 0 HG23 THR A 85 12.943 -15.178 8.659 1.00 0.00 H new ATOM 1274 N MET A 86 11.369 -13.815 9.908 1.00 0.00 N ATOM 1275 CA MET A 86 10.933 -12.653 9.152 1.00 0.00 C ATOM 1276 C MET A 86 10.728 -11.448 10.071 1.00 0.00 C ATOM 1277 O MET A 86 11.118 -10.330 9.734 1.00 0.00 O ATOM 1278 CB MET A 86 9.622 -12.975 8.431 1.00 0.00 C ATOM 1279 CG MET A 86 8.796 -11.708 8.208 1.00 0.00 C ATOM 1280 SD MET A 86 7.446 -12.048 7.090 1.00 0.00 S ATOM 1281 CE MET A 86 8.337 -12.131 5.545 1.00 0.00 C ATOM 0 H MET A 86 10.802 -14.651 9.768 1.00 0.00 H new ATOM 0 HA MET A 86 11.706 -12.405 8.425 1.00 0.00 H new ATOM 0 HB2 MET A 86 9.836 -13.448 7.472 1.00 0.00 H new ATOM 0 HB3 MET A 86 9.046 -13.691 9.018 1.00 0.00 H new ATOM 0 HG2 MET A 86 8.408 -11.345 9.160 1.00 0.00 H new ATOM 0 HG3 MET A 86 9.428 -10.919 7.799 1.00 0.00 H new ATOM 0 HE1 MET A 86 7.816 -11.540 4.792 1.00 0.00 H new ATOM 0 HE2 MET A 86 9.343 -11.736 5.684 1.00 0.00 H new ATOM 0 HE3 MET A 86 8.397 -13.168 5.215 1.00 0.00 H new ATOM 1291 N ALA A 87 10.115 -11.714 11.216 1.00 0.00 N ATOM 1292 CA ALA A 87 9.854 -10.665 12.187 1.00 0.00 C ATOM 1293 C ALA A 87 11.162 -9.945 12.519 1.00 0.00 C ATOM 1294 O ALA A 87 11.211 -8.716 12.541 1.00 0.00 O ATOM 1295 CB ALA A 87 9.189 -11.269 13.426 1.00 0.00 C ATOM 0 H ALA A 87 9.792 -12.641 11.493 1.00 0.00 H new ATOM 0 HA ALA A 87 9.167 -9.925 11.777 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.993 -10.482 14.154 1.00 0.00 H new ATOM 0 HB2 ALA A 87 8.249 -11.741 13.141 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.850 -12.015 13.867 1.00 0.00 H new ATOM 1301 N GLN A 88 12.190 -10.741 12.771 1.00 0.00 N ATOM 1302 CA GLN A 88 13.496 -10.197 13.102 1.00 0.00 C ATOM 1303 C GLN A 88 14.165 -9.626 11.849 1.00 0.00 C ATOM 1304 O GLN A 88 14.772 -8.557 11.898 1.00 0.00 O ATOM 1305 CB GLN A 88 14.381 -11.254 13.763 1.00 0.00 C ATOM 1306 CG GLN A 88 15.834 -10.783 13.843 1.00 0.00 C ATOM 1307 CD GLN A 88 16.712 -11.533 12.839 1.00 0.00 C ATOM 1308 OE1 GLN A 88 17.209 -12.616 13.099 1.00 0.00 O ATOM 1309 NE2 GLN A 88 16.872 -10.900 11.681 1.00 0.00 N ATOM 0 H GLN A 88 12.145 -11.760 12.753 1.00 0.00 H new ATOM 0 HA GLN A 88 13.359 -9.388 13.819 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.009 -11.469 14.765 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.327 -12.184 13.197 1.00 0.00 H new ATOM 0 HG2 GLN A 88 15.884 -9.712 13.646 1.00 0.00 H new ATOM 0 HG3 GLN A 88 16.215 -10.939 14.852 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.427 -9.995 11.529 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.439 -11.320 10.945 1.00 0.00 H new ATOM 1318 N GLN A 89 14.033 -10.364 10.758 1.00 0.00 N ATOM 1319 CA GLN A 89 14.617 -9.946 9.495 1.00 0.00 C ATOM 1320 C GLN A 89 14.267 -8.485 9.207 1.00 0.00 C ATOM 1321 O GLN A 89 15.152 -7.664 8.975 1.00 0.00 O ATOM 1322 CB GLN A 89 14.161 -10.854 8.351 1.00 0.00 C ATOM 1323 CG GLN A 89 14.867 -12.212 8.416 1.00 0.00 C ATOM 1324 CD GLN A 89 16.385 -12.038 8.489 1.00 0.00 C ATOM 1325 OE1 GLN A 89 17.002 -12.167 9.534 1.00 0.00 O ATOM 1326 NE2 GLN A 89 16.952 -11.737 7.324 1.00 0.00 N ATOM 0 H GLN A 89 13.529 -11.250 10.722 1.00 0.00 H new ATOM 0 HA GLN A 89 15.701 -10.032 9.573 1.00 0.00 H new ATOM 0 HB2 GLN A 89 13.082 -10.998 8.404 1.00 0.00 H new ATOM 0 HB3 GLN A 89 14.372 -10.375 7.395 1.00 0.00 H new ATOM 0 HG2 GLN A 89 14.519 -12.766 9.288 1.00 0.00 H new ATOM 0 HG3 GLN A 89 14.607 -12.803 7.538 1.00 0.00 H new ATOM 0 HE21 GLN A 89 16.378 -11.644 6.486 1.00 0.00 H new ATOM 0 HE22 GLN A 89 17.961 -11.600 7.268 1.00 0.00 H new ATOM 1335 N LEU A 90 12.972 -8.204 9.231 1.00 0.00 N ATOM 1336 CA LEU A 90 12.493 -6.856 8.974 1.00 0.00 C ATOM 1337 C LEU A 90 13.324 -5.862 9.786 1.00 0.00 C ATOM 1338 O LEU A 90 13.749 -4.832 9.265 1.00 0.00 O ATOM 1339 CB LEU A 90 10.989 -6.762 9.241 1.00 0.00 C ATOM 1340 CG LEU A 90 10.077 -7.054 8.047 1.00 0.00 C ATOM 1341 CD1 LEU A 90 10.471 -8.365 7.363 1.00 0.00 C ATOM 1342 CD2 LEU A 90 8.605 -7.045 8.465 1.00 0.00 C ATOM 0 H LEU A 90 12.240 -8.887 9.425 1.00 0.00 H new ATOM 0 HA LEU A 90 12.624 -6.599 7.923 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.738 -7.456 10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.767 -5.759 9.606 1.00 0.00 H new ATOM 0 HG LEU A 90 10.208 -6.257 7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 90 9.807 -8.548 6.518 1.00 0.00 H new ATOM 0 HD12 LEU A 90 11.499 -8.296 7.008 1.00 0.00 H new ATOM 0 HD13 LEU A 90 10.388 -9.186 8.075 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.979 -7.255 7.598 1.00 0.00 H new ATOM 0 HD22 LEU A 90 8.438 -7.807 9.226 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.348 -6.066 8.869 1.00 0.00 H new ATOM 1354 N VAL A 91 13.531 -6.204 11.049 1.00 0.00 N ATOM 1355 CA VAL A 91 14.305 -5.354 11.939 1.00 0.00 C ATOM 1356 C VAL A 91 15.651 -5.034 11.287 1.00 0.00 C ATOM 1357 O VAL A 91 16.332 -4.092 11.692 1.00 0.00 O ATOM 1358 CB VAL A 91 14.447 -6.023 13.308 1.00 0.00 C ATOM 1359 CG1 VAL A 91 14.974 -5.032 14.348 1.00 0.00 C ATOM 1360 CG2 VAL A 91 13.121 -6.637 13.759 1.00 0.00 C ATOM 0 H VAL A 91 13.176 -7.059 11.478 1.00 0.00 H new ATOM 0 HA VAL A 91 13.792 -4.407 12.107 1.00 0.00 H new ATOM 0 HB VAL A 91 15.174 -6.830 13.214 1.00 0.00 H new ATOM 0 HG11 VAL A 91 15.066 -5.531 15.312 1.00 0.00 H new ATOM 0 HG12 VAL A 91 15.951 -4.662 14.036 1.00 0.00 H new ATOM 0 HG13 VAL A 91 14.281 -4.195 14.437 1.00 0.00 H new ATOM 0 HG21 VAL A 91 13.250 -7.106 14.735 1.00 0.00 H new ATOM 0 HG22 VAL A 91 12.364 -5.856 13.829 1.00 0.00 H new ATOM 0 HG23 VAL A 91 12.803 -7.387 13.035 1.00 0.00 H new ATOM 1370 N ASP A 92 15.995 -5.833 10.289 1.00 0.00 N ATOM 1371 CA ASP A 92 17.248 -5.646 9.577 1.00 0.00 C ATOM 1372 C ASP A 92 17.115 -4.458 8.622 1.00 0.00 C ATOM 1373 O ASP A 92 17.738 -3.418 8.830 1.00 0.00 O ATOM 1374 CB ASP A 92 17.600 -6.882 8.747 1.00 0.00 C ATOM 1375 CG ASP A 92 19.034 -6.917 8.215 1.00 0.00 C ATOM 1376 OD1 ASP A 92 19.820 -6.043 8.642 1.00 0.00 O ATOM 1377 OD2 ASP A 92 19.313 -7.816 7.392 1.00 0.00 O ATOM 0 H ASP A 92 15.428 -6.612 9.956 1.00 0.00 H new ATOM 0 HA ASP A 92 18.031 -5.472 10.314 1.00 0.00 H new ATOM 0 HB2 ASP A 92 17.433 -7.770 9.357 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.914 -6.941 7.902 1.00 0.00 H new ATOM 1382 N ILE A 93 16.299 -4.652 7.597 1.00 0.00 N ATOM 1383 CA ILE A 93 16.075 -3.608 6.610 1.00 0.00 C ATOM 1384 C ILE A 93 15.335 -2.441 7.267 1.00 0.00 C ATOM 1385 O ILE A 93 15.716 -1.285 7.094 1.00 0.00 O ATOM 1386 CB ILE A 93 15.362 -4.177 5.382 1.00 0.00 C ATOM 1387 CG1 ILE A 93 13.847 -3.988 5.492 1.00 0.00 C ATOM 1388 CG2 ILE A 93 15.741 -5.642 5.157 1.00 0.00 C ATOM 1389 CD1 ILE A 93 13.225 -5.059 6.389 1.00 0.00 C ATOM 0 H ILE A 93 15.784 -5.516 7.428 1.00 0.00 H new ATOM 0 HA ILE A 93 17.025 -3.217 6.245 1.00 0.00 H new ATOM 0 HB ILE A 93 15.694 -3.620 4.506 1.00 0.00 H new ATOM 0 HG12 ILE A 93 13.629 -2.999 5.895 1.00 0.00 H new ATOM 0 HG13 ILE A 93 13.398 -4.034 4.500 1.00 0.00 H new ATOM 0 HG21 ILE A 93 15.220 -6.022 4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 93 16.817 -5.720 5.003 1.00 0.00 H new ATOM 0 HG23 ILE A 93 15.456 -6.230 6.030 1.00 0.00 H new ATOM 0 HD11 ILE A 93 12.148 -4.902 6.450 1.00 0.00 H new ATOM 0 HD12 ILE A 93 13.424 -6.045 5.970 1.00 0.00 H new ATOM 0 HD13 ILE A 93 13.658 -4.994 7.387 1.00 0.00 H new ATOM 1401 N ILE A 94 14.291 -2.785 8.006 1.00 0.00 N ATOM 1402 CA ILE A 94 13.493 -1.781 8.688 1.00 0.00 C ATOM 1403 C ILE A 94 14.416 -0.876 9.509 1.00 0.00 C ATOM 1404 O ILE A 94 14.071 0.270 9.797 1.00 0.00 O ATOM 1405 CB ILE A 94 12.388 -2.443 9.514 1.00 0.00 C ATOM 1406 CG1 ILE A 94 11.467 -3.280 8.624 1.00 0.00 C ATOM 1407 CG2 ILE A 94 11.614 -1.404 10.327 1.00 0.00 C ATOM 1408 CD1 ILE A 94 10.003 -3.108 9.037 1.00 0.00 C ATOM 0 H ILE A 94 13.979 -3.746 8.147 1.00 0.00 H new ATOM 0 HA ILE A 94 12.981 -1.146 7.965 1.00 0.00 H new ATOM 0 HB ILE A 94 12.854 -3.125 10.226 1.00 0.00 H new ATOM 0 HG12 ILE A 94 11.592 -2.983 7.583 1.00 0.00 H new ATOM 0 HG13 ILE A 94 11.747 -4.331 8.691 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.835 -1.901 10.905 1.00 0.00 H new ATOM 0 HG22 ILE A 94 12.296 -0.890 11.004 1.00 0.00 H new ATOM 0 HG23 ILE A 94 11.159 -0.679 9.652 1.00 0.00 H new ATOM 0 HD11 ILE A 94 9.369 -3.713 8.389 1.00 0.00 H new ATOM 0 HD12 ILE A 94 9.877 -3.429 10.071 1.00 0.00 H new ATOM 0 HD13 ILE A 94 9.720 -2.059 8.945 1.00 0.00 H new ATOM 1420 N HIS A 95 15.568 -1.424 9.862 1.00 0.00 N ATOM 1421 CA HIS A 95 16.541 -0.682 10.645 1.00 0.00 C ATOM 1422 C HIS A 95 17.268 0.320 9.743 1.00 0.00 C ATOM 1423 O HIS A 95 17.680 1.386 10.199 1.00 0.00 O ATOM 1424 CB HIS A 95 17.499 -1.632 11.365 1.00 0.00 C ATOM 1425 CG HIS A 95 17.141 -1.888 12.810 1.00 0.00 C ATOM 1426 ND1 HIS A 95 18.079 -1.889 13.827 1.00 0.00 N ATOM 1427 CD2 HIS A 95 15.936 -2.148 13.396 1.00 0.00 C ATOM 1428 CE1 HIS A 95 17.456 -2.142 14.970 1.00 0.00 C ATOM 1429 NE2 HIS A 95 16.129 -2.303 14.699 1.00 0.00 N ATOM 0 H HIS A 95 15.850 -2.374 9.620 1.00 0.00 H new ATOM 0 HA HIS A 95 16.030 -0.116 11.424 1.00 0.00 H new ATOM 0 HB2 HIS A 95 17.520 -2.583 10.833 1.00 0.00 H new ATOM 0 HB3 HIS A 95 18.507 -1.219 11.319 1.00 0.00 H new ATOM 0 HD2 HIS A 95 14.987 -2.216 12.885 1.00 0.00 H new ATOM 0 HE1 HIS A 95 17.918 -2.209 15.944 1.00 0.00 H new ATOM 0 HE2 HIS A 95 15.404 -2.509 15.386 1.00 0.00 H new ATOM 1438 N GLY A 96 17.399 -0.058 8.480 1.00 0.00 N ATOM 1439 CA GLY A 96 18.068 0.794 7.510 1.00 0.00 C ATOM 1440 C GLY A 96 17.074 1.742 6.836 1.00 0.00 C ATOM 1441 O GLY A 96 17.457 2.804 6.349 1.00 0.00 O ATOM 0 H GLY A 96 17.054 -0.942 8.106 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.849 1.372 8.005 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.557 0.178 6.756 1.00 0.00 H new ATOM 1445 N CYS A 97 15.817 1.320 6.828 1.00 0.00 N ATOM 1446 CA CYS A 97 14.766 2.118 6.221 1.00 0.00 C ATOM 1447 C CYS A 97 14.222 3.082 7.278 1.00 0.00 C ATOM 1448 O CYS A 97 14.341 4.298 7.135 1.00 0.00 O ATOM 1449 CB CYS A 97 13.661 1.241 5.627 1.00 0.00 C ATOM 1450 SG CYS A 97 13.661 1.139 3.800 1.00 0.00 S ATOM 0 H CYS A 97 15.504 0.437 7.232 1.00 0.00 H new ATOM 0 HA CYS A 97 15.176 2.688 5.387 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.758 0.234 6.033 1.00 0.00 H new ATOM 0 HB3 CYS A 97 12.695 1.626 5.955 1.00 0.00 H new ATOM 1455 N GLU A 98 13.636 2.503 8.315 1.00 0.00 N ATOM 1456 CA GLU A 98 13.073 3.296 9.396 1.00 0.00 C ATOM 1457 C GLU A 98 14.055 4.392 9.814 1.00 0.00 C ATOM 1458 O GLU A 98 13.641 5.485 10.199 1.00 0.00 O ATOM 1459 CB GLU A 98 12.700 2.411 10.587 1.00 0.00 C ATOM 1460 CG GLU A 98 11.677 3.107 11.488 1.00 0.00 C ATOM 1461 CD GLU A 98 11.560 2.395 12.836 1.00 0.00 C ATOM 1462 OE1 GLU A 98 12.506 2.538 13.639 1.00 0.00 O ATOM 1463 OE2 GLU A 98 10.525 1.723 13.036 1.00 0.00 O ATOM 0 H GLU A 98 13.538 1.494 8.430 1.00 0.00 H new ATOM 0 HA GLU A 98 12.159 3.770 9.037 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.291 1.466 10.229 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.595 2.173 11.162 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.972 4.145 11.645 1.00 0.00 H new ATOM 0 HG3 GLU A 98 10.705 3.123 10.996 1.00 0.00 H new ATOM 1470 N LYS A 99 15.335 4.064 9.727 1.00 0.00 N ATOM 1471 CA LYS A 99 16.377 5.008 10.091 1.00 0.00 C ATOM 1472 C LYS A 99 16.485 6.084 9.009 1.00 0.00 C ATOM 1473 O LYS A 99 16.828 7.229 9.300 1.00 0.00 O ATOM 1474 CB LYS A 99 17.692 4.275 10.364 1.00 0.00 C ATOM 1475 CG LYS A 99 18.360 3.842 9.058 1.00 0.00 C ATOM 1476 CD LYS A 99 19.856 3.596 9.262 1.00 0.00 C ATOM 1477 CE LYS A 99 20.616 3.713 7.940 1.00 0.00 C ATOM 1478 NZ LYS A 99 22.076 3.720 8.180 1.00 0.00 N ATOM 0 H LYS A 99 15.675 3.156 9.409 1.00 0.00 H new ATOM 0 HA LYS A 99 16.123 5.516 11.021 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.365 4.925 10.923 1.00 0.00 H new ATOM 0 HB3 LYS A 99 17.503 3.401 10.987 1.00 0.00 H new ATOM 0 HG2 LYS A 99 17.886 2.933 8.687 1.00 0.00 H new ATOM 0 HG3 LYS A 99 18.214 4.611 8.299 1.00 0.00 H new ATOM 0 HD2 LYS A 99 20.252 4.316 9.978 1.00 0.00 H new ATOM 0 HD3 LYS A 99 20.010 2.605 9.688 1.00 0.00 H new ATOM 0 HE2 LYS A 99 20.353 2.880 7.288 1.00 0.00 H new ATOM 0 HE3 LYS A 99 20.322 4.627 7.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 22.577 3.800 7.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 22.325 4.529 8.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 22.354 2.836 8.652 1.00 0.00 H new ATOM 1492 N SER A 100 16.189 5.678 7.784 1.00 0.00 N ATOM 1493 CA SER A 100 16.248 6.594 6.658 1.00 0.00 C ATOM 1494 C SER A 100 14.863 7.187 6.390 1.00 0.00 C ATOM 1495 O SER A 100 14.718 8.083 5.561 1.00 0.00 O ATOM 1496 CB SER A 100 16.776 5.891 5.405 1.00 0.00 C ATOM 1497 OG SER A 100 17.939 6.530 4.885 1.00 0.00 O ATOM 0 H SER A 100 15.908 4.727 7.546 1.00 0.00 H new ATOM 0 HA SER A 100 16.938 7.400 6.909 1.00 0.00 H new ATOM 0 HB2 SER A 100 17.008 4.853 5.642 1.00 0.00 H new ATOM 0 HB3 SER A 100 15.998 5.877 4.642 1.00 0.00 H new ATOM 0 HG SER A 100 18.338 5.967 4.189 1.00 0.00 H new ATOM 1503 N ALA A 101 13.881 6.661 7.108 1.00 0.00 N ATOM 1504 CA ALA A 101 12.513 7.127 6.959 1.00 0.00 C ATOM 1505 C ALA A 101 12.052 7.770 8.269 1.00 0.00 C ATOM 1506 O ALA A 101 11.400 7.123 9.086 1.00 0.00 O ATOM 1507 CB ALA A 101 11.620 5.959 6.537 1.00 0.00 C ATOM 0 H ALA A 101 14.006 5.917 7.794 1.00 0.00 H new ATOM 0 HA ALA A 101 12.448 7.886 6.179 1.00 0.00 H new ATOM 0 HB1 ALA A 101 10.593 6.308 6.425 1.00 0.00 H new ATOM 0 HB2 ALA A 101 11.972 5.556 5.587 1.00 0.00 H new ATOM 0 HB3 ALA A 101 11.657 5.179 7.298 1.00 0.00 H new ATOM 1513 N PRO A 102 12.419 9.070 8.432 1.00 0.00 N ATOM 1514 CA PRO A 102 12.050 9.807 9.627 1.00 0.00 C ATOM 1515 C PRO A 102 10.569 10.193 9.600 1.00 0.00 C ATOM 1516 O PRO A 102 9.877 9.941 8.613 1.00 0.00 O ATOM 1517 CB PRO A 102 12.976 11.013 9.648 1.00 0.00 C ATOM 1518 CG PRO A 102 13.507 11.154 8.232 1.00 0.00 C ATOM 1519 CD PRO A 102 13.191 9.869 7.484 1.00 0.00 C ATOM 0 HA PRO A 102 12.165 9.216 10.536 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.441 11.911 9.956 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.790 10.868 10.358 1.00 0.00 H new ATOM 0 HG2 PRO A 102 13.046 12.008 7.735 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.582 11.334 8.244 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.620 10.069 6.577 1.00 0.00 H new ATOM 0 HD3 PRO A 102 14.102 9.353 7.180 1.00 0.00 H new ATOM 1527 N PRO A 103 10.115 10.811 10.724 1.00 0.00 N ATOM 1528 CA PRO A 103 8.729 11.232 10.837 1.00 0.00 C ATOM 1529 C PRO A 103 8.466 12.485 10.000 1.00 0.00 C ATOM 1530 O PRO A 103 7.829 13.427 10.467 1.00 0.00 O ATOM 1531 CB PRO A 103 8.507 11.455 12.324 1.00 0.00 C ATOM 1532 CG PRO A 103 9.890 11.599 12.936 1.00 0.00 C ATOM 1533 CD PRO A 103 10.906 11.124 11.910 1.00 0.00 C ATOM 0 HA PRO A 103 8.031 10.490 10.449 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.908 12.348 12.500 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.969 10.618 12.768 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.080 12.637 13.209 1.00 0.00 H new ATOM 0 HG3 PRO A 103 9.966 11.010 13.850 1.00 0.00 H new ATOM 0 HD2 PRO A 103 11.647 11.895 11.700 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.449 10.249 12.266 1.00 0.00 H new ATOM 1541 N ASN A 104 8.973 12.456 8.775 1.00 0.00 N ATOM 1542 CA ASN A 104 8.801 13.578 7.868 1.00 0.00 C ATOM 1543 C ASN A 104 7.312 13.762 7.565 1.00 0.00 C ATOM 1544 O ASN A 104 6.573 12.783 7.458 1.00 0.00 O ATOM 1545 CB ASN A 104 9.525 13.331 6.543 1.00 0.00 C ATOM 1546 CG ASN A 104 9.605 14.614 5.713 1.00 0.00 C ATOM 1547 OD1 ASN A 104 8.623 15.305 5.496 1.00 0.00 O ATOM 1548 ND2 ASN A 104 10.825 14.893 5.264 1.00 0.00 N ATOM 0 H ASN A 104 9.502 11.674 8.390 1.00 0.00 H new ATOM 0 HA ASN A 104 9.216 14.464 8.347 1.00 0.00 H new ATOM 0 HB2 ASN A 104 10.530 12.957 6.738 1.00 0.00 H new ATOM 0 HB3 ASN A 104 9.002 12.560 5.977 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.982 15.729 4.701 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.603 14.271 5.483 1.00 0.00 H new ATOM 1555 N ASP A 105 6.918 15.019 7.435 1.00 0.00 N ATOM 1556 CA ASP A 105 5.530 15.342 7.147 1.00 0.00 C ATOM 1557 C ASP A 105 5.105 14.641 5.856 1.00 0.00 C ATOM 1558 O ASP A 105 3.915 14.476 5.597 1.00 0.00 O ATOM 1559 CB ASP A 105 5.345 16.848 6.952 1.00 0.00 C ATOM 1560 CG ASP A 105 5.014 17.629 8.223 1.00 0.00 C ATOM 1561 OD1 ASP A 105 5.612 17.294 9.268 1.00 0.00 O ATOM 1562 OD2 ASP A 105 4.168 18.545 8.123 1.00 0.00 O ATOM 0 H ASP A 105 7.535 15.827 7.524 1.00 0.00 H new ATOM 0 HA ASP A 105 4.924 15.011 7.990 1.00 0.00 H new ATOM 0 HB2 ASP A 105 6.258 17.258 6.519 1.00 0.00 H new ATOM 0 HB3 ASP A 105 4.548 17.010 6.226 1.00 0.00 H new ATOM 1567 N ASP A 106 6.104 14.247 5.078 1.00 0.00 N ATOM 1568 CA ASP A 106 5.849 13.568 3.820 1.00 0.00 C ATOM 1569 C ASP A 106 5.587 12.085 4.089 1.00 0.00 C ATOM 1570 O ASP A 106 5.898 11.234 3.257 1.00 0.00 O ATOM 1571 CB ASP A 106 7.053 13.672 2.882 1.00 0.00 C ATOM 1572 CG ASP A 106 7.114 14.953 2.046 1.00 0.00 C ATOM 1573 OD1 ASP A 106 6.041 15.568 1.875 1.00 0.00 O ATOM 1574 OD2 ASP A 106 8.232 15.285 1.598 1.00 0.00 O ATOM 0 H ASP A 106 7.091 14.386 5.296 1.00 0.00 H new ATOM 0 HA ASP A 106 4.986 14.041 3.352 1.00 0.00 H new ATOM 0 HB2 ASP A 106 7.964 13.600 3.476 1.00 0.00 H new ATOM 0 HB3 ASP A 106 7.044 12.816 2.207 1.00 0.00 H new ATOM 1579 N LYS A 107 5.017 11.820 5.256 1.00 0.00 N ATOM 1580 CA LYS A 107 4.709 10.454 5.646 1.00 0.00 C ATOM 1581 C LYS A 107 4.149 9.697 4.439 1.00 0.00 C ATOM 1582 O LYS A 107 4.264 8.476 4.360 1.00 0.00 O ATOM 1583 CB LYS A 107 3.785 10.440 6.864 1.00 0.00 C ATOM 1584 CG LYS A 107 4.591 10.408 8.164 1.00 0.00 C ATOM 1585 CD LYS A 107 4.169 11.542 9.100 1.00 0.00 C ATOM 1586 CE LYS A 107 3.201 11.037 10.172 1.00 0.00 C ATOM 1587 NZ LYS A 107 3.082 12.023 11.270 1.00 0.00 N ATOM 0 H LYS A 107 4.760 12.528 5.944 1.00 0.00 H new ATOM 0 HA LYS A 107 5.615 9.933 5.957 1.00 0.00 H new ATOM 0 HB2 LYS A 107 3.146 11.323 6.850 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.129 9.571 6.817 1.00 0.00 H new ATOM 0 HG2 LYS A 107 4.447 9.449 8.661 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.654 10.494 7.939 1.00 0.00 H new ATOM 0 HD2 LYS A 107 5.050 11.973 9.575 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.696 12.337 8.524 1.00 0.00 H new ATOM 0 HE2 LYS A 107 2.221 10.857 9.730 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.552 10.084 10.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.421 11.664 11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 4.015 12.175 11.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.726 12.923 10.891 1.00 0.00 H new ATOM 1601 N CYS A 108 3.553 10.457 3.530 1.00 0.00 N ATOM 1602 CA CYS A 108 2.973 9.873 2.333 1.00 0.00 C ATOM 1603 C CYS A 108 4.093 9.198 1.538 1.00 0.00 C ATOM 1604 O CYS A 108 3.977 8.032 1.162 1.00 0.00 O ATOM 1605 CB CYS A 108 2.229 10.917 1.498 1.00 0.00 C ATOM 1606 SG CYS A 108 1.235 10.234 0.123 1.00 0.00 S ATOM 0 H CYS A 108 3.460 11.470 3.599 1.00 0.00 H new ATOM 0 HA CYS A 108 2.227 9.129 2.612 1.00 0.00 H new ATOM 0 HB2 CYS A 108 1.571 11.486 2.155 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.955 11.619 1.089 1.00 0.00 H new ATOM 1611 N MET A 109 5.152 9.961 1.303 1.00 0.00 N ATOM 1612 CA MET A 109 6.289 9.451 0.559 1.00 0.00 C ATOM 1613 C MET A 109 7.389 8.965 1.505 1.00 0.00 C ATOM 1614 O MET A 109 8.349 8.330 1.072 1.00 0.00 O ATOM 1615 CB MET A 109 6.844 10.554 -0.344 1.00 0.00 C ATOM 1616 CG MET A 109 7.850 9.986 -1.349 1.00 0.00 C ATOM 1617 SD MET A 109 9.277 11.053 -1.453 1.00 0.00 S ATOM 1618 CE MET A 109 10.504 10.004 -0.690 1.00 0.00 C ATOM 0 H MET A 109 5.245 10.928 1.615 1.00 0.00 H new ATOM 0 HA MET A 109 5.956 8.607 -0.045 1.00 0.00 H new ATOM 0 HB2 MET A 109 6.026 11.038 -0.877 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.325 11.319 0.265 1.00 0.00 H new ATOM 0 HG2 MET A 109 8.155 8.985 -1.044 1.00 0.00 H new ATOM 0 HG3 MET A 109 7.383 9.892 -2.330 1.00 0.00 H new ATOM 0 HE1 MET A 109 11.489 10.458 -0.799 1.00 0.00 H new ATOM 0 HE2 MET A 109 10.274 9.886 0.369 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.499 9.027 -1.173 1.00 0.00 H new ATOM 1628 N LYS A 110 7.212 9.282 2.780 1.00 0.00 N ATOM 1629 CA LYS A 110 8.178 8.885 3.790 1.00 0.00 C ATOM 1630 C LYS A 110 7.815 7.496 4.320 1.00 0.00 C ATOM 1631 O LYS A 110 8.524 6.526 4.062 1.00 0.00 O ATOM 1632 CB LYS A 110 8.280 9.952 4.882 1.00 0.00 C ATOM 1633 CG LYS A 110 8.974 9.398 6.128 1.00 0.00 C ATOM 1634 CD LYS A 110 7.960 9.097 7.233 1.00 0.00 C ATOM 1635 CE LYS A 110 8.413 7.908 8.084 1.00 0.00 C ATOM 1636 NZ LYS A 110 8.065 8.126 9.506 1.00 0.00 N ATOM 0 H LYS A 110 6.414 9.809 3.136 1.00 0.00 H new ATOM 0 HA LYS A 110 9.175 8.810 3.355 1.00 0.00 H new ATOM 0 HB2 LYS A 110 8.834 10.811 4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.283 10.306 5.144 1.00 0.00 H new ATOM 0 HG2 LYS A 110 9.518 8.489 5.872 1.00 0.00 H new ATOM 0 HG3 LYS A 110 9.708 10.118 6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 110 7.835 9.975 7.866 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.987 8.882 6.790 1.00 0.00 H new ATOM 0 HE2 LYS A 110 7.940 6.994 7.724 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.490 7.771 7.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.714 7.238 9.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.910 8.438 10.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.327 8.855 9.575 1.00 0.00 H new ATOM 1650 N THR A 111 6.710 7.446 5.049 1.00 0.00 N ATOM 1651 CA THR A 111 6.244 6.192 5.617 1.00 0.00 C ATOM 1652 C THR A 111 6.246 5.092 4.552 1.00 0.00 C ATOM 1653 O THR A 111 6.660 3.965 4.820 1.00 0.00 O ATOM 1654 CB THR A 111 4.866 6.437 6.235 1.00 0.00 C ATOM 1655 OG1 THR A 111 5.020 7.658 6.952 1.00 0.00 O ATOM 1656 CG2 THR A 111 4.520 5.410 7.316 1.00 0.00 C ATOM 0 H THR A 111 6.124 8.254 5.260 1.00 0.00 H new ATOM 0 HA THR A 111 6.911 5.841 6.404 1.00 0.00 H new ATOM 0 HB THR A 111 4.107 6.412 5.453 1.00 0.00 H new ATOM 0 HG1 THR A 111 4.989 7.478 7.915 1.00 0.00 H new ATOM 0 HG21 THR A 111 3.533 5.628 7.723 1.00 0.00 H new ATOM 0 HG22 THR A 111 4.521 4.410 6.882 1.00 0.00 H new ATOM 0 HG23 THR A 111 5.260 5.459 8.115 1.00 0.00 H new ATOM 1664 N ILE A 112 5.779 5.459 3.368 1.00 0.00 N ATOM 1665 CA ILE A 112 5.721 4.517 2.262 1.00 0.00 C ATOM 1666 C ILE A 112 7.061 3.787 2.149 1.00 0.00 C ATOM 1667 O ILE A 112 7.098 2.566 2.011 1.00 0.00 O ATOM 1668 CB ILE A 112 5.297 5.226 0.975 1.00 0.00 C ATOM 1669 CG1 ILE A 112 4.731 4.230 -0.039 1.00 0.00 C ATOM 1670 CG2 ILE A 112 6.450 6.045 0.394 1.00 0.00 C ATOM 1671 CD1 ILE A 112 5.775 3.175 -0.411 1.00 0.00 C ATOM 0 H ILE A 112 5.437 6.395 3.150 1.00 0.00 H new ATOM 0 HA ILE A 112 4.959 3.760 2.447 1.00 0.00 H new ATOM 0 HB ILE A 112 4.498 5.926 1.218 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.849 3.743 0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.409 4.761 -0.935 1.00 0.00 H new ATOM 0 HG21 ILE A 112 6.121 6.539 -0.521 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.764 6.796 1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 112 7.288 5.385 0.169 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.348 2.479 -1.133 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.646 3.663 -0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.076 2.630 0.484 1.00 0.00 H new ATOM 1683 N ASP A 113 8.130 4.569 2.212 1.00 0.00 N ATOM 1684 CA ASP A 113 9.469 4.012 2.118 1.00 0.00 C ATOM 1685 C ASP A 113 9.549 2.741 2.965 1.00 0.00 C ATOM 1686 O ASP A 113 9.937 1.684 2.469 1.00 0.00 O ATOM 1687 CB ASP A 113 10.512 4.999 2.644 1.00 0.00 C ATOM 1688 CG ASP A 113 11.827 5.031 1.860 1.00 0.00 C ATOM 1689 OD1 ASP A 113 12.312 3.930 1.521 1.00 0.00 O ATOM 1690 OD2 ASP A 113 12.316 6.156 1.618 1.00 0.00 O ATOM 0 H ASP A 113 8.096 5.582 2.327 1.00 0.00 H new ATOM 0 HA ASP A 113 9.673 3.797 1.069 1.00 0.00 H new ATOM 0 HB2 ASP A 113 10.079 5.999 2.638 1.00 0.00 H new ATOM 0 HB3 ASP A 113 10.732 4.753 3.683 1.00 0.00 H new ATOM 1695 N VAL A 114 9.177 2.887 4.228 1.00 0.00 N ATOM 1696 CA VAL A 114 9.203 1.762 5.149 1.00 0.00 C ATOM 1697 C VAL A 114 8.009 0.849 4.866 1.00 0.00 C ATOM 1698 O VAL A 114 8.166 -0.366 4.750 1.00 0.00 O ATOM 1699 CB VAL A 114 9.237 2.269 6.593 1.00 0.00 C ATOM 1700 CG1 VAL A 114 10.108 1.368 7.471 1.00 0.00 C ATOM 1701 CG2 VAL A 114 9.719 3.720 6.652 1.00 0.00 C ATOM 0 H VAL A 114 8.856 3.765 4.635 1.00 0.00 H new ATOM 0 HA VAL A 114 10.107 1.171 5.004 1.00 0.00 H new ATOM 0 HB VAL A 114 8.220 2.236 6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.115 1.751 8.491 1.00 0.00 H new ATOM 0 HG12 VAL A 114 9.705 0.355 7.466 1.00 0.00 H new ATOM 0 HG13 VAL A 114 11.126 1.355 7.082 1.00 0.00 H new ATOM 0 HG21 VAL A 114 9.734 4.056 7.689 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.723 3.787 6.234 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.043 4.352 6.075 1.00 0.00 H new ATOM 1711 N ALA A 115 6.842 1.468 4.762 1.00 0.00 N ATOM 1712 CA ALA A 115 5.623 0.726 4.494 1.00 0.00 C ATOM 1713 C ALA A 115 5.865 -0.245 3.336 1.00 0.00 C ATOM 1714 O ALA A 115 5.168 -1.249 3.207 1.00 0.00 O ATOM 1715 CB ALA A 115 4.483 1.704 4.206 1.00 0.00 C ATOM 0 H ALA A 115 6.715 2.475 4.859 1.00 0.00 H new ATOM 0 HA ALA A 115 5.334 0.136 5.364 1.00 0.00 H new ATOM 0 HB1 ALA A 115 3.568 1.147 4.005 1.00 0.00 H new ATOM 0 HB2 ALA A 115 4.332 2.351 5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 115 4.736 2.312 3.337 1.00 0.00 H new ATOM 1721 N MET A 116 6.857 0.090 2.524 1.00 0.00 N ATOM 1722 CA MET A 116 7.200 -0.739 1.382 1.00 0.00 C ATOM 1723 C MET A 116 8.490 -1.521 1.639 1.00 0.00 C ATOM 1724 O MET A 116 8.618 -2.670 1.216 1.00 0.00 O ATOM 1725 CB MET A 116 7.377 0.144 0.143 1.00 0.00 C ATOM 1726 CG MET A 116 6.275 -0.123 -0.883 1.00 0.00 C ATOM 1727 SD MET A 116 6.909 -1.134 -2.211 1.00 0.00 S ATOM 1728 CE MET A 116 7.149 -2.674 -1.341 1.00 0.00 C ATOM 0 H MET A 116 7.434 0.924 2.635 1.00 0.00 H new ATOM 0 HA MET A 116 6.391 -1.451 1.219 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.360 1.194 0.435 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.351 -0.046 -0.307 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.434 -0.624 -0.403 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.900 0.820 -1.280 1.00 0.00 H new ATOM 0 HE1 MET A 116 8.200 -2.958 -1.388 1.00 0.00 H new ATOM 0 HE2 MET A 116 6.852 -2.554 -0.299 1.00 0.00 H new ATOM 0 HE3 MET A 116 6.542 -3.452 -1.804 1.00 0.00 H new ATOM 1738 N CYS A 117 9.411 -0.869 2.331 1.00 0.00 N ATOM 1739 CA CYS A 117 10.685 -1.489 2.649 1.00 0.00 C ATOM 1740 C CYS A 117 10.426 -2.944 3.045 1.00 0.00 C ATOM 1741 O CYS A 117 11.053 -3.857 2.511 1.00 0.00 O ATOM 1742 CB CYS A 117 11.429 -0.723 3.747 1.00 0.00 C ATOM 1743 SG CYS A 117 13.242 -0.967 3.759 1.00 0.00 S ATOM 0 H CYS A 117 9.301 0.083 2.681 1.00 0.00 H new ATOM 0 HA CYS A 117 11.334 -1.461 1.774 1.00 0.00 H new ATOM 0 HB2 CYS A 117 11.220 0.341 3.633 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.030 -1.025 4.715 1.00 0.00 H new ATOM 1748 N PHE A 118 9.502 -3.113 3.979 1.00 0.00 N ATOM 1749 CA PHE A 118 9.152 -4.443 4.452 1.00 0.00 C ATOM 1750 C PHE A 118 8.484 -5.261 3.345 1.00 0.00 C ATOM 1751 O PHE A 118 8.817 -6.428 3.144 1.00 0.00 O ATOM 1752 CB PHE A 118 8.162 -4.261 5.604 1.00 0.00 C ATOM 1753 CG PHE A 118 7.289 -5.489 5.874 1.00 0.00 C ATOM 1754 CD1 PHE A 118 7.785 -6.737 5.655 1.00 0.00 C ATOM 1755 CD2 PHE A 118 6.019 -5.333 6.334 1.00 0.00 C ATOM 1756 CE1 PHE A 118 6.976 -7.876 5.906 1.00 0.00 C ATOM 1757 CE2 PHE A 118 5.210 -6.473 6.585 1.00 0.00 C ATOM 1758 CZ PHE A 118 5.705 -7.720 6.365 1.00 0.00 C ATOM 0 H PHE A 118 8.985 -2.353 4.421 1.00 0.00 H new ATOM 0 HA PHE A 118 10.050 -4.974 4.767 1.00 0.00 H new ATOM 0 HB2 PHE A 118 8.716 -4.015 6.510 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.517 -3.410 5.384 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.794 -6.861 5.290 1.00 0.00 H new ATOM 0 HD2 PHE A 118 5.626 -4.342 6.508 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.370 -8.867 5.733 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.201 -6.349 6.951 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.089 -8.587 6.555 1.00 0.00 H new ATOM 1768 N LYS A 119 7.555 -4.617 2.655 1.00 0.00 N ATOM 1769 CA LYS A 119 6.837 -5.269 1.573 1.00 0.00 C ATOM 1770 C LYS A 119 7.836 -5.735 0.513 1.00 0.00 C ATOM 1771 O LYS A 119 7.609 -6.739 -0.162 1.00 0.00 O ATOM 1772 CB LYS A 119 5.742 -4.352 1.025 1.00 0.00 C ATOM 1773 CG LYS A 119 4.353 -4.879 1.389 1.00 0.00 C ATOM 1774 CD LYS A 119 3.276 -4.232 0.515 1.00 0.00 C ATOM 1775 CE LYS A 119 2.024 -3.914 1.334 1.00 0.00 C ATOM 1776 NZ LYS A 119 0.908 -3.520 0.445 1.00 0.00 N ATOM 0 H LYS A 119 7.282 -3.649 2.824 1.00 0.00 H new ATOM 0 HA LYS A 119 6.322 -6.157 1.939 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.870 -3.347 1.426 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.834 -4.277 -0.059 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.326 -5.961 1.264 1.00 0.00 H new ATOM 0 HG3 LYS A 119 4.146 -4.674 2.439 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.666 -3.317 0.069 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.018 -4.901 -0.306 1.00 0.00 H new ATOM 0 HE2 LYS A 119 1.737 -4.785 1.923 1.00 0.00 H new ATOM 0 HE3 LYS A 119 2.237 -3.109 2.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.066 -3.308 1.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 1.179 -2.676 -0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 0.694 -4.299 -0.210 1.00 0.00 H new ATOM 1790 N LYS A 120 8.923 -4.984 0.398 1.00 0.00 N ATOM 1791 CA LYS A 120 9.957 -5.308 -0.570 1.00 0.00 C ATOM 1792 C LYS A 120 10.534 -6.689 -0.250 1.00 0.00 C ATOM 1793 O LYS A 120 11.002 -7.392 -1.143 1.00 0.00 O ATOM 1794 CB LYS A 120 11.009 -4.199 -0.620 1.00 0.00 C ATOM 1795 CG LYS A 120 10.697 -3.197 -1.733 1.00 0.00 C ATOM 1796 CD LYS A 120 11.980 -2.719 -2.416 1.00 0.00 C ATOM 1797 CE LYS A 120 12.303 -3.580 -3.639 1.00 0.00 C ATOM 1798 NZ LYS A 120 13.679 -4.118 -3.545 1.00 0.00 N ATOM 0 H LYS A 120 9.109 -4.153 0.959 1.00 0.00 H new ATOM 0 HA LYS A 120 9.536 -5.363 -1.574 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.044 -3.683 0.339 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.995 -4.635 -0.784 1.00 0.00 H new ATOM 0 HG2 LYS A 120 10.039 -3.659 -2.469 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.161 -2.343 -1.319 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.869 -1.678 -2.719 1.00 0.00 H new ATOM 0 HD3 LYS A 120 12.809 -2.759 -1.709 1.00 0.00 H new ATOM 0 HE2 LYS A 120 11.589 -4.401 -3.712 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.200 -2.986 -4.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 13.882 -4.700 -4.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.357 -3.331 -3.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 13.766 -4.702 -2.689 1.00 0.00 H new ATOM 1812 N GLU A 121 10.480 -7.036 1.028 1.00 0.00 N ATOM 1813 CA GLU A 121 10.992 -8.320 1.477 1.00 0.00 C ATOM 1814 C GLU A 121 10.264 -9.460 0.763 1.00 0.00 C ATOM 1815 O GLU A 121 10.828 -10.535 0.566 1.00 0.00 O ATOM 1816 CB GLU A 121 10.871 -8.457 2.995 1.00 0.00 C ATOM 1817 CG GLU A 121 11.569 -7.297 3.708 1.00 0.00 C ATOM 1818 CD GLU A 121 13.088 -7.478 3.691 1.00 0.00 C ATOM 1819 OE1 GLU A 121 13.568 -8.333 4.464 1.00 0.00 O ATOM 1820 OE2 GLU A 121 13.737 -6.755 2.903 1.00 0.00 O ATOM 0 H GLU A 121 10.090 -6.451 1.766 1.00 0.00 H new ATOM 0 HA GLU A 121 12.051 -8.377 1.224 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.819 -8.482 3.279 1.00 0.00 H new ATOM 0 HB3 GLU A 121 11.310 -9.402 3.315 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.306 -6.357 3.224 1.00 0.00 H new ATOM 0 HG3 GLU A 121 11.218 -7.234 4.738 1.00 0.00 H new ATOM 1827 N ILE A 122 9.021 -9.187 0.395 1.00 0.00 N ATOM 1828 CA ILE A 122 8.209 -10.177 -0.292 1.00 0.00 C ATOM 1829 C ILE A 122 8.614 -10.227 -1.768 1.00 0.00 C ATOM 1830 O ILE A 122 8.630 -11.297 -2.373 1.00 0.00 O ATOM 1831 CB ILE A 122 6.721 -9.896 -0.072 1.00 0.00 C ATOM 1832 CG1 ILE A 122 6.478 -9.276 1.304 1.00 0.00 C ATOM 1833 CG2 ILE A 122 5.886 -11.160 -0.287 1.00 0.00 C ATOM 1834 CD1 ILE A 122 7.260 -10.020 2.388 1.00 0.00 C ATOM 0 H ILE A 122 8.556 -8.294 0.560 1.00 0.00 H new ATOM 0 HA ILE A 122 8.387 -11.169 0.122 1.00 0.00 H new ATOM 0 HB ILE A 122 6.398 -9.167 -0.815 1.00 0.00 H new ATOM 0 HG12 ILE A 122 6.775 -8.227 1.292 1.00 0.00 H new ATOM 0 HG13 ILE A 122 5.413 -9.303 1.536 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.833 -10.932 -0.124 1.00 0.00 H new ATOM 0 HG22 ILE A 122 6.026 -11.520 -1.306 1.00 0.00 H new ATOM 0 HG23 ILE A 122 6.204 -11.930 0.416 1.00 0.00 H new ATOM 0 HD11 ILE A 122 7.069 -9.558 3.357 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.943 -11.063 2.414 1.00 0.00 H new ATOM 0 HD13 ILE A 122 8.326 -9.970 2.166 1.00 0.00 H new ATOM 1846 N HIS A 123 8.930 -9.055 -2.300 1.00 0.00 N ATOM 1847 CA HIS A 123 9.333 -8.954 -3.693 1.00 0.00 C ATOM 1848 C HIS A 123 10.377 -10.027 -4.005 1.00 0.00 C ATOM 1849 O HIS A 123 10.605 -10.358 -5.168 1.00 0.00 O ATOM 1850 CB HIS A 123 9.823 -7.539 -4.014 1.00 0.00 C ATOM 1851 CG HIS A 123 11.027 -7.498 -4.923 1.00 0.00 C ATOM 1852 ND1 HIS A 123 12.168 -6.774 -4.626 1.00 0.00 N ATOM 1853 CD2 HIS A 123 11.257 -8.099 -6.126 1.00 0.00 C ATOM 1854 CE1 HIS A 123 13.038 -6.938 -5.612 1.00 0.00 C ATOM 1855 NE2 HIS A 123 12.471 -7.759 -6.540 1.00 0.00 N ATOM 0 H HIS A 123 8.915 -8.170 -1.793 1.00 0.00 H new ATOM 0 HA HIS A 123 8.473 -9.135 -4.338 1.00 0.00 H new ATOM 0 HB2 HIS A 123 9.010 -6.981 -4.479 1.00 0.00 H new ATOM 0 HB3 HIS A 123 10.067 -7.030 -3.082 1.00 0.00 H new ATOM 0 HD2 HIS A 123 10.568 -8.743 -6.652 1.00 0.00 H new ATOM 0 HE1 HIS A 123 14.023 -6.498 -5.670 1.00 0.00 H new ATOM 0 HE2 HIS A 123 12.908 -8.062 -7.410 1.00 0.00 H new ATOM 1864 N LYS A 124 10.985 -10.543 -2.947 1.00 0.00 N ATOM 1865 CA LYS A 124 12.000 -11.572 -3.093 1.00 0.00 C ATOM 1866 C LYS A 124 11.354 -12.947 -2.920 1.00 0.00 C ATOM 1867 O LYS A 124 12.016 -13.904 -2.518 1.00 0.00 O ATOM 1868 CB LYS A 124 13.165 -11.316 -2.133 1.00 0.00 C ATOM 1869 CG LYS A 124 12.936 -12.016 -0.793 1.00 0.00 C ATOM 1870 CD LYS A 124 13.694 -11.307 0.332 1.00 0.00 C ATOM 1871 CE LYS A 124 14.513 -12.305 1.152 1.00 0.00 C ATOM 1872 NZ LYS A 124 13.665 -12.960 2.172 1.00 0.00 N ATOM 0 H LYS A 124 10.794 -10.267 -1.984 1.00 0.00 H new ATOM 0 HA LYS A 124 12.429 -11.544 -4.095 1.00 0.00 H new ATOM 0 HB2 LYS A 124 14.093 -11.672 -2.579 1.00 0.00 H new ATOM 0 HB3 LYS A 124 13.279 -10.244 -1.972 1.00 0.00 H new ATOM 0 HG2 LYS A 124 11.870 -12.032 -0.564 1.00 0.00 H new ATOM 0 HG3 LYS A 124 13.264 -13.053 -0.860 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.354 -10.549 -0.090 1.00 0.00 H new ATOM 0 HD3 LYS A 124 12.988 -10.789 0.981 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.945 -13.058 0.493 1.00 0.00 H new ATOM 0 HE3 LYS A 124 15.343 -11.791 1.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 14.238 -13.634 2.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 13.273 -12.240 2.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 12.887 -13.467 1.703 1.00 0.00 H new ATOM 1886 N LEU A 125 10.067 -13.004 -3.233 1.00 0.00 N ATOM 1887 CA LEU A 125 9.323 -14.247 -3.120 1.00 0.00 C ATOM 1888 C LEU A 125 10.163 -15.394 -3.687 1.00 0.00 C ATOM 1889 O LEU A 125 10.969 -15.990 -2.974 1.00 0.00 O ATOM 1890 CB LEU A 125 7.947 -14.110 -3.773 1.00 0.00 C ATOM 1891 CG LEU A 125 7.786 -12.952 -4.758 1.00 0.00 C ATOM 1892 CD1 LEU A 125 8.938 -12.922 -5.764 1.00 0.00 C ATOM 1893 CD2 LEU A 125 6.422 -13.008 -5.452 1.00 0.00 C ATOM 0 H LEU A 125 9.521 -12.209 -3.565 1.00 0.00 H new ATOM 0 HA LEU A 125 9.130 -14.481 -2.073 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.720 -15.040 -4.295 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.202 -13.997 -2.985 1.00 0.00 H new ATOM 0 HG LEU A 125 7.825 -12.019 -4.196 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.798 -12.089 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.882 -12.799 -5.233 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.956 -13.857 -6.325 1.00 0.00 H new ATOM 0 HD21 LEU A 125 6.333 -12.173 -6.147 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.330 -13.947 -5.998 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.631 -12.944 -4.705 1.00 0.00 H new ATOM 1905 N ASN A 126 9.945 -15.668 -4.965 1.00 0.00 N ATOM 1906 CA ASN A 126 10.671 -16.731 -5.636 1.00 0.00 C ATOM 1907 C ASN A 126 11.600 -16.124 -6.689 1.00 0.00 C ATOM 1908 O ASN A 126 12.396 -16.832 -7.302 1.00 0.00 O ATOM 1909 CB ASN A 126 9.713 -17.689 -6.349 1.00 0.00 C ATOM 1910 CG ASN A 126 10.475 -18.645 -7.267 1.00 0.00 C ATOM 1911 OD1 ASN A 126 10.858 -19.740 -6.888 1.00 0.00 O ATOM 1912 ND2 ASN A 126 10.673 -18.174 -8.495 1.00 0.00 N ATOM 0 H ASN A 126 9.275 -15.172 -5.553 1.00 0.00 H new ATOM 0 HA ASN A 126 11.236 -17.279 -4.882 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.149 -18.260 -5.612 1.00 0.00 H new ATOM 0 HB3 ASN A 126 8.990 -17.119 -6.932 1.00 0.00 H new ATOM 0 HD21 ASN A 126 11.171 -18.738 -9.183 1.00 0.00 H new ATOM 0 HD22 ASN A 126 10.327 -17.249 -8.748 1.00 0.00 H new ATOM 1919 N TRP A 127 11.467 -14.817 -6.866 1.00 0.00 N ATOM 1920 CA TRP A 127 12.284 -14.105 -7.834 1.00 0.00 C ATOM 1921 C TRP A 127 13.533 -13.594 -7.112 1.00 0.00 C ATOM 1922 O TRP A 127 13.500 -13.345 -5.907 1.00 0.00 O ATOM 1923 CB TRP A 127 11.486 -12.990 -8.511 1.00 0.00 C ATOM 1924 CG TRP A 127 9.978 -13.248 -8.566 1.00 0.00 C ATOM 1925 CD1 TRP A 127 9.347 -14.427 -8.657 1.00 0.00 C ATOM 1926 CD2 TRP A 127 8.935 -12.254 -8.530 1.00 0.00 C ATOM 1927 NE1 TRP A 127 7.976 -14.263 -8.682 1.00 0.00 N ATOM 1928 CE2 TRP A 127 7.718 -12.901 -8.602 1.00 0.00 C ATOM 1929 CE3 TRP A 127 9.015 -10.852 -8.437 1.00 0.00 C ATOM 1930 CZ2 TRP A 127 6.489 -12.228 -8.591 1.00 0.00 C ATOM 1931 CZ3 TRP A 127 7.779 -10.195 -8.429 1.00 0.00 C ATOM 1932 CH2 TRP A 127 6.546 -10.832 -8.500 1.00 0.00 C ATOM 0 H TRP A 127 10.805 -14.233 -6.355 1.00 0.00 H new ATOM 0 HA TRP A 127 12.595 -14.770 -8.640 1.00 0.00 H new ATOM 0 HB2 TRP A 127 11.665 -12.055 -7.980 1.00 0.00 H new ATOM 0 HB3 TRP A 127 11.858 -12.856 -9.527 1.00 0.00 H new ATOM 0 HD1 TRP A 127 9.847 -15.383 -8.705 1.00 0.00 H new ATOM 0 HE1 TRP A 127 7.280 -15.006 -8.747 1.00 0.00 H new ATOM 0 HE3 TRP A 127 9.956 -10.325 -8.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.549 -12.757 -8.650 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 7.784 -9.117 -8.363 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.635 -10.252 -8.485 1.00 0.00 H new ATOM 1943 N VAL A 128 14.604 -13.452 -7.879 1.00 0.00 N ATOM 1944 CA VAL A 128 15.860 -12.975 -7.328 1.00 0.00 C ATOM 1945 C VAL A 128 15.957 -11.460 -7.526 1.00 0.00 C ATOM 1946 O VAL A 128 15.968 -10.977 -8.656 1.00 0.00 O ATOM 1947 CB VAL A 128 17.031 -13.733 -7.956 1.00 0.00 C ATOM 1948 CG1 VAL A 128 16.735 -15.234 -8.026 1.00 0.00 C ATOM 1949 CG2 VAL A 128 17.366 -13.177 -9.340 1.00 0.00 C ATOM 0 H VAL A 128 14.627 -13.659 -8.877 1.00 0.00 H new ATOM 0 HA VAL A 128 15.902 -13.168 -6.256 1.00 0.00 H new ATOM 0 HB VAL A 128 17.903 -13.590 -7.318 1.00 0.00 H new ATOM 0 HG11 VAL A 128 17.582 -15.751 -8.476 1.00 0.00 H new ATOM 0 HG12 VAL A 128 16.567 -15.619 -7.020 1.00 0.00 H new ATOM 0 HG13 VAL A 128 15.844 -15.401 -8.632 1.00 0.00 H new ATOM 0 HG21 VAL A 128 18.202 -13.734 -9.763 1.00 0.00 H new ATOM 0 HG22 VAL A 128 16.498 -13.275 -9.991 1.00 0.00 H new ATOM 0 HG23 VAL A 128 17.638 -12.125 -9.253 1.00 0.00 H new ATOM 1959 N PRO A 129 16.025 -10.733 -6.377 1.00 0.00 N ATOM 1960 CA PRO A 129 16.119 -9.284 -6.413 1.00 0.00 C ATOM 1961 C PRO A 129 17.524 -8.836 -6.822 1.00 0.00 C ATOM 1962 O PRO A 129 18.139 -8.013 -6.144 1.00 0.00 O ATOM 1963 CB PRO A 129 15.735 -8.830 -5.015 1.00 0.00 C ATOM 1964 CG PRO A 129 15.889 -10.051 -4.123 1.00 0.00 C ATOM 1965 CD PRO A 129 16.014 -11.271 -5.020 1.00 0.00 C ATOM 0 HA PRO A 129 15.459 -8.838 -7.157 1.00 0.00 H new ATOM 0 HB2 PRO A 129 16.378 -8.017 -4.678 1.00 0.00 H new ATOM 0 HB3 PRO A 129 14.711 -8.457 -4.993 1.00 0.00 H new ATOM 0 HG2 PRO A 129 16.770 -9.952 -3.489 1.00 0.00 H new ATOM 0 HG3 PRO A 129 15.029 -10.151 -3.461 1.00 0.00 H new ATOM 0 HD2 PRO A 129 16.927 -11.827 -4.807 1.00 0.00 H new ATOM 0 HD3 PRO A 129 15.180 -11.958 -4.873 1.00 0.00 H new ATOM 1973 N ASN A 130 17.992 -9.398 -7.927 1.00 0.00 N ATOM 1974 CA ASN A 130 19.313 -9.066 -8.433 1.00 0.00 C ATOM 1975 C ASN A 130 19.563 -7.567 -8.252 1.00 0.00 C ATOM 1976 O ASN A 130 20.702 -7.144 -8.053 1.00 0.00 O ATOM 1977 CB ASN A 130 19.427 -9.387 -9.925 1.00 0.00 C ATOM 1978 CG ASN A 130 20.841 -9.853 -10.278 1.00 0.00 C ATOM 1979 OD1 ASN A 130 21.828 -9.191 -10.003 1.00 0.00 O ATOM 1980 ND2 ASN A 130 20.884 -11.027 -10.903 1.00 0.00 N ATOM 0 H ASN A 130 17.480 -10.081 -8.486 1.00 0.00 H new ATOM 0 HA ASN A 130 20.044 -9.655 -7.879 1.00 0.00 H new ATOM 0 HB2 ASN A 130 18.708 -10.162 -10.190 1.00 0.00 H new ATOM 0 HB3 ASN A 130 19.174 -8.504 -10.511 1.00 0.00 H new ATOM 0 HD21 ASN A 130 21.781 -11.424 -11.182 1.00 0.00 H new ATOM 0 HD22 ASN A 130 20.020 -11.530 -11.103 1.00 0.00 H new ATOM 1987 N MET A 131 18.482 -6.807 -8.327 1.00 0.00 N ATOM 1988 CA MET A 131 18.569 -5.364 -8.173 1.00 0.00 C ATOM 1989 C MET A 131 18.268 -4.946 -6.733 1.00 0.00 C ATOM 1990 O MET A 131 17.107 -4.877 -6.332 1.00 0.00 O ATOM 1991 CB MET A 131 17.575 -4.688 -9.120 1.00 0.00 C ATOM 1992 CG MET A 131 17.937 -3.217 -9.334 1.00 0.00 C ATOM 1993 SD MET A 131 16.458 -2.217 -9.317 1.00 0.00 S ATOM 1994 CE MET A 131 16.641 -1.365 -10.874 1.00 0.00 C ATOM 0 H MET A 131 17.540 -7.162 -8.492 1.00 0.00 H new ATOM 0 HA MET A 131 19.585 -5.053 -8.416 1.00 0.00 H new ATOM 0 HB2 MET A 131 17.568 -5.208 -10.078 1.00 0.00 H new ATOM 0 HB3 MET A 131 16.568 -4.763 -8.710 1.00 0.00 H new ATOM 0 HG2 MET A 131 18.620 -2.884 -8.552 1.00 0.00 H new ATOM 0 HG3 MET A 131 18.457 -3.096 -10.284 1.00 0.00 H new ATOM 0 HE1 MET A 131 15.795 -0.694 -11.023 1.00 0.00 H new ATOM 0 HE2 MET A 131 17.566 -0.788 -10.866 1.00 0.00 H new ATOM 0 HE3 MET A 131 16.674 -2.092 -11.685 1.00 0.00 H new ATOM 2004 N ASP A 132 19.334 -4.680 -5.992 1.00 0.00 N ATOM 2005 CA ASP A 132 19.198 -4.271 -4.604 1.00 0.00 C ATOM 2006 C ASP A 132 19.788 -2.871 -4.430 1.00 0.00 C ATOM 2007 O ASP A 132 21.006 -2.703 -4.434 1.00 0.00 O ATOM 2008 CB ASP A 132 19.953 -5.223 -3.673 1.00 0.00 C ATOM 2009 CG ASP A 132 19.080 -5.957 -2.653 1.00 0.00 C ATOM 2010 OD1 ASP A 132 18.511 -5.260 -1.786 1.00 0.00 O ATOM 2011 OD2 ASP A 132 19.002 -7.200 -2.765 1.00 0.00 O ATOM 0 H ASP A 132 20.296 -4.740 -6.327 1.00 0.00 H new ATOM 0 HA ASP A 132 18.138 -4.284 -4.350 1.00 0.00 H new ATOM 0 HB2 ASP A 132 20.476 -5.962 -4.280 1.00 0.00 H new ATOM 0 HB3 ASP A 132 20.713 -4.656 -3.136 1.00 0.00 H new ATOM 2016 N LEU A 133 18.897 -1.903 -4.279 1.00 0.00 N ATOM 2017 CA LEU A 133 19.315 -0.521 -4.102 1.00 0.00 C ATOM 2018 C LEU A 133 18.084 0.352 -3.850 1.00 0.00 C ATOM 2019 O LEU A 133 17.223 0.482 -4.720 1.00 0.00 O ATOM 2020 CB LEU A 133 20.162 -0.063 -5.291 1.00 0.00 C ATOM 2021 CG LEU A 133 19.399 0.592 -6.444 1.00 0.00 C ATOM 2022 CD1 LEU A 133 18.271 -0.314 -6.940 1.00 0.00 C ATOM 2023 CD2 LEU A 133 18.889 1.978 -6.048 1.00 0.00 C ATOM 0 H LEU A 133 17.887 -2.047 -4.275 1.00 0.00 H new ATOM 0 HA LEU A 133 19.957 -0.425 -3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 133 20.910 0.643 -4.929 1.00 0.00 H new ATOM 0 HB3 LEU A 133 20.701 -0.926 -5.682 1.00 0.00 H new ATOM 0 HG LEU A 133 20.090 0.730 -7.275 1.00 0.00 H new ATOM 0 HD11 LEU A 133 17.745 0.176 -7.759 1.00 0.00 H new ATOM 0 HD12 LEU A 133 18.689 -1.258 -7.290 1.00 0.00 H new ATOM 0 HD13 LEU A 133 17.574 -0.506 -6.125 1.00 0.00 H new ATOM 0 HD21 LEU A 133 18.351 2.421 -6.886 1.00 0.00 H new ATOM 0 HD22 LEU A 133 18.219 1.889 -5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 133 19.733 2.614 -5.783 1.00 0.00 H new ATOM 2035 N VAL A 134 18.039 0.927 -2.658 1.00 0.00 N ATOM 2036 CA VAL A 134 16.928 1.782 -2.281 1.00 0.00 C ATOM 2037 C VAL A 134 17.437 3.210 -2.074 1.00 0.00 C ATOM 2038 O VAL A 134 16.999 4.135 -2.757 1.00 0.00 O ATOM 2039 CB VAL A 134 16.224 1.215 -1.047 1.00 0.00 C ATOM 2040 CG1 VAL A 134 15.119 2.156 -0.565 1.00 0.00 C ATOM 2041 CG2 VAL A 134 15.669 -0.184 -1.328 1.00 0.00 C ATOM 0 H VAL A 134 18.755 0.817 -1.940 1.00 0.00 H new ATOM 0 HA VAL A 134 16.184 1.813 -3.077 1.00 0.00 H new ATOM 0 HB VAL A 134 16.962 1.130 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 134 14.635 1.729 0.313 1.00 0.00 H new ATOM 0 HG12 VAL A 134 15.551 3.123 -0.307 1.00 0.00 H new ATOM 0 HG13 VAL A 134 14.382 2.288 -1.357 1.00 0.00 H new ATOM 0 HG21 VAL A 134 15.173 -0.565 -0.435 1.00 0.00 H new ATOM 0 HG22 VAL A 134 14.952 -0.133 -2.147 1.00 0.00 H new ATOM 0 HG23 VAL A 134 16.486 -0.851 -1.602 1.00 0.00 H new ATOM 2051 N ILE A 135 18.356 3.346 -1.129 1.00 0.00 N ATOM 2052 CA ILE A 135 18.930 4.645 -0.823 1.00 0.00 C ATOM 2053 C ILE A 135 20.351 4.715 -1.387 1.00 0.00 C ATOM 2054 O ILE A 135 20.894 5.803 -1.577 1.00 0.00 O ATOM 2055 CB ILE A 135 18.849 4.927 0.678 1.00 0.00 C ATOM 2056 CG1 ILE A 135 19.159 3.668 1.490 1.00 0.00 C ATOM 2057 CG2 ILE A 135 17.492 5.529 1.051 1.00 0.00 C ATOM 2058 CD1 ILE A 135 17.895 2.835 1.714 1.00 0.00 C ATOM 0 H ILE A 135 18.717 2.577 -0.565 1.00 0.00 H new ATOM 0 HA ILE A 135 18.356 5.438 -1.303 1.00 0.00 H new ATOM 0 HB ILE A 135 19.609 5.667 0.927 1.00 0.00 H new ATOM 0 HG12 ILE A 135 19.906 3.069 0.968 1.00 0.00 H new ATOM 0 HG13 ILE A 135 19.590 3.948 2.451 1.00 0.00 H new ATOM 0 HG21 ILE A 135 17.461 5.720 2.124 1.00 0.00 H new ATOM 0 HG22 ILE A 135 17.349 6.465 0.512 1.00 0.00 H new ATOM 0 HG23 ILE A 135 16.699 4.831 0.784 1.00 0.00 H new ATOM 0 HD11 ILE A 135 18.143 1.946 2.294 1.00 0.00 H new ATOM 0 HD12 ILE A 135 17.160 3.429 2.257 1.00 0.00 H new ATOM 0 HD13 ILE A 135 17.481 2.536 0.751 1.00 0.00 H new ATOM 2070 N GLY A 136 20.912 3.542 -1.638 1.00 0.00 N ATOM 2071 CA GLY A 136 22.259 3.456 -2.177 1.00 0.00 C ATOM 2072 C GLY A 136 23.302 3.529 -1.059 1.00 0.00 C ATOM 2073 O GLY A 136 24.411 4.015 -1.270 1.00 0.00 O ATOM 0 H GLY A 136 20.458 2.642 -1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 136 22.375 2.523 -2.728 1.00 0.00 H new ATOM 0 HA3 GLY A 136 22.423 4.267 -2.886 1.00 0.00 H new ATOM 2077 N GLU A 137 22.907 3.037 0.107 1.00 0.00 N ATOM 2078 CA GLU A 137 23.793 3.039 1.259 1.00 0.00 C ATOM 2079 C GLU A 137 24.125 1.605 1.676 1.00 0.00 C ATOM 2080 O GLU A 137 23.558 0.653 1.143 1.00 0.00 O ATOM 2081 CB GLU A 137 23.180 3.822 2.421 1.00 0.00 C ATOM 2082 CG GLU A 137 24.056 5.016 2.803 1.00 0.00 C ATOM 2083 CD GLU A 137 24.172 5.148 4.322 1.00 0.00 C ATOM 2084 OE1 GLU A 137 24.964 4.374 4.902 1.00 0.00 O ATOM 2085 OE2 GLU A 137 23.466 6.021 4.871 1.00 0.00 O ATOM 0 H GLU A 137 21.986 2.635 0.278 1.00 0.00 H new ATOM 0 HA GLU A 137 24.721 3.538 0.979 1.00 0.00 H new ATOM 0 HB2 GLU A 137 22.185 4.171 2.144 1.00 0.00 H new ATOM 0 HB3 GLU A 137 23.059 3.165 3.283 1.00 0.00 H new ATOM 0 HG2 GLU A 137 25.048 4.897 2.368 1.00 0.00 H new ATOM 0 HG3 GLU A 137 23.633 5.930 2.386 1.00 0.00 H new ATOM 2092 N VAL A 138 25.041 1.497 2.626 1.00 0.00 N ATOM 2093 CA VAL A 138 25.456 0.195 3.123 1.00 0.00 C ATOM 2094 C VAL A 138 24.273 -0.478 3.822 1.00 0.00 C ATOM 2095 O VAL A 138 23.979 -0.181 4.977 1.00 0.00 O ATOM 2096 CB VAL A 138 26.680 0.344 4.028 1.00 0.00 C ATOM 2097 CG1 VAL A 138 27.795 1.116 3.319 1.00 0.00 C ATOM 2098 CG2 VAL A 138 26.304 1.014 5.351 1.00 0.00 C ATOM 0 H VAL A 138 25.508 2.290 3.066 1.00 0.00 H new ATOM 0 HA VAL A 138 25.758 -0.450 2.298 1.00 0.00 H new ATOM 0 HB VAL A 138 27.055 -0.654 4.253 1.00 0.00 H new ATOM 0 HG11 VAL A 138 28.654 1.208 3.984 1.00 0.00 H new ATOM 0 HG12 VAL A 138 28.091 0.581 2.416 1.00 0.00 H new ATOM 0 HG13 VAL A 138 27.436 2.110 3.051 1.00 0.00 H new ATOM 0 HG21 VAL A 138 27.192 1.108 5.976 1.00 0.00 H new ATOM 0 HG22 VAL A 138 25.893 2.004 5.154 1.00 0.00 H new ATOM 0 HG23 VAL A 138 25.559 0.408 5.867 1.00 0.00 H new ATOM 2108 N LEU A 139 23.626 -1.375 3.091 1.00 0.00 N ATOM 2109 CA LEU A 139 22.483 -2.094 3.627 1.00 0.00 C ATOM 2110 C LEU A 139 21.971 -3.082 2.578 1.00 0.00 C ATOM 2111 O LEU A 139 22.005 -4.294 2.792 1.00 0.00 O ATOM 2112 CB LEU A 139 21.417 -1.113 4.120 1.00 0.00 C ATOM 2113 CG LEU A 139 20.655 -1.527 5.380 1.00 0.00 C ATOM 2114 CD1 LEU A 139 19.842 -2.801 5.134 1.00 0.00 C ATOM 2115 CD2 LEU A 139 21.604 -1.675 6.571 1.00 0.00 C ATOM 0 H LEU A 139 23.872 -1.620 2.132 1.00 0.00 H new ATOM 0 HA LEU A 139 22.775 -2.678 4.500 1.00 0.00 H new ATOM 0 HB2 LEU A 139 21.896 -0.152 4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 139 20.696 -0.958 3.318 1.00 0.00 H new ATOM 0 HG LEU A 139 19.948 -0.735 5.628 1.00 0.00 H new ATOM 0 HD11 LEU A 139 19.310 -3.074 6.045 1.00 0.00 H new ATOM 0 HD12 LEU A 139 19.124 -2.625 4.333 1.00 0.00 H new ATOM 0 HD13 LEU A 139 20.513 -3.611 4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 139 21.037 -1.970 7.454 1.00 0.00 H new ATOM 0 HD22 LEU A 139 22.351 -2.437 6.348 1.00 0.00 H new ATOM 0 HD23 LEU A 139 22.101 -0.724 6.760 1.00 0.00 H new ATOM 2127 N ALA A 140 21.508 -2.530 1.466 1.00 0.00 N ATOM 2128 CA ALA A 140 20.989 -3.350 0.384 1.00 0.00 C ATOM 2129 C ALA A 140 22.155 -3.995 -0.366 1.00 0.00 C ATOM 2130 O ALA A 140 23.305 -3.585 -0.205 1.00 0.00 O ATOM 2131 CB ALA A 140 20.112 -2.491 -0.530 1.00 0.00 C ATOM 0 H ALA A 140 21.481 -1.526 1.291 1.00 0.00 H new ATOM 0 HA ALA A 140 20.365 -4.153 0.776 1.00 0.00 H new ATOM 0 HB1 ALA A 140 19.722 -3.105 -1.342 1.00 0.00 H new ATOM 0 HB2 ALA A 140 19.282 -2.079 0.044 1.00 0.00 H new ATOM 0 HB3 ALA A 140 20.706 -1.677 -0.944 1.00 0.00 H new ATOM 2137 N GLU A 141 21.821 -4.995 -1.168 1.00 0.00 N ATOM 2138 CA GLU A 141 22.827 -5.703 -1.943 1.00 0.00 C ATOM 2139 C GLU A 141 23.313 -4.831 -3.102 1.00 0.00 C ATOM 2140 O GLU A 141 22.815 -4.947 -4.222 1.00 0.00 O ATOM 2141 CB GLU A 141 22.288 -7.041 -2.450 1.00 0.00 C ATOM 2142 CG GLU A 141 22.935 -8.211 -1.707 1.00 0.00 C ATOM 2143 CD GLU A 141 21.947 -9.366 -1.533 1.00 0.00 C ATOM 2144 OE1 GLU A 141 21.815 -10.148 -2.499 1.00 0.00 O ATOM 2145 OE2 GLU A 141 21.345 -9.439 -0.441 1.00 0.00 O ATOM 0 H GLU A 141 20.867 -5.332 -1.298 1.00 0.00 H new ATOM 0 HA GLU A 141 23.676 -5.916 -1.293 1.00 0.00 H new ATOM 0 HB2 GLU A 141 21.207 -7.075 -2.317 1.00 0.00 H new ATOM 0 HB3 GLU A 141 22.481 -7.133 -3.519 1.00 0.00 H new ATOM 0 HG2 GLU A 141 23.810 -8.556 -2.258 1.00 0.00 H new ATOM 0 HG3 GLU A 141 23.285 -7.877 -0.730 1.00 0.00 H new ATOM 2152 N VAL A 142 24.279 -3.978 -2.796 1.00 0.00 N ATOM 2153 CA VAL A 142 24.837 -3.088 -3.800 1.00 0.00 C ATOM 2154 C VAL A 142 26.173 -3.652 -4.290 1.00 0.00 C ATOM 2155 O VAL A 142 26.892 -2.993 -5.037 1.00 0.00 O ATOM 2156 CB VAL A 142 24.959 -1.672 -3.233 1.00 0.00 C ATOM 2157 CG1 VAL A 142 26.186 -1.548 -2.327 1.00 0.00 C ATOM 2158 CG2 VAL A 142 24.998 -0.634 -4.357 1.00 0.00 C ATOM 0 H VAL A 142 24.690 -3.884 -1.867 1.00 0.00 H new ATOM 0 HA VAL A 142 24.175 -3.023 -4.663 1.00 0.00 H new ATOM 0 HB VAL A 142 24.075 -1.476 -2.626 1.00 0.00 H new ATOM 0 HG11 VAL A 142 26.249 -0.532 -1.937 1.00 0.00 H new ATOM 0 HG12 VAL A 142 26.098 -2.250 -1.498 1.00 0.00 H new ATOM 0 HG13 VAL A 142 27.086 -1.774 -2.900 1.00 0.00 H new ATOM 0 HG21 VAL A 142 25.085 0.364 -3.928 1.00 0.00 H new ATOM 0 HG22 VAL A 142 25.855 -0.828 -5.002 1.00 0.00 H new ATOM 0 HG23 VAL A 142 24.081 -0.698 -4.943 1.00 0.00 H new TER 2168 VAL A 142