USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1063 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 20 GLN : amide:sc= -1.23 K(o=-3,f=-0.33) USER MOD Set 1.2: A 78 GLN : amide:sc= -1.72 X(o=-3,f=-3!) USER MOD Set 2.1: A 39 THR OG1 : rot 180:sc= 0.206 USER MOD Set 2.2: A 40 THR OG1 : rot 180:sc= 0.0502 USER MOD Single : A 1 HIS : no HD1:sc= -1.67 K(o=-1.7,f=-0.96) USER MOD Single : A 1 HIS N :NH3+ -132:sc= 0.103 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.889 K(o=-0.89,f=-3.5!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 79:sc= 0.224 USER MOD Single : A 21 LYS NZ :NH3+ 165:sc= -1.7! (180deg=-1.91!) USER MOD Single : A 22 THR OG1 : rot -56:sc= 1.01 USER MOD Single : A 25 THR OG1 : rot -82:sc= 0.299! USER MOD Single : A 28 THR OG1 : rot 25:sc= 0.161 USER MOD Single : A 30 THR OG1 : rot 180:sc=-0.00645 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= -0.0982 X(o=-0.098,f=-0.25) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 176:sc= -0.741 USER MOD Single : A 50 THR OG1 : rot -42:sc= 0.105 USER MOD Single : A 54 GLN : amide:sc= -0.736 K(o=-0.74,f=0) USER MOD Single : A 56 TYR OH : rot -179:sc= 0.894 USER MOD Single : A 57 SER OG : rot -98:sc= 0.901 USER MOD Single : A 58 HIS : no HD1:sc= -1.22 K(o=-1.2,f=0.029) USER MOD Single : A 59 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-0.75) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 38:sc= 1.26 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0226 USER MOD Single : A 71 GLN : amide:sc= -0.953 X(o=-0.95,f=-0.49) USER MOD Single : A 72 GLN : amide:sc= -5.48! C(o=-5.5!,f=-15!) USER MOD Single : A 74 HIS : no HD1:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 76 HIS : no HE2:sc= -6.3! C(o=-6.3!,f=-9!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -8.79! C(o=-8.8!,f=-6.5!) USER MOD Single : A 97 ASN : amide:sc= -5.09! C(o=-5.1!,f=-6.5!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0155) USER MOD Single : A 105 ASN : amide:sc= -0.905 K(o=-0.9,f=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.162 K(o=-0.16,f=-2.8!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 MET CE :methyl -142:sc= -5.81! (180deg=-14.3!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 120:sc= -0.0938 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= -0.0971 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 18.834 0.254 -33.259 1.00 0.00 N ATOM 2 CA HIS A 1 19.767 0.245 -32.098 1.00 0.00 C ATOM 3 C HIS A 1 19.469 1.442 -31.193 1.00 0.00 C ATOM 4 O HIS A 1 18.413 2.040 -31.269 1.00 0.00 O ATOM 5 CB HIS A 1 21.208 0.332 -32.603 1.00 0.00 C ATOM 6 CG HIS A 1 22.119 -0.388 -31.645 1.00 0.00 C ATOM 7 ND1 HIS A 1 23.466 -0.578 -31.911 1.00 0.00 N ATOM 8 CD2 HIS A 1 21.891 -0.970 -30.424 1.00 0.00 C ATOM 9 CE1 HIS A 1 23.993 -1.249 -30.870 1.00 0.00 C ATOM 10 NE2 HIS A 1 23.076 -1.513 -29.935 1.00 0.00 N ATOM 0 H1 HIS A 1 18.424 -0.694 -33.382 1.00 0.00 H new ATOM 0 H2 HIS A 1 18.073 0.941 -33.087 1.00 0.00 H new ATOM 0 H3 HIS A 1 19.353 0.521 -34.120 1.00 0.00 H new ATOM 0 HA HIS A 1 19.635 -0.677 -31.533 1.00 0.00 H new ATOM 0 HB2 HIS A 1 21.284 -0.110 -33.596 1.00 0.00 H new ATOM 0 HB3 HIS A 1 21.510 1.375 -32.695 1.00 0.00 H new ATOM 0 HD2 HIS A 1 20.937 -1.002 -29.919 1.00 0.00 H new ATOM 0 HE1 HIS A 1 25.031 -1.539 -30.799 1.00 0.00 H new ATOM 0 HE2 HIS A 1 23.214 -2.006 -29.053 1.00 0.00 H new ATOM 20 N LYS A 2 20.387 1.798 -30.337 1.00 0.00 N ATOM 21 CA LYS A 2 20.150 2.956 -29.432 1.00 0.00 C ATOM 22 C LYS A 2 18.917 2.686 -28.569 1.00 0.00 C ATOM 23 O LYS A 2 18.160 1.770 -28.821 1.00 0.00 O ATOM 24 CB LYS A 2 19.920 4.217 -30.268 1.00 0.00 C ATOM 25 CG LYS A 2 20.597 5.411 -29.588 1.00 0.00 C ATOM 26 CD LYS A 2 19.785 6.679 -29.855 1.00 0.00 C ATOM 27 CE LYS A 2 20.668 7.908 -29.632 1.00 0.00 C ATOM 28 NZ LYS A 2 20.614 8.784 -30.837 1.00 0.00 N ATOM 0 H LYS A 2 21.290 1.337 -30.226 1.00 0.00 H new ATOM 0 HA LYS A 2 21.019 3.098 -28.789 1.00 0.00 H new ATOM 0 HB2 LYS A 2 20.323 4.080 -31.271 1.00 0.00 H new ATOM 0 HB3 LYS A 2 18.852 4.404 -30.377 1.00 0.00 H new ATOM 0 HG2 LYS A 2 20.675 5.236 -28.515 1.00 0.00 H new ATOM 0 HG3 LYS A 2 21.612 5.530 -29.966 1.00 0.00 H new ATOM 0 HD2 LYS A 2 19.405 6.672 -30.877 1.00 0.00 H new ATOM 0 HD3 LYS A 2 18.920 6.715 -29.193 1.00 0.00 H new ATOM 0 HE2 LYS A 2 20.329 8.458 -28.754 1.00 0.00 H new ATOM 0 HE3 LYS A 2 21.696 7.600 -29.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 21.214 9.620 -30.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 20.957 8.257 -31.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 19.633 9.088 -31.002 1.00 0.00 H new ATOM 42 N CYS A 3 18.708 3.476 -27.553 1.00 0.00 N ATOM 43 CA CYS A 3 17.530 3.270 -26.675 1.00 0.00 C ATOM 44 C CYS A 3 16.535 4.413 -26.886 1.00 0.00 C ATOM 45 O CYS A 3 16.893 5.479 -27.346 1.00 0.00 O ATOM 46 CB CYS A 3 17.986 3.250 -25.224 1.00 0.00 C ATOM 47 SG CYS A 3 17.968 1.548 -24.608 1.00 0.00 S ATOM 0 H CYS A 3 19.308 4.259 -27.294 1.00 0.00 H new ATOM 0 HA CYS A 3 17.049 2.323 -26.918 1.00 0.00 H new ATOM 0 HB2 CYS A 3 18.990 3.667 -25.141 1.00 0.00 H new ATOM 0 HB3 CYS A 3 17.330 3.874 -24.617 1.00 0.00 H new ATOM 52 N ASP A 4 15.287 4.197 -26.570 1.00 0.00 N ATOM 53 CA ASP A 4 14.271 5.267 -26.772 1.00 0.00 C ATOM 54 C ASP A 4 14.824 6.623 -26.360 1.00 0.00 C ATOM 55 O ASP A 4 15.716 6.736 -25.544 1.00 0.00 O ATOM 56 CB ASP A 4 13.012 4.985 -25.957 1.00 0.00 C ATOM 57 CG ASP A 4 13.303 3.976 -24.840 1.00 0.00 C ATOM 58 OD1 ASP A 4 14.145 4.270 -24.008 1.00 0.00 O ATOM 59 OD2 ASP A 4 12.677 2.929 -24.838 1.00 0.00 O ATOM 0 H ASP A 4 14.928 3.325 -26.181 1.00 0.00 H new ATOM 0 HA ASP A 4 14.022 5.280 -27.833 1.00 0.00 H new ATOM 0 HB2 ASP A 4 12.636 5.913 -25.526 1.00 0.00 H new ATOM 0 HB3 ASP A 4 12.230 4.597 -26.610 1.00 0.00 H new ATOM 64 N ILE A 5 14.283 7.650 -26.937 1.00 0.00 N ATOM 65 CA ILE A 5 14.730 9.030 -26.626 1.00 0.00 C ATOM 66 C ILE A 5 14.278 9.436 -25.221 1.00 0.00 C ATOM 67 O ILE A 5 15.027 10.006 -24.455 1.00 0.00 O ATOM 68 CB ILE A 5 14.102 9.956 -27.653 1.00 0.00 C ATOM 69 CG1 ILE A 5 14.407 9.406 -29.054 1.00 0.00 C ATOM 70 CG2 ILE A 5 14.656 11.376 -27.488 1.00 0.00 C ATOM 71 CD1 ILE A 5 15.737 9.965 -29.572 1.00 0.00 C ATOM 0 H ILE A 5 13.533 7.591 -27.626 1.00 0.00 H new ATOM 0 HA ILE A 5 15.818 9.090 -26.660 1.00 0.00 H new ATOM 0 HB ILE A 5 13.022 10.002 -27.511 1.00 0.00 H new ATOM 0 HG12 ILE A 5 14.451 8.317 -29.022 1.00 0.00 H new ATOM 0 HG13 ILE A 5 13.602 9.673 -29.739 1.00 0.00 H new ATOM 0 HG21 ILE A 5 14.200 12.033 -28.229 1.00 0.00 H new ATOM 0 HG22 ILE A 5 14.426 11.742 -26.488 1.00 0.00 H new ATOM 0 HG23 ILE A 5 15.737 11.364 -27.630 1.00 0.00 H new ATOM 0 HD11 ILE A 5 15.937 9.565 -30.566 1.00 0.00 H new ATOM 0 HD12 ILE A 5 15.679 11.052 -29.623 1.00 0.00 H new ATOM 0 HD13 ILE A 5 16.541 9.676 -28.896 1.00 0.00 H new ATOM 83 N THR A 6 13.047 9.170 -24.889 1.00 0.00 N ATOM 84 CA THR A 6 12.531 9.569 -23.547 1.00 0.00 C ATOM 85 C THR A 6 13.491 9.116 -22.437 1.00 0.00 C ATOM 86 O THR A 6 13.604 9.757 -21.413 1.00 0.00 O ATOM 87 CB THR A 6 11.142 8.942 -23.327 1.00 0.00 C ATOM 88 OG1 THR A 6 10.407 9.747 -22.416 1.00 0.00 O ATOM 89 CG2 THR A 6 11.271 7.523 -22.760 1.00 0.00 C ATOM 0 H THR A 6 12.373 8.693 -25.488 1.00 0.00 H new ATOM 0 HA THR A 6 12.454 10.656 -23.509 1.00 0.00 H new ATOM 0 HB THR A 6 10.625 8.888 -24.285 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.521 9.354 -22.273 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.278 7.099 -22.612 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.831 6.901 -23.459 1.00 0.00 H new ATOM 0 HG23 THR A 6 11.796 7.559 -21.805 1.00 0.00 H new ATOM 97 N LEU A 7 14.176 8.021 -22.622 1.00 0.00 N ATOM 98 CA LEU A 7 15.103 7.555 -21.560 1.00 0.00 C ATOM 99 C LEU A 7 16.322 8.482 -21.494 1.00 0.00 C ATOM 100 O LEU A 7 16.679 8.964 -20.438 1.00 0.00 O ATOM 101 CB LEU A 7 15.527 6.097 -21.814 1.00 0.00 C ATOM 102 CG LEU A 7 16.815 5.810 -21.081 1.00 0.00 C ATOM 103 CD1 LEU A 7 16.735 6.343 -19.647 1.00 0.00 C ATOM 104 CD2 LEU A 7 17.062 4.299 -21.052 1.00 0.00 C ATOM 0 H LEU A 7 14.133 7.435 -23.456 1.00 0.00 H new ATOM 0 HA LEU A 7 14.590 7.588 -20.599 1.00 0.00 H new ATOM 0 HB2 LEU A 7 14.745 5.416 -21.477 1.00 0.00 H new ATOM 0 HB3 LEU A 7 15.659 5.927 -22.883 1.00 0.00 H new ATOM 0 HG LEU A 7 17.636 6.305 -21.599 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.669 6.131 -19.127 1.00 0.00 H new ATOM 0 HD12 LEU A 7 16.568 7.420 -19.668 1.00 0.00 H new ATOM 0 HD13 LEU A 7 15.911 5.858 -19.124 1.00 0.00 H new ATOM 0 HD21 LEU A 7 17.992 4.092 -20.523 1.00 0.00 H new ATOM 0 HD22 LEU A 7 16.236 3.805 -20.540 1.00 0.00 H new ATOM 0 HD23 LEU A 7 17.134 3.922 -22.072 1.00 0.00 H new ATOM 116 N GLN A 8 16.959 8.753 -22.602 1.00 0.00 N ATOM 117 CA GLN A 8 18.135 9.662 -22.552 1.00 0.00 C ATOM 118 C GLN A 8 17.722 10.931 -21.822 1.00 0.00 C ATOM 119 O GLN A 8 18.517 11.597 -21.188 1.00 0.00 O ATOM 120 CB GLN A 8 18.616 9.992 -23.968 1.00 0.00 C ATOM 121 CG GLN A 8 17.490 10.666 -24.751 1.00 0.00 C ATOM 122 CD GLN A 8 18.067 11.807 -25.594 1.00 0.00 C ATOM 123 OE1 GLN A 8 18.323 11.641 -26.769 1.00 0.00 O ATOM 124 NE2 GLN A 8 18.282 12.967 -25.036 1.00 0.00 N ATOM 0 H GLN A 8 16.719 8.390 -23.525 1.00 0.00 H new ATOM 0 HA GLN A 8 18.958 9.179 -22.026 1.00 0.00 H new ATOM 0 HB2 GLN A 8 19.485 10.649 -23.923 1.00 0.00 H new ATOM 0 HB3 GLN A 8 18.931 9.081 -24.477 1.00 0.00 H new ATOM 0 HG2 GLN A 8 16.994 9.939 -25.394 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.736 11.052 -24.065 1.00 0.00 H new ATOM 0 HE21 GLN A 8 18.067 13.106 -24.049 1.00 0.00 H new ATOM 0 HE22 GLN A 8 18.665 13.735 -25.587 1.00 0.00 H new ATOM 133 N GLU A 9 16.474 11.254 -21.913 1.00 0.00 N ATOM 134 CA GLU A 9 15.950 12.470 -21.234 1.00 0.00 C ATOM 135 C GLU A 9 15.947 12.255 -19.718 1.00 0.00 C ATOM 136 O GLU A 9 16.391 13.100 -18.967 1.00 0.00 O ATOM 137 CB GLU A 9 14.523 12.744 -21.712 1.00 0.00 C ATOM 138 CG GLU A 9 14.552 13.757 -22.858 1.00 0.00 C ATOM 139 CD GLU A 9 13.162 13.858 -23.487 1.00 0.00 C ATOM 140 OE1 GLU A 9 12.381 14.672 -23.024 1.00 0.00 O ATOM 141 OE2 GLU A 9 12.902 13.118 -24.423 1.00 0.00 O ATOM 0 H GLU A 9 15.778 10.722 -22.436 1.00 0.00 H new ATOM 0 HA GLU A 9 16.587 13.321 -21.476 1.00 0.00 H new ATOM 0 HB2 GLU A 9 14.056 11.817 -22.044 1.00 0.00 H new ATOM 0 HB3 GLU A 9 13.920 13.128 -20.889 1.00 0.00 H new ATOM 0 HG2 GLU A 9 14.866 14.733 -22.487 1.00 0.00 H new ATOM 0 HG3 GLU A 9 15.281 13.452 -23.609 1.00 0.00 H new ATOM 148 N ILE A 10 15.448 11.136 -19.255 1.00 0.00 N ATOM 149 CA ILE A 10 15.425 10.896 -17.785 1.00 0.00 C ATOM 150 C ILE A 10 16.850 10.943 -17.239 1.00 0.00 C ATOM 151 O ILE A 10 17.133 11.632 -16.279 1.00 0.00 O ATOM 152 CB ILE A 10 14.809 9.525 -17.496 1.00 0.00 C ATOM 153 CG1 ILE A 10 13.644 9.262 -18.458 1.00 0.00 C ATOM 154 CG2 ILE A 10 14.296 9.491 -16.056 1.00 0.00 C ATOM 155 CD1 ILE A 10 12.793 10.526 -18.606 1.00 0.00 C ATOM 0 H ILE A 10 15.060 10.386 -19.827 1.00 0.00 H new ATOM 0 HA ILE A 10 14.826 11.668 -17.302 1.00 0.00 H new ATOM 0 HB ILE A 10 15.568 8.755 -17.634 1.00 0.00 H new ATOM 0 HG12 ILE A 10 14.027 8.955 -19.431 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.031 8.442 -18.084 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.857 8.515 -15.849 1.00 0.00 H new ATOM 0 HG22 ILE A 10 15.124 9.669 -15.370 1.00 0.00 H new ATOM 0 HG23 ILE A 10 13.540 10.265 -15.921 1.00 0.00 H new ATOM 0 HD11 ILE A 10 11.968 10.331 -19.291 1.00 0.00 H new ATOM 0 HD12 ILE A 10 12.396 10.814 -17.632 1.00 0.00 H new ATOM 0 HD13 ILE A 10 13.408 11.335 -19.000 1.00 0.00 H new ATOM 167 N ILE A 11 17.756 10.224 -17.841 1.00 0.00 N ATOM 168 CA ILE A 11 19.160 10.249 -17.348 1.00 0.00 C ATOM 169 C ILE A 11 19.655 11.693 -17.349 1.00 0.00 C ATOM 170 O ILE A 11 20.427 12.096 -16.502 1.00 0.00 O ATOM 171 CB ILE A 11 20.043 9.396 -18.263 1.00 0.00 C ATOM 172 CG1 ILE A 11 19.753 7.914 -18.013 1.00 0.00 C ATOM 173 CG2 ILE A 11 21.517 9.683 -17.966 1.00 0.00 C ATOM 174 CD1 ILE A 11 19.780 7.158 -19.342 1.00 0.00 C ATOM 0 H ILE A 11 17.586 9.624 -18.648 1.00 0.00 H new ATOM 0 HA ILE A 11 19.206 9.844 -16.337 1.00 0.00 H new ATOM 0 HB ILE A 11 19.829 9.640 -19.304 1.00 0.00 H new ATOM 0 HG12 ILE A 11 20.494 7.498 -17.330 1.00 0.00 H new ATOM 0 HG13 ILE A 11 18.780 7.798 -17.536 1.00 0.00 H new ATOM 0 HG21 ILE A 11 22.145 9.075 -18.618 1.00 0.00 H new ATOM 0 HG22 ILE A 11 21.725 10.738 -18.143 1.00 0.00 H new ATOM 0 HG23 ILE A 11 21.732 9.440 -16.925 1.00 0.00 H new ATOM 0 HD11 ILE A 11 19.574 6.103 -19.164 1.00 0.00 H new ATOM 0 HD12 ILE A 11 19.023 7.569 -20.010 1.00 0.00 H new ATOM 0 HD13 ILE A 11 20.763 7.263 -19.801 1.00 0.00 H new ATOM 186 N LYS A 12 19.211 12.477 -18.292 1.00 0.00 N ATOM 187 CA LYS A 12 19.647 13.899 -18.345 1.00 0.00 C ATOM 188 C LYS A 12 19.189 14.621 -17.074 1.00 0.00 C ATOM 189 O LYS A 12 19.900 15.440 -16.524 1.00 0.00 O ATOM 190 CB LYS A 12 19.023 14.576 -19.567 1.00 0.00 C ATOM 191 CG LYS A 12 20.122 15.230 -20.407 1.00 0.00 C ATOM 192 CD LYS A 12 20.132 14.611 -21.806 1.00 0.00 C ATOM 193 CE LYS A 12 21.431 14.983 -22.520 1.00 0.00 C ATOM 194 NZ LYS A 12 21.605 14.114 -23.719 1.00 0.00 N ATOM 0 H LYS A 12 18.565 12.193 -19.028 1.00 0.00 H new ATOM 0 HA LYS A 12 20.734 13.944 -18.417 1.00 0.00 H new ATOM 0 HB2 LYS A 12 18.482 13.843 -20.165 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.299 15.326 -19.250 1.00 0.00 H new ATOM 0 HG2 LYS A 12 19.952 16.305 -20.474 1.00 0.00 H new ATOM 0 HG3 LYS A 12 21.092 15.090 -19.929 1.00 0.00 H new ATOM 0 HD2 LYS A 12 20.041 13.527 -21.736 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.275 14.967 -22.379 1.00 0.00 H new ATOM 0 HE2 LYS A 12 21.408 16.031 -22.818 1.00 0.00 H new ATOM 0 HE3 LYS A 12 22.278 14.862 -21.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 22.489 14.367 -24.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 21.645 13.118 -23.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 20.802 14.251 -24.366 1.00 0.00 H new ATOM 208 N THR A 13 18.003 14.331 -16.603 1.00 0.00 N ATOM 209 CA THR A 13 17.504 15.006 -15.372 1.00 0.00 C ATOM 210 C THR A 13 18.291 14.513 -14.156 1.00 0.00 C ATOM 211 O THR A 13 18.747 15.295 -13.343 1.00 0.00 O ATOM 212 CB THR A 13 16.016 14.688 -15.189 1.00 0.00 C ATOM 213 OG1 THR A 13 15.259 15.429 -16.137 1.00 0.00 O ATOM 214 CG2 THR A 13 15.575 15.070 -13.774 1.00 0.00 C ATOM 0 H THR A 13 17.361 13.656 -17.019 1.00 0.00 H new ATOM 0 HA THR A 13 17.637 16.084 -15.468 1.00 0.00 H new ATOM 0 HB THR A 13 15.852 13.621 -15.340 1.00 0.00 H new ATOM 0 HG1 THR A 13 14.307 15.227 -16.025 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.516 14.842 -13.649 1.00 0.00 H new ATOM 0 HG22 THR A 13 16.157 14.504 -13.046 1.00 0.00 H new ATOM 0 HG23 THR A 13 15.737 16.136 -13.618 1.00 0.00 H new ATOM 222 N LEU A 14 18.456 13.228 -14.022 1.00 0.00 N ATOM 223 CA LEU A 14 19.215 12.696 -12.856 1.00 0.00 C ATOM 224 C LEU A 14 20.641 13.246 -12.888 1.00 0.00 C ATOM 225 O LEU A 14 21.280 13.407 -11.867 1.00 0.00 O ATOM 226 CB LEU A 14 19.263 11.168 -12.926 1.00 0.00 C ATOM 227 CG LEU A 14 17.849 10.611 -13.102 1.00 0.00 C ATOM 228 CD1 LEU A 14 17.914 9.282 -13.860 1.00 0.00 C ATOM 229 CD2 LEU A 14 17.217 10.384 -11.728 1.00 0.00 C ATOM 0 H LEU A 14 18.099 12.524 -14.668 1.00 0.00 H new ATOM 0 HA LEU A 14 18.721 13.002 -11.934 1.00 0.00 H new ATOM 0 HB2 LEU A 14 19.894 10.853 -13.757 1.00 0.00 H new ATOM 0 HB3 LEU A 14 19.711 10.767 -12.017 1.00 0.00 H new ATOM 0 HG LEU A 14 17.246 11.322 -13.667 1.00 0.00 H new ATOM 0 HD11 LEU A 14 16.907 8.885 -13.985 1.00 0.00 H new ATOM 0 HD12 LEU A 14 18.365 9.443 -14.839 1.00 0.00 H new ATOM 0 HD13 LEU A 14 18.517 8.570 -13.296 1.00 0.00 H new ATOM 0 HD21 LEU A 14 16.209 9.987 -11.852 1.00 0.00 H new ATOM 0 HD22 LEU A 14 17.820 9.673 -11.163 1.00 0.00 H new ATOM 0 HD23 LEU A 14 17.170 11.330 -11.188 1.00 0.00 H new ATOM 241 N ASN A 15 21.146 13.523 -14.057 1.00 0.00 N ATOM 242 CA ASN A 15 22.534 14.050 -14.171 1.00 0.00 C ATOM 243 C ASN A 15 22.599 15.493 -13.632 1.00 0.00 C ATOM 244 O ASN A 15 23.457 15.812 -12.837 1.00 0.00 O ATOM 245 CB ASN A 15 22.952 14.046 -15.643 1.00 0.00 C ATOM 246 CG ASN A 15 24.407 14.499 -15.761 1.00 0.00 C ATOM 247 OD1 ASN A 15 24.751 15.592 -15.358 1.00 0.00 O ATOM 248 ND2 ASN A 15 25.286 13.700 -16.303 1.00 0.00 N ATOM 0 H ASN A 15 20.654 13.406 -14.943 1.00 0.00 H new ATOM 0 HA ASN A 15 23.205 13.419 -13.588 1.00 0.00 H new ATOM 0 HB2 ASN A 15 22.836 13.047 -16.062 1.00 0.00 H new ATOM 0 HB3 ASN A 15 22.306 14.710 -16.217 1.00 0.00 H new ATOM 0 HD21 ASN A 15 26.259 13.994 -16.387 1.00 0.00 H new ATOM 0 HD22 ASN A 15 25.000 12.782 -16.642 1.00 0.00 H new ATOM 255 N SER A 16 21.716 16.380 -14.062 1.00 0.00 N ATOM 256 CA SER A 16 21.783 17.783 -13.559 1.00 0.00 C ATOM 257 C SER A 16 21.769 17.807 -12.027 1.00 0.00 C ATOM 258 O SER A 16 22.587 18.453 -11.403 1.00 0.00 O ATOM 259 CB SER A 16 20.580 18.567 -14.088 1.00 0.00 C ATOM 260 OG SER A 16 21.015 19.502 -15.063 1.00 0.00 O ATOM 0 H SER A 16 20.968 16.188 -14.728 1.00 0.00 H new ATOM 0 HA SER A 16 22.710 18.238 -13.909 1.00 0.00 H new ATOM 0 HB2 SER A 16 19.851 17.884 -14.524 1.00 0.00 H new ATOM 0 HB3 SER A 16 20.082 19.085 -13.269 1.00 0.00 H new ATOM 0 HG SER A 16 20.244 20.003 -15.403 1.00 0.00 H new ATOM 266 N LEU A 17 20.841 17.124 -11.415 1.00 0.00 N ATOM 267 CA LEU A 17 20.771 17.132 -9.923 1.00 0.00 C ATOM 268 C LEU A 17 22.128 16.760 -9.312 1.00 0.00 C ATOM 269 O LEU A 17 22.544 17.331 -8.324 1.00 0.00 O ATOM 270 CB LEU A 17 19.715 16.122 -9.460 1.00 0.00 C ATOM 271 CG LEU A 17 18.416 16.344 -10.240 1.00 0.00 C ATOM 272 CD1 LEU A 17 17.280 15.544 -9.592 1.00 0.00 C ATOM 273 CD2 LEU A 17 18.064 17.833 -10.226 1.00 0.00 C ATOM 0 H LEU A 17 20.129 16.561 -11.881 1.00 0.00 H new ATOM 0 HA LEU A 17 20.503 18.135 -9.593 1.00 0.00 H new ATOM 0 HB2 LEU A 17 20.076 15.105 -9.617 1.00 0.00 H new ATOM 0 HB3 LEU A 17 19.533 16.235 -8.391 1.00 0.00 H new ATOM 0 HG LEU A 17 18.550 16.009 -11.269 1.00 0.00 H new ATOM 0 HD11 LEU A 17 16.358 15.705 -10.150 1.00 0.00 H new ATOM 0 HD12 LEU A 17 17.530 14.483 -9.602 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.143 15.875 -8.562 1.00 0.00 H new ATOM 0 HD21 LEU A 17 17.140 17.994 -10.781 1.00 0.00 H new ATOM 0 HD22 LEU A 17 17.932 18.166 -9.197 1.00 0.00 H new ATOM 0 HD23 LEU A 17 18.869 18.402 -10.691 1.00 0.00 H new ATOM 285 N THR A 18 22.815 15.801 -9.871 1.00 0.00 N ATOM 286 CA THR A 18 24.132 15.397 -9.289 1.00 0.00 C ATOM 287 C THR A 18 25.175 16.486 -9.514 1.00 0.00 C ATOM 288 O THR A 18 25.947 16.820 -8.637 1.00 0.00 O ATOM 289 CB THR A 18 24.603 14.093 -9.938 1.00 0.00 C ATOM 290 OG1 THR A 18 23.593 13.103 -9.796 1.00 0.00 O ATOM 291 CG2 THR A 18 25.888 13.617 -9.258 1.00 0.00 C ATOM 0 H THR A 18 22.526 15.281 -10.700 1.00 0.00 H new ATOM 0 HA THR A 18 24.008 15.249 -8.216 1.00 0.00 H new ATOM 0 HB THR A 18 24.798 14.263 -10.997 1.00 0.00 H new ATOM 0 HG1 THR A 18 22.895 13.249 -10.468 1.00 0.00 H new ATOM 0 HG21 THR A 18 26.222 12.689 -9.721 1.00 0.00 H new ATOM 0 HG22 THR A 18 26.661 14.377 -9.369 1.00 0.00 H new ATOM 0 HG23 THR A 18 25.697 13.446 -8.199 1.00 0.00 H new ATOM 299 N GLU A 19 25.196 17.034 -10.679 1.00 0.00 N ATOM 300 CA GLU A 19 26.182 18.107 -10.990 1.00 0.00 C ATOM 301 C GLU A 19 26.137 19.149 -9.885 1.00 0.00 C ATOM 302 O GLU A 19 27.113 19.805 -9.577 1.00 0.00 O ATOM 303 CB GLU A 19 25.833 18.756 -12.331 1.00 0.00 C ATOM 304 CG GLU A 19 27.032 19.565 -12.834 1.00 0.00 C ATOM 305 CD GLU A 19 26.881 19.823 -14.333 1.00 0.00 C ATOM 306 OE1 GLU A 19 26.236 20.798 -14.685 1.00 0.00 O ATOM 307 OE2 GLU A 19 27.412 19.043 -15.106 1.00 0.00 O ATOM 0 H GLU A 19 24.569 16.789 -11.446 1.00 0.00 H new ATOM 0 HA GLU A 19 27.184 17.682 -11.055 1.00 0.00 H new ATOM 0 HB2 GLU A 19 25.566 17.990 -13.059 1.00 0.00 H new ATOM 0 HB3 GLU A 19 24.964 19.405 -12.218 1.00 0.00 H new ATOM 0 HG2 GLU A 19 27.097 20.511 -12.296 1.00 0.00 H new ATOM 0 HG3 GLU A 19 27.957 19.023 -12.639 1.00 0.00 H new ATOM 314 N GLN A 20 25.003 19.289 -9.288 1.00 0.00 N ATOM 315 CA GLN A 20 24.848 20.274 -8.178 1.00 0.00 C ATOM 316 C GLN A 20 23.803 19.763 -7.183 1.00 0.00 C ATOM 317 O GLN A 20 22.639 19.625 -7.503 1.00 0.00 O ATOM 318 CB GLN A 20 24.416 21.629 -8.743 1.00 0.00 C ATOM 319 CG GLN A 20 23.234 21.432 -9.684 1.00 0.00 C ATOM 320 CD GLN A 20 22.418 22.724 -9.761 1.00 0.00 C ATOM 321 OE1 GLN A 20 22.694 23.584 -10.575 1.00 0.00 O ATOM 322 NE2 GLN A 20 21.417 22.901 -8.942 1.00 0.00 N ATOM 0 H GLN A 20 24.160 18.762 -9.516 1.00 0.00 H new ATOM 0 HA GLN A 20 25.802 20.394 -7.665 1.00 0.00 H new ATOM 0 HB2 GLN A 20 24.140 22.303 -7.931 1.00 0.00 H new ATOM 0 HB3 GLN A 20 25.245 22.094 -9.276 1.00 0.00 H new ATOM 0 HG2 GLN A 20 23.589 21.154 -10.677 1.00 0.00 H new ATOM 0 HG3 GLN A 20 22.606 20.614 -9.330 1.00 0.00 H new ATOM 0 HE21 GLN A 20 21.184 22.181 -8.258 1.00 0.00 H new ATOM 0 HE22 GLN A 20 20.868 23.760 -8.986 1.00 0.00 H new ATOM 331 N LYS A 21 24.209 19.472 -5.976 1.00 0.00 N ATOM 332 CA LYS A 21 23.241 18.967 -4.970 1.00 0.00 C ATOM 333 C LYS A 21 23.576 19.581 -3.614 1.00 0.00 C ATOM 334 O LYS A 21 23.140 20.665 -3.282 1.00 0.00 O ATOM 335 CB LYS A 21 23.334 17.436 -4.911 1.00 0.00 C ATOM 336 CG LYS A 21 22.391 16.909 -3.826 1.00 0.00 C ATOM 337 CD LYS A 21 21.260 16.112 -4.479 1.00 0.00 C ATOM 338 CE LYS A 21 20.214 15.750 -3.423 1.00 0.00 C ATOM 339 NZ LYS A 21 20.067 14.268 -3.356 1.00 0.00 N ATOM 0 H LYS A 21 25.170 19.563 -5.647 1.00 0.00 H new ATOM 0 HA LYS A 21 22.223 19.245 -5.243 1.00 0.00 H new ATOM 0 HB2 LYS A 21 23.069 17.007 -5.878 1.00 0.00 H new ATOM 0 HB3 LYS A 21 24.358 17.131 -4.697 1.00 0.00 H new ATOM 0 HG2 LYS A 21 22.940 16.277 -3.127 1.00 0.00 H new ATOM 0 HG3 LYS A 21 21.981 17.739 -3.251 1.00 0.00 H new ATOM 0 HD2 LYS A 21 20.801 16.698 -5.275 1.00 0.00 H new ATOM 0 HD3 LYS A 21 21.657 15.207 -4.938 1.00 0.00 H new ATOM 0 HE2 LYS A 21 20.513 16.141 -2.450 1.00 0.00 H new ATOM 0 HE3 LYS A 21 19.257 16.210 -3.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.561 14.008 -2.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.529 13.935 -4.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 21.008 13.826 -3.354 1.00 0.00 H new ATOM 353 N THR A 22 24.360 18.902 -2.840 1.00 0.00 N ATOM 354 CA THR A 22 24.754 19.436 -1.504 1.00 0.00 C ATOM 355 C THR A 22 23.517 19.933 -0.727 1.00 0.00 C ATOM 356 O THR A 22 23.651 20.659 0.237 1.00 0.00 O ATOM 357 CB THR A 22 25.712 20.612 -1.707 1.00 0.00 C ATOM 358 OG1 THR A 22 24.964 21.787 -1.991 1.00 0.00 O ATOM 359 CG2 THR A 22 26.652 20.310 -2.876 1.00 0.00 C ATOM 0 H THR A 22 24.753 17.990 -3.072 1.00 0.00 H new ATOM 0 HA THR A 22 25.232 18.640 -0.934 1.00 0.00 H new ATOM 0 HB THR A 22 26.298 20.764 -0.801 1.00 0.00 H new ATOM 0 HG1 THR A 22 24.385 21.627 -2.765 1.00 0.00 H new ATOM 0 HG21 THR A 22 27.334 21.148 -3.020 1.00 0.00 H new ATOM 0 HG22 THR A 22 27.225 19.409 -2.659 1.00 0.00 H new ATOM 0 HG23 THR A 22 26.067 20.158 -3.783 1.00 0.00 H new ATOM 367 N LEU A 23 22.312 19.564 -1.117 1.00 0.00 N ATOM 368 CA LEU A 23 21.127 20.051 -0.365 1.00 0.00 C ATOM 369 C LEU A 23 20.932 19.190 0.872 1.00 0.00 C ATOM 370 O LEU A 23 21.409 19.494 1.949 1.00 0.00 O ATOM 371 CB LEU A 23 19.887 19.973 -1.263 1.00 0.00 C ATOM 372 CG LEU A 23 18.635 20.304 -0.447 1.00 0.00 C ATOM 373 CD1 LEU A 23 18.223 21.754 -0.713 1.00 0.00 C ATOM 374 CD2 LEU A 23 17.496 19.369 -0.857 1.00 0.00 C ATOM 0 H LEU A 23 22.111 18.957 -1.911 1.00 0.00 H new ATOM 0 HA LEU A 23 21.280 21.086 -0.060 1.00 0.00 H new ATOM 0 HB2 LEU A 23 19.985 20.670 -2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 23 19.799 18.975 -1.692 1.00 0.00 H new ATOM 0 HG LEU A 23 18.848 20.174 0.614 1.00 0.00 H new ATOM 0 HD11 LEU A 23 17.331 21.991 -0.133 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.034 22.422 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 23 18.010 21.883 -1.774 1.00 0.00 H new ATOM 0 HD21 LEU A 23 16.605 19.605 -0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 23 17.282 19.499 -1.918 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.788 18.336 -0.670 1.00 0.00 H new ATOM 386 N CYS A 24 20.236 18.123 0.714 1.00 0.00 N ATOM 387 CA CYS A 24 19.983 17.204 1.853 1.00 0.00 C ATOM 388 C CYS A 24 20.695 15.872 1.587 1.00 0.00 C ATOM 389 O CYS A 24 21.780 15.648 2.078 1.00 0.00 O ATOM 390 CB CYS A 24 18.480 17.000 2.000 1.00 0.00 C ATOM 391 SG CYS A 24 18.066 16.966 3.760 1.00 0.00 S ATOM 0 H CYS A 24 19.818 17.833 -0.170 1.00 0.00 H new ATOM 0 HA CYS A 24 20.370 17.626 2.781 1.00 0.00 H new ATOM 0 HB2 CYS A 24 17.939 17.804 1.501 1.00 0.00 H new ATOM 0 HB3 CYS A 24 18.177 16.068 1.523 1.00 0.00 H new ATOM 396 N THR A 25 20.117 15.002 0.792 1.00 0.00 N ATOM 397 CA THR A 25 20.785 13.694 0.482 1.00 0.00 C ATOM 398 C THR A 25 20.731 12.736 1.696 1.00 0.00 C ATOM 399 O THR A 25 20.061 11.724 1.644 1.00 0.00 O ATOM 400 CB THR A 25 22.244 13.932 0.053 1.00 0.00 C ATOM 401 OG1 THR A 25 23.107 13.838 1.174 1.00 0.00 O ATOM 402 CG2 THR A 25 22.378 15.320 -0.579 1.00 0.00 C ATOM 0 H THR A 25 19.211 15.140 0.344 1.00 0.00 H new ATOM 0 HA THR A 25 20.245 13.224 -0.340 1.00 0.00 H new ATOM 0 HB THR A 25 22.523 13.171 -0.676 1.00 0.00 H new ATOM 0 HG1 THR A 25 23.108 14.690 1.659 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.412 15.484 -0.881 1.00 0.00 H new ATOM 0 HG22 THR A 25 21.730 15.386 -1.453 1.00 0.00 H new ATOM 0 HG23 THR A 25 22.087 16.080 0.146 1.00 0.00 H new ATOM 410 N GLU A 26 21.427 13.023 2.781 1.00 0.00 N ATOM 411 CA GLU A 26 21.400 12.111 3.961 1.00 0.00 C ATOM 412 C GLU A 26 19.989 11.559 4.181 1.00 0.00 C ATOM 413 O GLU A 26 19.821 10.492 4.738 1.00 0.00 O ATOM 414 CB GLU A 26 21.841 12.881 5.207 1.00 0.00 C ATOM 415 CG GLU A 26 21.723 11.976 6.436 1.00 0.00 C ATOM 416 CD GLU A 26 20.470 12.353 7.230 1.00 0.00 C ATOM 417 OE1 GLU A 26 20.232 13.538 7.395 1.00 0.00 O ATOM 418 OE2 GLU A 26 19.772 11.450 7.662 1.00 0.00 O ATOM 0 H GLU A 26 22.010 13.852 2.891 1.00 0.00 H new ATOM 0 HA GLU A 26 22.079 11.279 3.777 1.00 0.00 H new ATOM 0 HB2 GLU A 26 22.870 13.222 5.091 1.00 0.00 H new ATOM 0 HB3 GLU A 26 21.223 13.769 5.336 1.00 0.00 H new ATOM 0 HG2 GLU A 26 21.671 10.932 6.128 1.00 0.00 H new ATOM 0 HG3 GLU A 26 22.609 12.079 7.063 1.00 0.00 H new ATOM 425 N LEU A 27 18.977 12.273 3.754 1.00 0.00 N ATOM 426 CA LEU A 27 17.582 11.778 3.942 1.00 0.00 C ATOM 427 C LEU A 27 17.539 10.270 3.687 1.00 0.00 C ATOM 428 O LEU A 27 18.410 9.723 3.042 1.00 0.00 O ATOM 429 CB LEU A 27 16.646 12.492 2.967 1.00 0.00 C ATOM 430 CG LEU A 27 16.591 14.005 3.252 1.00 0.00 C ATOM 431 CD1 LEU A 27 15.147 14.478 3.109 1.00 0.00 C ATOM 432 CD2 LEU A 27 17.084 14.341 4.666 1.00 0.00 C ATOM 0 H LEU A 27 19.058 13.175 3.285 1.00 0.00 H new ATOM 0 HA LEU A 27 17.259 11.983 4.963 1.00 0.00 H new ATOM 0 HB2 LEU A 27 16.985 12.324 1.945 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.645 12.068 3.044 1.00 0.00 H new ATOM 0 HG LEU A 27 17.245 14.508 2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.093 15.548 3.308 1.00 0.00 H new ATOM 0 HD12 LEU A 27 14.798 14.280 2.096 1.00 0.00 H new ATOM 0 HD13 LEU A 27 14.517 13.944 3.821 1.00 0.00 H new ATOM 0 HD21 LEU A 27 17.028 15.418 4.824 1.00 0.00 H new ATOM 0 HD22 LEU A 27 16.458 13.833 5.400 1.00 0.00 H new ATOM 0 HD23 LEU A 27 18.116 14.011 4.779 1.00 0.00 H new ATOM 444 N THR A 28 16.551 9.587 4.199 1.00 0.00 N ATOM 445 CA THR A 28 16.492 8.114 3.989 1.00 0.00 C ATOM 446 C THR A 28 15.283 7.734 3.129 1.00 0.00 C ATOM 447 O THR A 28 14.164 8.118 3.404 1.00 0.00 O ATOM 448 CB THR A 28 16.386 7.415 5.348 1.00 0.00 C ATOM 449 OG1 THR A 28 15.272 7.936 6.058 1.00 0.00 O ATOM 450 CG2 THR A 28 17.664 7.657 6.149 1.00 0.00 C ATOM 0 H THR A 28 15.788 9.982 4.749 1.00 0.00 H new ATOM 0 HA THR A 28 17.399 7.799 3.472 1.00 0.00 H new ATOM 0 HB THR A 28 16.254 6.343 5.198 1.00 0.00 H new ATOM 0 HG1 THR A 28 14.618 8.295 5.423 1.00 0.00 H new ATOM 0 HG21 THR A 28 17.587 7.159 7.116 1.00 0.00 H new ATOM 0 HG22 THR A 28 18.518 7.257 5.602 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.800 8.728 6.302 1.00 0.00 H new ATOM 458 N VAL A 29 15.505 6.957 2.101 1.00 0.00 N ATOM 459 CA VAL A 29 14.374 6.521 1.229 1.00 0.00 C ATOM 460 C VAL A 29 14.381 4.994 1.144 1.00 0.00 C ATOM 461 O VAL A 29 15.394 4.353 1.344 1.00 0.00 O ATOM 462 CB VAL A 29 14.522 7.104 -0.186 1.00 0.00 C ATOM 463 CG1 VAL A 29 13.677 8.374 -0.343 1.00 0.00 C ATOM 464 CG2 VAL A 29 15.986 7.444 -0.465 1.00 0.00 C ATOM 0 H VAL A 29 16.422 6.605 1.827 1.00 0.00 H new ATOM 0 HA VAL A 29 13.437 6.878 1.657 1.00 0.00 H new ATOM 0 HB VAL A 29 14.175 6.353 -0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 29 13.797 8.769 -1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 29 12.627 8.137 -0.169 1.00 0.00 H new ATOM 0 HG13 VAL A 29 14.005 9.121 0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 29 16.079 7.856 -1.470 1.00 0.00 H new ATOM 0 HG22 VAL A 29 16.334 8.178 0.262 1.00 0.00 H new ATOM 0 HG23 VAL A 29 16.591 6.541 -0.386 1.00 0.00 H new ATOM 474 N THR A 30 13.254 4.408 0.852 1.00 0.00 N ATOM 475 CA THR A 30 13.182 2.923 0.755 1.00 0.00 C ATOM 476 C THR A 30 14.316 2.408 -0.136 1.00 0.00 C ATOM 477 O THR A 30 14.465 2.822 -1.268 1.00 0.00 O ATOM 478 CB THR A 30 11.836 2.518 0.151 1.00 0.00 C ATOM 479 OG1 THR A 30 10.790 3.204 0.826 1.00 0.00 O ATOM 480 CG2 THR A 30 11.639 1.010 0.302 1.00 0.00 C ATOM 0 H THR A 30 12.376 4.896 0.676 1.00 0.00 H new ATOM 0 HA THR A 30 13.281 2.491 1.751 1.00 0.00 H new ATOM 0 HB THR A 30 11.820 2.780 -0.907 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.927 2.947 0.439 1.00 0.00 H new ATOM 0 HG21 THR A 30 10.680 0.723 -0.129 1.00 0.00 H new ATOM 0 HG22 THR A 30 12.441 0.485 -0.216 1.00 0.00 H new ATOM 0 HG23 THR A 30 11.656 0.745 1.359 1.00 0.00 H new ATOM 488 N ASP A 31 15.113 1.502 0.364 1.00 0.00 N ATOM 489 CA ASP A 31 16.230 0.958 -0.458 1.00 0.00 C ATOM 490 C ASP A 31 15.680 -0.100 -1.419 1.00 0.00 C ATOM 491 O ASP A 31 15.820 -1.287 -1.200 1.00 0.00 O ATOM 492 CB ASP A 31 17.282 0.329 0.460 1.00 0.00 C ATOM 493 CG ASP A 31 16.684 -0.885 1.172 1.00 0.00 C ATOM 494 OD1 ASP A 31 15.739 -0.703 1.923 1.00 0.00 O ATOM 495 OD2 ASP A 31 17.181 -1.978 0.955 1.00 0.00 O ATOM 0 H ASP A 31 15.038 1.116 1.305 1.00 0.00 H new ATOM 0 HA ASP A 31 16.691 1.763 -1.030 1.00 0.00 H new ATOM 0 HB2 ASP A 31 18.154 0.029 -0.122 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.624 1.060 1.192 1.00 0.00 H new ATOM 500 N ILE A 32 15.045 0.323 -2.476 1.00 0.00 N ATOM 501 CA ILE A 32 14.470 -0.655 -3.449 1.00 0.00 C ATOM 502 C ILE A 32 15.546 -1.100 -4.442 1.00 0.00 C ATOM 503 O ILE A 32 15.280 -1.272 -5.615 1.00 0.00 O ATOM 504 CB ILE A 32 13.327 0.018 -4.221 1.00 0.00 C ATOM 505 CG1 ILE A 32 13.911 1.093 -5.144 1.00 0.00 C ATOM 506 CG2 ILE A 32 12.366 0.672 -3.230 1.00 0.00 C ATOM 507 CD1 ILE A 32 13.696 0.686 -6.603 1.00 0.00 C ATOM 0 H ILE A 32 14.898 1.305 -2.711 1.00 0.00 H new ATOM 0 HA ILE A 32 14.098 -1.524 -2.906 1.00 0.00 H new ATOM 0 HB ILE A 32 12.793 -0.726 -4.812 1.00 0.00 H new ATOM 0 HG12 ILE A 32 13.433 2.053 -4.949 1.00 0.00 H new ATOM 0 HG13 ILE A 32 14.975 1.220 -4.944 1.00 0.00 H new ATOM 0 HG21 ILE A 32 11.552 1.151 -3.774 1.00 0.00 H new ATOM 0 HG22 ILE A 32 11.958 -0.088 -2.563 1.00 0.00 H new ATOM 0 HG23 ILE A 32 12.901 1.420 -2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 32 14.111 1.451 -7.259 1.00 0.00 H new ATOM 0 HD12 ILE A 32 14.194 -0.265 -6.793 1.00 0.00 H new ATOM 0 HD13 ILE A 32 12.629 0.581 -6.798 1.00 0.00 H new ATOM 519 N PHE A 33 16.753 -1.292 -3.994 1.00 0.00 N ATOM 520 CA PHE A 33 17.821 -1.726 -4.933 1.00 0.00 C ATOM 521 C PHE A 33 18.612 -2.877 -4.312 1.00 0.00 C ATOM 522 O PHE A 33 18.272 -4.031 -4.480 1.00 0.00 O ATOM 523 CB PHE A 33 18.759 -0.552 -5.216 1.00 0.00 C ATOM 524 CG PHE A 33 18.054 0.446 -6.105 1.00 0.00 C ATOM 525 CD1 PHE A 33 17.330 0.001 -7.216 1.00 0.00 C ATOM 526 CD2 PHE A 33 18.123 1.814 -5.816 1.00 0.00 C ATOM 527 CE1 PHE A 33 16.675 0.923 -8.042 1.00 0.00 C ATOM 528 CE2 PHE A 33 17.468 2.737 -6.640 1.00 0.00 C ATOM 529 CZ PHE A 33 16.744 2.292 -7.754 1.00 0.00 C ATOM 0 H PHE A 33 17.045 -1.168 -3.025 1.00 0.00 H new ATOM 0 HA PHE A 33 17.369 -2.062 -5.866 1.00 0.00 H new ATOM 0 HB2 PHE A 33 19.058 -0.077 -4.282 1.00 0.00 H new ATOM 0 HB3 PHE A 33 19.670 -0.907 -5.699 1.00 0.00 H new ATOM 0 HD1 PHE A 33 17.276 -1.055 -7.437 1.00 0.00 H new ATOM 0 HD2 PHE A 33 18.681 2.157 -4.958 1.00 0.00 H new ATOM 0 HE1 PHE A 33 16.117 0.579 -8.900 1.00 0.00 H new ATOM 0 HE2 PHE A 33 17.521 3.792 -6.417 1.00 0.00 H new ATOM 0 HZ PHE A 33 16.239 3.004 -8.390 1.00 0.00 H new ATOM 539 N ALA A 34 19.661 -2.564 -3.598 1.00 0.00 N ATOM 540 CA ALA A 34 20.493 -3.629 -2.960 1.00 0.00 C ATOM 541 C ALA A 34 20.579 -4.840 -3.884 1.00 0.00 C ATOM 542 O ALA A 34 20.633 -5.972 -3.446 1.00 0.00 O ATOM 543 CB ALA A 34 19.868 -4.041 -1.626 1.00 0.00 C ATOM 0 H ALA A 34 19.980 -1.610 -3.428 1.00 0.00 H new ATOM 0 HA ALA A 34 21.496 -3.242 -2.783 1.00 0.00 H new ATOM 0 HB1 ALA A 34 20.477 -4.818 -1.163 1.00 0.00 H new ATOM 0 HB2 ALA A 34 19.819 -3.176 -0.965 1.00 0.00 H new ATOM 0 HB3 ALA A 34 18.862 -4.423 -1.798 1.00 0.00 H new ATOM 549 N ALA A 35 20.586 -4.597 -5.164 1.00 0.00 N ATOM 550 CA ALA A 35 20.658 -5.703 -6.151 1.00 0.00 C ATOM 551 C ALA A 35 20.120 -5.189 -7.483 1.00 0.00 C ATOM 552 O ALA A 35 18.934 -5.231 -7.741 1.00 0.00 O ATOM 553 CB ALA A 35 19.802 -6.882 -5.678 1.00 0.00 C ATOM 0 H ALA A 35 20.544 -3.663 -5.572 1.00 0.00 H new ATOM 0 HA ALA A 35 21.689 -6.039 -6.259 1.00 0.00 H new ATOM 0 HB1 ALA A 35 19.860 -7.690 -6.408 1.00 0.00 H new ATOM 0 HB2 ALA A 35 20.170 -7.236 -4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 35 18.766 -6.561 -5.574 1.00 0.00 H new ATOM 559 N SER A 36 20.980 -4.688 -8.328 1.00 0.00 N ATOM 560 CA SER A 36 20.501 -4.155 -9.639 1.00 0.00 C ATOM 561 C SER A 36 20.084 -5.292 -10.567 1.00 0.00 C ATOM 562 O SER A 36 19.727 -5.081 -11.709 1.00 0.00 O ATOM 563 CB SER A 36 21.602 -3.322 -10.297 1.00 0.00 C ATOM 564 OG SER A 36 22.408 -4.161 -11.111 1.00 0.00 O ATOM 0 H SER A 36 21.986 -4.624 -8.171 1.00 0.00 H new ATOM 0 HA SER A 36 19.632 -3.523 -9.457 1.00 0.00 H new ATOM 0 HB2 SER A 36 21.161 -2.528 -10.899 1.00 0.00 H new ATOM 0 HB3 SER A 36 22.214 -2.841 -9.534 1.00 0.00 H new ATOM 0 HG SER A 36 23.113 -3.627 -11.534 1.00 0.00 H new ATOM 570 N LYS A 37 20.109 -6.485 -10.078 1.00 0.00 N ATOM 571 CA LYS A 37 19.700 -7.649 -10.903 1.00 0.00 C ATOM 572 C LYS A 37 18.477 -8.317 -10.262 1.00 0.00 C ATOM 573 O LYS A 37 18.263 -9.503 -10.407 1.00 0.00 O ATOM 574 CB LYS A 37 20.854 -8.648 -10.966 1.00 0.00 C ATOM 575 CG LYS A 37 20.782 -9.428 -12.281 1.00 0.00 C ATOM 576 CD LYS A 37 21.585 -10.726 -12.150 1.00 0.00 C ATOM 577 CE LYS A 37 22.512 -10.877 -13.357 1.00 0.00 C ATOM 578 NZ LYS A 37 23.431 -12.029 -13.137 1.00 0.00 N ATOM 0 H LYS A 37 20.399 -6.713 -9.127 1.00 0.00 H new ATOM 0 HA LYS A 37 19.447 -7.319 -11.911 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.807 -8.124 -10.893 1.00 0.00 H new ATOM 0 HB3 LYS A 37 20.802 -9.334 -10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 37 19.744 -9.653 -12.526 1.00 0.00 H new ATOM 0 HG3 LYS A 37 21.178 -8.823 -13.097 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.168 -10.714 -11.229 1.00 0.00 H new ATOM 0 HD3 LYS A 37 20.910 -11.579 -12.088 1.00 0.00 H new ATOM 0 HE2 LYS A 37 21.925 -11.034 -14.262 1.00 0.00 H new ATOM 0 HE3 LYS A 37 23.087 -9.963 -13.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 24.061 -12.132 -13.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 24.000 -11.861 -12.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 22.874 -12.899 -13.017 1.00 0.00 H new ATOM 592 N ASN A 38 17.676 -7.565 -9.548 1.00 0.00 N ATOM 593 CA ASN A 38 16.479 -8.168 -8.898 1.00 0.00 C ATOM 594 C ASN A 38 15.508 -8.672 -9.970 1.00 0.00 C ATOM 595 O ASN A 38 15.157 -9.834 -10.003 1.00 0.00 O ATOM 596 CB ASN A 38 15.781 -7.111 -8.039 1.00 0.00 C ATOM 597 CG ASN A 38 15.503 -7.688 -6.649 1.00 0.00 C ATOM 598 OD1 ASN A 38 16.378 -8.258 -6.029 1.00 0.00 O ATOM 599 ND2 ASN A 38 14.311 -7.564 -6.132 1.00 0.00 N ATOM 0 H ASN A 38 17.801 -6.565 -9.390 1.00 0.00 H new ATOM 0 HA ASN A 38 16.791 -9.003 -8.271 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.406 -6.222 -7.957 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.848 -6.802 -8.510 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.114 -7.946 -5.207 1.00 0.00 H new ATOM 0 HD22 ASN A 38 13.576 -7.085 -6.653 1.00 0.00 H new ATOM 606 N THR A 39 15.068 -7.807 -10.842 1.00 0.00 N ATOM 607 CA THR A 39 14.118 -8.242 -11.903 1.00 0.00 C ATOM 608 C THR A 39 14.145 -7.239 -13.060 1.00 0.00 C ATOM 609 O THR A 39 15.006 -6.385 -13.134 1.00 0.00 O ATOM 610 CB THR A 39 12.705 -8.320 -11.316 1.00 0.00 C ATOM 611 OG1 THR A 39 11.868 -9.063 -12.190 1.00 0.00 O ATOM 612 CG2 THR A 39 12.138 -6.909 -11.139 1.00 0.00 C ATOM 0 H THR A 39 15.325 -6.820 -10.865 1.00 0.00 H new ATOM 0 HA THR A 39 14.410 -9.224 -12.276 1.00 0.00 H new ATOM 0 HB THR A 39 12.746 -8.814 -10.345 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.965 -9.114 -11.813 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.133 -6.970 -10.721 1.00 0.00 H new ATOM 0 HG22 THR A 39 12.778 -6.342 -10.463 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.099 -6.409 -12.107 1.00 0.00 H new ATOM 620 N THR A 40 13.209 -7.340 -13.967 1.00 0.00 N ATOM 621 CA THR A 40 13.179 -6.397 -15.121 1.00 0.00 C ATOM 622 C THR A 40 13.469 -4.976 -14.633 1.00 0.00 C ATOM 623 O THR A 40 12.957 -4.538 -13.622 1.00 0.00 O ATOM 624 CB THR A 40 11.795 -6.435 -15.773 1.00 0.00 C ATOM 625 OG1 THR A 40 10.852 -6.961 -14.850 1.00 0.00 O ATOM 626 CG2 THR A 40 11.841 -7.321 -17.020 1.00 0.00 C ATOM 0 H THR A 40 12.464 -8.036 -13.957 1.00 0.00 H new ATOM 0 HA THR A 40 13.936 -6.692 -15.848 1.00 0.00 H new ATOM 0 HB THR A 40 11.499 -5.425 -16.058 1.00 0.00 H new ATOM 0 HG1 THR A 40 9.965 -6.984 -15.266 1.00 0.00 H new ATOM 0 HG21 THR A 40 10.855 -7.348 -17.484 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.564 -6.916 -17.728 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.137 -8.331 -16.738 1.00 0.00 H new ATOM 634 N GLU A 41 14.290 -4.252 -15.345 1.00 0.00 N ATOM 635 CA GLU A 41 14.613 -2.861 -14.922 1.00 0.00 C ATOM 636 C GLU A 41 13.320 -2.048 -14.822 1.00 0.00 C ATOM 637 O GLU A 41 13.133 -1.275 -13.904 1.00 0.00 O ATOM 638 CB GLU A 41 15.545 -2.219 -15.953 1.00 0.00 C ATOM 639 CG GLU A 41 16.754 -3.129 -16.183 1.00 0.00 C ATOM 640 CD GLU A 41 17.323 -3.580 -14.837 1.00 0.00 C ATOM 641 OE1 GLU A 41 17.801 -2.730 -14.104 1.00 0.00 O ATOM 642 OE2 GLU A 41 17.270 -4.767 -14.561 1.00 0.00 O ATOM 0 H GLU A 41 14.750 -4.564 -16.200 1.00 0.00 H new ATOM 0 HA GLU A 41 15.106 -2.879 -13.950 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.013 -2.059 -16.891 1.00 0.00 H new ATOM 0 HB3 GLU A 41 15.874 -1.241 -15.603 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.461 -3.997 -16.774 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.517 -2.599 -16.752 1.00 0.00 H new ATOM 649 N LYS A 42 12.425 -2.219 -15.755 1.00 0.00 N ATOM 650 CA LYS A 42 11.146 -1.456 -15.704 1.00 0.00 C ATOM 651 C LYS A 42 10.493 -1.654 -14.333 1.00 0.00 C ATOM 652 O LYS A 42 9.852 -0.767 -13.806 1.00 0.00 O ATOM 653 CB LYS A 42 10.202 -1.968 -16.794 1.00 0.00 C ATOM 654 CG LYS A 42 10.619 -1.381 -18.144 1.00 0.00 C ATOM 655 CD LYS A 42 10.940 -2.516 -19.118 1.00 0.00 C ATOM 656 CE LYS A 42 10.438 -2.148 -20.515 1.00 0.00 C ATOM 657 NZ LYS A 42 11.556 -2.274 -21.493 1.00 0.00 N ATOM 0 H LYS A 42 12.523 -2.852 -16.549 1.00 0.00 H new ATOM 0 HA LYS A 42 11.347 -0.397 -15.865 1.00 0.00 H new ATOM 0 HB2 LYS A 42 10.231 -3.057 -16.834 1.00 0.00 H new ATOM 0 HB3 LYS A 42 9.175 -1.685 -16.563 1.00 0.00 H new ATOM 0 HG2 LYS A 42 9.818 -0.759 -18.545 1.00 0.00 H new ATOM 0 HG3 LYS A 42 11.490 -0.738 -18.019 1.00 0.00 H new ATOM 0 HD2 LYS A 42 12.015 -2.696 -19.142 1.00 0.00 H new ATOM 0 HD3 LYS A 42 10.470 -3.441 -18.783 1.00 0.00 H new ATOM 0 HE2 LYS A 42 9.614 -2.802 -20.801 1.00 0.00 H new ATOM 0 HE3 LYS A 42 10.051 -1.129 -20.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 11.216 -2.024 -22.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 12.328 -1.632 -21.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 11.905 -3.254 -21.497 1.00 0.00 H new ATOM 671 N GLU A 43 10.656 -2.811 -13.751 1.00 0.00 N ATOM 672 CA GLU A 43 10.048 -3.064 -12.414 1.00 0.00 C ATOM 673 C GLU A 43 10.778 -2.236 -11.357 1.00 0.00 C ATOM 674 O GLU A 43 10.164 -1.647 -10.490 1.00 0.00 O ATOM 675 CB GLU A 43 10.166 -4.551 -12.072 1.00 0.00 C ATOM 676 CG GLU A 43 9.235 -4.881 -10.903 1.00 0.00 C ATOM 677 CD GLU A 43 9.931 -4.537 -9.584 1.00 0.00 C ATOM 678 OE1 GLU A 43 10.890 -5.215 -9.249 1.00 0.00 O ATOM 679 OE2 GLU A 43 9.493 -3.604 -8.931 1.00 0.00 O ATOM 0 H GLU A 43 11.183 -3.591 -14.143 1.00 0.00 H new ATOM 0 HA GLU A 43 8.996 -2.780 -12.434 1.00 0.00 H new ATOM 0 HB2 GLU A 43 9.906 -5.157 -12.940 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.196 -4.794 -11.811 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.306 -4.318 -10.994 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.970 -5.938 -10.922 1.00 0.00 H new ATOM 686 N THR A 44 12.082 -2.173 -11.418 1.00 0.00 N ATOM 687 CA THR A 44 12.813 -1.360 -10.401 1.00 0.00 C ATOM 688 C THR A 44 12.376 0.090 -10.552 1.00 0.00 C ATOM 689 O THR A 44 12.359 0.851 -9.614 1.00 0.00 O ATOM 690 CB THR A 44 14.342 -1.476 -10.573 1.00 0.00 C ATOM 691 OG1 THR A 44 14.971 -1.154 -9.340 1.00 0.00 O ATOM 692 CG2 THR A 44 14.836 -0.509 -11.656 1.00 0.00 C ATOM 0 H THR A 44 12.664 -2.639 -12.114 1.00 0.00 H new ATOM 0 HA THR A 44 12.574 -1.732 -9.405 1.00 0.00 H new ATOM 0 HB THR A 44 14.589 -2.495 -10.871 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.938 -1.288 -9.422 1.00 0.00 H new ATOM 0 HG21 THR A 44 15.916 -0.604 -11.764 1.00 0.00 H new ATOM 0 HG22 THR A 44 14.354 -0.748 -12.604 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.589 0.514 -11.371 1.00 0.00 H new ATOM 700 N PHE A 45 12.024 0.465 -11.741 1.00 0.00 N ATOM 701 CA PHE A 45 11.569 1.860 -11.992 1.00 0.00 C ATOM 702 C PHE A 45 10.185 2.069 -11.370 1.00 0.00 C ATOM 703 O PHE A 45 9.851 3.147 -10.921 1.00 0.00 O ATOM 704 CB PHE A 45 11.503 2.109 -13.495 1.00 0.00 C ATOM 705 CG PHE A 45 12.928 2.184 -14.054 1.00 0.00 C ATOM 706 CD1 PHE A 45 13.942 2.852 -13.336 1.00 0.00 C ATOM 707 CD2 PHE A 45 13.246 1.578 -15.284 1.00 0.00 C ATOM 708 CE1 PHE A 45 15.244 2.909 -13.845 1.00 0.00 C ATOM 709 CE2 PHE A 45 14.552 1.640 -15.784 1.00 0.00 C ATOM 710 CZ PHE A 45 15.547 2.305 -15.066 1.00 0.00 C ATOM 0 H PHE A 45 12.031 -0.139 -12.563 1.00 0.00 H new ATOM 0 HA PHE A 45 12.273 2.560 -11.541 1.00 0.00 H new ATOM 0 HB2 PHE A 45 10.949 1.308 -13.985 1.00 0.00 H new ATOM 0 HB3 PHE A 45 10.970 3.037 -13.699 1.00 0.00 H new ATOM 0 HD1 PHE A 45 13.713 3.321 -12.391 1.00 0.00 H new ATOM 0 HD2 PHE A 45 12.479 1.063 -15.844 1.00 0.00 H new ATOM 0 HE1 PHE A 45 16.017 3.422 -13.291 1.00 0.00 H new ATOM 0 HE2 PHE A 45 14.790 1.172 -16.728 1.00 0.00 H new ATOM 0 HZ PHE A 45 16.553 2.352 -15.456 1.00 0.00 H new ATOM 720 N CYS A 46 9.371 1.043 -11.350 1.00 0.00 N ATOM 721 CA CYS A 46 8.006 1.181 -10.772 1.00 0.00 C ATOM 722 C CYS A 46 8.100 1.335 -9.249 1.00 0.00 C ATOM 723 O CYS A 46 7.531 2.239 -8.670 1.00 0.00 O ATOM 724 CB CYS A 46 7.192 -0.073 -11.127 1.00 0.00 C ATOM 725 SG CYS A 46 5.713 -0.182 -10.084 1.00 0.00 S ATOM 0 H CYS A 46 9.597 0.116 -11.710 1.00 0.00 H new ATOM 0 HA CYS A 46 7.516 2.065 -11.181 1.00 0.00 H new ATOM 0 HB2 CYS A 46 6.903 -0.041 -12.177 1.00 0.00 H new ATOM 0 HB3 CYS A 46 7.806 -0.963 -10.992 1.00 0.00 H new ATOM 730 N ARG A 47 8.813 0.460 -8.600 1.00 0.00 N ATOM 731 CA ARG A 47 8.944 0.551 -7.118 1.00 0.00 C ATOM 732 C ARG A 47 9.820 1.751 -6.748 1.00 0.00 C ATOM 733 O ARG A 47 9.630 2.389 -5.733 1.00 0.00 O ATOM 734 CB ARG A 47 9.597 -0.731 -6.600 1.00 0.00 C ATOM 735 CG ARG A 47 9.143 -1.003 -5.163 1.00 0.00 C ATOM 736 CD ARG A 47 9.250 0.278 -4.336 1.00 0.00 C ATOM 737 NE ARG A 47 9.041 -0.042 -2.896 1.00 0.00 N ATOM 738 CZ ARG A 47 7.917 0.275 -2.314 1.00 0.00 C ATOM 739 NH1 ARG A 47 6.818 0.353 -3.014 1.00 0.00 N ATOM 740 NH2 ARG A 47 7.891 0.516 -1.031 1.00 0.00 N ATOM 0 H ARG A 47 9.313 -0.317 -9.032 1.00 0.00 H new ATOM 0 HA ARG A 47 7.958 0.676 -6.670 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.328 -1.571 -7.241 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.682 -0.637 -6.636 1.00 0.00 H new ATOM 0 HG2 ARG A 47 8.115 -1.365 -5.159 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.758 -1.786 -4.719 1.00 0.00 H new ATOM 0 HD2 ARG A 47 10.229 0.736 -4.480 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.507 1.002 -4.670 1.00 0.00 H new ATOM 0 HE ARG A 47 9.776 -0.509 -2.365 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.838 0.166 -4.017 1.00 0.00 H new ATOM 0 HH12 ARG A 47 5.940 0.601 -2.558 1.00 0.00 H new ATOM 0 HH21 ARG A 47 8.749 0.457 -0.483 1.00 0.00 H new ATOM 0 HH22 ARG A 47 7.012 0.764 -0.576 1.00 0.00 H new ATOM 754 N ALA A 48 10.792 2.047 -7.562 1.00 0.00 N ATOM 755 CA ALA A 48 11.706 3.197 -7.250 1.00 0.00 C ATOM 756 C ALA A 48 10.965 4.513 -7.401 1.00 0.00 C ATOM 757 O ALA A 48 11.214 5.472 -6.700 1.00 0.00 O ATOM 758 CB ALA A 48 12.928 3.203 -8.182 1.00 0.00 C ATOM 0 H ALA A 48 10.999 1.550 -8.428 1.00 0.00 H new ATOM 0 HA ALA A 48 12.046 3.079 -6.221 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.572 4.047 -7.933 1.00 0.00 H new ATOM 0 HB2 ALA A 48 13.484 2.274 -8.059 1.00 0.00 H new ATOM 0 HB3 ALA A 48 12.596 3.293 -9.216 1.00 0.00 H new ATOM 764 N ALA A 49 10.067 4.557 -8.315 1.00 0.00 N ATOM 765 CA ALA A 49 9.291 5.804 -8.544 1.00 0.00 C ATOM 766 C ALA A 49 8.343 6.035 -7.372 1.00 0.00 C ATOM 767 O ALA A 49 8.018 7.156 -7.034 1.00 0.00 O ATOM 768 CB ALA A 49 8.491 5.672 -9.840 1.00 0.00 C ATOM 0 H ALA A 49 9.825 3.779 -8.928 1.00 0.00 H new ATOM 0 HA ALA A 49 9.973 6.651 -8.626 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.921 6.585 -10.010 1.00 0.00 H new ATOM 0 HB2 ALA A 49 9.174 5.510 -10.674 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.807 4.827 -9.761 1.00 0.00 H new ATOM 774 N THR A 50 7.898 4.985 -6.745 1.00 0.00 N ATOM 775 CA THR A 50 6.975 5.147 -5.592 1.00 0.00 C ATOM 776 C THR A 50 7.711 5.847 -4.450 1.00 0.00 C ATOM 777 O THR A 50 7.200 6.767 -3.841 1.00 0.00 O ATOM 778 CB THR A 50 6.495 3.770 -5.123 1.00 0.00 C ATOM 779 OG1 THR A 50 6.262 2.943 -6.255 1.00 0.00 O ATOM 780 CG2 THR A 50 5.201 3.924 -4.324 1.00 0.00 C ATOM 0 H THR A 50 8.134 4.021 -6.981 1.00 0.00 H new ATOM 0 HA THR A 50 6.116 5.746 -5.894 1.00 0.00 H new ATOM 0 HB THR A 50 7.256 3.314 -4.490 1.00 0.00 H new ATOM 0 HG1 THR A 50 5.808 3.462 -6.951 1.00 0.00 H new ATOM 0 HG21 THR A 50 4.860 2.944 -3.991 1.00 0.00 H new ATOM 0 HG22 THR A 50 5.382 4.559 -3.457 1.00 0.00 H new ATOM 0 HG23 THR A 50 4.437 4.379 -4.954 1.00 0.00 H new ATOM 788 N VAL A 51 8.905 5.415 -4.146 1.00 0.00 N ATOM 789 CA VAL A 51 9.662 6.056 -3.036 1.00 0.00 C ATOM 790 C VAL A 51 10.110 7.462 -3.439 1.00 0.00 C ATOM 791 O VAL A 51 9.900 8.410 -2.714 1.00 0.00 O ATOM 792 CB VAL A 51 10.880 5.196 -2.671 1.00 0.00 C ATOM 793 CG1 VAL A 51 12.040 5.481 -3.630 1.00 0.00 C ATOM 794 CG2 VAL A 51 11.314 5.521 -1.242 1.00 0.00 C ATOM 0 H VAL A 51 9.386 4.649 -4.617 1.00 0.00 H new ATOM 0 HA VAL A 51 9.010 6.137 -2.166 1.00 0.00 H new ATOM 0 HB VAL A 51 10.608 4.143 -2.749 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.896 4.864 -3.359 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.734 5.249 -4.650 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.316 6.533 -3.565 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.179 4.913 -0.977 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.578 6.576 -1.173 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.495 5.306 -0.555 1.00 0.00 H new ATOM 804 N LEU A 52 10.721 7.618 -4.580 1.00 0.00 N ATOM 805 CA LEU A 52 11.161 8.981 -4.983 1.00 0.00 C ATOM 806 C LEU A 52 9.946 9.904 -4.949 1.00 0.00 C ATOM 807 O LEU A 52 10.057 11.085 -4.687 1.00 0.00 O ATOM 808 CB LEU A 52 11.748 8.945 -6.396 1.00 0.00 C ATOM 809 CG LEU A 52 12.230 10.345 -6.783 1.00 0.00 C ATOM 810 CD1 LEU A 52 13.226 10.238 -7.940 1.00 0.00 C ATOM 811 CD2 LEU A 52 11.035 11.195 -7.216 1.00 0.00 C ATOM 0 H LEU A 52 10.932 6.872 -5.242 1.00 0.00 H new ATOM 0 HA LEU A 52 11.929 9.344 -4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.577 8.238 -6.439 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.996 8.598 -7.105 1.00 0.00 H new ATOM 0 HG LEU A 52 12.716 10.812 -5.926 1.00 0.00 H new ATOM 0 HD11 LEU A 52 13.570 11.234 -8.217 1.00 0.00 H new ATOM 0 HD12 LEU A 52 14.078 9.632 -7.632 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.740 9.771 -8.797 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.379 12.192 -7.492 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.549 10.729 -8.073 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.325 11.271 -6.393 1.00 0.00 H new ATOM 823 N ARG A 53 8.784 9.367 -5.196 1.00 0.00 N ATOM 824 CA ARG A 53 7.559 10.206 -5.158 1.00 0.00 C ATOM 825 C ARG A 53 7.357 10.704 -3.729 1.00 0.00 C ATOM 826 O ARG A 53 7.104 11.866 -3.496 1.00 0.00 O ATOM 827 CB ARG A 53 6.350 9.372 -5.588 1.00 0.00 C ATOM 828 CG ARG A 53 5.064 10.129 -5.250 1.00 0.00 C ATOM 829 CD ARG A 53 4.363 9.443 -4.076 1.00 0.00 C ATOM 830 NE ARG A 53 3.051 8.902 -4.528 1.00 0.00 N ATOM 831 CZ ARG A 53 2.176 9.694 -5.086 1.00 0.00 C ATOM 832 NH1 ARG A 53 1.463 10.501 -4.349 1.00 0.00 N ATOM 833 NH2 ARG A 53 2.016 9.679 -6.382 1.00 0.00 N ATOM 0 H ARG A 53 8.632 8.384 -5.422 1.00 0.00 H new ATOM 0 HA ARG A 53 7.664 11.052 -5.837 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.396 9.170 -6.658 1.00 0.00 H new ATOM 0 HB3 ARG A 53 6.361 8.407 -5.081 1.00 0.00 H new ATOM 0 HG2 ARG A 53 5.294 11.164 -4.996 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.405 10.153 -6.118 1.00 0.00 H new ATOM 0 HD2 ARG A 53 4.986 8.638 -3.687 1.00 0.00 H new ATOM 0 HD3 ARG A 53 4.215 10.153 -3.262 1.00 0.00 H new ATOM 0 HE ARG A 53 2.836 7.913 -4.402 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.589 10.513 -3.337 1.00 0.00 H new ATOM 0 HH12 ARG A 53 0.779 11.120 -4.785 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.574 9.049 -6.958 1.00 0.00 H new ATOM 0 HH22 ARG A 53 1.333 10.298 -6.819 1.00 0.00 H new ATOM 847 N GLN A 54 7.469 9.828 -2.767 1.00 0.00 N ATOM 848 CA GLN A 54 7.286 10.250 -1.348 1.00 0.00 C ATOM 849 C GLN A 54 8.416 11.192 -0.921 1.00 0.00 C ATOM 850 O GLN A 54 8.262 12.002 -0.032 1.00 0.00 O ATOM 851 CB GLN A 54 7.244 9.014 -0.434 1.00 0.00 C ATOM 852 CG GLN A 54 8.658 8.469 -0.226 1.00 0.00 C ATOM 853 CD GLN A 54 9.028 8.560 1.255 1.00 0.00 C ATOM 854 OE1 GLN A 54 9.117 7.557 1.934 1.00 0.00 O ATOM 855 NE2 GLN A 54 9.250 9.730 1.788 1.00 0.00 N ATOM 0 H GLN A 54 7.679 8.839 -2.902 1.00 0.00 H new ATOM 0 HA GLN A 54 6.341 10.785 -1.259 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.802 9.277 0.527 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.611 8.245 -0.877 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.713 7.434 -0.562 1.00 0.00 H new ATOM 0 HG3 GLN A 54 9.370 9.037 -0.825 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.175 10.573 1.218 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.498 9.802 2.775 1.00 0.00 H new ATOM 864 N PHE A 55 9.550 11.063 -1.525 1.00 0.00 N ATOM 865 CA PHE A 55 10.713 11.919 -1.146 1.00 0.00 C ATOM 866 C PHE A 55 10.461 13.381 -1.534 1.00 0.00 C ATOM 867 O PHE A 55 10.565 14.271 -0.713 1.00 0.00 O ATOM 868 CB PHE A 55 11.955 11.410 -1.898 1.00 0.00 C ATOM 869 CG PHE A 55 13.197 12.014 -1.298 1.00 0.00 C ATOM 870 CD1 PHE A 55 13.766 11.447 -0.155 1.00 0.00 C ATOM 871 CD2 PHE A 55 13.776 13.145 -1.882 1.00 0.00 C ATOM 872 CE1 PHE A 55 14.916 12.007 0.405 1.00 0.00 C ATOM 873 CE2 PHE A 55 14.927 13.711 -1.321 1.00 0.00 C ATOM 874 CZ PHE A 55 15.498 13.142 -0.175 1.00 0.00 C ATOM 0 H PHE A 55 9.733 10.396 -2.275 1.00 0.00 H new ATOM 0 HA PHE A 55 10.860 11.866 -0.067 1.00 0.00 H new ATOM 0 HB2 PHE A 55 12.005 10.323 -1.842 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.885 11.672 -2.954 1.00 0.00 H new ATOM 0 HD1 PHE A 55 13.316 10.575 0.296 1.00 0.00 H new ATOM 0 HD2 PHE A 55 13.335 13.582 -2.766 1.00 0.00 H new ATOM 0 HE1 PHE A 55 15.357 11.565 1.286 1.00 0.00 H new ATOM 0 HE2 PHE A 55 15.374 14.585 -1.771 1.00 0.00 H new ATOM 0 HZ PHE A 55 16.385 13.577 0.261 1.00 0.00 H new ATOM 884 N TYR A 56 10.128 13.643 -2.767 1.00 0.00 N ATOM 885 CA TYR A 56 9.869 15.059 -3.176 1.00 0.00 C ATOM 886 C TYR A 56 8.503 15.557 -2.628 1.00 0.00 C ATOM 887 O TYR A 56 8.399 16.677 -2.168 1.00 0.00 O ATOM 888 CB TYR A 56 9.939 15.205 -4.718 1.00 0.00 C ATOM 889 CG TYR A 56 8.610 14.886 -5.361 1.00 0.00 C ATOM 890 CD1 TYR A 56 7.603 15.856 -5.402 1.00 0.00 C ATOM 891 CD2 TYR A 56 8.389 13.622 -5.926 1.00 0.00 C ATOM 892 CE1 TYR A 56 6.372 15.563 -6.001 1.00 0.00 C ATOM 893 CE2 TYR A 56 7.156 13.330 -6.523 1.00 0.00 C ATOM 894 CZ TYR A 56 6.148 14.300 -6.558 1.00 0.00 C ATOM 895 OH TYR A 56 4.935 14.011 -7.148 1.00 0.00 O ATOM 0 H TYR A 56 10.024 12.948 -3.506 1.00 0.00 H new ATOM 0 HA TYR A 56 10.648 15.686 -2.742 1.00 0.00 H new ATOM 0 HB2 TYR A 56 10.235 16.222 -4.976 1.00 0.00 H new ATOM 0 HB3 TYR A 56 10.706 14.539 -5.114 1.00 0.00 H new ATOM 0 HD1 TYR A 56 7.775 16.831 -4.971 1.00 0.00 H new ATOM 0 HD2 TYR A 56 9.168 12.875 -5.901 1.00 0.00 H new ATOM 0 HE1 TYR A 56 5.595 16.313 -6.033 1.00 0.00 H new ATOM 0 HE2 TYR A 56 6.983 12.356 -6.956 1.00 0.00 H new ATOM 0 HH TYR A 56 4.941 13.086 -7.471 1.00 0.00 H new ATOM 905 N SER A 57 7.438 14.759 -2.701 1.00 0.00 N ATOM 906 CA SER A 57 6.105 15.236 -2.216 1.00 0.00 C ATOM 907 C SER A 57 6.024 15.326 -0.685 1.00 0.00 C ATOM 908 O SER A 57 5.344 16.177 -0.147 1.00 0.00 O ATOM 909 CB SER A 57 5.027 14.271 -2.712 1.00 0.00 C ATOM 910 OG SER A 57 5.344 12.951 -2.295 1.00 0.00 O ATOM 0 H SER A 57 7.448 13.810 -3.074 1.00 0.00 H new ATOM 0 HA SER A 57 5.955 16.241 -2.609 1.00 0.00 H new ATOM 0 HB2 SER A 57 4.053 14.564 -2.319 1.00 0.00 H new ATOM 0 HB3 SER A 57 4.958 14.314 -3.799 1.00 0.00 H new ATOM 0 HG SER A 57 5.779 12.471 -3.030 1.00 0.00 H new ATOM 916 N HIS A 58 6.657 14.432 0.021 1.00 0.00 N ATOM 917 CA HIS A 58 6.549 14.448 1.510 1.00 0.00 C ATOM 918 C HIS A 58 7.284 15.645 2.108 1.00 0.00 C ATOM 919 O HIS A 58 6.746 16.371 2.921 1.00 0.00 O ATOM 920 CB HIS A 58 7.149 13.157 2.071 1.00 0.00 C ATOM 921 CG HIS A 58 6.679 12.953 3.485 1.00 0.00 C ATOM 922 ND1 HIS A 58 6.491 11.692 4.027 1.00 0.00 N ATOM 923 CD2 HIS A 58 6.355 13.842 4.482 1.00 0.00 C ATOM 924 CE1 HIS A 58 6.073 11.854 5.296 1.00 0.00 C ATOM 925 NE2 HIS A 58 5.972 13.144 5.624 1.00 0.00 N ATOM 0 H HIS A 58 7.243 13.692 -0.365 1.00 0.00 H new ATOM 0 HA HIS A 58 5.495 14.526 1.776 1.00 0.00 H new ATOM 0 HB2 HIS A 58 6.854 12.309 1.453 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.237 13.208 2.043 1.00 0.00 H new ATOM 0 HD2 HIS A 58 6.392 14.918 4.393 1.00 0.00 H new ATOM 0 HE1 HIS A 58 5.847 11.039 5.968 1.00 0.00 H new ATOM 0 HE2 HIS A 58 5.677 13.534 6.519 1.00 0.00 H new ATOM 933 N HIS A 59 8.511 15.853 1.733 1.00 0.00 N ATOM 934 CA HIS A 59 9.266 17.006 2.317 1.00 0.00 C ATOM 935 C HIS A 59 8.713 18.318 1.773 1.00 0.00 C ATOM 936 O HIS A 59 8.342 19.173 2.542 1.00 0.00 O ATOM 937 CB HIS A 59 10.753 16.890 1.965 1.00 0.00 C ATOM 938 CG HIS A 59 11.246 15.518 2.343 1.00 0.00 C ATOM 939 ND1 HIS A 59 11.054 14.991 3.611 1.00 0.00 N ATOM 940 CD2 HIS A 59 11.924 14.556 1.637 1.00 0.00 C ATOM 941 CE1 HIS A 59 11.606 13.764 3.628 1.00 0.00 C ATOM 942 NE2 HIS A 59 12.150 13.449 2.450 1.00 0.00 N ATOM 0 H HIS A 59 9.024 15.287 1.057 1.00 0.00 H new ATOM 0 HA HIS A 59 9.152 16.990 3.401 1.00 0.00 H new ATOM 0 HB2 HIS A 59 10.901 17.062 0.899 1.00 0.00 H new ATOM 0 HB3 HIS A 59 11.325 17.653 2.493 1.00 0.00 H new ATOM 0 HD2 HIS A 59 12.235 14.645 0.607 1.00 0.00 H new ATOM 0 HE1 HIS A 59 11.609 13.113 4.490 1.00 0.00 H new ATOM 0 HE2 HIS A 59 12.628 12.584 2.200 1.00 0.00 H new ATOM 950 N GLU A 60 8.622 18.449 0.460 1.00 0.00 N ATOM 951 CA GLU A 60 8.079 19.696 -0.187 1.00 0.00 C ATOM 952 C GLU A 60 8.140 20.888 0.776 1.00 0.00 C ATOM 953 O GLU A 60 7.238 21.699 0.838 1.00 0.00 O ATOM 954 CB GLU A 60 6.641 19.427 -0.597 1.00 0.00 C ATOM 955 CG GLU A 60 6.629 18.872 -2.019 1.00 0.00 C ATOM 956 CD GLU A 60 5.392 19.379 -2.760 1.00 0.00 C ATOM 957 OE1 GLU A 60 5.254 20.585 -2.887 1.00 0.00 O ATOM 958 OE2 GLU A 60 4.601 18.553 -3.188 1.00 0.00 O ATOM 0 H GLU A 60 8.908 17.727 -0.201 1.00 0.00 H new ATOM 0 HA GLU A 60 8.683 19.948 -1.058 1.00 0.00 H new ATOM 0 HB2 GLU A 60 6.180 18.717 0.089 1.00 0.00 H new ATOM 0 HB3 GLU A 60 6.056 20.345 -0.546 1.00 0.00 H new ATOM 0 HG2 GLU A 60 7.532 19.179 -2.547 1.00 0.00 H new ATOM 0 HG3 GLU A 60 6.629 17.782 -1.994 1.00 0.00 H new ATOM 965 N LYS A 61 9.201 20.964 1.535 1.00 0.00 N ATOM 966 CA LYS A 61 9.386 22.037 2.549 1.00 0.00 C ATOM 967 C LYS A 61 10.231 21.421 3.667 1.00 0.00 C ATOM 968 O LYS A 61 11.363 21.049 3.441 1.00 0.00 O ATOM 969 CB LYS A 61 8.025 22.507 3.107 1.00 0.00 C ATOM 970 CG LYS A 61 7.159 21.294 3.487 1.00 0.00 C ATOM 971 CD LYS A 61 6.066 21.738 4.461 1.00 0.00 C ATOM 972 CE LYS A 61 5.818 20.633 5.490 1.00 0.00 C ATOM 973 NZ LYS A 61 4.440 20.770 6.042 1.00 0.00 N ATOM 0 H LYS A 61 9.974 20.300 1.489 1.00 0.00 H new ATOM 0 HA LYS A 61 9.870 22.910 2.112 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.181 23.140 3.981 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.508 23.113 2.363 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.711 20.858 2.594 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.777 20.521 3.944 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.365 22.658 4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 61 5.147 21.956 3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 61 5.940 19.654 5.026 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.552 20.698 6.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.270 20.019 6.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.340 21.699 6.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.747 20.688 5.271 1.00 0.00 H new ATOM 987 N ASP A 62 9.714 21.272 4.863 1.00 0.00 N ATOM 988 CA ASP A 62 10.544 20.646 5.920 1.00 0.00 C ATOM 989 C ASP A 62 11.807 21.488 6.088 1.00 0.00 C ATOM 990 O ASP A 62 12.914 20.992 6.085 1.00 0.00 O ATOM 991 CB ASP A 62 10.901 19.213 5.489 1.00 0.00 C ATOM 992 CG ASP A 62 11.949 18.636 6.445 1.00 0.00 C ATOM 993 OD1 ASP A 62 11.568 18.219 7.528 1.00 0.00 O ATOM 994 OD2 ASP A 62 13.112 18.623 6.079 1.00 0.00 O ATOM 0 H ASP A 62 8.774 21.552 5.142 1.00 0.00 H new ATOM 0 HA ASP A 62 10.008 20.601 6.868 1.00 0.00 H new ATOM 0 HB2 ASP A 62 10.008 18.588 5.492 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.286 19.214 4.469 1.00 0.00 H new ATOM 999 N THR A 63 11.622 22.772 6.232 1.00 0.00 N ATOM 1000 CA THR A 63 12.766 23.719 6.395 1.00 0.00 C ATOM 1001 C THR A 63 13.835 23.126 7.314 1.00 0.00 C ATOM 1002 O THR A 63 14.976 23.540 7.288 1.00 0.00 O ATOM 1003 CB THR A 63 12.256 25.031 6.992 1.00 0.00 C ATOM 1004 OG1 THR A 63 13.364 25.840 7.366 1.00 0.00 O ATOM 1005 CG2 THR A 63 11.400 24.736 8.224 1.00 0.00 C ATOM 0 H THR A 63 10.704 23.216 6.244 1.00 0.00 H new ATOM 0 HA THR A 63 13.210 23.900 5.416 1.00 0.00 H new ATOM 0 HB THR A 63 11.653 25.557 6.252 1.00 0.00 H new ATOM 0 HG1 THR A 63 14.075 25.750 6.698 1.00 0.00 H new ATOM 0 HG21 THR A 63 11.038 25.672 8.648 1.00 0.00 H new ATOM 0 HG22 THR A 63 10.551 24.115 7.937 1.00 0.00 H new ATOM 0 HG23 THR A 63 12.000 24.210 8.966 1.00 0.00 H new ATOM 1013 N ARG A 64 13.480 22.177 8.132 1.00 0.00 N ATOM 1014 CA ARG A 64 14.495 21.571 9.045 1.00 0.00 C ATOM 1015 C ARG A 64 15.805 21.360 8.275 1.00 0.00 C ATOM 1016 O ARG A 64 16.820 21.955 8.583 1.00 0.00 O ATOM 1017 CB ARG A 64 13.979 20.224 9.557 1.00 0.00 C ATOM 1018 CG ARG A 64 14.856 19.750 10.718 1.00 0.00 C ATOM 1019 CD ARG A 64 13.966 19.251 11.858 1.00 0.00 C ATOM 1020 NE ARG A 64 14.039 17.764 11.929 1.00 0.00 N ATOM 1021 CZ ARG A 64 13.732 17.148 13.039 1.00 0.00 C ATOM 1022 NH1 ARG A 64 12.484 16.891 13.318 1.00 0.00 N ATOM 1023 NH2 ARG A 64 14.674 16.789 13.867 1.00 0.00 N ATOM 0 H ARG A 64 12.538 21.794 8.210 1.00 0.00 H new ATOM 0 HA ARG A 64 14.672 22.236 9.891 1.00 0.00 H new ATOM 0 HB2 ARG A 64 12.944 20.320 9.885 1.00 0.00 H new ATOM 0 HB3 ARG A 64 13.992 19.488 8.753 1.00 0.00 H new ATOM 0 HG2 ARG A 64 15.520 18.952 10.384 1.00 0.00 H new ATOM 0 HG3 ARG A 64 15.489 20.566 11.067 1.00 0.00 H new ATOM 0 HD2 ARG A 64 14.288 19.687 12.803 1.00 0.00 H new ATOM 0 HD3 ARG A 64 12.936 19.568 11.695 1.00 0.00 H new ATOM 0 HE ARG A 64 14.329 17.228 11.111 1.00 0.00 H new ATOM 0 HH11 ARG A 64 11.748 17.171 12.669 1.00 0.00 H new ATOM 0 HH12 ARG A 64 12.244 16.410 14.185 1.00 0.00 H new ATOM 0 HH21 ARG A 64 15.650 16.989 13.647 1.00 0.00 H new ATOM 0 HH22 ARG A 64 14.435 16.308 14.734 1.00 0.00 H new ATOM 1037 N CYS A 65 15.793 20.518 7.275 1.00 0.00 N ATOM 1038 CA CYS A 65 17.035 20.268 6.482 1.00 0.00 C ATOM 1039 C CYS A 65 17.326 21.463 5.558 1.00 0.00 C ATOM 1040 O CYS A 65 18.400 21.577 5.003 1.00 0.00 O ATOM 1041 CB CYS A 65 16.842 19.001 5.634 1.00 0.00 C ATOM 1042 SG CYS A 65 18.119 18.898 4.348 1.00 0.00 S ATOM 0 H CYS A 65 14.974 19.991 6.972 1.00 0.00 H new ATOM 0 HA CYS A 65 17.876 20.137 7.163 1.00 0.00 H new ATOM 0 HB2 CYS A 65 16.888 18.118 6.272 1.00 0.00 H new ATOM 0 HB3 CYS A 65 15.854 19.011 5.174 1.00 0.00 H new ATOM 1047 N LEU A 66 16.380 22.345 5.379 1.00 0.00 N ATOM 1048 CA LEU A 66 16.608 23.516 4.479 1.00 0.00 C ATOM 1049 C LEU A 66 16.144 24.799 5.172 1.00 0.00 C ATOM 1050 O LEU A 66 14.979 24.965 5.464 1.00 0.00 O ATOM 1051 CB LEU A 66 15.799 23.342 3.184 1.00 0.00 C ATOM 1052 CG LEU A 66 15.357 21.883 3.020 1.00 0.00 C ATOM 1053 CD1 LEU A 66 14.235 21.574 4.004 1.00 0.00 C ATOM 1054 CD2 LEU A 66 14.833 21.664 1.607 1.00 0.00 C ATOM 0 H LEU A 66 15.459 22.307 5.816 1.00 0.00 H new ATOM 0 HA LEU A 66 17.672 23.579 4.249 1.00 0.00 H new ATOM 0 HB2 LEU A 66 14.925 23.993 3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 66 16.402 23.644 2.328 1.00 0.00 H new ATOM 0 HG LEU A 66 16.210 21.231 3.209 1.00 0.00 H new ATOM 0 HD11 LEU A 66 13.923 20.536 3.885 1.00 0.00 H new ATOM 0 HD12 LEU A 66 14.590 21.732 5.022 1.00 0.00 H new ATOM 0 HD13 LEU A 66 13.388 22.232 3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 66 14.519 20.626 1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 66 13.983 22.322 1.428 1.00 0.00 H new ATOM 0 HD23 LEU A 66 15.621 21.886 0.888 1.00 0.00 H new ATOM 1066 N GLY A 67 17.033 25.719 5.432 1.00 0.00 N ATOM 1067 CA GLY A 67 16.595 26.976 6.099 1.00 0.00 C ATOM 1068 C GLY A 67 17.806 27.770 6.606 1.00 0.00 C ATOM 1069 O GLY A 67 17.851 28.978 6.474 1.00 0.00 O ATOM 0 H GLY A 67 18.028 25.657 5.215 1.00 0.00 H new ATOM 0 HA2 GLY A 67 16.022 27.584 5.399 1.00 0.00 H new ATOM 0 HA3 GLY A 67 15.933 26.740 6.933 1.00 0.00 H new ATOM 1073 N ALA A 68 18.788 27.116 7.189 1.00 0.00 N ATOM 1074 CA ALA A 68 19.978 27.861 7.697 1.00 0.00 C ATOM 1075 C ALA A 68 20.388 28.927 6.678 1.00 0.00 C ATOM 1076 O ALA A 68 20.963 29.941 7.018 1.00 0.00 O ATOM 1077 CB ALA A 68 21.138 26.886 7.909 1.00 0.00 C ATOM 0 H ALA A 68 18.813 26.106 7.332 1.00 0.00 H new ATOM 0 HA ALA A 68 19.728 28.341 8.643 1.00 0.00 H new ATOM 0 HB1 ALA A 68 22.007 27.430 8.280 1.00 0.00 H new ATOM 0 HB2 ALA A 68 20.847 26.127 8.636 1.00 0.00 H new ATOM 0 HB3 ALA A 68 21.387 26.406 6.963 1.00 0.00 H new ATOM 1083 N THR A 69 20.092 28.700 5.429 1.00 0.00 N ATOM 1084 CA THR A 69 20.456 29.689 4.377 1.00 0.00 C ATOM 1085 C THR A 69 19.340 29.745 3.331 1.00 0.00 C ATOM 1086 O THR A 69 18.832 28.722 2.923 1.00 0.00 O ATOM 1087 CB THR A 69 21.755 29.245 3.700 1.00 0.00 C ATOM 1088 OG1 THR A 69 22.520 28.470 4.611 1.00 0.00 O ATOM 1089 CG2 THR A 69 22.557 30.476 3.275 1.00 0.00 C ATOM 0 H THR A 69 19.611 27.867 5.090 1.00 0.00 H new ATOM 0 HA THR A 69 20.590 30.673 4.826 1.00 0.00 H new ATOM 0 HB THR A 69 21.521 28.646 2.820 1.00 0.00 H new ATOM 0 HG1 THR A 69 23.352 28.183 4.179 1.00 0.00 H new ATOM 0 HG21 THR A 69 23.482 30.159 2.793 1.00 0.00 H new ATOM 0 HG22 THR A 69 21.969 31.070 2.576 1.00 0.00 H new ATOM 0 HG23 THR A 69 22.793 31.077 4.153 1.00 0.00 H new ATOM 1097 N ALA A 70 18.955 30.910 2.860 1.00 0.00 N ATOM 1098 CA ALA A 70 17.903 30.946 1.817 1.00 0.00 C ATOM 1099 C ALA A 70 18.301 29.945 0.739 1.00 0.00 C ATOM 1100 O ALA A 70 17.470 29.386 0.054 1.00 0.00 O ATOM 1101 CB ALA A 70 17.811 32.351 1.216 1.00 0.00 C ATOM 0 H ALA A 70 19.321 31.816 3.152 1.00 0.00 H new ATOM 0 HA ALA A 70 16.931 30.693 2.240 1.00 0.00 H new ATOM 0 HB1 ALA A 70 17.036 32.369 0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 70 17.564 33.067 2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 70 18.768 32.619 0.769 1.00 0.00 H new ATOM 1107 N GLN A 71 19.582 29.704 0.597 1.00 0.00 N ATOM 1108 CA GLN A 71 20.035 28.724 -0.430 1.00 0.00 C ATOM 1109 C GLN A 71 19.317 27.398 -0.182 1.00 0.00 C ATOM 1110 O GLN A 71 18.721 26.825 -1.067 1.00 0.00 O ATOM 1111 CB GLN A 71 21.547 28.520 -0.312 1.00 0.00 C ATOM 1112 CG GLN A 71 22.082 27.893 -1.600 1.00 0.00 C ATOM 1113 CD GLN A 71 22.021 28.921 -2.731 1.00 0.00 C ATOM 1114 OE1 GLN A 71 22.944 29.685 -2.924 1.00 0.00 O ATOM 1115 NE2 GLN A 71 20.963 28.971 -3.493 1.00 0.00 N ATOM 0 H GLN A 71 20.324 30.140 1.144 1.00 0.00 H new ATOM 0 HA GLN A 71 19.804 29.093 -1.429 1.00 0.00 H new ATOM 0 HB2 GLN A 71 22.040 29.475 -0.128 1.00 0.00 H new ATOM 0 HB3 GLN A 71 21.772 27.876 0.538 1.00 0.00 H new ATOM 0 HG2 GLN A 71 23.109 27.557 -1.454 1.00 0.00 H new ATOM 0 HG3 GLN A 71 21.493 27.014 -1.861 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.187 28.329 -3.331 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.912 29.652 -4.251 1.00 0.00 H new ATOM 1124 N GLN A 72 19.352 26.918 1.028 1.00 0.00 N ATOM 1125 CA GLN A 72 18.652 25.647 1.352 1.00 0.00 C ATOM 1126 C GLN A 72 17.212 25.720 0.837 1.00 0.00 C ATOM 1127 O GLN A 72 16.641 24.734 0.410 1.00 0.00 O ATOM 1128 CB GLN A 72 18.627 25.468 2.874 1.00 0.00 C ATOM 1129 CG GLN A 72 19.643 24.406 3.305 1.00 0.00 C ATOM 1130 CD GLN A 72 19.428 23.131 2.488 1.00 0.00 C ATOM 1131 OE1 GLN A 72 18.340 22.589 2.465 1.00 0.00 O ATOM 1132 NE2 GLN A 72 20.422 22.626 1.815 1.00 0.00 N ATOM 0 H GLN A 72 19.839 27.355 1.811 1.00 0.00 H new ATOM 0 HA GLN A 72 19.170 24.810 0.884 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.854 26.416 3.362 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.627 25.175 3.195 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.657 24.777 3.159 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.532 24.192 4.368 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.335 23.081 1.835 1.00 0.00 H new ATOM 0 HE22 GLN A 72 20.288 21.775 1.268 1.00 0.00 H new ATOM 1141 N PHE A 73 16.617 26.877 0.898 1.00 0.00 N ATOM 1142 CA PHE A 73 15.205 27.028 0.441 1.00 0.00 C ATOM 1143 C PHE A 73 15.086 26.919 -1.092 1.00 0.00 C ATOM 1144 O PHE A 73 14.240 26.210 -1.599 1.00 0.00 O ATOM 1145 CB PHE A 73 14.666 28.385 0.917 1.00 0.00 C ATOM 1146 CG PHE A 73 13.171 28.433 0.704 1.00 0.00 C ATOM 1147 CD1 PHE A 73 12.322 27.690 1.533 1.00 0.00 C ATOM 1148 CD2 PHE A 73 12.634 29.220 -0.321 1.00 0.00 C ATOM 1149 CE1 PHE A 73 10.937 27.734 1.337 1.00 0.00 C ATOM 1150 CE2 PHE A 73 11.249 29.264 -0.517 1.00 0.00 C ATOM 1151 CZ PHE A 73 10.400 28.522 0.312 1.00 0.00 C ATOM 0 H PHE A 73 17.050 27.732 1.247 1.00 0.00 H new ATOM 0 HA PHE A 73 14.615 26.218 0.871 1.00 0.00 H new ATOM 0 HB2 PHE A 73 14.899 28.532 1.972 1.00 0.00 H new ATOM 0 HB3 PHE A 73 15.149 29.193 0.368 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.736 27.083 2.324 1.00 0.00 H new ATOM 0 HD2 PHE A 73 13.288 29.793 -0.961 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.283 27.160 1.976 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.835 29.871 -1.309 1.00 0.00 H new ATOM 0 HZ PHE A 73 9.331 28.557 0.161 1.00 0.00 H new ATOM 1161 N HIS A 74 15.895 27.632 -1.838 1.00 0.00 N ATOM 1162 CA HIS A 74 15.777 27.577 -3.331 1.00 0.00 C ATOM 1163 C HIS A 74 16.257 26.244 -3.883 1.00 0.00 C ATOM 1164 O HIS A 74 15.598 25.598 -4.672 1.00 0.00 O ATOM 1165 CB HIS A 74 16.607 28.707 -3.944 1.00 0.00 C ATOM 1166 CG HIS A 74 16.387 28.740 -5.431 1.00 0.00 C ATOM 1167 ND1 HIS A 74 15.472 29.596 -6.024 1.00 0.00 N ATOM 1168 CD2 HIS A 74 16.957 28.030 -6.459 1.00 0.00 C ATOM 1169 CE1 HIS A 74 15.516 29.381 -7.352 1.00 0.00 C ATOM 1170 NE2 HIS A 74 16.406 28.436 -7.671 1.00 0.00 N ATOM 0 H HIS A 74 16.627 28.246 -1.482 1.00 0.00 H new ATOM 0 HA HIS A 74 14.725 27.691 -3.592 1.00 0.00 H new ATOM 0 HB2 HIS A 74 16.323 29.662 -3.502 1.00 0.00 H new ATOM 0 HB3 HIS A 74 17.664 28.556 -3.725 1.00 0.00 H new ATOM 0 HD2 HIS A 74 17.717 27.272 -6.344 1.00 0.00 H new ATOM 0 HE1 HIS A 74 14.907 29.908 -8.072 1.00 0.00 H new ATOM 0 HE2 HIS A 74 16.633 28.087 -8.602 1.00 0.00 H new ATOM 1178 N ARG A 75 17.410 25.861 -3.489 1.00 0.00 N ATOM 1179 CA ARG A 75 18.016 24.586 -3.979 1.00 0.00 C ATOM 1180 C ARG A 75 17.027 23.430 -3.844 1.00 0.00 C ATOM 1181 O ARG A 75 16.893 22.616 -4.735 1.00 0.00 O ATOM 1182 CB ARG A 75 19.272 24.277 -3.164 1.00 0.00 C ATOM 1183 CG ARG A 75 20.514 24.582 -4.007 1.00 0.00 C ATOM 1184 CD ARG A 75 20.609 23.576 -5.157 1.00 0.00 C ATOM 1185 NE ARG A 75 21.979 23.618 -5.740 1.00 0.00 N ATOM 1186 CZ ARG A 75 22.456 24.740 -6.207 1.00 0.00 C ATOM 1187 NH1 ARG A 75 21.839 25.358 -7.177 1.00 0.00 N ATOM 1188 NH2 ARG A 75 23.549 25.244 -5.703 1.00 0.00 N ATOM 0 H ARG A 75 17.990 26.379 -2.829 1.00 0.00 H new ATOM 0 HA ARG A 75 18.273 24.703 -5.032 1.00 0.00 H new ATOM 0 HB2 ARG A 75 19.283 24.874 -2.252 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.273 23.230 -2.860 1.00 0.00 H new ATOM 0 HG2 ARG A 75 20.459 25.597 -4.401 1.00 0.00 H new ATOM 0 HG3 ARG A 75 21.409 24.528 -3.388 1.00 0.00 H new ATOM 0 HD2 ARG A 75 20.386 22.572 -4.796 1.00 0.00 H new ATOM 0 HD3 ARG A 75 19.869 23.811 -5.922 1.00 0.00 H new ATOM 0 HE ARG A 75 22.545 22.770 -5.774 1.00 0.00 H new ATOM 0 HH11 ARG A 75 20.984 24.964 -7.570 1.00 0.00 H new ATOM 0 HH12 ARG A 75 22.212 26.235 -7.542 1.00 0.00 H new ATOM 0 HH21 ARG A 75 24.031 24.761 -4.944 1.00 0.00 H new ATOM 0 HH22 ARG A 75 23.922 26.121 -6.068 1.00 0.00 H new ATOM 1202 N HIS A 76 16.338 23.337 -2.744 1.00 0.00 N ATOM 1203 CA HIS A 76 15.373 22.209 -2.585 1.00 0.00 C ATOM 1204 C HIS A 76 14.189 22.425 -3.526 1.00 0.00 C ATOM 1205 O HIS A 76 13.570 21.490 -3.978 1.00 0.00 O ATOM 1206 CB HIS A 76 14.912 22.082 -1.113 1.00 0.00 C ATOM 1207 CG HIS A 76 13.478 22.522 -0.930 1.00 0.00 C ATOM 1208 ND1 HIS A 76 12.425 21.907 -1.590 1.00 0.00 N ATOM 1209 CD2 HIS A 76 12.909 23.498 -0.149 1.00 0.00 C ATOM 1210 CE1 HIS A 76 11.289 22.513 -1.199 1.00 0.00 C ATOM 1211 NE2 HIS A 76 11.527 23.492 -0.320 1.00 0.00 N ATOM 0 H HIS A 76 16.397 23.982 -1.956 1.00 0.00 H new ATOM 0 HA HIS A 76 15.864 21.272 -2.848 1.00 0.00 H new ATOM 0 HB2 HIS A 76 15.018 21.047 -0.788 1.00 0.00 H new ATOM 0 HB3 HIS A 76 15.560 22.684 -0.477 1.00 0.00 H new ATOM 0 HD1 HIS A 76 12.498 21.135 -2.252 1.00 0.00 H new ATOM 0 HD2 HIS A 76 13.452 24.169 0.500 1.00 0.00 H new ATOM 0 HE1 HIS A 76 10.305 22.242 -1.552 1.00 0.00 H new ATOM 1219 N LYS A 77 13.862 23.650 -3.822 1.00 0.00 N ATOM 1220 CA LYS A 77 12.736 23.925 -4.717 1.00 0.00 C ATOM 1221 C LYS A 77 13.054 23.445 -6.139 1.00 0.00 C ATOM 1222 O LYS A 77 12.247 22.808 -6.781 1.00 0.00 O ATOM 1223 CB LYS A 77 12.543 25.429 -4.705 1.00 0.00 C ATOM 1224 CG LYS A 77 11.233 25.765 -4.004 1.00 0.00 C ATOM 1225 CD LYS A 77 10.992 27.274 -4.059 1.00 0.00 C ATOM 1226 CE LYS A 77 10.555 27.671 -5.472 1.00 0.00 C ATOM 1227 NZ LYS A 77 11.104 29.016 -5.802 1.00 0.00 N ATOM 0 H LYS A 77 14.343 24.478 -3.470 1.00 0.00 H new ATOM 0 HA LYS A 77 11.836 23.404 -4.391 1.00 0.00 H new ATOM 0 HB2 LYS A 77 13.376 25.910 -4.192 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.532 25.813 -5.725 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.408 25.237 -4.482 1.00 0.00 H new ATOM 0 HG3 LYS A 77 11.268 25.430 -2.967 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.226 27.557 -3.337 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.902 27.808 -3.785 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.909 26.935 -6.194 1.00 0.00 H new ATOM 0 HE3 LYS A 77 9.467 27.684 -5.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.808 29.286 -6.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.746 29.714 -5.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 12.143 28.988 -5.756 1.00 0.00 H new ATOM 1241 N GLN A 78 14.220 23.764 -6.638 1.00 0.00 N ATOM 1242 CA GLN A 78 14.593 23.351 -8.025 1.00 0.00 C ATOM 1243 C GLN A 78 14.830 21.838 -8.112 1.00 0.00 C ATOM 1244 O GLN A 78 14.433 21.200 -9.063 1.00 0.00 O ATOM 1245 CB GLN A 78 15.869 24.085 -8.440 1.00 0.00 C ATOM 1246 CG GLN A 78 16.264 23.659 -9.856 1.00 0.00 C ATOM 1247 CD GLN A 78 17.462 22.712 -9.790 1.00 0.00 C ATOM 1248 OE1 GLN A 78 17.304 21.526 -9.581 1.00 0.00 O ATOM 1249 NE2 GLN A 78 18.665 23.190 -9.959 1.00 0.00 N ATOM 0 H GLN A 78 14.935 24.296 -6.141 1.00 0.00 H new ATOM 0 HA GLN A 78 13.770 23.607 -8.693 1.00 0.00 H new ATOM 0 HB2 GLN A 78 15.710 25.163 -8.404 1.00 0.00 H new ATOM 0 HB3 GLN A 78 16.675 23.858 -7.742 1.00 0.00 H new ATOM 0 HG2 GLN A 78 15.424 23.166 -10.346 1.00 0.00 H new ATOM 0 HG3 GLN A 78 16.513 24.535 -10.454 1.00 0.00 H new ATOM 0 HE21 GLN A 78 18.798 24.186 -10.135 1.00 0.00 H new ATOM 0 HE22 GLN A 78 19.472 22.568 -9.916 1.00 0.00 H new ATOM 1258 N LEU A 79 15.489 21.260 -7.145 1.00 0.00 N ATOM 1259 CA LEU A 79 15.761 19.796 -7.199 1.00 0.00 C ATOM 1260 C LEU A 79 14.465 19.033 -6.994 1.00 0.00 C ATOM 1261 O LEU A 79 14.164 18.131 -7.732 1.00 0.00 O ATOM 1262 CB LEU A 79 16.767 19.412 -6.113 1.00 0.00 C ATOM 1263 CG LEU A 79 18.147 19.958 -6.480 1.00 0.00 C ATOM 1264 CD1 LEU A 79 18.662 20.849 -5.348 1.00 0.00 C ATOM 1265 CD2 LEU A 79 19.116 18.792 -6.692 1.00 0.00 C ATOM 0 H LEU A 79 15.851 21.739 -6.320 1.00 0.00 H new ATOM 0 HA LEU A 79 16.179 19.543 -8.173 1.00 0.00 H new ATOM 0 HB2 LEU A 79 16.450 19.813 -5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 79 16.809 18.328 -6.008 1.00 0.00 H new ATOM 0 HG LEU A 79 18.074 20.543 -7.397 1.00 0.00 H new ATOM 0 HD11 LEU A 79 19.646 21.238 -5.610 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.972 21.679 -5.196 1.00 0.00 H new ATOM 0 HD13 LEU A 79 18.735 20.265 -4.430 1.00 0.00 H new ATOM 0 HD21 LEU A 79 20.100 19.180 -6.954 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.188 18.208 -5.775 1.00 0.00 H new ATOM 0 HD23 LEU A 79 18.750 18.157 -7.499 1.00 0.00 H new ATOM 1277 N ILE A 80 13.696 19.386 -6.007 1.00 0.00 N ATOM 1278 CA ILE A 80 12.404 18.677 -5.781 1.00 0.00 C ATOM 1279 C ILE A 80 11.494 18.925 -6.994 1.00 0.00 C ATOM 1280 O ILE A 80 10.680 18.094 -7.346 1.00 0.00 O ATOM 1281 CB ILE A 80 11.743 19.225 -4.508 1.00 0.00 C ATOM 1282 CG1 ILE A 80 12.313 18.477 -3.293 1.00 0.00 C ATOM 1283 CG2 ILE A 80 10.219 19.040 -4.573 1.00 0.00 C ATOM 1284 CD1 ILE A 80 11.352 18.581 -2.104 1.00 0.00 C ATOM 0 H ILE A 80 13.903 20.134 -5.345 1.00 0.00 H new ATOM 0 HA ILE A 80 12.572 17.607 -5.660 1.00 0.00 H new ATOM 0 HB ILE A 80 11.953 20.291 -4.419 1.00 0.00 H new ATOM 0 HG12 ILE A 80 12.476 17.430 -3.546 1.00 0.00 H new ATOM 0 HG13 ILE A 80 13.283 18.895 -3.023 1.00 0.00 H new ATOM 0 HG21 ILE A 80 9.766 19.434 -3.663 1.00 0.00 H new ATOM 0 HG22 ILE A 80 9.824 19.576 -5.436 1.00 0.00 H new ATOM 0 HG23 ILE A 80 9.985 17.979 -4.666 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.770 18.046 -1.251 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.210 19.629 -1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 80 10.391 18.141 -2.373 1.00 0.00 H new ATOM 1296 N ARG A 81 11.630 20.056 -7.644 1.00 0.00 N ATOM 1297 CA ARG A 81 10.776 20.328 -8.833 1.00 0.00 C ATOM 1298 C ARG A 81 11.158 19.322 -9.908 1.00 0.00 C ATOM 1299 O ARG A 81 10.327 18.620 -10.450 1.00 0.00 O ATOM 1300 CB ARG A 81 11.039 21.745 -9.338 1.00 0.00 C ATOM 1301 CG ARG A 81 9.741 22.552 -9.302 1.00 0.00 C ATOM 1302 CD ARG A 81 9.510 23.212 -10.662 1.00 0.00 C ATOM 1303 NE ARG A 81 8.241 23.992 -10.627 1.00 0.00 N ATOM 1304 CZ ARG A 81 7.220 23.610 -11.346 1.00 0.00 C ATOM 1305 NH1 ARG A 81 6.549 22.543 -11.008 1.00 0.00 N ATOM 1306 NH2 ARG A 81 6.872 24.296 -12.399 1.00 0.00 N ATOM 0 H ARG A 81 12.291 20.794 -7.402 1.00 0.00 H new ATOM 0 HA ARG A 81 9.720 20.239 -8.580 1.00 0.00 H new ATOM 0 HB2 ARG A 81 11.796 22.227 -8.720 1.00 0.00 H new ATOM 0 HB3 ARG A 81 11.431 21.713 -10.355 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.903 21.901 -9.055 1.00 0.00 H new ATOM 0 HG3 ARG A 81 9.795 23.312 -8.522 1.00 0.00 H new ATOM 0 HD2 ARG A 81 10.346 23.868 -10.906 1.00 0.00 H new ATOM 0 HD3 ARG A 81 9.461 22.453 -11.443 1.00 0.00 H new ATOM 0 HE ARG A 81 8.170 24.824 -10.042 1.00 0.00 H new ATOM 0 HH11 ARG A 81 6.822 22.009 -10.183 1.00 0.00 H new ATOM 0 HH12 ARG A 81 5.751 22.243 -11.569 1.00 0.00 H new ATOM 0 HH21 ARG A 81 7.397 25.130 -12.661 1.00 0.00 H new ATOM 0 HH22 ARG A 81 6.075 23.998 -12.961 1.00 0.00 H new ATOM 1320 N PHE A 82 12.426 19.216 -10.179 1.00 0.00 N ATOM 1321 CA PHE A 82 12.900 18.235 -11.161 1.00 0.00 C ATOM 1322 C PHE A 82 12.595 16.852 -10.588 1.00 0.00 C ATOM 1323 O PHE A 82 12.369 15.900 -11.309 1.00 0.00 O ATOM 1324 CB PHE A 82 14.399 18.449 -11.362 1.00 0.00 C ATOM 1325 CG PHE A 82 14.622 19.354 -12.550 1.00 0.00 C ATOM 1326 CD1 PHE A 82 13.986 20.600 -12.610 1.00 0.00 C ATOM 1327 CD2 PHE A 82 15.465 18.949 -13.591 1.00 0.00 C ATOM 1328 CE1 PHE A 82 14.192 21.441 -13.710 1.00 0.00 C ATOM 1329 CE2 PHE A 82 15.672 19.790 -14.692 1.00 0.00 C ATOM 1330 CZ PHE A 82 15.036 21.034 -14.752 1.00 0.00 C ATOM 0 H PHE A 82 13.158 19.782 -9.749 1.00 0.00 H new ATOM 0 HA PHE A 82 12.413 18.337 -12.131 1.00 0.00 H new ATOM 0 HB2 PHE A 82 14.838 18.891 -10.467 1.00 0.00 H new ATOM 0 HB3 PHE A 82 14.896 17.492 -11.522 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.336 20.913 -11.807 1.00 0.00 H new ATOM 0 HD2 PHE A 82 15.956 17.988 -13.546 1.00 0.00 H new ATOM 0 HE1 PHE A 82 13.701 22.402 -13.756 1.00 0.00 H new ATOM 0 HE2 PHE A 82 16.323 19.477 -15.495 1.00 0.00 H new ATOM 0 HZ PHE A 82 15.195 21.681 -15.602 1.00 0.00 H new ATOM 1340 N LEU A 83 12.558 16.744 -9.278 1.00 0.00 N ATOM 1341 CA LEU A 83 12.239 15.445 -8.637 1.00 0.00 C ATOM 1342 C LEU A 83 10.810 15.069 -8.998 1.00 0.00 C ATOM 1343 O LEU A 83 10.462 13.914 -9.136 1.00 0.00 O ATOM 1344 CB LEU A 83 12.383 15.615 -7.125 1.00 0.00 C ATOM 1345 CG LEU A 83 13.854 15.445 -6.742 1.00 0.00 C ATOM 1346 CD1 LEU A 83 14.060 15.778 -5.262 1.00 0.00 C ATOM 1347 CD2 LEU A 83 14.273 13.998 -6.984 1.00 0.00 C ATOM 0 H LEU A 83 12.738 17.511 -8.630 1.00 0.00 H new ATOM 0 HA LEU A 83 12.910 14.657 -8.978 1.00 0.00 H new ATOM 0 HB2 LEU A 83 12.026 16.599 -6.821 1.00 0.00 H new ATOM 0 HB3 LEU A 83 11.771 14.879 -6.604 1.00 0.00 H new ATOM 0 HG LEU A 83 14.456 16.120 -7.350 1.00 0.00 H new ATOM 0 HD11 LEU A 83 15.112 15.653 -5.004 1.00 0.00 H new ATOM 0 HD12 LEU A 83 13.761 16.810 -5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 83 13.454 15.109 -4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 83 15.321 13.872 -6.712 1.00 0.00 H new ATOM 0 HD22 LEU A 83 13.658 13.335 -6.376 1.00 0.00 H new ATOM 0 HD23 LEU A 83 14.139 13.752 -8.037 1.00 0.00 H new ATOM 1359 N LYS A 84 9.994 16.059 -9.173 1.00 0.00 N ATOM 1360 CA LYS A 84 8.577 15.819 -9.553 1.00 0.00 C ATOM 1361 C LYS A 84 8.538 15.320 -10.995 1.00 0.00 C ATOM 1362 O LYS A 84 7.911 14.326 -11.298 1.00 0.00 O ATOM 1363 CB LYS A 84 7.786 17.124 -9.437 1.00 0.00 C ATOM 1364 CG LYS A 84 6.300 16.807 -9.265 1.00 0.00 C ATOM 1365 CD LYS A 84 5.473 18.062 -9.550 1.00 0.00 C ATOM 1366 CE LYS A 84 4.147 17.663 -10.203 1.00 0.00 C ATOM 1367 NZ LYS A 84 4.333 17.556 -11.678 1.00 0.00 N ATOM 0 H LYS A 84 10.249 17.041 -9.068 1.00 0.00 H new ATOM 0 HA LYS A 84 8.133 15.076 -8.890 1.00 0.00 H new ATOM 0 HB2 LYS A 84 8.145 17.705 -8.588 1.00 0.00 H new ATOM 0 HB3 LYS A 84 7.938 17.734 -10.328 1.00 0.00 H new ATOM 0 HG2 LYS A 84 6.008 16.005 -9.943 1.00 0.00 H new ATOM 0 HG3 LYS A 84 6.108 16.454 -8.252 1.00 0.00 H new ATOM 0 HD2 LYS A 84 5.285 18.605 -8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 84 6.026 18.734 -10.207 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.802 16.711 -9.799 1.00 0.00 H new ATOM 0 HE3 LYS A 84 3.380 18.403 -9.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 3.433 17.285 -12.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.644 18.474 -12.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.053 16.835 -11.886 1.00 0.00 H new ATOM 1381 N ARG A 85 9.216 15.992 -11.890 1.00 0.00 N ATOM 1382 CA ARG A 85 9.216 15.526 -13.302 1.00 0.00 C ATOM 1383 C ARG A 85 9.664 14.074 -13.316 1.00 0.00 C ATOM 1384 O ARG A 85 9.215 13.269 -14.106 1.00 0.00 O ATOM 1385 CB ARG A 85 10.182 16.375 -14.131 1.00 0.00 C ATOM 1386 CG ARG A 85 9.801 17.851 -14.012 1.00 0.00 C ATOM 1387 CD ARG A 85 10.862 18.710 -14.702 1.00 0.00 C ATOM 1388 NE ARG A 85 10.811 20.096 -14.156 1.00 0.00 N ATOM 1389 CZ ARG A 85 10.326 21.065 -14.883 1.00 0.00 C ATOM 1390 NH1 ARG A 85 10.582 21.114 -16.161 1.00 0.00 N ATOM 1391 NH2 ARG A 85 9.584 21.985 -14.331 1.00 0.00 N ATOM 0 H ARG A 85 9.762 16.833 -11.704 1.00 0.00 H new ATOM 0 HA ARG A 85 8.219 15.620 -13.731 1.00 0.00 H new ATOM 0 HB2 ARG A 85 11.204 16.224 -13.784 1.00 0.00 H new ATOM 0 HB3 ARG A 85 10.151 16.064 -15.175 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.826 18.024 -14.467 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.717 18.132 -12.962 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.852 18.281 -14.544 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.690 18.725 -15.778 1.00 0.00 H new ATOM 0 HE ARG A 85 11.155 20.287 -13.215 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.162 20.394 -16.593 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.202 21.872 -16.728 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.383 21.947 -13.332 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.205 22.743 -14.899 1.00 0.00 H new ATOM 1405 N LEU A 86 10.548 13.748 -12.428 1.00 0.00 N ATOM 1406 CA LEU A 86 11.057 12.352 -12.340 1.00 0.00 C ATOM 1407 C LEU A 86 9.953 11.424 -11.808 1.00 0.00 C ATOM 1408 O LEU A 86 9.867 10.277 -12.191 1.00 0.00 O ATOM 1409 CB LEU A 86 12.261 12.314 -11.392 1.00 0.00 C ATOM 1410 CG LEU A 86 12.944 10.943 -11.464 1.00 0.00 C ATOM 1411 CD1 LEU A 86 13.095 10.516 -12.927 1.00 0.00 C ATOM 1412 CD2 LEU A 86 14.327 11.033 -10.818 1.00 0.00 C ATOM 0 H LEU A 86 10.948 14.394 -11.748 1.00 0.00 H new ATOM 0 HA LEU A 86 11.358 12.013 -13.331 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.970 13.097 -11.660 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.936 12.514 -10.371 1.00 0.00 H new ATOM 0 HG LEU A 86 12.337 10.209 -10.935 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.581 9.541 -12.973 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.111 10.453 -13.391 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.701 11.249 -13.459 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.816 10.060 -10.867 1.00 0.00 H new ATOM 0 HD22 LEU A 86 14.930 11.769 -11.350 1.00 0.00 H new ATOM 0 HD23 LEU A 86 14.223 11.334 -9.776 1.00 0.00 H new ATOM 1424 N ASP A 87 9.117 11.898 -10.918 1.00 0.00 N ATOM 1425 CA ASP A 87 8.042 11.023 -10.371 1.00 0.00 C ATOM 1426 C ASP A 87 6.975 10.739 -11.439 1.00 0.00 C ATOM 1427 O ASP A 87 6.553 9.614 -11.620 1.00 0.00 O ATOM 1428 CB ASP A 87 7.391 11.720 -9.173 1.00 0.00 C ATOM 1429 CG ASP A 87 6.315 10.808 -8.575 1.00 0.00 C ATOM 1430 OD1 ASP A 87 6.402 9.610 -8.782 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.426 11.326 -7.921 1.00 0.00 O ATOM 0 H ASP A 87 9.134 12.849 -10.550 1.00 0.00 H new ATOM 0 HA ASP A 87 8.482 10.075 -10.062 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.144 11.953 -8.421 1.00 0.00 H new ATOM 0 HB3 ASP A 87 6.949 12.666 -9.485 1.00 0.00 H new ATOM 1436 N ARG A 88 6.523 11.749 -12.132 1.00 0.00 N ATOM 1437 CA ARG A 88 5.469 11.540 -13.170 1.00 0.00 C ATOM 1438 C ARG A 88 6.037 10.776 -14.375 1.00 0.00 C ATOM 1439 O ARG A 88 5.408 9.886 -14.911 1.00 0.00 O ATOM 1440 CB ARG A 88 4.957 12.902 -13.640 1.00 0.00 C ATOM 1441 CG ARG A 88 3.499 12.775 -14.087 1.00 0.00 C ATOM 1442 CD ARG A 88 2.605 13.585 -13.145 1.00 0.00 C ATOM 1443 NE ARG A 88 1.783 14.539 -13.939 1.00 0.00 N ATOM 1444 CZ ARG A 88 0.560 14.226 -14.273 1.00 0.00 C ATOM 1445 NH1 ARG A 88 0.346 13.335 -15.202 1.00 0.00 N ATOM 1446 NH2 ARG A 88 -0.447 14.804 -13.678 1.00 0.00 N ATOM 0 H ARG A 88 6.838 12.713 -12.025 1.00 0.00 H new ATOM 0 HA ARG A 88 4.658 10.956 -12.735 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.039 13.631 -12.834 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.570 13.268 -14.464 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.388 13.135 -15.110 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.196 11.728 -14.083 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.958 12.917 -12.576 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.216 14.128 -12.424 1.00 0.00 H new ATOM 0 HE ARG A 88 2.175 15.437 -14.222 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.134 12.883 -15.667 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.609 13.090 -15.463 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.279 15.500 -12.952 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -1.402 14.559 -13.939 1.00 0.00 H new ATOM 1460 N ASN A 89 7.213 11.135 -14.811 1.00 0.00 N ATOM 1461 CA ASN A 89 7.820 10.440 -16.005 1.00 0.00 C ATOM 1462 C ASN A 89 8.235 9.013 -15.632 1.00 0.00 C ATOM 1463 O ASN A 89 8.121 8.101 -16.421 1.00 0.00 O ATOM 1464 CB ASN A 89 9.040 11.238 -16.541 1.00 0.00 C ATOM 1465 CG ASN A 89 10.187 10.295 -16.932 1.00 0.00 C ATOM 1466 OD1 ASN A 89 10.099 9.589 -17.917 1.00 0.00 O ATOM 1467 ND2 ASN A 89 11.262 10.255 -16.195 1.00 0.00 N ATOM 0 H ASN A 89 7.785 11.874 -14.402 1.00 0.00 H new ATOM 0 HA ASN A 89 7.071 10.391 -16.795 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.740 11.830 -17.406 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.384 11.938 -15.780 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.029 9.631 -16.445 1.00 0.00 H new ATOM 0 HD22 ASN A 89 11.336 10.848 -15.368 1.00 0.00 H new ATOM 1474 N LEU A 90 8.744 8.819 -14.451 1.00 0.00 N ATOM 1475 CA LEU A 90 9.185 7.451 -14.055 1.00 0.00 C ATOM 1476 C LEU A 90 8.051 6.452 -14.305 1.00 0.00 C ATOM 1477 O LEU A 90 8.258 5.400 -14.875 1.00 0.00 O ATOM 1478 CB LEU A 90 9.561 7.440 -12.574 1.00 0.00 C ATOM 1479 CG LEU A 90 11.046 7.778 -12.418 1.00 0.00 C ATOM 1480 CD1 LEU A 90 11.447 7.650 -10.948 1.00 0.00 C ATOM 1481 CD2 LEU A 90 11.883 6.813 -13.262 1.00 0.00 C ATOM 0 H LEU A 90 8.875 9.542 -13.744 1.00 0.00 H new ATOM 0 HA LEU A 90 10.054 7.167 -14.649 1.00 0.00 H new ATOM 0 HB2 LEU A 90 8.954 8.163 -12.029 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.353 6.461 -12.143 1.00 0.00 H new ATOM 0 HG LEU A 90 11.222 8.800 -12.755 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.504 7.891 -10.837 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.853 8.339 -10.348 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.270 6.629 -10.610 1.00 0.00 H new ATOM 0 HD21 LEU A 90 12.940 7.055 -13.150 1.00 0.00 H new ATOM 0 HD22 LEU A 90 11.707 5.791 -12.927 1.00 0.00 H new ATOM 0 HD23 LEU A 90 11.599 6.906 -14.310 1.00 0.00 H new ATOM 1493 N TRP A 91 6.856 6.772 -13.890 1.00 0.00 N ATOM 1494 CA TRP A 91 5.719 5.846 -14.110 1.00 0.00 C ATOM 1495 C TRP A 91 5.700 5.419 -15.583 1.00 0.00 C ATOM 1496 O TRP A 91 5.407 4.284 -15.901 1.00 0.00 O ATOM 1497 CB TRP A 91 4.414 6.560 -13.731 1.00 0.00 C ATOM 1498 CG TRP A 91 4.340 6.708 -12.253 1.00 0.00 C ATOM 1499 CD1 TRP A 91 4.297 7.887 -11.609 1.00 0.00 C ATOM 1500 CD2 TRP A 91 4.292 5.674 -11.229 1.00 0.00 C ATOM 1501 NE1 TRP A 91 4.233 7.652 -10.247 1.00 0.00 N ATOM 1502 CE2 TRP A 91 4.228 6.301 -9.962 1.00 0.00 C ATOM 1503 CE3 TRP A 91 4.300 4.267 -11.275 1.00 0.00 C ATOM 1504 CZ2 TRP A 91 4.175 5.559 -8.782 1.00 0.00 C ATOM 1505 CZ3 TRP A 91 4.245 3.517 -10.088 1.00 0.00 C ATOM 1506 CH2 TRP A 91 4.184 4.163 -8.845 1.00 0.00 C ATOM 0 H TRP A 91 6.621 7.639 -13.407 1.00 0.00 H new ATOM 0 HA TRP A 91 5.824 4.956 -13.490 1.00 0.00 H new ATOM 0 HB2 TRP A 91 4.371 7.539 -14.208 1.00 0.00 H new ATOM 0 HB3 TRP A 91 3.558 5.991 -14.093 1.00 0.00 H new ATOM 0 HD1 TRP A 91 4.310 8.860 -12.078 1.00 0.00 H new ATOM 0 HE1 TRP A 91 4.194 8.387 -9.540 1.00 0.00 H new ATOM 0 HE3 TRP A 91 4.349 3.761 -12.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 4.127 6.060 -7.826 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 4.250 2.438 -10.133 1.00 0.00 H new ATOM 0 HH2 TRP A 91 4.144 3.581 -7.936 1.00 0.00 H new ATOM 1517 N GLY A 92 6.031 6.310 -16.486 1.00 0.00 N ATOM 1518 CA GLY A 92 6.053 5.935 -17.927 1.00 0.00 C ATOM 1519 C GLY A 92 7.232 4.993 -18.180 1.00 0.00 C ATOM 1520 O GLY A 92 7.107 3.977 -18.834 1.00 0.00 O ATOM 0 H GLY A 92 6.286 7.277 -16.284 1.00 0.00 H new ATOM 0 HA2 GLY A 92 5.117 5.449 -18.204 1.00 0.00 H new ATOM 0 HA3 GLY A 92 6.144 6.827 -18.547 1.00 0.00 H new ATOM 1524 N LEU A 93 8.380 5.337 -17.662 1.00 0.00 N ATOM 1525 CA LEU A 93 9.587 4.498 -17.851 1.00 0.00 C ATOM 1526 C LEU A 93 9.293 3.051 -17.425 1.00 0.00 C ATOM 1527 O LEU A 93 9.797 2.113 -18.009 1.00 0.00 O ATOM 1528 CB LEU A 93 10.703 5.091 -16.994 1.00 0.00 C ATOM 1529 CG LEU A 93 12.086 4.793 -17.597 1.00 0.00 C ATOM 1530 CD1 LEU A 93 12.085 3.479 -18.386 1.00 0.00 C ATOM 1531 CD2 LEU A 93 12.488 5.948 -18.517 1.00 0.00 C ATOM 0 H LEU A 93 8.530 6.180 -17.107 1.00 0.00 H new ATOM 0 HA LEU A 93 9.885 4.484 -18.899 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.565 6.169 -16.908 1.00 0.00 H new ATOM 0 HB3 LEU A 93 10.647 4.681 -15.985 1.00 0.00 H new ATOM 0 HG LEU A 93 12.803 4.690 -16.783 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.078 3.301 -18.798 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.814 2.657 -17.723 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.362 3.543 -19.199 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.468 5.745 -18.949 1.00 0.00 H new ATOM 0 HD22 LEU A 93 11.753 6.050 -19.316 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.530 6.873 -17.942 1.00 0.00 H new ATOM 1543 N ALA A 94 8.477 2.859 -16.419 1.00 0.00 N ATOM 1544 CA ALA A 94 8.160 1.474 -15.972 1.00 0.00 C ATOM 1545 C ALA A 94 6.973 0.940 -16.779 1.00 0.00 C ATOM 1546 O ALA A 94 7.116 0.055 -17.599 1.00 0.00 O ATOM 1547 CB ALA A 94 7.800 1.489 -14.485 1.00 0.00 C ATOM 0 H ALA A 94 8.019 3.602 -15.891 1.00 0.00 H new ATOM 0 HA ALA A 94 9.027 0.832 -16.129 1.00 0.00 H new ATOM 0 HB1 ALA A 94 7.568 0.476 -14.157 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.643 1.872 -13.910 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.932 2.129 -14.327 1.00 0.00 H new ATOM 1553 N GLY A 95 5.800 1.473 -16.556 1.00 0.00 N ATOM 1554 CA GLY A 95 4.611 0.994 -17.316 1.00 0.00 C ATOM 1555 C GLY A 95 3.542 0.479 -16.346 1.00 0.00 C ATOM 1556 O GLY A 95 2.363 0.512 -16.639 1.00 0.00 O ATOM 0 H GLY A 95 5.616 2.217 -15.883 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.205 1.805 -17.921 1.00 0.00 H new ATOM 0 HA3 GLY A 95 4.904 0.200 -18.003 1.00 0.00 H new ATOM 1560 N LEU A 96 3.938 0.002 -15.197 1.00 0.00 N ATOM 1561 CA LEU A 96 2.942 -0.513 -14.222 1.00 0.00 C ATOM 1562 C LEU A 96 2.879 0.429 -13.017 1.00 0.00 C ATOM 1563 O LEU A 96 3.734 1.272 -12.830 1.00 0.00 O ATOM 1564 CB LEU A 96 3.369 -1.901 -13.755 1.00 0.00 C ATOM 1565 CG LEU A 96 2.131 -2.745 -13.443 1.00 0.00 C ATOM 1566 CD1 LEU A 96 1.690 -3.490 -14.703 1.00 0.00 C ATOM 1567 CD2 LEU A 96 2.466 -3.757 -12.345 1.00 0.00 C ATOM 0 H LEU A 96 4.910 -0.052 -14.894 1.00 0.00 H new ATOM 0 HA LEU A 96 1.961 -0.569 -14.694 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.967 -2.387 -14.526 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.998 -1.819 -12.868 1.00 0.00 H new ATOM 0 HG LEU A 96 1.325 -2.094 -13.104 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.808 -4.091 -14.480 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.451 -2.771 -15.486 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.496 -4.140 -15.042 1.00 0.00 H new ATOM 0 HD21 LEU A 96 1.584 -4.358 -12.123 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.273 -4.407 -12.683 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.780 -3.227 -11.446 1.00 0.00 H new ATOM 1579 N ASN A 97 1.872 0.290 -12.197 1.00 0.00 N ATOM 1580 CA ASN A 97 1.749 1.176 -11.004 1.00 0.00 C ATOM 1581 C ASN A 97 1.355 0.339 -9.786 1.00 0.00 C ATOM 1582 O ASN A 97 0.624 0.786 -8.922 1.00 0.00 O ATOM 1583 CB ASN A 97 0.676 2.233 -11.265 1.00 0.00 C ATOM 1584 CG ASN A 97 1.308 3.624 -11.225 1.00 0.00 C ATOM 1585 OD1 ASN A 97 1.584 4.149 -10.164 1.00 0.00 O ATOM 1586 ND2 ASN A 97 1.550 4.251 -12.344 1.00 0.00 N ATOM 0 H ASN A 97 1.128 -0.400 -12.302 1.00 0.00 H new ATOM 0 HA ASN A 97 2.704 1.666 -10.814 1.00 0.00 H new ATOM 0 HB2 ASN A 97 0.210 2.062 -12.236 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -0.112 2.159 -10.516 1.00 0.00 H new ATOM 0 HD21 ASN A 97 1.970 5.180 -12.327 1.00 0.00 H new ATOM 0 HD22 ASN A 97 1.319 3.812 -13.235 1.00 0.00 H new ATOM 1593 N SER A 98 1.830 -0.874 -9.707 1.00 0.00 N ATOM 1594 CA SER A 98 1.483 -1.740 -8.545 1.00 0.00 C ATOM 1595 C SER A 98 2.631 -2.717 -8.282 1.00 0.00 C ATOM 1596 O SER A 98 2.507 -3.907 -8.494 1.00 0.00 O ATOM 1597 CB SER A 98 0.208 -2.526 -8.859 1.00 0.00 C ATOM 1598 OG SER A 98 -0.656 -2.496 -7.732 1.00 0.00 O ATOM 0 H SER A 98 2.445 -1.303 -10.399 1.00 0.00 H new ATOM 0 HA SER A 98 1.320 -1.121 -7.663 1.00 0.00 H new ATOM 0 HB2 SER A 98 -0.293 -2.096 -9.726 1.00 0.00 H new ATOM 0 HB3 SER A 98 0.456 -3.556 -9.113 1.00 0.00 H new ATOM 0 HG SER A 98 -1.473 -2.998 -7.933 1.00 0.00 H new ATOM 1604 N CYS A 99 3.753 -2.224 -7.832 1.00 0.00 N ATOM 1605 CA CYS A 99 4.911 -3.124 -7.569 1.00 0.00 C ATOM 1606 C CYS A 99 5.372 -2.971 -6.113 1.00 0.00 C ATOM 1607 O CYS A 99 6.466 -2.510 -5.860 1.00 0.00 O ATOM 1608 CB CYS A 99 6.060 -2.740 -8.501 1.00 0.00 C ATOM 1609 SG CYS A 99 6.386 -0.967 -8.348 1.00 0.00 S ATOM 0 H CYS A 99 3.917 -1.237 -7.635 1.00 0.00 H new ATOM 0 HA CYS A 99 4.613 -4.158 -7.745 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.955 -3.309 -8.248 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.806 -2.987 -9.532 1.00 0.00 H new ATOM 1614 N PRO A 100 4.524 -3.370 -5.200 1.00 0.00 N ATOM 1615 CA PRO A 100 4.811 -3.303 -3.733 1.00 0.00 C ATOM 1616 C PRO A 100 5.792 -4.409 -3.329 1.00 0.00 C ATOM 1617 O PRO A 100 5.896 -5.428 -3.983 1.00 0.00 O ATOM 1618 CB PRO A 100 3.445 -3.527 -3.099 1.00 0.00 C ATOM 1619 CG PRO A 100 2.603 -4.276 -4.123 1.00 0.00 C ATOM 1620 CD PRO A 100 3.170 -3.941 -5.504 1.00 0.00 C ATOM 0 HA PRO A 100 5.272 -2.365 -3.424 1.00 0.00 H new ATOM 0 HB2 PRO A 100 3.536 -4.103 -2.178 1.00 0.00 H new ATOM 0 HB3 PRO A 100 2.980 -2.577 -2.837 1.00 0.00 H new ATOM 0 HG2 PRO A 100 2.641 -5.350 -3.941 1.00 0.00 H new ATOM 0 HG3 PRO A 100 1.557 -3.978 -4.054 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.241 -4.828 -6.134 1.00 0.00 H new ATOM 0 HD3 PRO A 100 2.542 -3.224 -6.032 1.00 0.00 H new ATOM 1628 N VAL A 101 6.513 -4.216 -2.258 1.00 0.00 N ATOM 1629 CA VAL A 101 7.484 -5.258 -1.819 1.00 0.00 C ATOM 1630 C VAL A 101 7.751 -5.113 -0.318 1.00 0.00 C ATOM 1631 O VAL A 101 7.825 -6.087 0.405 1.00 0.00 O ATOM 1632 CB VAL A 101 8.795 -5.090 -2.590 1.00 0.00 C ATOM 1633 CG1 VAL A 101 9.279 -3.644 -2.465 1.00 0.00 C ATOM 1634 CG2 VAL A 101 9.852 -6.032 -2.011 1.00 0.00 C ATOM 0 H VAL A 101 6.472 -3.384 -1.669 1.00 0.00 H new ATOM 0 HA VAL A 101 7.069 -6.246 -2.018 1.00 0.00 H new ATOM 0 HB VAL A 101 8.631 -5.329 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 101 10.213 -3.524 -3.014 1.00 0.00 H new ATOM 0 HG12 VAL A 101 8.527 -2.972 -2.877 1.00 0.00 H new ATOM 0 HG13 VAL A 101 9.443 -3.405 -1.414 1.00 0.00 H new ATOM 0 HG21 VAL A 101 10.786 -5.912 -2.560 1.00 0.00 H new ATOM 0 HG22 VAL A 101 10.016 -5.793 -0.960 1.00 0.00 H new ATOM 0 HG23 VAL A 101 9.508 -7.063 -2.100 1.00 0.00 H new ATOM 1644 N LYS A 102 7.902 -3.904 0.155 1.00 0.00 N ATOM 1645 CA LYS A 102 8.169 -3.695 1.606 1.00 0.00 C ATOM 1646 C LYS A 102 9.639 -3.989 1.902 1.00 0.00 C ATOM 1647 O LYS A 102 9.986 -5.049 2.386 1.00 0.00 O ATOM 1648 CB LYS A 102 7.282 -4.627 2.435 1.00 0.00 C ATOM 1649 CG LYS A 102 5.901 -4.731 1.782 1.00 0.00 C ATOM 1650 CD LYS A 102 4.819 -4.529 2.844 1.00 0.00 C ATOM 1651 CE LYS A 102 4.770 -3.054 3.249 1.00 0.00 C ATOM 1652 NZ LYS A 102 5.036 -2.932 4.709 1.00 0.00 N ATOM 0 H LYS A 102 7.852 -3.052 -0.403 1.00 0.00 H new ATOM 0 HA LYS A 102 7.946 -2.661 1.868 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.739 -5.614 2.505 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.187 -4.247 3.452 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.800 -3.981 0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 102 5.783 -5.706 1.308 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.850 -4.843 2.455 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.029 -5.149 3.715 1.00 0.00 H new ATOM 0 HE2 LYS A 102 5.510 -2.486 2.685 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.794 -2.632 3.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 4.789 -1.973 5.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.461 -3.627 5.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.044 -3.110 4.894 1.00 0.00 H new ATOM 1666 N GLU A 103 10.503 -3.057 1.615 1.00 0.00 N ATOM 1667 CA GLU A 103 11.952 -3.275 1.878 1.00 0.00 C ATOM 1668 C GLU A 103 12.327 -2.634 3.214 1.00 0.00 C ATOM 1669 O GLU A 103 12.699 -1.481 3.283 1.00 0.00 O ATOM 1670 CB GLU A 103 12.777 -2.638 0.757 1.00 0.00 C ATOM 1671 CG GLU A 103 14.170 -3.271 0.726 1.00 0.00 C ATOM 1672 CD GLU A 103 14.083 -4.669 0.109 1.00 0.00 C ATOM 1673 OE1 GLU A 103 13.756 -4.758 -1.063 1.00 0.00 O ATOM 1674 OE2 GLU A 103 14.344 -5.625 0.819 1.00 0.00 O ATOM 0 H GLU A 103 10.268 -2.151 1.209 1.00 0.00 H new ATOM 0 HA GLU A 103 12.158 -4.345 1.916 1.00 0.00 H new ATOM 0 HB2 GLU A 103 12.279 -2.782 -0.202 1.00 0.00 H new ATOM 0 HB3 GLU A 103 12.858 -1.563 0.916 1.00 0.00 H new ATOM 0 HG2 GLU A 103 14.851 -2.648 0.146 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.576 -3.332 1.736 1.00 0.00 H new ATOM 1681 N ALA A 104 12.232 -3.381 4.279 1.00 0.00 N ATOM 1682 CA ALA A 104 12.579 -2.825 5.617 1.00 0.00 C ATOM 1683 C ALA A 104 13.927 -2.106 5.539 1.00 0.00 C ATOM 1684 O ALA A 104 14.133 -1.084 6.166 1.00 0.00 O ATOM 1685 CB ALA A 104 12.669 -3.966 6.634 1.00 0.00 C ATOM 0 H ALA A 104 11.928 -4.355 4.280 1.00 0.00 H new ATOM 0 HA ALA A 104 11.809 -2.119 5.927 1.00 0.00 H new ATOM 0 HB1 ALA A 104 12.923 -3.561 7.614 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.709 -4.479 6.691 1.00 0.00 H new ATOM 0 HB3 ALA A 104 13.439 -4.671 6.322 1.00 0.00 H new ATOM 1691 N ASN A 105 14.847 -2.628 4.775 1.00 0.00 N ATOM 1692 CA ASN A 105 16.181 -1.971 4.660 1.00 0.00 C ATOM 1693 C ASN A 105 15.992 -0.464 4.471 1.00 0.00 C ATOM 1694 O ASN A 105 14.895 0.010 4.255 1.00 0.00 O ATOM 1695 CB ASN A 105 16.934 -2.544 3.457 1.00 0.00 C ATOM 1696 CG ASN A 105 17.637 -3.840 3.865 1.00 0.00 C ATOM 1697 OD1 ASN A 105 18.785 -4.053 3.533 1.00 0.00 O ATOM 1698 ND2 ASN A 105 16.992 -4.722 4.578 1.00 0.00 N ATOM 0 H ASN A 105 14.733 -3.480 4.226 1.00 0.00 H new ATOM 0 HA ASN A 105 16.755 -2.156 5.568 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.240 -2.736 2.638 1.00 0.00 H new ATOM 0 HB3 ASN A 105 17.664 -1.821 3.093 1.00 0.00 H new ATOM 0 HD21 ASN A 105 17.452 -5.589 4.856 1.00 0.00 H new ATOM 0 HD22 ASN A 105 16.027 -4.545 4.858 1.00 0.00 H new ATOM 1705 N GLN A 106 17.052 0.296 4.553 1.00 0.00 N ATOM 1706 CA GLN A 106 16.922 1.769 4.381 1.00 0.00 C ATOM 1707 C GLN A 106 18.154 2.322 3.662 1.00 0.00 C ATOM 1708 O GLN A 106 19.262 1.864 3.865 1.00 0.00 O ATOM 1709 CB GLN A 106 16.795 2.432 5.754 1.00 0.00 C ATOM 1710 CG GLN A 106 15.777 1.663 6.599 1.00 0.00 C ATOM 1711 CD GLN A 106 15.267 2.561 7.727 1.00 0.00 C ATOM 1712 OE1 GLN A 106 14.077 2.774 7.858 1.00 0.00 O ATOM 1713 NE2 GLN A 106 16.120 3.103 8.552 1.00 0.00 N ATOM 0 H GLN A 106 17.998 -0.040 4.731 1.00 0.00 H new ATOM 0 HA GLN A 106 16.034 1.982 3.786 1.00 0.00 H new ATOM 0 HB2 GLN A 106 17.763 2.445 6.254 1.00 0.00 H new ATOM 0 HB3 GLN A 106 16.480 3.469 5.641 1.00 0.00 H new ATOM 0 HG2 GLN A 106 14.945 1.336 5.976 1.00 0.00 H new ATOM 0 HG3 GLN A 106 16.237 0.766 7.014 1.00 0.00 H new ATOM 0 HE21 GLN A 106 17.118 2.925 8.443 1.00 0.00 H new ATOM 0 HE22 GLN A 106 15.788 3.705 9.306 1.00 0.00 H new ATOM 1722 N SER A 107 17.969 3.308 2.827 1.00 0.00 N ATOM 1723 CA SER A 107 19.124 3.902 2.095 1.00 0.00 C ATOM 1724 C SER A 107 19.032 5.427 2.168 1.00 0.00 C ATOM 1725 O SER A 107 18.177 5.970 2.837 1.00 0.00 O ATOM 1726 CB SER A 107 19.086 3.454 0.631 1.00 0.00 C ATOM 1727 OG SER A 107 20.408 3.202 0.178 1.00 0.00 O ATOM 0 H SER A 107 17.064 3.729 2.619 1.00 0.00 H new ATOM 0 HA SER A 107 20.058 3.569 2.548 1.00 0.00 H new ATOM 0 HB2 SER A 107 18.478 2.555 0.531 1.00 0.00 H new ATOM 0 HB3 SER A 107 18.620 4.224 0.016 1.00 0.00 H new ATOM 0 HG SER A 107 20.384 2.914 -0.758 1.00 0.00 H new ATOM 1733 N THR A 108 19.902 6.125 1.490 1.00 0.00 N ATOM 1734 CA THR A 108 19.850 7.615 1.531 1.00 0.00 C ATOM 1735 C THR A 108 19.487 8.151 0.143 1.00 0.00 C ATOM 1736 O THR A 108 19.890 7.601 -0.862 1.00 0.00 O ATOM 1737 CB THR A 108 21.220 8.158 1.944 1.00 0.00 C ATOM 1738 OG1 THR A 108 22.213 7.650 1.065 1.00 0.00 O ATOM 1739 CG2 THR A 108 21.533 7.725 3.377 1.00 0.00 C ATOM 0 H THR A 108 20.644 5.730 0.912 1.00 0.00 H new ATOM 0 HA THR A 108 19.097 7.935 2.252 1.00 0.00 H new ATOM 0 HB THR A 108 21.210 9.247 1.891 1.00 0.00 H new ATOM 0 HG1 THR A 108 23.091 7.998 1.327 1.00 0.00 H new ATOM 0 HG21 THR A 108 22.509 8.113 3.669 1.00 0.00 H new ATOM 0 HG22 THR A 108 20.771 8.117 4.050 1.00 0.00 H new ATOM 0 HG23 THR A 108 21.543 6.637 3.434 1.00 0.00 H new ATOM 1747 N LEU A 109 18.739 9.222 0.070 1.00 0.00 N ATOM 1748 CA LEU A 109 18.376 9.775 -1.268 1.00 0.00 C ATOM 1749 C LEU A 109 19.654 9.896 -2.091 1.00 0.00 C ATOM 1750 O LEU A 109 19.666 9.614 -3.262 1.00 0.00 O ATOM 1751 CB LEU A 109 17.734 11.163 -1.105 1.00 0.00 C ATOM 1752 CG LEU A 109 17.100 11.657 -2.429 1.00 0.00 C ATOM 1753 CD1 LEU A 109 18.107 11.628 -3.572 1.00 0.00 C ATOM 1754 CD2 LEU A 109 15.910 10.786 -2.821 1.00 0.00 C ATOM 0 H LEU A 109 18.367 9.733 0.871 1.00 0.00 H new ATOM 0 HA LEU A 109 17.663 9.118 -1.765 1.00 0.00 H new ATOM 0 HB2 LEU A 109 16.970 11.122 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 109 18.488 11.877 -0.774 1.00 0.00 H new ATOM 0 HG LEU A 109 16.772 12.682 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 109 17.630 11.981 -4.486 1.00 0.00 H new ATOM 0 HD12 LEU A 109 18.951 12.275 -3.330 1.00 0.00 H new ATOM 0 HD13 LEU A 109 18.462 10.608 -3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 109 15.482 11.153 -3.754 1.00 0.00 H new ATOM 0 HD22 LEU A 109 16.241 9.756 -2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 109 15.156 10.826 -2.035 1.00 0.00 H new ATOM 1766 N GLU A 110 20.733 10.310 -1.499 1.00 0.00 N ATOM 1767 CA GLU A 110 21.986 10.438 -2.289 1.00 0.00 C ATOM 1768 C GLU A 110 22.200 9.146 -3.079 1.00 0.00 C ATOM 1769 O GLU A 110 22.446 9.167 -4.269 1.00 0.00 O ATOM 1770 CB GLU A 110 23.167 10.663 -1.342 1.00 0.00 C ATOM 1771 CG GLU A 110 24.346 11.244 -2.127 1.00 0.00 C ATOM 1772 CD GLU A 110 25.424 10.172 -2.301 1.00 0.00 C ATOM 1773 OE1 GLU A 110 25.786 9.559 -1.309 1.00 0.00 O ATOM 1774 OE2 GLU A 110 25.870 9.983 -3.420 1.00 0.00 O ATOM 0 H GLU A 110 20.804 10.563 -0.514 1.00 0.00 H new ATOM 0 HA GLU A 110 21.912 11.284 -2.973 1.00 0.00 H new ATOM 0 HB2 GLU A 110 22.880 11.343 -0.540 1.00 0.00 H new ATOM 0 HB3 GLU A 110 23.456 9.722 -0.874 1.00 0.00 H new ATOM 0 HG2 GLU A 110 24.009 11.597 -3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 110 24.757 12.106 -1.601 1.00 0.00 H new ATOM 1781 N ASN A 111 22.105 8.024 -2.426 1.00 0.00 N ATOM 1782 CA ASN A 111 22.296 6.726 -3.132 1.00 0.00 C ATOM 1783 C ASN A 111 21.114 6.437 -4.059 1.00 0.00 C ATOM 1784 O ASN A 111 21.265 5.768 -5.047 1.00 0.00 O ATOM 1785 CB ASN A 111 22.442 5.590 -2.116 1.00 0.00 C ATOM 1786 CG ASN A 111 23.244 4.446 -2.742 1.00 0.00 C ATOM 1787 OD1 ASN A 111 23.843 4.610 -3.787 1.00 0.00 O ATOM 1788 ND2 ASN A 111 23.284 3.288 -2.142 1.00 0.00 N ATOM 0 H ASN A 111 21.902 7.948 -1.429 1.00 0.00 H new ATOM 0 HA ASN A 111 23.204 6.793 -3.731 1.00 0.00 H new ATOM 0 HB2 ASN A 111 22.944 5.952 -1.219 1.00 0.00 H new ATOM 0 HB3 ASN A 111 21.459 5.234 -1.809 1.00 0.00 H new ATOM 0 HD21 ASN A 111 23.818 2.520 -2.550 1.00 0.00 H new ATOM 0 HD22 ASN A 111 22.781 3.150 -1.265 1.00 0.00 H new ATOM 1795 N PHE A 112 19.938 6.904 -3.758 1.00 0.00 N ATOM 1796 CA PHE A 112 18.789 6.615 -4.670 1.00 0.00 C ATOM 1797 C PHE A 112 19.000 7.348 -5.981 1.00 0.00 C ATOM 1798 O PHE A 112 18.687 6.856 -7.037 1.00 0.00 O ATOM 1799 CB PHE A 112 17.499 7.134 -4.044 1.00 0.00 C ATOM 1800 CG PHE A 112 16.319 6.665 -4.861 1.00 0.00 C ATOM 1801 CD1 PHE A 112 15.877 7.435 -5.944 1.00 0.00 C ATOM 1802 CD2 PHE A 112 15.671 5.468 -4.541 1.00 0.00 C ATOM 1803 CE1 PHE A 112 14.785 7.006 -6.709 1.00 0.00 C ATOM 1804 CE2 PHE A 112 14.578 5.039 -5.305 1.00 0.00 C ATOM 1805 CZ PHE A 112 14.136 5.809 -6.389 1.00 0.00 C ATOM 0 H PHE A 112 19.719 7.465 -2.935 1.00 0.00 H new ATOM 0 HA PHE A 112 18.724 5.540 -4.835 1.00 0.00 H new ATOM 0 HB2 PHE A 112 17.410 6.776 -3.018 1.00 0.00 H new ATOM 0 HB3 PHE A 112 17.515 8.223 -4.001 1.00 0.00 H new ATOM 0 HD1 PHE A 112 16.378 8.360 -6.189 1.00 0.00 H new ATOM 0 HD2 PHE A 112 16.013 4.875 -3.706 1.00 0.00 H new ATOM 0 HE1 PHE A 112 14.444 7.599 -7.545 1.00 0.00 H new ATOM 0 HE2 PHE A 112 14.076 4.115 -5.059 1.00 0.00 H new ATOM 0 HZ PHE A 112 13.293 5.478 -6.978 1.00 0.00 H new ATOM 1815 N LEU A 113 19.510 8.532 -5.923 1.00 0.00 N ATOM 1816 CA LEU A 113 19.737 9.290 -7.159 1.00 0.00 C ATOM 1817 C LEU A 113 20.917 8.654 -7.920 1.00 0.00 C ATOM 1818 O LEU A 113 20.932 8.617 -9.134 1.00 0.00 O ATOM 1819 CB LEU A 113 20.007 10.759 -6.797 1.00 0.00 C ATOM 1820 CG LEU A 113 18.897 11.643 -7.375 1.00 0.00 C ATOM 1821 CD1 LEU A 113 19.324 13.109 -7.293 1.00 0.00 C ATOM 1822 CD2 LEU A 113 18.640 11.268 -8.836 1.00 0.00 C ATOM 0 H LEU A 113 19.781 9.009 -5.063 1.00 0.00 H new ATOM 0 HA LEU A 113 18.862 9.260 -7.809 1.00 0.00 H new ATOM 0 HB2 LEU A 113 20.051 10.875 -5.714 1.00 0.00 H new ATOM 0 HB3 LEU A 113 20.975 11.069 -7.191 1.00 0.00 H new ATOM 0 HG LEU A 113 17.982 11.493 -6.801 1.00 0.00 H new ATOM 0 HD11 LEU A 113 18.536 13.741 -7.704 1.00 0.00 H new ATOM 0 HD12 LEU A 113 19.500 13.379 -6.252 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.240 13.254 -7.865 1.00 0.00 H new ATOM 0 HD21 LEU A 113 17.850 11.900 -9.240 1.00 0.00 H new ATOM 0 HD22 LEU A 113 19.552 11.413 -9.415 1.00 0.00 H new ATOM 0 HD23 LEU A 113 18.335 10.223 -8.895 1.00 0.00 H new ATOM 1834 N GLU A 114 21.902 8.129 -7.215 1.00 0.00 N ATOM 1835 CA GLU A 114 23.059 7.476 -7.890 1.00 0.00 C ATOM 1836 C GLU A 114 22.604 6.149 -8.505 1.00 0.00 C ATOM 1837 O GLU A 114 22.840 5.857 -9.661 1.00 0.00 O ATOM 1838 CB GLU A 114 24.127 7.198 -6.838 1.00 0.00 C ATOM 1839 CG GLU A 114 25.478 7.739 -7.299 1.00 0.00 C ATOM 1840 CD GLU A 114 25.721 7.353 -8.759 1.00 0.00 C ATOM 1841 OE1 GLU A 114 25.083 6.419 -9.218 1.00 0.00 O ATOM 1842 OE2 GLU A 114 26.540 7.997 -9.393 1.00 0.00 O ATOM 0 H GLU A 114 21.945 8.130 -6.196 1.00 0.00 H new ATOM 0 HA GLU A 114 23.454 8.122 -8.674 1.00 0.00 H new ATOM 0 HB2 GLU A 114 23.845 7.662 -5.893 1.00 0.00 H new ATOM 0 HB3 GLU A 114 24.199 6.125 -6.658 1.00 0.00 H new ATOM 0 HG2 GLU A 114 25.501 8.823 -7.191 1.00 0.00 H new ATOM 0 HG3 GLU A 114 26.274 7.339 -6.670 1.00 0.00 H new ATOM 1849 N ARG A 115 21.952 5.350 -7.709 1.00 0.00 N ATOM 1850 CA ARG A 115 21.451 4.024 -8.161 1.00 0.00 C ATOM 1851 C ARG A 115 20.418 4.222 -9.261 1.00 0.00 C ATOM 1852 O ARG A 115 20.501 3.651 -10.328 1.00 0.00 O ATOM 1853 CB ARG A 115 20.775 3.341 -6.965 1.00 0.00 C ATOM 1854 CG ARG A 115 21.011 1.831 -7.031 1.00 0.00 C ATOM 1855 CD ARG A 115 22.511 1.543 -6.954 1.00 0.00 C ATOM 1856 NE ARG A 115 22.732 0.223 -6.299 1.00 0.00 N ATOM 1857 CZ ARG A 115 23.272 -0.758 -6.969 1.00 0.00 C ATOM 1858 NH1 ARG A 115 23.013 -0.901 -8.239 1.00 0.00 N ATOM 1859 NH2 ARG A 115 24.073 -1.596 -6.367 1.00 0.00 N ATOM 0 H ARG A 115 21.740 5.568 -6.735 1.00 0.00 H new ATOM 0 HA ARG A 115 22.274 3.418 -8.540 1.00 0.00 H new ATOM 0 HB2 ARG A 115 21.174 3.741 -6.033 1.00 0.00 H new ATOM 0 HB3 ARG A 115 19.706 3.552 -6.970 1.00 0.00 H new ATOM 0 HG2 ARG A 115 20.493 1.335 -6.210 1.00 0.00 H new ATOM 0 HG3 ARG A 115 20.600 1.429 -7.957 1.00 0.00 H new ATOM 0 HD2 ARG A 115 22.943 1.541 -7.955 1.00 0.00 H new ATOM 0 HD3 ARG A 115 23.014 2.329 -6.391 1.00 0.00 H new ATOM 0 HE ARG A 115 22.461 0.086 -5.325 1.00 0.00 H new ATOM 0 HH11 ARG A 115 22.388 -0.246 -8.709 1.00 0.00 H new ATOM 0 HH12 ARG A 115 23.435 -1.668 -8.762 1.00 0.00 H new ATOM 0 HH21 ARG A 115 24.276 -1.483 -5.374 1.00 0.00 H new ATOM 0 HH22 ARG A 115 24.495 -2.363 -6.890 1.00 0.00 H new ATOM 1873 N LEU A 116 19.453 5.047 -9.002 1.00 0.00 N ATOM 1874 CA LEU A 116 18.403 5.321 -10.014 1.00 0.00 C ATOM 1875 C LEU A 116 19.084 5.674 -11.348 1.00 0.00 C ATOM 1876 O LEU A 116 18.637 5.262 -12.400 1.00 0.00 O ATOM 1877 CB LEU A 116 17.554 6.505 -9.539 1.00 0.00 C ATOM 1878 CG LEU A 116 16.331 6.646 -10.446 1.00 0.00 C ATOM 1879 CD1 LEU A 116 15.239 5.679 -9.984 1.00 0.00 C ATOM 1880 CD2 LEU A 116 15.803 8.081 -10.375 1.00 0.00 C ATOM 0 H LEU A 116 19.344 5.551 -8.122 1.00 0.00 H new ATOM 0 HA LEU A 116 17.766 4.447 -10.148 1.00 0.00 H new ATOM 0 HB2 LEU A 116 17.240 6.351 -8.507 1.00 0.00 H new ATOM 0 HB3 LEU A 116 18.144 7.421 -9.559 1.00 0.00 H new ATOM 0 HG LEU A 116 16.613 6.413 -11.473 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.367 5.779 -10.630 1.00 0.00 H new ATOM 0 HD12 LEU A 116 15.613 4.656 -10.035 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.958 5.911 -8.957 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.931 8.180 -11.022 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.521 8.315 -9.348 1.00 0.00 H new ATOM 0 HD23 LEU A 116 16.580 8.771 -10.704 1.00 0.00 H new ATOM 1892 N LYS A 117 20.165 6.436 -11.323 1.00 0.00 N ATOM 1893 CA LYS A 117 20.840 6.794 -12.605 1.00 0.00 C ATOM 1894 C LYS A 117 21.524 5.567 -13.215 1.00 0.00 C ATOM 1895 O LYS A 117 21.518 5.377 -14.415 1.00 0.00 O ATOM 1896 CB LYS A 117 21.893 7.865 -12.341 1.00 0.00 C ATOM 1897 CG LYS A 117 21.324 9.236 -12.706 1.00 0.00 C ATOM 1898 CD LYS A 117 22.218 9.896 -13.758 1.00 0.00 C ATOM 1899 CE LYS A 117 23.310 10.712 -13.063 1.00 0.00 C ATOM 1900 NZ LYS A 117 24.413 10.988 -14.027 1.00 0.00 N ATOM 0 H LYS A 117 20.596 6.815 -10.480 1.00 0.00 H new ATOM 0 HA LYS A 117 20.088 7.166 -13.301 1.00 0.00 H new ATOM 0 HB2 LYS A 117 22.189 7.849 -11.292 1.00 0.00 H new ATOM 0 HB3 LYS A 117 22.789 7.663 -12.928 1.00 0.00 H new ATOM 0 HG2 LYS A 117 20.310 9.130 -13.090 1.00 0.00 H new ATOM 0 HG3 LYS A 117 21.264 9.865 -11.818 1.00 0.00 H new ATOM 0 HD2 LYS A 117 22.668 9.136 -14.396 1.00 0.00 H new ATOM 0 HD3 LYS A 117 21.622 10.542 -14.403 1.00 0.00 H new ATOM 0 HE2 LYS A 117 22.897 11.649 -12.689 1.00 0.00 H new ATOM 0 HE3 LYS A 117 23.694 10.166 -12.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 25.156 11.543 -13.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 24.813 10.089 -14.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 24.041 11.525 -14.836 1.00 0.00 H new ATOM 1914 N THR A 118 22.138 4.744 -12.407 1.00 0.00 N ATOM 1915 CA THR A 118 22.844 3.550 -12.957 1.00 0.00 C ATOM 1916 C THR A 118 21.854 2.609 -13.657 1.00 0.00 C ATOM 1917 O THR A 118 22.196 1.943 -14.614 1.00 0.00 O ATOM 1918 CB THR A 118 23.570 2.812 -11.820 1.00 0.00 C ATOM 1919 OG1 THR A 118 24.653 2.068 -12.360 1.00 0.00 O ATOM 1920 CG2 THR A 118 22.613 1.860 -11.095 1.00 0.00 C ATOM 0 H THR A 118 22.181 4.846 -11.393 1.00 0.00 H new ATOM 0 HA THR A 118 23.575 3.881 -13.695 1.00 0.00 H new ATOM 0 HB THR A 118 23.940 3.547 -11.105 1.00 0.00 H new ATOM 0 HG1 THR A 118 25.119 1.597 -11.638 1.00 0.00 H new ATOM 0 HG21 THR A 118 23.147 1.348 -10.294 1.00 0.00 H new ATOM 0 HG22 THR A 118 21.784 2.429 -10.673 1.00 0.00 H new ATOM 0 HG23 THR A 118 22.226 1.125 -11.801 1.00 0.00 H new ATOM 1928 N ILE A 119 20.636 2.537 -13.192 1.00 0.00 N ATOM 1929 CA ILE A 119 19.652 1.628 -13.841 1.00 0.00 C ATOM 1930 C ILE A 119 19.268 2.162 -15.224 1.00 0.00 C ATOM 1931 O ILE A 119 19.171 1.418 -16.173 1.00 0.00 O ATOM 1932 CB ILE A 119 18.415 1.510 -12.974 1.00 0.00 C ATOM 1933 CG1 ILE A 119 18.794 0.847 -11.652 1.00 0.00 C ATOM 1934 CG2 ILE A 119 17.358 0.663 -13.686 1.00 0.00 C ATOM 1935 CD1 ILE A 119 18.677 1.866 -10.522 1.00 0.00 C ATOM 0 H ILE A 119 20.282 3.066 -12.395 1.00 0.00 H new ATOM 0 HA ILE A 119 20.105 0.644 -13.958 1.00 0.00 H new ATOM 0 HB ILE A 119 18.007 2.503 -12.787 1.00 0.00 H new ATOM 0 HG12 ILE A 119 18.140 -0.004 -11.459 1.00 0.00 H new ATOM 0 HG13 ILE A 119 19.812 0.461 -11.705 1.00 0.00 H new ATOM 0 HG21 ILE A 119 16.472 0.583 -13.057 1.00 0.00 H new ATOM 0 HG22 ILE A 119 17.090 1.135 -14.631 1.00 0.00 H new ATOM 0 HG23 ILE A 119 17.758 -0.333 -13.878 1.00 0.00 H new ATOM 0 HD11 ILE A 119 18.947 1.394 -9.577 1.00 0.00 H new ATOM 0 HD12 ILE A 119 19.349 2.702 -10.715 1.00 0.00 H new ATOM 0 HD13 ILE A 119 17.651 2.230 -10.465 1.00 0.00 H new ATOM 1947 N MET A 120 19.040 3.441 -15.341 1.00 0.00 N ATOM 1948 CA MET A 120 18.654 4.018 -16.666 1.00 0.00 C ATOM 1949 C MET A 120 19.839 3.991 -17.624 1.00 0.00 C ATOM 1950 O MET A 120 19.673 3.830 -18.810 1.00 0.00 O ATOM 1951 CB MET A 120 18.195 5.460 -16.476 1.00 0.00 C ATOM 1952 CG MET A 120 16.861 5.480 -15.729 1.00 0.00 C ATOM 1953 SD MET A 120 17.014 6.483 -14.233 1.00 0.00 S ATOM 1954 CE MET A 120 15.465 5.963 -13.454 1.00 0.00 C ATOM 0 H MET A 120 19.104 4.114 -14.578 1.00 0.00 H new ATOM 0 HA MET A 120 17.845 3.421 -17.087 1.00 0.00 H new ATOM 0 HB2 MET A 120 18.945 6.020 -15.917 1.00 0.00 H new ATOM 0 HB3 MET A 120 18.088 5.949 -17.444 1.00 0.00 H new ATOM 0 HG2 MET A 120 16.080 5.885 -16.372 1.00 0.00 H new ATOM 0 HG3 MET A 120 16.564 4.464 -15.468 1.00 0.00 H new ATOM 0 HE1 MET A 120 15.006 6.815 -12.953 1.00 0.00 H new ATOM 0 HE2 MET A 120 14.785 5.580 -14.215 1.00 0.00 H new ATOM 0 HE3 MET A 120 15.670 5.180 -12.724 1.00 0.00 H new ATOM 1964 N ARG A 121 21.029 4.152 -17.132 1.00 0.00 N ATOM 1965 CA ARG A 121 22.204 4.125 -18.045 1.00 0.00 C ATOM 1966 C ARG A 121 22.333 2.720 -18.632 1.00 0.00 C ATOM 1967 O ARG A 121 22.583 2.544 -19.808 1.00 0.00 O ATOM 1968 CB ARG A 121 23.471 4.467 -17.261 1.00 0.00 C ATOM 1969 CG ARG A 121 23.838 5.935 -17.496 1.00 0.00 C ATOM 1970 CD ARG A 121 24.985 6.020 -18.504 1.00 0.00 C ATOM 1971 NE ARG A 121 26.155 5.252 -17.992 1.00 0.00 N ATOM 1972 CZ ARG A 121 27.340 5.452 -18.501 1.00 0.00 C ATOM 1973 NH1 ARG A 121 27.824 6.663 -18.576 1.00 0.00 N ATOM 1974 NH2 ARG A 121 28.042 4.441 -18.936 1.00 0.00 N ATOM 0 H ARG A 121 21.242 4.300 -16.146 1.00 0.00 H new ATOM 0 HA ARG A 121 22.071 4.854 -18.844 1.00 0.00 H new ATOM 0 HB2 ARG A 121 23.313 4.287 -16.198 1.00 0.00 H new ATOM 0 HB3 ARG A 121 24.291 3.821 -17.575 1.00 0.00 H new ATOM 0 HG2 ARG A 121 22.972 6.482 -17.868 1.00 0.00 H new ATOM 0 HG3 ARG A 121 24.131 6.403 -16.556 1.00 0.00 H new ATOM 0 HD2 ARG A 121 24.667 5.620 -19.467 1.00 0.00 H new ATOM 0 HD3 ARG A 121 25.263 7.061 -18.667 1.00 0.00 H new ATOM 0 HE ARG A 121 26.030 4.570 -17.244 1.00 0.00 H new ATOM 0 HH11 ARG A 121 27.276 7.453 -18.237 1.00 0.00 H new ATOM 0 HH12 ARG A 121 28.750 6.818 -18.974 1.00 0.00 H new ATOM 0 HH21 ARG A 121 27.664 3.495 -18.878 1.00 0.00 H new ATOM 0 HH22 ARG A 121 28.968 4.597 -19.334 1.00 0.00 H new ATOM 1988 N GLU A 122 22.158 1.715 -17.817 1.00 0.00 N ATOM 1989 CA GLU A 122 22.264 0.316 -18.322 1.00 0.00 C ATOM 1990 C GLU A 122 21.062 0.001 -19.223 1.00 0.00 C ATOM 1991 O GLU A 122 21.197 -0.669 -20.228 1.00 0.00 O ATOM 1992 CB GLU A 122 22.295 -0.672 -17.140 1.00 0.00 C ATOM 1993 CG GLU A 122 23.539 -0.447 -16.263 1.00 0.00 C ATOM 1994 CD GLU A 122 23.254 -0.950 -14.846 1.00 0.00 C ATOM 1995 OE1 GLU A 122 22.444 -0.335 -14.171 1.00 0.00 O ATOM 1996 OE2 GLU A 122 23.850 -1.943 -14.460 1.00 0.00 O ATOM 0 H GLU A 122 21.946 1.802 -16.823 1.00 0.00 H new ATOM 0 HA GLU A 122 23.186 0.215 -18.895 1.00 0.00 H new ATOM 0 HB2 GLU A 122 21.395 -0.551 -16.537 1.00 0.00 H new ATOM 0 HB3 GLU A 122 22.292 -1.695 -17.517 1.00 0.00 H new ATOM 0 HG2 GLU A 122 24.395 -0.974 -16.684 1.00 0.00 H new ATOM 0 HG3 GLU A 122 23.796 0.612 -16.241 1.00 0.00 H new ATOM 2003 N LYS A 123 19.889 0.477 -18.886 1.00 0.00 N ATOM 2004 CA LYS A 123 18.704 0.192 -19.744 1.00 0.00 C ATOM 2005 C LYS A 123 18.833 0.973 -21.051 1.00 0.00 C ATOM 2006 O LYS A 123 18.347 0.565 -22.086 1.00 0.00 O ATOM 2007 CB LYS A 123 17.429 0.621 -19.016 1.00 0.00 C ATOM 2008 CG LYS A 123 16.811 -0.591 -18.316 1.00 0.00 C ATOM 2009 CD LYS A 123 15.776 -1.240 -19.237 1.00 0.00 C ATOM 2010 CE LYS A 123 16.215 -2.668 -19.571 1.00 0.00 C ATOM 2011 NZ LYS A 123 15.047 -3.588 -19.447 1.00 0.00 N ATOM 0 H LYS A 123 19.704 1.046 -18.060 1.00 0.00 H new ATOM 0 HA LYS A 123 18.654 -0.876 -19.957 1.00 0.00 H new ATOM 0 HB2 LYS A 123 17.657 1.398 -18.287 1.00 0.00 H new ATOM 0 HB3 LYS A 123 16.718 1.047 -19.724 1.00 0.00 H new ATOM 0 HG2 LYS A 123 17.588 -1.311 -18.060 1.00 0.00 H new ATOM 0 HG3 LYS A 123 16.340 -0.284 -17.382 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.799 -1.252 -18.753 1.00 0.00 H new ATOM 0 HD3 LYS A 123 15.671 -0.657 -20.152 1.00 0.00 H new ATOM 0 HE2 LYS A 123 16.618 -2.709 -20.583 1.00 0.00 H new ATOM 0 HE3 LYS A 123 17.012 -2.982 -18.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 15.344 -4.559 -19.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 14.682 -3.556 -18.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 14.300 -3.292 -20.107 1.00 0.00 H new ATOM 2025 N TYR A 124 19.483 2.097 -20.998 1.00 0.00 N ATOM 2026 CA TYR A 124 19.657 2.937 -22.210 1.00 0.00 C ATOM 2027 C TYR A 124 20.619 2.245 -23.178 1.00 0.00 C ATOM 2028 O TYR A 124 20.540 2.421 -24.377 1.00 0.00 O ATOM 2029 CB TYR A 124 20.216 4.302 -21.795 1.00 0.00 C ATOM 2030 CG TYR A 124 20.156 5.243 -22.969 1.00 0.00 C ATOM 2031 CD1 TYR A 124 18.918 5.611 -23.512 1.00 0.00 C ATOM 2032 CD2 TYR A 124 21.338 5.745 -23.517 1.00 0.00 C ATOM 2033 CE1 TYR A 124 18.867 6.483 -24.607 1.00 0.00 C ATOM 2034 CE2 TYR A 124 21.289 6.616 -24.610 1.00 0.00 C ATOM 2035 CZ TYR A 124 20.054 6.985 -25.156 1.00 0.00 C ATOM 2036 OH TYR A 124 20.005 7.845 -26.235 1.00 0.00 O ATOM 0 H TYR A 124 19.908 2.476 -20.152 1.00 0.00 H new ATOM 0 HA TYR A 124 18.697 3.076 -22.708 1.00 0.00 H new ATOM 0 HB2 TYR A 124 19.641 4.705 -20.962 1.00 0.00 H new ATOM 0 HB3 TYR A 124 21.245 4.197 -21.451 1.00 0.00 H new ATOM 0 HD1 TYR A 124 18.004 5.223 -23.087 1.00 0.00 H new ATOM 0 HD2 TYR A 124 22.291 5.460 -23.096 1.00 0.00 H new ATOM 0 HE1 TYR A 124 17.914 6.768 -25.027 1.00 0.00 H new ATOM 0 HE2 TYR A 124 22.204 7.004 -25.033 1.00 0.00 H new ATOM 0 HH TYR A 124 20.420 8.699 -25.992 1.00 0.00 H new ATOM 2046 N SER A 125 21.532 1.469 -22.668 1.00 0.00 N ATOM 2047 CA SER A 125 22.497 0.775 -23.563 1.00 0.00 C ATOM 2048 C SER A 125 21.851 -0.486 -24.153 1.00 0.00 C ATOM 2049 O SER A 125 22.519 -1.304 -24.754 1.00 0.00 O ATOM 2050 CB SER A 125 23.741 0.382 -22.762 1.00 0.00 C ATOM 2051 OG SER A 125 24.904 0.650 -23.531 1.00 0.00 O ATOM 0 H SER A 125 21.652 1.285 -21.672 1.00 0.00 H new ATOM 0 HA SER A 125 22.779 1.446 -24.375 1.00 0.00 H new ATOM 0 HB2 SER A 125 23.775 0.939 -21.826 1.00 0.00 H new ATOM 0 HB3 SER A 125 23.700 -0.676 -22.502 1.00 0.00 H new ATOM 0 HG SER A 125 25.700 0.400 -23.018 1.00 0.00 H new ATOM 2057 N LYS A 126 20.564 -0.658 -23.988 1.00 0.00 N ATOM 2058 CA LYS A 126 19.909 -1.874 -24.549 1.00 0.00 C ATOM 2059 C LYS A 126 18.419 -1.608 -24.794 1.00 0.00 C ATOM 2060 O LYS A 126 18.032 -1.163 -25.855 1.00 0.00 O ATOM 2061 CB LYS A 126 20.065 -3.035 -23.564 1.00 0.00 C ATOM 2062 CG LYS A 126 19.265 -4.238 -24.067 1.00 0.00 C ATOM 2063 CD LYS A 126 19.729 -5.502 -23.340 1.00 0.00 C ATOM 2064 CE LYS A 126 19.692 -5.266 -21.829 1.00 0.00 C ATOM 2065 NZ LYS A 126 19.937 -6.553 -21.120 1.00 0.00 N ATOM 0 H LYS A 126 19.945 -0.015 -23.494 1.00 0.00 H new ATOM 0 HA LYS A 126 20.383 -2.128 -25.497 1.00 0.00 H new ATOM 0 HB2 LYS A 126 21.117 -3.301 -23.462 1.00 0.00 H new ATOM 0 HB3 LYS A 126 19.714 -2.738 -22.576 1.00 0.00 H new ATOM 0 HG2 LYS A 126 18.201 -4.077 -23.895 1.00 0.00 H new ATOM 0 HG3 LYS A 126 19.401 -4.354 -25.142 1.00 0.00 H new ATOM 0 HD2 LYS A 126 19.086 -6.342 -23.603 1.00 0.00 H new ATOM 0 HD3 LYS A 126 20.740 -5.764 -23.653 1.00 0.00 H new ATOM 0 HE2 LYS A 126 20.447 -4.533 -21.546 1.00 0.00 H new ATOM 0 HE3 LYS A 126 18.725 -4.856 -21.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 19.912 -6.394 -20.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 19.201 -7.239 -21.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 20.870 -6.926 -21.390 1.00 0.00 H new ATOM 2079 N CYS A 127 17.592 -1.881 -23.813 1.00 0.00 N ATOM 2080 CA CYS A 127 16.126 -1.664 -23.952 1.00 0.00 C ATOM 2081 C CYS A 127 15.680 -1.919 -25.393 1.00 0.00 C ATOM 2082 O CYS A 127 14.783 -1.280 -25.902 1.00 0.00 O ATOM 2083 CB CYS A 127 15.796 -0.239 -23.514 1.00 0.00 C ATOM 2084 SG CYS A 127 16.064 0.935 -24.870 1.00 0.00 S ATOM 0 H CYS A 127 17.881 -2.251 -22.908 1.00 0.00 H new ATOM 0 HA CYS A 127 15.586 -2.366 -23.317 1.00 0.00 H new ATOM 0 HB2 CYS A 127 14.759 -0.187 -23.183 1.00 0.00 H new ATOM 0 HB3 CYS A 127 16.417 0.036 -22.661 1.00 0.00 H new ATOM 2089 N SER A 128 16.307 -2.855 -26.050 1.00 0.00 N ATOM 2090 CA SER A 128 15.928 -3.160 -27.459 1.00 0.00 C ATOM 2091 C SER A 128 15.978 -4.672 -27.683 1.00 0.00 C ATOM 2092 O SER A 128 16.971 -5.318 -27.413 1.00 0.00 O ATOM 2093 CB SER A 128 16.907 -2.471 -28.410 1.00 0.00 C ATOM 2094 OG SER A 128 17.926 -3.387 -28.786 1.00 0.00 O ATOM 0 H SER A 128 17.066 -3.422 -25.672 1.00 0.00 H new ATOM 0 HA SER A 128 14.918 -2.797 -27.651 1.00 0.00 H new ATOM 0 HB2 SER A 128 16.380 -2.113 -29.295 1.00 0.00 H new ATOM 0 HB3 SER A 128 17.347 -1.599 -27.927 1.00 0.00 H new ATOM 0 HG SER A 128 18.553 -2.946 -29.397 1.00 0.00 H new ATOM 2100 N SER A 129 14.912 -5.244 -28.175 1.00 0.00 N ATOM 2101 CA SER A 129 14.900 -6.714 -28.416 1.00 0.00 C ATOM 2102 C SER A 129 16.107 -7.101 -29.272 1.00 0.00 C ATOM 2103 O SER A 129 16.025 -6.946 -30.479 1.00 0.00 O ATOM 2104 CB SER A 129 13.612 -7.099 -29.148 1.00 0.00 C ATOM 2105 OG SER A 129 13.339 -8.476 -28.934 1.00 0.00 O ATOM 2106 OXT SER A 129 17.092 -7.546 -28.706 1.00 0.00 O ATOM 0 H SER A 129 14.050 -4.757 -28.420 1.00 0.00 H new ATOM 0 HA SER A 129 14.948 -7.239 -27.462 1.00 0.00 H new ATOM 0 HB2 SER A 129 12.781 -6.492 -28.788 1.00 0.00 H new ATOM 0 HB3 SER A 129 13.714 -6.899 -30.215 1.00 0.00 H new ATOM 0 HG SER A 129 12.513 -8.722 -29.401 1.00 0.00 H new TER 2112 SER A 129