USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1069 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 12 SER OG : rot -150:sc= -0.439 USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 127 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 129 GLN : amide:sc= -0.574 X(o=-0.57,f=-0.22) USER MOD Set 3.1: A 80 TYR OH : rot 167:sc= 0.581 USER MOD Set 3.2: A 126 SER OG : rot 11:sc= 0.705 USER MOD Set 4.1: A 62 TYR OH : rot 180:sc= -0.729 USER MOD Set 4.2: A 108 SER OG : rot 174:sc= 0.0623 USER MOD Set 5.1: A 58 ASN : amide:sc= -1.05 K(o=-1.7,f=-5.4) USER MOD Set 5.2: A 61 GLN : amide:sc= 0.0463 K(o=-1.7,f=-0.34) USER MOD Set 5.3: A 91 GLN : amide:sc= -0.728 K(o=-1.7,f=-0.34) USER MOD Set 6.1: A 25 ASN : amide:sc= -4.88! C(o=-4.3!,f=-12!) USER MOD Set 6.2: A 44 THR OG1 : rot -63:sc= 0.584 USER MOD Set 7.1: A 11 GLN : amide:sc= -0.391 K(o=-0.39,f=-2.1!) USER MOD Set 7.2: A 20 LYS NZ :NH3+ 154:sc= 0 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ 136:sc= 0.00808 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 163:sc= 0.384 USER MOD Single : A 3 SER OG : rot 69:sc= 1.12 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0211 USER MOD Single : A 6 THR OG1 : rot 120:sc= -0.82 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.185 K(o=-0.18,f=-0.77) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.799 K(o=-0.8,f=-2.1!) USER MOD Single : A 21 MET CE :methyl -158:sc= -0.234 (180deg=-1.27) USER MOD Single : A 27 LYS NZ :NH3+ 170:sc=-0.00945 (180deg=-0.0924) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -1.09 K(o=-1.1,f=-7.2!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= -0.722 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.276 USER MOD Single : A 48 LYS NZ :NH3+ 148:sc=-0.00859 (180deg=-0.788) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -15:sc= 0.538 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -0.409 K(o=-0.41,f=-5.2!) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.705 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 78 SER OG : rot -110:sc= 0.629 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 167:sc= -0.921 (180deg=-1.31) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.32 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.221 K(o=-0.22,f=-1.2) USER MOD Single : A 116 ASN : amide:sc= -1.27 K(o=-1.3,f=-2.1!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -0.643 K(o=-0.64,f=-4.6!) USER MOD Single : A 130 SER OG : rot 180:sc= -0.476 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 118.017 -19.494 18.209 1.00 0.00 N ATOM 2 CA ALA A 1 116.750 -18.917 17.682 1.00 0.00 C ATOM 3 C ALA A 1 116.921 -18.587 16.201 1.00 0.00 C ATOM 4 O ALA A 1 117.934 -18.020 15.795 1.00 0.00 O ATOM 5 CB ALA A 1 116.406 -17.646 18.461 1.00 0.00 C ATOM 0 H1 ALA A 1 118.234 -19.069 19.133 1.00 0.00 H new ATOM 0 H2 ALA A 1 117.911 -20.523 18.317 1.00 0.00 H new ATOM 0 H3 ALA A 1 118.792 -19.293 17.545 1.00 0.00 H new ATOM 0 HA ALA A 1 115.942 -19.639 17.799 1.00 0.00 H new ATOM 0 HB1 ALA A 1 115.478 -17.223 18.076 1.00 0.00 H new ATOM 0 HB2 ALA A 1 116.283 -17.888 19.517 1.00 0.00 H new ATOM 0 HB3 ALA A 1 117.211 -16.920 18.347 1.00 0.00 H new ATOM 13 N THR A 2 115.923 -18.948 15.402 1.00 0.00 N ATOM 14 CA THR A 2 115.969 -18.683 13.969 1.00 0.00 C ATOM 15 C THR A 2 115.510 -17.259 13.669 1.00 0.00 C ATOM 16 O THR A 2 114.897 -16.605 14.513 1.00 0.00 O ATOM 17 CB THR A 2 115.085 -19.684 13.221 1.00 0.00 C ATOM 18 OG1 THR A 2 113.740 -19.530 13.647 1.00 0.00 O ATOM 19 CG2 THR A 2 115.559 -21.109 13.514 1.00 0.00 C ATOM 0 H THR A 2 115.077 -19.422 15.720 1.00 0.00 H new ATOM 0 HA THR A 2 117.000 -18.793 13.632 1.00 0.00 H new ATOM 0 HB THR A 2 115.151 -19.499 12.149 1.00 0.00 H new ATOM 0 HG1 THR A 2 113.141 -19.953 12.997 1.00 0.00 H new ATOM 0 HG21 THR A 2 114.928 -21.819 12.980 1.00 0.00 H new ATOM 0 HG22 THR A 2 116.592 -21.224 13.186 1.00 0.00 H new ATOM 0 HG23 THR A 2 115.495 -21.301 14.585 1.00 0.00 H new ATOM 27 N SER A 3 115.809 -16.788 12.465 1.00 0.00 N ATOM 28 CA SER A 3 115.487 -15.417 12.085 1.00 0.00 C ATOM 29 C SER A 3 115.410 -15.283 10.566 1.00 0.00 C ATOM 30 O SER A 3 116.019 -16.062 9.833 1.00 0.00 O ATOM 31 CB SER A 3 116.552 -14.463 12.627 1.00 0.00 C ATOM 32 OG SER A 3 116.225 -13.133 12.250 1.00 0.00 O ATOM 0 H SER A 3 116.272 -17.332 11.737 1.00 0.00 H new ATOM 0 HA SER A 3 114.516 -15.161 12.510 1.00 0.00 H new ATOM 0 HB2 SER A 3 116.609 -14.542 13.713 1.00 0.00 H new ATOM 0 HB3 SER A 3 117.533 -14.734 12.236 1.00 0.00 H new ATOM 0 HG SER A 3 115.423 -12.844 12.733 1.00 0.00 H new ATOM 38 N THR A 4 114.655 -14.291 10.102 1.00 0.00 N ATOM 39 CA THR A 4 114.519 -14.039 8.671 1.00 0.00 C ATOM 40 C THR A 4 114.823 -12.575 8.374 1.00 0.00 C ATOM 41 O THR A 4 114.438 -11.686 9.135 1.00 0.00 O ATOM 42 CB THR A 4 113.095 -14.372 8.216 1.00 0.00 C ATOM 43 OG1 THR A 4 112.781 -15.706 8.591 1.00 0.00 O ATOM 44 CG2 THR A 4 112.996 -14.232 6.697 1.00 0.00 C ATOM 0 H THR A 4 114.129 -13.650 10.695 1.00 0.00 H new ATOM 0 HA THR A 4 115.224 -14.670 8.130 1.00 0.00 H new ATOM 0 HB THR A 4 112.393 -13.685 8.688 1.00 0.00 H new ATOM 0 HG1 THR A 4 111.869 -15.921 8.302 1.00 0.00 H new ATOM 0 HG21 THR A 4 111.982 -14.469 6.375 1.00 0.00 H new ATOM 0 HG22 THR A 4 113.238 -13.209 6.409 1.00 0.00 H new ATOM 0 HG23 THR A 4 113.697 -14.918 6.222 1.00 0.00 H new ATOM 52 N VAL A 5 115.511 -12.328 7.266 1.00 0.00 N ATOM 53 CA VAL A 5 115.864 -10.965 6.879 1.00 0.00 C ATOM 54 C VAL A 5 115.424 -10.699 5.444 1.00 0.00 C ATOM 55 O VAL A 5 115.604 -11.542 4.567 1.00 0.00 O ATOM 56 CB VAL A 5 117.376 -10.758 7.001 1.00 0.00 C ATOM 57 CG1 VAL A 5 117.798 -10.939 8.461 1.00 0.00 C ATOM 58 CG2 VAL A 5 118.112 -11.782 6.131 1.00 0.00 C ATOM 0 H VAL A 5 115.835 -13.049 6.621 1.00 0.00 H new ATOM 0 HA VAL A 5 115.354 -10.269 7.545 1.00 0.00 H new ATOM 0 HB VAL A 5 117.629 -9.752 6.667 1.00 0.00 H new ATOM 0 HG11 VAL A 5 118.874 -10.792 8.550 1.00 0.00 H new ATOM 0 HG12 VAL A 5 117.280 -10.209 9.083 1.00 0.00 H new ATOM 0 HG13 VAL A 5 117.541 -11.945 8.792 1.00 0.00 H new ATOM 0 HG21 VAL A 5 119.188 -11.630 6.222 1.00 0.00 H new ATOM 0 HG22 VAL A 5 117.859 -12.789 6.462 1.00 0.00 H new ATOM 0 HG23 VAL A 5 117.814 -11.656 5.090 1.00 0.00 H new ATOM 68 N THR A 6 114.849 -9.522 5.211 1.00 0.00 N ATOM 69 CA THR A 6 114.368 -9.164 3.879 1.00 0.00 C ATOM 70 C THR A 6 114.933 -7.811 3.465 1.00 0.00 C ATOM 71 O THR A 6 115.071 -6.908 4.289 1.00 0.00 O ATOM 72 CB THR A 6 112.836 -9.086 3.853 1.00 0.00 C ATOM 73 OG1 THR A 6 112.407 -7.981 4.633 1.00 0.00 O ATOM 74 CG2 THR A 6 112.212 -10.371 4.404 1.00 0.00 C ATOM 0 H THR A 6 114.705 -8.804 5.921 1.00 0.00 H new ATOM 0 HA THR A 6 114.700 -9.936 3.185 1.00 0.00 H new ATOM 0 HB THR A 6 112.514 -8.962 2.819 1.00 0.00 H new ATOM 0 HG1 THR A 6 111.905 -7.357 4.068 1.00 0.00 H new ATOM 0 HG21 THR A 6 111.125 -10.290 4.374 1.00 0.00 H new ATOM 0 HG22 THR A 6 112.529 -11.219 3.797 1.00 0.00 H new ATOM 0 HG23 THR A 6 112.537 -10.521 5.434 1.00 0.00 H new ATOM 82 N GLY A 7 115.255 -7.672 2.184 1.00 0.00 N ATOM 83 CA GLY A 7 115.662 -6.380 1.645 1.00 0.00 C ATOM 84 C GLY A 7 114.818 -6.075 0.419 1.00 0.00 C ATOM 85 O GLY A 7 114.542 -6.978 -0.369 1.00 0.00 O ATOM 0 H GLY A 7 115.242 -8.432 1.504 1.00 0.00 H new ATOM 0 HA2 GLY A 7 115.533 -5.600 2.396 1.00 0.00 H new ATOM 0 HA3 GLY A 7 116.719 -6.397 1.381 1.00 0.00 H new ATOM 89 N GLY A 8 114.415 -4.818 0.258 1.00 0.00 N ATOM 90 CA GLY A 8 113.516 -4.477 -0.839 1.00 0.00 C ATOM 91 C GLY A 8 113.718 -3.053 -1.331 1.00 0.00 C ATOM 92 O GLY A 8 114.365 -2.236 -0.676 1.00 0.00 O ATOM 0 H GLY A 8 114.688 -4.038 0.855 1.00 0.00 H new ATOM 0 HA2 GLY A 8 113.675 -5.170 -1.665 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.484 -4.603 -0.512 1.00 0.00 H new ATOM 96 N TYR A 9 113.103 -2.771 -2.475 1.00 0.00 N ATOM 97 CA TYR A 9 113.182 -1.455 -3.092 1.00 0.00 C ATOM 98 C TYR A 9 111.772 -0.907 -3.249 1.00 0.00 C ATOM 99 O TYR A 9 110.860 -1.639 -3.636 1.00 0.00 O ATOM 100 CB TYR A 9 113.856 -1.553 -4.462 1.00 0.00 C ATOM 101 CG TYR A 9 114.063 -0.215 -5.128 1.00 0.00 C ATOM 102 CD1 TYR A 9 113.072 0.312 -5.965 1.00 0.00 C ATOM 103 CD2 TYR A 9 115.247 0.501 -4.908 1.00 0.00 C ATOM 104 CE1 TYR A 9 113.266 1.555 -6.582 1.00 0.00 C ATOM 105 CE2 TYR A 9 115.440 1.743 -5.526 1.00 0.00 C ATOM 106 CZ TYR A 9 114.449 2.269 -6.363 1.00 0.00 C ATOM 107 OH TYR A 9 114.639 3.493 -6.972 1.00 0.00 O ATOM 0 H TYR A 9 112.540 -3.444 -2.996 1.00 0.00 H new ATOM 0 HA TYR A 9 113.774 -0.790 -2.463 1.00 0.00 H new ATOM 0 HB2 TYR A 9 114.821 -2.047 -4.349 1.00 0.00 H new ATOM 0 HB3 TYR A 9 113.250 -2.184 -5.112 1.00 0.00 H new ATOM 0 HD1 TYR A 9 112.159 -0.239 -6.135 1.00 0.00 H new ATOM 0 HD2 TYR A 9 116.011 0.095 -4.262 1.00 0.00 H new ATOM 0 HE1 TYR A 9 112.502 1.962 -7.227 1.00 0.00 H new ATOM 0 HE2 TYR A 9 116.353 2.295 -5.357 1.00 0.00 H new ATOM 0 HH TYR A 9 115.512 3.855 -6.713 1.00 0.00 H new ATOM 117 N ALA A 10 111.587 0.367 -2.913 1.00 0.00 N ATOM 118 CA ALA A 10 110.256 0.964 -2.928 1.00 0.00 C ATOM 119 C ALA A 10 110.239 2.247 -3.745 1.00 0.00 C ATOM 120 O ALA A 10 111.231 2.970 -3.805 1.00 0.00 O ATOM 121 CB ALA A 10 109.819 1.276 -1.496 1.00 0.00 C ATOM 0 H ALA A 10 112.335 1.000 -2.630 1.00 0.00 H new ATOM 0 HA ALA A 10 109.569 0.252 -3.385 1.00 0.00 H new ATOM 0 HB1 ALA A 10 108.825 1.722 -1.508 1.00 0.00 H new ATOM 0 HB2 ALA A 10 109.797 0.355 -0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 10 110.524 1.974 -1.044 1.00 0.00 H new ATOM 127 N GLN A 11 109.091 2.522 -4.357 1.00 0.00 N ATOM 128 CA GLN A 11 108.903 3.749 -5.119 1.00 0.00 C ATOM 129 C GLN A 11 107.804 4.577 -4.470 1.00 0.00 C ATOM 130 O GLN A 11 106.764 4.036 -4.095 1.00 0.00 O ATOM 131 CB GLN A 11 108.518 3.421 -6.562 1.00 0.00 C ATOM 132 CG GLN A 11 108.446 4.711 -7.381 1.00 0.00 C ATOM 133 CD GLN A 11 107.891 4.417 -8.770 1.00 0.00 C ATOM 134 OE1 GLN A 11 106.788 3.882 -8.898 1.00 0.00 O ATOM 135 NE2 GLN A 11 108.589 4.736 -9.825 1.00 0.00 N ATOM 0 H GLN A 11 108.276 1.909 -4.339 1.00 0.00 H new ATOM 0 HA GLN A 11 109.835 4.314 -5.126 1.00 0.00 H new ATOM 0 HB2 GLN A 11 109.250 2.742 -6.999 1.00 0.00 H new ATOM 0 HB3 GLN A 11 107.556 2.910 -6.585 1.00 0.00 H new ATOM 0 HG2 GLN A 11 107.812 5.439 -6.874 1.00 0.00 H new ATOM 0 HG3 GLN A 11 109.438 5.155 -7.463 1.00 0.00 H new ATOM 0 HE21 GLN A 11 109.502 5.179 -9.718 1.00 0.00 H new ATOM 0 HE22 GLN A 11 108.222 4.543 -10.757 1.00 0.00 H new ATOM 144 N SER A 12 108.045 5.877 -4.314 1.00 0.00 N ATOM 145 CA SER A 12 107.069 6.763 -3.689 1.00 0.00 C ATOM 146 C SER A 12 106.536 7.745 -4.721 1.00 0.00 C ATOM 147 O SER A 12 107.300 8.256 -5.541 1.00 0.00 O ATOM 148 CB SER A 12 107.720 7.531 -2.538 1.00 0.00 C ATOM 149 OG SER A 12 106.722 8.276 -1.850 1.00 0.00 O ATOM 0 H SER A 12 108.905 6.338 -4.611 1.00 0.00 H new ATOM 0 HA SER A 12 106.246 6.165 -3.297 1.00 0.00 H new ATOM 0 HB2 SER A 12 108.210 6.838 -1.854 1.00 0.00 H new ATOM 0 HB3 SER A 12 108.491 8.200 -2.921 1.00 0.00 H new ATOM 0 HG SER A 12 107.123 9.085 -1.469 1.00 0.00 H new ATOM 155 N ASP A 13 105.245 8.051 -4.626 1.00 0.00 N ATOM 156 CA ASP A 13 104.587 8.865 -5.641 1.00 0.00 C ATOM 157 C ASP A 13 104.911 10.341 -5.449 1.00 0.00 C ATOM 158 O ASP A 13 104.998 10.836 -4.324 1.00 0.00 O ATOM 159 CB ASP A 13 103.071 8.660 -5.570 1.00 0.00 C ATOM 160 CG ASP A 13 102.713 7.213 -5.894 1.00 0.00 C ATOM 161 OD1 ASP A 13 103.418 6.604 -6.684 1.00 0.00 O ATOM 162 OD2 ASP A 13 101.734 6.731 -5.347 1.00 0.00 O ATOM 0 H ASP A 13 104.639 7.750 -3.863 1.00 0.00 H new ATOM 0 HA ASP A 13 104.954 8.553 -6.619 1.00 0.00 H new ATOM 0 HB2 ASP A 13 102.709 8.916 -4.574 1.00 0.00 H new ATOM 0 HB3 ASP A 13 102.574 9.330 -6.272 1.00 0.00 H new ATOM 167 N ALA A 14 105.085 11.034 -6.567 1.00 0.00 N ATOM 168 CA ALA A 14 105.513 12.426 -6.548 1.00 0.00 C ATOM 169 C ALA A 14 104.327 13.375 -6.677 1.00 0.00 C ATOM 170 O ALA A 14 103.366 13.102 -7.399 1.00 0.00 O ATOM 171 CB ALA A 14 106.497 12.682 -7.692 1.00 0.00 C ATOM 0 H ALA A 14 104.936 10.653 -7.501 1.00 0.00 H new ATOM 0 HA ALA A 14 105.999 12.614 -5.591 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.814 13.725 -7.673 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.367 12.036 -7.575 1.00 0.00 H new ATOM 0 HB3 ALA A 14 106.012 12.468 -8.644 1.00 0.00 H new ATOM 177 N GLN A 15 104.413 14.491 -5.965 1.00 0.00 N ATOM 178 CA GLN A 15 103.397 15.535 -6.038 1.00 0.00 C ATOM 179 C GLN A 15 103.785 16.509 -7.147 1.00 0.00 C ATOM 180 O GLN A 15 104.965 16.635 -7.474 1.00 0.00 O ATOM 181 CB GLN A 15 103.308 16.259 -4.691 1.00 0.00 C ATOM 182 CG GLN A 15 102.071 17.159 -4.648 1.00 0.00 C ATOM 183 CD GLN A 15 100.808 16.307 -4.601 1.00 0.00 C ATOM 184 OE1 GLN A 15 100.750 15.321 -3.867 1.00 0.00 O ATOM 185 NE2 GLN A 15 99.787 16.628 -5.348 1.00 0.00 N ATOM 0 H GLN A 15 105.181 14.698 -5.326 1.00 0.00 H new ATOM 0 HA GLN A 15 102.421 15.103 -6.260 1.00 0.00 H new ATOM 0 HB2 GLN A 15 103.263 15.530 -3.882 1.00 0.00 H new ATOM 0 HB3 GLN A 15 104.206 16.857 -4.532 1.00 0.00 H new ATOM 0 HG2 GLN A 15 102.114 17.809 -3.774 1.00 0.00 H new ATOM 0 HG3 GLN A 15 102.051 17.806 -5.525 1.00 0.00 H new ATOM 0 HE21 GLN A 15 99.837 17.446 -5.956 1.00 0.00 H new ATOM 0 HE22 GLN A 15 98.939 16.061 -5.324 1.00 0.00 H new ATOM 194 N GLY A 16 102.807 17.181 -7.748 1.00 0.00 N ATOM 195 CA GLY A 16 103.074 18.037 -8.904 1.00 0.00 C ATOM 196 C GLY A 16 104.240 18.996 -8.653 1.00 0.00 C ATOM 197 O GLY A 16 104.423 19.489 -7.541 1.00 0.00 O ATOM 0 H GLY A 16 101.830 17.151 -7.458 1.00 0.00 H new ATOM 0 HA2 GLY A 16 103.297 17.415 -9.771 1.00 0.00 H new ATOM 0 HA3 GLY A 16 102.179 18.610 -9.144 1.00 0.00 H new ATOM 201 N GLN A 17 105.035 19.214 -9.697 1.00 0.00 N ATOM 202 CA GLN A 17 106.243 20.032 -9.612 1.00 0.00 C ATOM 203 C GLN A 17 107.261 19.426 -8.641 1.00 0.00 C ATOM 204 O GLN A 17 107.981 20.151 -7.953 1.00 0.00 O ATOM 205 CB GLN A 17 105.896 21.462 -9.185 1.00 0.00 C ATOM 206 CG GLN A 17 104.983 22.100 -10.233 1.00 0.00 C ATOM 207 CD GLN A 17 104.553 23.498 -9.794 1.00 0.00 C ATOM 208 OE1 GLN A 17 104.645 23.843 -8.615 1.00 0.00 O ATOM 209 NE2 GLN A 17 104.083 24.331 -10.681 1.00 0.00 N ATOM 0 H GLN A 17 104.861 18.829 -10.625 1.00 0.00 H new ATOM 0 HA GLN A 17 106.694 20.058 -10.604 1.00 0.00 H new ATOM 0 HB2 GLN A 17 105.402 21.453 -8.214 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.807 22.051 -9.074 1.00 0.00 H new ATOM 0 HG2 GLN A 17 105.503 22.157 -11.189 1.00 0.00 H new ATOM 0 HG3 GLN A 17 104.103 21.475 -10.386 1.00 0.00 H new ATOM 0 HE21 GLN A 17 104.006 24.047 -11.658 1.00 0.00 H new ATOM 0 HE22 GLN A 17 103.792 25.267 -10.398 1.00 0.00 H new ATOM 218 N MET A 18 107.327 18.097 -8.599 1.00 0.00 N ATOM 219 CA MET A 18 108.346 17.406 -7.815 1.00 0.00 C ATOM 220 C MET A 18 108.690 16.072 -8.472 1.00 0.00 C ATOM 221 O MET A 18 107.986 15.617 -9.373 1.00 0.00 O ATOM 222 CB MET A 18 107.868 17.159 -6.381 1.00 0.00 C ATOM 223 CG MET A 18 107.548 18.493 -5.703 1.00 0.00 C ATOM 224 SD MET A 18 107.102 18.200 -3.973 1.00 0.00 S ATOM 225 CE MET A 18 106.668 19.907 -3.559 1.00 0.00 C ATOM 0 H MET A 18 106.688 17.479 -9.098 1.00 0.00 H new ATOM 0 HA MET A 18 109.232 18.040 -7.780 1.00 0.00 H new ATOM 0 HB2 MET A 18 106.983 16.523 -6.388 1.00 0.00 H new ATOM 0 HB3 MET A 18 108.637 16.630 -5.818 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.410 19.158 -5.760 1.00 0.00 H new ATOM 0 HG3 MET A 18 106.728 18.989 -6.222 1.00 0.00 H new ATOM 0 HE1 MET A 18 106.357 19.960 -2.516 1.00 0.00 H new ATOM 0 HE2 MET A 18 107.535 20.550 -3.713 1.00 0.00 H new ATOM 0 HE3 MET A 18 105.851 20.240 -4.199 1.00 0.00 H new ATOM 235 N ASN A 19 109.773 15.445 -8.017 1.00 0.00 N ATOM 236 CA ASN A 19 110.205 14.168 -8.579 1.00 0.00 C ATOM 237 C ASN A 19 109.937 13.025 -7.604 1.00 0.00 C ATOM 238 O ASN A 19 110.026 13.201 -6.389 1.00 0.00 O ATOM 239 CB ASN A 19 111.699 14.222 -8.900 1.00 0.00 C ATOM 240 CG ASN A 19 111.980 15.340 -9.899 1.00 0.00 C ATOM 241 OD1 ASN A 19 112.910 16.122 -9.710 1.00 0.00 O ATOM 242 ND2 ASN A 19 111.226 15.458 -10.958 1.00 0.00 N ATOM 0 H ASN A 19 110.364 15.798 -7.265 1.00 0.00 H new ATOM 0 HA ASN A 19 109.638 13.988 -9.492 1.00 0.00 H new ATOM 0 HB2 ASN A 19 112.270 14.388 -7.986 1.00 0.00 H new ATOM 0 HB3 ASN A 19 112.026 13.266 -9.310 1.00 0.00 H new ATOM 0 HD21 ASN A 19 111.407 16.201 -11.633 1.00 0.00 H new ATOM 0 HD22 ASN A 19 110.456 14.807 -11.111 1.00 0.00 H new ATOM 249 N LYS A 20 109.610 11.854 -8.143 1.00 0.00 N ATOM 250 CA LYS A 20 109.374 10.675 -7.314 1.00 0.00 C ATOM 251 C LYS A 20 110.592 10.382 -6.438 1.00 0.00 C ATOM 252 O LYS A 20 111.638 11.012 -6.596 1.00 0.00 O ATOM 253 CB LYS A 20 109.018 9.473 -8.203 1.00 0.00 C ATOM 254 CG LYS A 20 110.220 9.040 -9.050 1.00 0.00 C ATOM 255 CD LYS A 20 109.794 7.928 -10.012 1.00 0.00 C ATOM 256 CE LYS A 20 111.034 7.283 -10.631 1.00 0.00 C ATOM 257 NZ LYS A 20 110.632 6.462 -11.808 1.00 0.00 N ATOM 0 H LYS A 20 109.503 11.696 -9.145 1.00 0.00 H new ATOM 0 HA LYS A 20 108.532 10.868 -6.650 1.00 0.00 H new ATOM 0 HB2 LYS A 20 108.689 8.641 -7.581 1.00 0.00 H new ATOM 0 HB3 LYS A 20 108.184 9.733 -8.855 1.00 0.00 H new ATOM 0 HG2 LYS A 20 110.609 9.890 -9.610 1.00 0.00 H new ATOM 0 HG3 LYS A 20 111.025 8.688 -8.405 1.00 0.00 H new ATOM 0 HD2 LYS A 20 109.208 7.178 -9.480 1.00 0.00 H new ATOM 0 HD3 LYS A 20 109.154 8.336 -10.795 1.00 0.00 H new ATOM 0 HE2 LYS A 20 111.743 8.052 -10.936 1.00 0.00 H new ATOM 0 HE3 LYS A 20 111.539 6.658 -9.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 111.431 6.390 -12.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 110.359 5.510 -11.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 109.826 6.912 -12.286 1.00 0.00 H new ATOM 271 N MET A 21 110.459 9.426 -5.518 1.00 0.00 N ATOM 272 CA MET A 21 111.557 9.117 -4.599 1.00 0.00 C ATOM 273 C MET A 21 111.794 7.614 -4.523 1.00 0.00 C ATOM 274 O MET A 21 110.906 6.824 -4.840 1.00 0.00 O ATOM 275 CB MET A 21 111.233 9.654 -3.202 1.00 0.00 C ATOM 276 CG MET A 21 111.138 11.180 -3.253 1.00 0.00 C ATOM 277 SD MET A 21 110.981 11.840 -1.572 1.00 0.00 S ATOM 278 CE MET A 21 109.438 11.001 -1.130 1.00 0.00 C ATOM 0 H MET A 21 109.619 8.861 -5.389 1.00 0.00 H new ATOM 0 HA MET A 21 112.462 9.594 -4.975 1.00 0.00 H new ATOM 0 HB2 MET A 21 110.293 9.232 -2.847 1.00 0.00 H new ATOM 0 HB3 MET A 21 112.005 9.350 -2.496 1.00 0.00 H new ATOM 0 HG2 MET A 21 112.024 11.593 -3.735 1.00 0.00 H new ATOM 0 HG3 MET A 21 110.279 11.481 -3.854 1.00 0.00 H new ATOM 0 HE1 MET A 21 108.951 11.539 -0.317 1.00 0.00 H new ATOM 0 HE2 MET A 21 108.777 10.976 -1.996 1.00 0.00 H new ATOM 0 HE3 MET A 21 109.656 9.982 -0.811 1.00 0.00 H new ATOM 288 N GLY A 22 112.991 7.226 -4.084 1.00 0.00 N ATOM 289 CA GLY A 22 113.331 5.812 -3.957 1.00 0.00 C ATOM 290 C GLY A 22 113.729 5.499 -2.520 1.00 0.00 C ATOM 291 O GLY A 22 114.384 6.309 -1.869 1.00 0.00 O ATOM 0 H GLY A 22 113.736 7.867 -3.812 1.00 0.00 H new ATOM 0 HA2 GLY A 22 112.480 5.197 -4.249 1.00 0.00 H new ATOM 0 HA3 GLY A 22 114.150 5.564 -4.632 1.00 0.00 H new ATOM 295 N GLY A 23 113.335 4.329 -2.029 1.00 0.00 N ATOM 296 CA GLY A 23 113.617 3.963 -0.643 1.00 0.00 C ATOM 297 C GLY A 23 114.140 2.535 -0.543 1.00 0.00 C ATOM 298 O GLY A 23 113.707 1.655 -1.282 1.00 0.00 O ATOM 0 H GLY A 23 112.825 3.624 -2.562 1.00 0.00 H new ATOM 0 HA2 GLY A 23 114.351 4.652 -0.225 1.00 0.00 H new ATOM 0 HA3 GLY A 23 112.710 4.063 -0.046 1.00 0.00 H new ATOM 302 N PHE A 24 115.082 2.321 0.372 1.00 0.00 N ATOM 303 CA PHE A 24 115.622 0.986 0.614 1.00 0.00 C ATOM 304 C PHE A 24 115.245 0.543 2.021 1.00 0.00 C ATOM 305 O PHE A 24 115.347 1.332 2.962 1.00 0.00 O ATOM 306 CB PHE A 24 117.145 1.002 0.468 1.00 0.00 C ATOM 307 CG PHE A 24 117.612 1.382 -0.917 1.00 0.00 C ATOM 308 CD1 PHE A 24 117.712 0.404 -1.914 1.00 0.00 C ATOM 309 CD2 PHE A 24 117.944 2.712 -1.204 1.00 0.00 C ATOM 310 CE1 PHE A 24 118.145 0.757 -3.199 1.00 0.00 C ATOM 311 CE2 PHE A 24 118.377 3.063 -2.488 1.00 0.00 C ATOM 312 CZ PHE A 24 118.477 2.085 -3.486 1.00 0.00 C ATOM 0 H PHE A 24 115.486 3.053 0.957 1.00 0.00 H new ATOM 0 HA PHE A 24 115.207 0.290 -0.115 1.00 0.00 H new ATOM 0 HB2 PHE A 24 117.564 1.703 1.190 1.00 0.00 H new ATOM 0 HB3 PHE A 24 117.537 0.016 0.717 1.00 0.00 H new ATOM 0 HD1 PHE A 24 117.456 -0.622 -1.693 1.00 0.00 H new ATOM 0 HD2 PHE A 24 117.866 3.466 -0.435 1.00 0.00 H new ATOM 0 HE1 PHE A 24 118.222 0.003 -3.968 1.00 0.00 H new ATOM 0 HE2 PHE A 24 118.634 4.088 -2.709 1.00 0.00 H new ATOM 0 HZ PHE A 24 118.810 2.356 -4.477 1.00 0.00 H new ATOM 322 N ASN A 25 114.792 -0.701 2.162 1.00 0.00 N ATOM 323 CA ASN A 25 114.364 -1.205 3.465 1.00 0.00 C ATOM 324 C ASN A 25 115.075 -2.506 3.818 1.00 0.00 C ATOM 325 O ASN A 25 115.177 -3.409 2.989 1.00 0.00 O ATOM 326 CB ASN A 25 112.850 -1.439 3.468 1.00 0.00 C ATOM 327 CG ASN A 25 112.096 -0.111 3.397 1.00 0.00 C ATOM 328 OD1 ASN A 25 112.678 0.958 3.590 1.00 0.00 O ATOM 329 ND2 ASN A 25 110.817 -0.116 3.144 1.00 0.00 N ATOM 0 H ASN A 25 114.712 -1.373 1.398 1.00 0.00 H new ATOM 0 HA ASN A 25 114.624 -0.455 4.212 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.573 -2.066 2.620 1.00 0.00 H new ATOM 0 HB3 ASN A 25 112.562 -1.978 4.371 1.00 0.00 H new ATOM 0 HD21 ASN A 25 110.301 0.763 3.106 1.00 0.00 H new ATOM 0 HD22 ASN A 25 110.332 -0.999 2.984 1.00 0.00 H new ATOM 336 N LEU A 26 115.574 -2.570 5.051 1.00 0.00 N ATOM 337 CA LEU A 26 116.176 -3.790 5.581 1.00 0.00 C ATOM 338 C LEU A 26 115.399 -4.231 6.819 1.00 0.00 C ATOM 339 O LEU A 26 115.074 -3.402 7.665 1.00 0.00 O ATOM 340 CB LEU A 26 117.639 -3.537 5.952 1.00 0.00 C ATOM 341 CG LEU A 26 118.294 -4.851 6.382 1.00 0.00 C ATOM 342 CD1 LEU A 26 118.520 -5.736 5.155 1.00 0.00 C ATOM 343 CD2 LEU A 26 119.639 -4.554 7.050 1.00 0.00 C ATOM 0 H LEU A 26 115.573 -1.786 5.704 1.00 0.00 H new ATOM 0 HA LEU A 26 116.138 -4.572 4.823 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.173 -3.114 5.101 1.00 0.00 H new ATOM 0 HB3 LEU A 26 117.699 -2.808 6.760 1.00 0.00 H new ATOM 0 HG LEU A 26 117.642 -5.368 7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 26 118.987 -6.672 5.462 1.00 0.00 H new ATOM 0 HD12 LEU A 26 117.563 -5.947 4.678 1.00 0.00 H new ATOM 0 HD13 LEU A 26 119.171 -5.220 4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 26 120.107 -5.489 7.357 1.00 0.00 H new ATOM 0 HD22 LEU A 26 120.289 -4.037 6.344 1.00 0.00 H new ATOM 0 HD23 LEU A 26 119.479 -3.924 7.925 1.00 0.00 H new ATOM 355 N LYS A 27 115.090 -5.523 6.923 1.00 0.00 N ATOM 356 CA LYS A 27 114.235 -6.005 8.008 1.00 0.00 C ATOM 357 C LYS A 27 114.844 -7.204 8.728 1.00 0.00 C ATOM 358 O LYS A 27 115.519 -8.037 8.124 1.00 0.00 O ATOM 359 CB LYS A 27 112.872 -6.409 7.444 1.00 0.00 C ATOM 360 CG LYS A 27 112.192 -5.184 6.830 1.00 0.00 C ATOM 361 CD LYS A 27 110.784 -5.561 6.366 1.00 0.00 C ATOM 362 CE LYS A 27 110.149 -4.373 5.639 1.00 0.00 C ATOM 363 NZ LYS A 27 110.729 -4.262 4.270 1.00 0.00 N ATOM 0 H LYS A 27 115.413 -6.246 6.280 1.00 0.00 H new ATOM 0 HA LYS A 27 114.131 -5.193 8.727 1.00 0.00 H new ATOM 0 HB2 LYS A 27 112.994 -7.187 6.690 1.00 0.00 H new ATOM 0 HB3 LYS A 27 112.248 -6.827 8.234 1.00 0.00 H new ATOM 0 HG2 LYS A 27 112.142 -4.378 7.562 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.777 -4.814 5.988 1.00 0.00 H new ATOM 0 HD2 LYS A 27 110.828 -6.425 5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 27 110.172 -5.846 7.222 1.00 0.00 H new ATOM 0 HE2 LYS A 27 109.069 -4.505 5.579 1.00 0.00 H new ATOM 0 HE3 LYS A 27 110.327 -3.454 6.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 110.185 -3.569 3.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.719 -3.951 4.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 110.688 -5.189 3.800 1.00 0.00 H new ATOM 377 N TYR A 28 114.595 -7.270 10.033 1.00 0.00 N ATOM 378 CA TYR A 28 114.976 -8.427 10.837 1.00 0.00 C ATOM 379 C TYR A 28 113.724 -9.030 11.466 1.00 0.00 C ATOM 380 O TYR A 28 112.856 -8.294 11.936 1.00 0.00 O ATOM 381 CB TYR A 28 115.955 -8.007 11.934 1.00 0.00 C ATOM 382 CG TYR A 28 117.221 -7.379 11.403 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.286 -5.995 11.203 1.00 0.00 C ATOM 384 CD2 TYR A 28 118.330 -8.182 11.107 1.00 0.00 C ATOM 385 CE1 TYR A 28 118.459 -5.412 10.710 1.00 0.00 C ATOM 386 CE2 TYR A 28 119.504 -7.599 10.614 1.00 0.00 C ATOM 387 CZ TYR A 28 119.568 -6.216 10.415 1.00 0.00 C ATOM 388 OH TYR A 28 120.726 -5.640 9.928 1.00 0.00 O ATOM 0 H TYR A 28 114.128 -6.531 10.559 1.00 0.00 H new ATOM 0 HA TYR A 28 115.462 -9.166 10.200 1.00 0.00 H new ATOM 0 HB2 TYR A 28 115.460 -7.301 12.601 1.00 0.00 H new ATOM 0 HB3 TYR A 28 116.215 -8.881 12.532 1.00 0.00 H new ATOM 0 HD1 TYR A 28 116.430 -5.376 11.429 1.00 0.00 H new ATOM 0 HD2 TYR A 28 118.280 -9.250 11.259 1.00 0.00 H new ATOM 0 HE1 TYR A 28 118.509 -4.344 10.557 1.00 0.00 H new ATOM 0 HE2 TYR A 28 120.360 -8.217 10.387 1.00 0.00 H new ATOM 0 HH TYR A 28 121.399 -6.336 9.777 1.00 0.00 H new ATOM 398 N ARG A 29 113.626 -10.359 11.468 1.00 0.00 N ATOM 399 CA ARG A 29 112.419 -11.029 11.946 1.00 0.00 C ATOM 400 C ARG A 29 112.759 -12.206 12.853 1.00 0.00 C ATOM 401 O ARG A 29 113.770 -12.879 12.660 1.00 0.00 O ATOM 402 CB ARG A 29 111.593 -11.523 10.754 1.00 0.00 C ATOM 403 CG ARG A 29 110.254 -12.075 11.249 1.00 0.00 C ATOM 404 CD ARG A 29 109.444 -12.600 10.061 1.00 0.00 C ATOM 405 NE ARG A 29 108.106 -12.999 10.502 1.00 0.00 N ATOM 406 CZ ARG A 29 107.847 -14.153 11.135 1.00 0.00 C ATOM 407 NH1 ARG A 29 108.782 -15.036 11.391 1.00 0.00 N ATOM 408 NH2 ARG A 29 106.621 -14.407 11.503 1.00 0.00 N ATOM 0 H ARG A 29 114.362 -10.988 11.147 1.00 0.00 H new ATOM 0 HA ARG A 29 111.841 -10.308 12.524 1.00 0.00 H new ATOM 0 HB2 ARG A 29 111.424 -10.706 10.053 1.00 0.00 H new ATOM 0 HB3 ARG A 29 112.140 -12.297 10.216 1.00 0.00 H new ATOM 0 HG2 ARG A 29 110.423 -12.876 11.969 1.00 0.00 H new ATOM 0 HG3 ARG A 29 109.696 -11.294 11.766 1.00 0.00 H new ATOM 0 HD2 ARG A 29 109.368 -11.830 9.294 1.00 0.00 H new ATOM 0 HD3 ARG A 29 109.955 -13.450 9.609 1.00 0.00 H new ATOM 0 HE ARG A 29 107.329 -12.365 10.318 1.00 0.00 H new ATOM 0 HH11 ARG A 29 109.745 -14.856 11.107 1.00 0.00 H new ATOM 0 HH12 ARG A 29 108.546 -15.903 11.875 1.00 0.00 H new ATOM 0 HH21 ARG A 29 105.880 -13.734 11.308 1.00 0.00 H new ATOM 0 HH22 ARG A 29 106.404 -15.279 11.986 1.00 0.00 H new ATOM 422 N TYR A 30 111.935 -12.429 13.875 1.00 0.00 N ATOM 423 CA TYR A 30 112.087 -13.610 14.718 1.00 0.00 C ATOM 424 C TYR A 30 110.972 -14.599 14.399 1.00 0.00 C ATOM 425 O TYR A 30 109.836 -14.191 14.150 1.00 0.00 O ATOM 426 CB TYR A 30 112.022 -13.215 16.194 1.00 0.00 C ATOM 427 CG TYR A 30 113.127 -12.272 16.611 1.00 0.00 C ATOM 428 CD1 TYR A 30 114.385 -12.778 16.958 1.00 0.00 C ATOM 429 CD2 TYR A 30 112.894 -10.893 16.647 1.00 0.00 C ATOM 430 CE1 TYR A 30 115.409 -11.907 17.343 1.00 0.00 C ATOM 431 CE2 TYR A 30 113.918 -10.020 17.033 1.00 0.00 C ATOM 432 CZ TYR A 30 115.177 -10.526 17.381 1.00 0.00 C ATOM 433 OH TYR A 30 116.186 -9.666 17.762 1.00 0.00 O ATOM 0 H TYR A 30 111.164 -11.814 14.136 1.00 0.00 H new ATOM 0 HA TYR A 30 113.055 -14.072 14.522 1.00 0.00 H new ATOM 0 HB2 TYR A 30 111.059 -12.746 16.395 1.00 0.00 H new ATOM 0 HB3 TYR A 30 112.072 -14.115 16.806 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.565 -13.842 16.928 1.00 0.00 H new ATOM 0 HD2 TYR A 30 111.924 -10.502 16.377 1.00 0.00 H new ATOM 0 HE1 TYR A 30 116.379 -12.299 17.611 1.00 0.00 H new ATOM 0 HE2 TYR A 30 113.737 -8.956 17.063 1.00 0.00 H new ATOM 0 HH TYR A 30 115.858 -8.743 17.733 1.00 0.00 H new ATOM 443 N GLU A 31 111.291 -15.892 14.406 1.00 0.00 N ATOM 444 CA GLU A 31 110.291 -16.903 14.079 1.00 0.00 C ATOM 445 C GLU A 31 109.607 -17.401 15.345 1.00 0.00 C ATOM 446 O GLU A 31 110.259 -17.821 16.302 1.00 0.00 O ATOM 447 CB GLU A 31 110.939 -18.077 13.345 1.00 0.00 C ATOM 448 CG GLU A 31 111.540 -17.587 12.023 1.00 0.00 C ATOM 449 CD GLU A 31 112.115 -18.739 11.193 1.00 0.00 C ATOM 450 OE1 GLU A 31 112.207 -19.849 11.696 1.00 0.00 O ATOM 451 OE2 GLU A 31 112.459 -18.490 10.049 1.00 0.00 O ATOM 0 H GLU A 31 112.216 -16.258 14.630 1.00 0.00 H new ATOM 0 HA GLU A 31 109.544 -16.448 13.428 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.716 -18.523 13.966 1.00 0.00 H new ATOM 0 HB3 GLU A 31 110.198 -18.853 13.154 1.00 0.00 H new ATOM 0 HG2 GLU A 31 110.773 -17.071 11.445 1.00 0.00 H new ATOM 0 HG3 GLU A 31 112.326 -16.861 12.229 1.00 0.00 H new ATOM 458 N GLU A 32 108.279 -17.345 15.331 1.00 0.00 N ATOM 459 CA GLU A 32 107.484 -17.674 16.505 1.00 0.00 C ATOM 460 C GLU A 32 106.181 -18.356 16.101 1.00 0.00 C ATOM 461 O GLU A 32 105.676 -18.154 14.997 1.00 0.00 O ATOM 462 CB GLU A 32 107.198 -16.416 17.326 1.00 0.00 C ATOM 463 CG GLU A 32 108.525 -15.829 17.823 1.00 0.00 C ATOM 464 CD GLU A 32 108.310 -14.635 18.760 1.00 0.00 C ATOM 465 OE1 GLU A 32 107.183 -14.189 18.910 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.293 -14.180 19.322 1.00 0.00 O ATOM 0 H GLU A 32 107.730 -17.073 14.515 1.00 0.00 H new ATOM 0 HA GLU A 32 108.055 -18.368 17.122 1.00 0.00 H new ATOM 0 HB2 GLU A 32 106.667 -15.683 16.719 1.00 0.00 H new ATOM 0 HB3 GLU A 32 106.553 -16.657 18.171 1.00 0.00 H new ATOM 0 HG2 GLU A 32 109.090 -16.601 18.344 1.00 0.00 H new ATOM 0 HG3 GLU A 32 109.125 -15.516 16.969 1.00 0.00 H new ATOM 473 N ASP A 33 105.644 -19.167 17.007 1.00 0.00 N ATOM 474 CA ASP A 33 104.467 -19.975 16.713 1.00 0.00 C ATOM 475 C ASP A 33 103.213 -19.106 16.683 1.00 0.00 C ATOM 476 O ASP A 33 103.291 -17.882 16.788 1.00 0.00 O ATOM 477 CB ASP A 33 104.317 -21.068 17.775 1.00 0.00 C ATOM 478 CG ASP A 33 103.650 -22.303 17.174 1.00 0.00 C ATOM 479 OD1 ASP A 33 104.234 -22.889 16.278 1.00 0.00 O ATOM 480 OD2 ASP A 33 102.566 -22.641 17.619 1.00 0.00 O ATOM 0 H ASP A 33 106.007 -19.282 17.953 1.00 0.00 H new ATOM 0 HA ASP A 33 104.593 -20.434 15.732 1.00 0.00 H new ATOM 0 HB2 ASP A 33 105.296 -21.333 18.174 1.00 0.00 H new ATOM 0 HB3 ASP A 33 103.723 -20.695 18.609 1.00 0.00 H new ATOM 485 N ASN A 34 102.069 -19.737 16.456 1.00 0.00 N ATOM 486 CA ASN A 34 100.817 -19.007 16.285 1.00 0.00 C ATOM 487 C ASN A 34 100.466 -18.106 17.475 1.00 0.00 C ATOM 488 O ASN A 34 99.913 -17.025 17.268 1.00 0.00 O ATOM 489 CB ASN A 34 99.675 -20.000 16.042 1.00 0.00 C ATOM 490 CG ASN A 34 99.462 -20.883 17.268 1.00 0.00 C ATOM 491 OD1 ASN A 34 100.377 -21.066 18.071 1.00 0.00 O ATOM 492 ND2 ASN A 34 98.300 -21.446 17.461 1.00 0.00 N ATOM 0 H ASN A 34 101.980 -20.751 16.386 1.00 0.00 H new ATOM 0 HA ASN A 34 100.953 -18.351 15.425 1.00 0.00 H new ATOM 0 HB2 ASN A 34 98.757 -19.458 15.813 1.00 0.00 H new ATOM 0 HB3 ASN A 34 99.903 -20.620 15.175 1.00 0.00 H new ATOM 0 HD21 ASN A 34 98.150 -22.038 18.278 1.00 0.00 H new ATOM 0 HD22 ASN A 34 97.543 -21.294 16.795 1.00 0.00 H new ATOM 499 N SER A 35 100.781 -18.523 18.705 1.00 0.00 N ATOM 500 CA SER A 35 100.274 -17.800 19.876 1.00 0.00 C ATOM 501 C SER A 35 101.164 -16.630 20.311 1.00 0.00 C ATOM 502 O SER A 35 100.663 -15.683 20.920 1.00 0.00 O ATOM 503 CB SER A 35 100.123 -18.772 21.047 1.00 0.00 C ATOM 504 OG SER A 35 99.071 -18.326 21.891 1.00 0.00 O ATOM 0 H SER A 35 101.366 -19.332 18.914 1.00 0.00 H new ATOM 0 HA SER A 35 99.313 -17.376 19.585 1.00 0.00 H new ATOM 0 HB2 SER A 35 99.909 -19.775 20.678 1.00 0.00 H new ATOM 0 HB3 SER A 35 101.055 -18.832 21.608 1.00 0.00 H new ATOM 0 HG SER A 35 98.969 -18.947 22.643 1.00 0.00 H new ATOM 510 N PRO A 36 102.442 -16.649 20.033 1.00 0.00 N ATOM 511 CA PRO A 36 103.257 -15.403 20.027 1.00 0.00 C ATOM 512 C PRO A 36 103.539 -14.907 18.609 1.00 0.00 C ATOM 513 O PRO A 36 103.984 -15.670 17.752 1.00 0.00 O ATOM 514 CB PRO A 36 104.548 -15.826 20.727 1.00 0.00 C ATOM 515 CG PRO A 36 104.684 -17.297 20.490 1.00 0.00 C ATOM 516 CD PRO A 36 103.321 -17.829 20.030 1.00 0.00 C ATOM 0 HA PRO A 36 102.750 -14.572 20.517 1.00 0.00 H new ATOM 0 HB2 PRO A 36 105.405 -15.285 20.325 1.00 0.00 H new ATOM 0 HB3 PRO A 36 104.504 -15.605 21.793 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.445 -17.493 19.734 1.00 0.00 H new ATOM 0 HG3 PRO A 36 105.003 -17.802 21.402 1.00 0.00 H new ATOM 0 HD2 PRO A 36 103.384 -18.274 19.037 1.00 0.00 H new ATOM 0 HD3 PRO A 36 102.949 -18.602 20.703 1.00 0.00 H new ATOM 524 N LEU A 37 103.282 -13.624 18.373 1.00 0.00 N ATOM 525 CA LEU A 37 103.449 -13.045 17.041 1.00 0.00 C ATOM 526 C LEU A 37 104.921 -12.777 16.742 1.00 0.00 C ATOM 527 O LEU A 37 105.721 -12.581 17.656 1.00 0.00 O ATOM 528 CB LEU A 37 102.662 -11.735 16.933 1.00 0.00 C ATOM 529 CG LEU A 37 101.185 -11.980 17.258 1.00 0.00 C ATOM 530 CD1 LEU A 37 100.433 -10.647 17.237 1.00 0.00 C ATOM 531 CD2 LEU A 37 100.573 -12.918 16.215 1.00 0.00 C ATOM 0 H LEU A 37 102.959 -12.966 19.083 1.00 0.00 H new ATOM 0 HA LEU A 37 103.069 -13.762 16.313 1.00 0.00 H new ATOM 0 HB2 LEU A 37 103.076 -10.996 17.619 1.00 0.00 H new ATOM 0 HB3 LEU A 37 102.758 -11.326 15.927 1.00 0.00 H new ATOM 0 HG LEU A 37 101.106 -12.435 18.245 1.00 0.00 H new ATOM 0 HD11 LEU A 37 99.382 -10.819 17.468 1.00 0.00 H new ATOM 0 HD12 LEU A 37 100.863 -9.975 17.980 1.00 0.00 H new ATOM 0 HD13 LEU A 37 100.518 -10.197 16.248 1.00 0.00 H new ATOM 0 HD21 LEU A 37 99.523 -13.089 16.451 1.00 0.00 H new ATOM 0 HD22 LEU A 37 100.654 -12.465 15.227 1.00 0.00 H new ATOM 0 HD23 LEU A 37 101.106 -13.869 16.223 1.00 0.00 H new ATOM 543 N GLY A 38 105.267 -12.745 15.459 1.00 0.00 N ATOM 544 CA GLY A 38 106.660 -12.565 15.057 1.00 0.00 C ATOM 545 C GLY A 38 107.006 -11.081 15.027 1.00 0.00 C ATOM 546 O GLY A 38 106.202 -10.275 14.566 1.00 0.00 O ATOM 0 H GLY A 38 104.610 -12.840 14.685 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.318 -13.086 15.752 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.823 -13.005 14.073 1.00 0.00 H new ATOM 550 N VAL A 39 108.204 -10.722 15.483 1.00 0.00 N ATOM 551 CA VAL A 39 108.558 -9.310 15.608 1.00 0.00 C ATOM 552 C VAL A 39 109.408 -8.883 14.418 1.00 0.00 C ATOM 553 O VAL A 39 110.446 -9.480 14.144 1.00 0.00 O ATOM 554 CB VAL A 39 109.332 -9.069 16.911 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.612 -7.574 17.080 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.504 -9.558 18.104 1.00 0.00 C ATOM 0 H VAL A 39 108.934 -11.375 15.767 1.00 0.00 H new ATOM 0 HA VAL A 39 107.642 -8.719 15.628 1.00 0.00 H new ATOM 0 HB VAL A 39 110.274 -9.616 16.867 1.00 0.00 H new ATOM 0 HG11 VAL A 39 110.162 -7.409 18.007 1.00 0.00 H new ATOM 0 HG12 VAL A 39 110.205 -7.217 16.238 1.00 0.00 H new ATOM 0 HG13 VAL A 39 108.669 -7.029 17.116 1.00 0.00 H new ATOM 0 HG21 VAL A 39 109.058 -9.385 19.027 1.00 0.00 H new ATOM 0 HG22 VAL A 39 107.560 -9.014 18.139 1.00 0.00 H new ATOM 0 HG23 VAL A 39 108.304 -10.624 17.996 1.00 0.00 H new ATOM 566 N ILE A 40 108.966 -7.838 13.721 1.00 0.00 N ATOM 567 CA ILE A 40 109.700 -7.333 12.565 1.00 0.00 C ATOM 568 C ILE A 40 110.089 -5.883 12.813 1.00 0.00 C ATOM 569 O ILE A 40 109.261 -5.093 13.257 1.00 0.00 O ATOM 570 CB ILE A 40 108.831 -7.428 11.302 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.392 -8.878 11.088 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.634 -6.968 10.082 1.00 0.00 C ATOM 573 CD1 ILE A 40 107.346 -8.938 9.971 1.00 0.00 C ATOM 0 H ILE A 40 108.109 -7.328 13.935 1.00 0.00 H new ATOM 0 HA ILE A 40 110.597 -7.934 12.418 1.00 0.00 H new ATOM 0 HB ILE A 40 107.956 -6.790 11.427 1.00 0.00 H new ATOM 0 HG12 ILE A 40 109.252 -9.495 10.828 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.977 -9.283 12.011 1.00 0.00 H new ATOM 0 HG21 ILE A 40 109.012 -7.038 9.190 1.00 0.00 H new ATOM 0 HG22 ILE A 40 109.951 -5.935 10.224 1.00 0.00 H new ATOM 0 HG23 ILE A 40 110.512 -7.604 9.963 1.00 0.00 H new ATOM 0 HD11 ILE A 40 107.034 -9.971 9.820 1.00 0.00 H new ATOM 0 HD12 ILE A 40 106.482 -8.335 10.249 1.00 0.00 H new ATOM 0 HD13 ILE A 40 107.777 -8.550 9.048 1.00 0.00 H new ATOM 585 N GLY A 41 111.348 -5.559 12.544 1.00 0.00 N ATOM 586 CA GLY A 41 111.823 -4.181 12.644 1.00 0.00 C ATOM 587 C GLY A 41 112.470 -3.772 11.328 1.00 0.00 C ATOM 588 O GLY A 41 113.259 -4.531 10.767 1.00 0.00 O ATOM 0 H GLY A 41 112.060 -6.230 12.255 1.00 0.00 H new ATOM 0 HA2 GLY A 41 110.992 -3.514 12.876 1.00 0.00 H new ATOM 0 HA3 GLY A 41 112.542 -4.091 13.459 1.00 0.00 H new ATOM 592 N SER A 42 112.136 -2.581 10.834 1.00 0.00 N ATOM 593 CA SER A 42 112.608 -2.151 9.521 1.00 0.00 C ATOM 594 C SER A 42 113.283 -0.787 9.590 1.00 0.00 C ATOM 595 O SER A 42 112.839 0.104 10.314 1.00 0.00 O ATOM 596 CB SER A 42 111.427 -2.074 8.553 1.00 0.00 C ATOM 597 OG SER A 42 110.562 -1.019 8.954 1.00 0.00 O ATOM 0 H SER A 42 111.547 -1.904 11.318 1.00 0.00 H new ATOM 0 HA SER A 42 113.339 -2.880 9.172 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.784 -1.902 7.538 1.00 0.00 H new ATOM 0 HB3 SER A 42 110.886 -3.020 8.544 1.00 0.00 H new ATOM 0 HG SER A 42 109.804 -0.964 8.335 1.00 0.00 H new ATOM 603 N PHE A 43 114.349 -0.645 8.809 1.00 0.00 N ATOM 604 CA PHE A 43 115.052 0.626 8.673 1.00 0.00 C ATOM 605 C PHE A 43 114.863 1.141 7.252 1.00 0.00 C ATOM 606 O PHE A 43 115.110 0.402 6.298 1.00 0.00 O ATOM 607 CB PHE A 43 116.542 0.409 8.948 1.00 0.00 C ATOM 608 CG PHE A 43 117.351 1.682 8.987 1.00 0.00 C ATOM 609 CD1 PHE A 43 117.520 2.365 10.195 1.00 0.00 C ATOM 610 CD2 PHE A 43 117.938 2.175 7.815 1.00 0.00 C ATOM 611 CE1 PHE A 43 118.276 3.542 10.235 1.00 0.00 C ATOM 612 CE2 PHE A 43 118.693 3.353 7.853 1.00 0.00 C ATOM 613 CZ PHE A 43 118.863 4.036 9.064 1.00 0.00 C ATOM 0 H PHE A 43 114.748 -1.403 8.255 1.00 0.00 H new ATOM 0 HA PHE A 43 114.657 1.352 9.383 1.00 0.00 H new ATOM 0 HB2 PHE A 43 116.653 -0.109 9.900 1.00 0.00 H new ATOM 0 HB3 PHE A 43 116.951 -0.246 8.179 1.00 0.00 H new ATOM 0 HD1 PHE A 43 117.067 1.984 11.098 1.00 0.00 H new ATOM 0 HD2 PHE A 43 117.808 1.646 6.882 1.00 0.00 H new ATOM 0 HE1 PHE A 43 118.407 4.069 11.169 1.00 0.00 H new ATOM 0 HE2 PHE A 43 119.144 3.735 6.949 1.00 0.00 H new ATOM 0 HZ PHE A 43 119.447 4.944 9.094 1.00 0.00 H new ATOM 623 N THR A 44 114.420 2.391 7.102 1.00 0.00 N ATOM 624 CA THR A 44 114.130 2.931 5.775 1.00 0.00 C ATOM 625 C THR A 44 114.911 4.216 5.522 1.00 0.00 C ATOM 626 O THR A 44 114.946 5.106 6.373 1.00 0.00 O ATOM 627 CB THR A 44 112.628 3.216 5.658 1.00 0.00 C ATOM 628 OG1 THR A 44 111.903 2.032 5.953 1.00 0.00 O ATOM 629 CG2 THR A 44 112.281 3.681 4.238 1.00 0.00 C ATOM 0 H THR A 44 114.256 3.040 7.872 1.00 0.00 H new ATOM 0 HA THR A 44 114.431 2.194 5.031 1.00 0.00 H new ATOM 0 HB THR A 44 112.361 4.004 6.363 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.114 1.345 5.287 1.00 0.00 H new ATOM 0 HG21 THR A 44 111.211 3.879 4.171 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.834 4.592 4.008 1.00 0.00 H new ATOM 0 HG23 THR A 44 112.551 2.903 3.524 1.00 0.00 H new ATOM 637 N TYR A 45 115.538 4.289 4.349 1.00 0.00 N ATOM 638 CA TYR A 45 116.226 5.506 3.920 1.00 0.00 C ATOM 639 C TYR A 45 115.727 5.912 2.537 1.00 0.00 C ATOM 640 O TYR A 45 115.591 5.063 1.661 1.00 0.00 O ATOM 641 CB TYR A 45 117.736 5.268 3.873 1.00 0.00 C ATOM 642 CG TYR A 45 118.529 6.506 3.530 1.00 0.00 C ATOM 643 CD1 TYR A 45 118.885 7.412 4.538 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.905 6.751 2.205 1.00 0.00 C ATOM 645 CE1 TYR A 45 119.618 8.560 4.218 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.639 7.900 1.885 1.00 0.00 C ATOM 647 CZ TYR A 45 119.994 8.804 2.892 1.00 0.00 C ATOM 648 OH TYR A 45 120.717 9.937 2.577 1.00 0.00 O ATOM 0 H TYR A 45 115.584 3.521 3.679 1.00 0.00 H new ATOM 0 HA TYR A 45 116.016 6.304 4.632 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.067 4.890 4.841 1.00 0.00 H new ATOM 0 HB3 TYR A 45 117.951 4.493 3.138 1.00 0.00 H new ATOM 0 HD1 TYR A 45 118.594 7.224 5.561 1.00 0.00 H new ATOM 0 HD2 TYR A 45 118.629 6.053 1.428 1.00 0.00 H new ATOM 0 HE1 TYR A 45 119.894 9.258 4.994 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.931 8.088 0.862 1.00 0.00 H new ATOM 0 HH TYR A 45 120.897 9.953 1.614 1.00 0.00 H new ATOM 658 N THR A 46 115.462 7.203 2.341 1.00 0.00 N ATOM 659 CA THR A 46 114.932 7.684 1.064 1.00 0.00 C ATOM 660 C THR A 46 115.900 8.661 0.405 1.00 0.00 C ATOM 661 O THR A 46 116.578 9.434 1.083 1.00 0.00 O ATOM 662 CB THR A 46 113.588 8.380 1.280 1.00 0.00 C ATOM 663 OG1 THR A 46 112.759 7.567 2.099 1.00 0.00 O ATOM 664 CG2 THR A 46 112.907 8.604 -0.071 1.00 0.00 C ATOM 0 H THR A 46 115.604 7.930 3.043 1.00 0.00 H new ATOM 0 HA THR A 46 114.800 6.822 0.411 1.00 0.00 H new ATOM 0 HB THR A 46 113.751 9.341 1.769 1.00 0.00 H new ATOM 0 HG1 THR A 46 111.898 8.014 2.239 1.00 0.00 H new ATOM 0 HG21 THR A 46 111.949 9.100 0.082 1.00 0.00 H new ATOM 0 HG22 THR A 46 113.542 9.228 -0.700 1.00 0.00 H new ATOM 0 HG23 THR A 46 112.744 7.644 -0.560 1.00 0.00 H new ATOM 672 N GLU A 47 115.955 8.620 -0.925 1.00 0.00 N ATOM 673 CA GLU A 47 116.831 9.506 -1.681 1.00 0.00 C ATOM 674 C GLU A 47 116.046 10.189 -2.796 1.00 0.00 C ATOM 675 O GLU A 47 115.173 9.577 -3.413 1.00 0.00 O ATOM 676 CB GLU A 47 117.987 8.706 -2.284 1.00 0.00 C ATOM 677 CG GLU A 47 118.999 9.667 -2.920 1.00 0.00 C ATOM 678 CD GLU A 47 120.138 8.919 -3.621 1.00 0.00 C ATOM 679 OE1 GLU A 47 120.129 7.697 -3.643 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.018 9.591 -4.135 1.00 0.00 O ATOM 0 H GLU A 47 115.403 7.983 -1.499 1.00 0.00 H new ATOM 0 HA GLU A 47 117.231 10.264 -1.008 1.00 0.00 H new ATOM 0 HB2 GLU A 47 118.472 8.110 -1.511 1.00 0.00 H new ATOM 0 HB3 GLU A 47 117.610 8.010 -3.034 1.00 0.00 H new ATOM 0 HG2 GLU A 47 118.489 10.307 -3.640 1.00 0.00 H new ATOM 0 HG3 GLU A 47 119.413 10.319 -2.151 1.00 0.00 H new ATOM 687 N LYS A 48 116.353 11.462 -3.033 1.00 0.00 N ATOM 688 CA LYS A 48 115.696 12.224 -4.090 1.00 0.00 C ATOM 689 C LYS A 48 116.670 12.484 -5.235 1.00 0.00 C ATOM 690 O LYS A 48 117.834 12.812 -5.005 1.00 0.00 O ATOM 691 CB LYS A 48 115.190 13.556 -3.536 1.00 0.00 C ATOM 692 CG LYS A 48 114.357 14.271 -4.602 1.00 0.00 C ATOM 693 CD LYS A 48 113.920 15.640 -4.077 1.00 0.00 C ATOM 694 CE LYS A 48 112.957 16.287 -5.074 1.00 0.00 C ATOM 695 NZ LYS A 48 111.634 15.604 -5.000 1.00 0.00 N ATOM 0 H LYS A 48 117.052 11.987 -2.507 1.00 0.00 H new ATOM 0 HA LYS A 48 114.852 11.645 -4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 48 114.588 13.385 -2.643 1.00 0.00 H new ATOM 0 HB3 LYS A 48 116.032 14.181 -3.238 1.00 0.00 H new ATOM 0 HG2 LYS A 48 114.940 14.389 -5.515 1.00 0.00 H new ATOM 0 HG3 LYS A 48 113.483 13.672 -4.858 1.00 0.00 H new ATOM 0 HD2 LYS A 48 113.436 15.531 -3.106 1.00 0.00 H new ATOM 0 HD3 LYS A 48 114.790 16.279 -3.929 1.00 0.00 H new ATOM 0 HE2 LYS A 48 112.844 17.348 -4.851 1.00 0.00 H new ATOM 0 HE3 LYS A 48 113.360 16.215 -6.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 110.878 16.288 -5.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 111.602 14.832 -5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 111.497 15.214 -4.045 1.00 0.00 H new ATOM 709 N SER A 49 116.190 12.336 -6.464 1.00 0.00 N ATOM 710 CA SER A 49 117.040 12.541 -7.630 1.00 0.00 C ATOM 711 C SER A 49 117.478 13.999 -7.723 1.00 0.00 C ATOM 712 O SER A 49 116.831 14.889 -7.167 1.00 0.00 O ATOM 713 CB SER A 49 116.285 12.152 -8.903 1.00 0.00 C ATOM 714 OG SER A 49 115.322 13.154 -9.200 1.00 0.00 O ATOM 0 H SER A 49 115.227 12.077 -6.678 1.00 0.00 H new ATOM 0 HA SER A 49 117.924 11.912 -7.526 1.00 0.00 H new ATOM 0 HB2 SER A 49 116.982 12.043 -9.734 1.00 0.00 H new ATOM 0 HB3 SER A 49 115.795 11.188 -8.769 1.00 0.00 H new ATOM 0 HG SER A 49 114.837 12.910 -10.016 1.00 0.00 H new ATOM 720 N ARG A 50 118.577 14.237 -8.428 1.00 0.00 N ATOM 721 CA ARG A 50 119.099 15.588 -8.586 1.00 0.00 C ATOM 722 C ARG A 50 118.049 16.500 -9.214 1.00 0.00 C ATOM 723 O ARG A 50 117.335 16.102 -10.134 1.00 0.00 O ATOM 724 CB ARG A 50 120.342 15.562 -9.476 1.00 0.00 C ATOM 725 CG ARG A 50 121.430 14.714 -8.815 1.00 0.00 C ATOM 726 CD ARG A 50 122.685 14.718 -9.687 1.00 0.00 C ATOM 727 NE ARG A 50 123.309 16.044 -9.674 1.00 0.00 N ATOM 728 CZ ARG A 50 124.525 16.296 -10.182 1.00 0.00 C ATOM 729 NH1 ARG A 50 125.258 15.361 -10.738 1.00 0.00 N ATOM 730 NH2 ARG A 50 124.994 17.511 -10.120 1.00 0.00 N ATOM 0 H ARG A 50 119.122 13.514 -8.898 1.00 0.00 H new ATOM 0 HA ARG A 50 119.359 15.974 -7.600 1.00 0.00 H new ATOM 0 HB2 ARG A 50 120.092 15.152 -10.455 1.00 0.00 H new ATOM 0 HB3 ARG A 50 120.706 16.576 -9.639 1.00 0.00 H new ATOM 0 HG2 ARG A 50 121.661 15.108 -7.826 1.00 0.00 H new ATOM 0 HG3 ARG A 50 121.075 13.693 -8.676 1.00 0.00 H new ATOM 0 HD2 ARG A 50 123.392 13.972 -9.323 1.00 0.00 H new ATOM 0 HD3 ARG A 50 122.427 14.440 -10.709 1.00 0.00 H new ATOM 0 HE ARG A 50 122.791 16.817 -9.256 1.00 0.00 H new ATOM 0 HH11 ARG A 50 124.908 14.405 -10.795 1.00 0.00 H new ATOM 0 HH12 ARG A 50 126.178 15.590 -11.114 1.00 0.00 H new ATOM 0 HH21 ARG A 50 124.438 18.251 -9.691 1.00 0.00 H new ATOM 0 HH22 ARG A 50 125.916 17.722 -10.501 1.00 0.00 H new ATOM 744 N THR A 51 117.964 17.728 -8.708 1.00 0.00 N ATOM 745 CA THR A 51 117.031 18.713 -9.246 1.00 0.00 C ATOM 746 C THR A 51 117.754 20.031 -9.510 1.00 0.00 C ATOM 747 O THR A 51 118.847 20.260 -8.993 1.00 0.00 O ATOM 748 CB THR A 51 115.883 18.951 -8.261 1.00 0.00 C ATOM 749 OG1 THR A 51 116.399 19.505 -7.059 1.00 0.00 O ATOM 750 CG2 THR A 51 115.178 17.628 -7.955 1.00 0.00 C ATOM 0 H THR A 51 118.529 18.064 -7.928 1.00 0.00 H new ATOM 0 HA THR A 51 116.626 18.329 -10.182 1.00 0.00 H new ATOM 0 HB THR A 51 115.167 19.643 -8.704 1.00 0.00 H new ATOM 0 HG1 THR A 51 115.665 19.659 -6.428 1.00 0.00 H new ATOM 0 HG21 THR A 51 114.362 17.804 -7.254 1.00 0.00 H new ATOM 0 HG22 THR A 51 114.779 17.207 -8.878 1.00 0.00 H new ATOM 0 HG23 THR A 51 115.890 16.929 -7.515 1.00 0.00 H new ATOM 758 N ALA A 52 117.141 20.892 -10.315 1.00 0.00 N ATOM 759 CA ALA A 52 117.736 22.192 -10.612 1.00 0.00 C ATOM 760 C ALA A 52 117.368 23.199 -9.527 1.00 0.00 C ATOM 761 O ALA A 52 116.316 23.835 -9.587 1.00 0.00 O ATOM 762 CB ALA A 52 117.241 22.694 -11.969 1.00 0.00 C ATOM 0 H ALA A 52 116.244 20.718 -10.769 1.00 0.00 H new ATOM 0 HA ALA A 52 118.820 22.083 -10.642 1.00 0.00 H new ATOM 0 HB1 ALA A 52 117.689 23.664 -12.184 1.00 0.00 H new ATOM 0 HB2 ALA A 52 117.525 21.983 -12.745 1.00 0.00 H new ATOM 0 HB3 ALA A 52 116.156 22.793 -11.947 1.00 0.00 H new ATOM 768 N SER A 53 118.244 23.338 -8.539 1.00 0.00 N ATOM 769 CA SER A 53 117.997 24.261 -7.436 1.00 0.00 C ATOM 770 C SER A 53 119.295 24.571 -6.696 1.00 0.00 C ATOM 771 O SER A 53 120.340 23.987 -6.985 1.00 0.00 O ATOM 772 CB SER A 53 116.987 23.654 -6.464 1.00 0.00 C ATOM 773 OG SER A 53 115.769 23.402 -7.152 1.00 0.00 O ATOM 0 H SER A 53 119.125 22.828 -8.478 1.00 0.00 H new ATOM 0 HA SER A 53 117.595 25.188 -7.846 1.00 0.00 H new ATOM 0 HB2 SER A 53 117.380 22.728 -6.044 1.00 0.00 H new ATOM 0 HB3 SER A 53 116.813 24.334 -5.630 1.00 0.00 H new ATOM 0 HG SER A 53 115.771 23.880 -8.007 1.00 0.00 H new ATOM 779 N SER A 54 119.221 25.493 -5.743 1.00 0.00 N ATOM 780 CA SER A 54 120.391 25.843 -4.940 1.00 0.00 C ATOM 781 C SER A 54 120.945 24.627 -4.192 1.00 0.00 C ATOM 782 O SER A 54 122.149 24.536 -3.956 1.00 0.00 O ATOM 783 CB SER A 54 120.021 26.933 -3.934 1.00 0.00 C ATOM 784 OG SER A 54 119.116 26.396 -2.976 1.00 0.00 O ATOM 0 H SER A 54 118.373 26.008 -5.507 1.00 0.00 H new ATOM 0 HA SER A 54 121.163 26.207 -5.618 1.00 0.00 H new ATOM 0 HB2 SER A 54 120.917 27.306 -3.437 1.00 0.00 H new ATOM 0 HB3 SER A 54 119.566 27.780 -4.448 1.00 0.00 H new ATOM 0 HG SER A 54 118.877 27.090 -2.327 1.00 0.00 H new ATOM 790 N GLY A 55 120.068 23.695 -3.823 1.00 0.00 N ATOM 791 CA GLY A 55 120.496 22.485 -3.123 1.00 0.00 C ATOM 792 C GLY A 55 121.271 21.536 -4.039 1.00 0.00 C ATOM 793 O GLY A 55 122.145 20.807 -3.570 1.00 0.00 O ATOM 0 H GLY A 55 119.064 23.753 -3.995 1.00 0.00 H new ATOM 0 HA2 GLY A 55 121.121 22.760 -2.273 1.00 0.00 H new ATOM 0 HA3 GLY A 55 119.623 21.970 -2.723 1.00 0.00 H new ATOM 797 N ASP A 56 120.949 21.554 -5.336 1.00 0.00 N ATOM 798 CA ASP A 56 121.595 20.702 -6.337 1.00 0.00 C ATOM 799 C ASP A 56 121.103 19.260 -6.239 1.00 0.00 C ATOM 800 O ASP A 56 120.316 18.817 -7.076 1.00 0.00 O ATOM 801 CB ASP A 56 123.125 20.747 -6.221 1.00 0.00 C ATOM 802 CG ASP A 56 123.757 20.159 -7.477 1.00 0.00 C ATOM 803 OD1 ASP A 56 123.989 18.962 -7.496 1.00 0.00 O ATOM 804 OD2 ASP A 56 124.002 20.915 -8.403 1.00 0.00 O ATOM 0 H ASP A 56 120.229 22.164 -5.722 1.00 0.00 H new ATOM 0 HA ASP A 56 121.318 21.098 -7.314 1.00 0.00 H new ATOM 0 HB2 ASP A 56 123.458 21.776 -6.083 1.00 0.00 H new ATOM 0 HB3 ASP A 56 123.449 20.187 -5.344 1.00 0.00 H new ATOM 809 N TYR A 57 121.561 18.522 -5.230 1.00 0.00 N ATOM 810 CA TYR A 57 121.160 17.128 -5.069 1.00 0.00 C ATOM 811 C TYR A 57 120.808 16.825 -3.613 1.00 0.00 C ATOM 812 O TYR A 57 121.183 17.568 -2.706 1.00 0.00 O ATOM 813 CB TYR A 57 122.290 16.207 -5.543 1.00 0.00 C ATOM 814 CG TYR A 57 123.520 16.221 -4.660 1.00 0.00 C ATOM 815 CD1 TYR A 57 124.550 17.135 -4.905 1.00 0.00 C ATOM 816 CD2 TYR A 57 123.624 15.316 -3.595 1.00 0.00 C ATOM 817 CE1 TYR A 57 125.687 17.145 -4.087 1.00 0.00 C ATOM 818 CE2 TYR A 57 124.759 15.327 -2.777 1.00 0.00 C ATOM 819 CZ TYR A 57 125.791 16.242 -3.022 1.00 0.00 C ATOM 820 OH TYR A 57 126.910 16.253 -2.216 1.00 0.00 O ATOM 0 H TYR A 57 122.205 18.864 -4.517 1.00 0.00 H new ATOM 0 HA TYR A 57 120.272 16.951 -5.675 1.00 0.00 H new ATOM 0 HB2 TYR A 57 121.911 15.187 -5.601 1.00 0.00 H new ATOM 0 HB3 TYR A 57 122.579 16.497 -6.553 1.00 0.00 H new ATOM 0 HD1 TYR A 57 124.469 17.833 -5.725 1.00 0.00 H new ATOM 0 HD2 TYR A 57 122.828 14.610 -3.406 1.00 0.00 H new ATOM 0 HE1 TYR A 57 126.483 17.849 -4.278 1.00 0.00 H new ATOM 0 HE2 TYR A 57 124.840 14.630 -1.956 1.00 0.00 H new ATOM 0 HH TYR A 57 126.822 15.564 -1.524 1.00 0.00 H new ATOM 830 N ASN A 58 120.086 15.729 -3.400 1.00 0.00 N ATOM 831 CA ASN A 58 119.726 15.317 -2.045 1.00 0.00 C ATOM 832 C ASN A 58 118.966 16.434 -1.327 1.00 0.00 C ATOM 833 O ASN A 58 119.331 16.860 -0.231 1.00 0.00 O ATOM 834 CB ASN A 58 120.994 14.944 -1.271 1.00 0.00 C ATOM 835 CG ASN A 58 120.622 14.268 0.045 1.00 0.00 C ATOM 836 OD1 ASN A 58 120.723 14.883 1.108 1.00 0.00 O ATOM 837 ND2 ASN A 58 120.196 13.037 0.037 1.00 0.00 N ATOM 0 H ASN A 58 119.741 15.115 -4.138 1.00 0.00 H new ATOM 0 HA ASN A 58 119.072 14.447 -2.099 1.00 0.00 H new ATOM 0 HB2 ASN A 58 121.613 14.276 -1.870 1.00 0.00 H new ATOM 0 HB3 ASN A 58 121.587 15.838 -1.076 1.00 0.00 H new ATOM 0 HD21 ASN A 58 119.945 12.579 0.913 1.00 0.00 H new ATOM 0 HD22 ASN A 58 120.114 12.531 -0.845 1.00 0.00 H new ATOM 844 N LYS A 59 117.895 16.905 -1.958 1.00 0.00 N ATOM 845 CA LYS A 59 117.118 18.012 -1.404 1.00 0.00 C ATOM 846 C LYS A 59 116.650 17.697 0.015 1.00 0.00 C ATOM 847 O LYS A 59 116.651 18.572 0.882 1.00 0.00 O ATOM 848 CB LYS A 59 115.904 18.290 -2.296 1.00 0.00 C ATOM 849 CG LYS A 59 115.177 19.543 -1.801 1.00 0.00 C ATOM 850 CD LYS A 59 113.920 19.770 -2.641 1.00 0.00 C ATOM 851 CE LYS A 59 113.277 21.103 -2.250 1.00 0.00 C ATOM 852 NZ LYS A 59 113.954 22.214 -2.976 1.00 0.00 N ATOM 0 H LYS A 59 117.546 16.542 -2.845 1.00 0.00 H new ATOM 0 HA LYS A 59 117.758 18.894 -1.368 1.00 0.00 H new ATOM 0 HB2 LYS A 59 116.223 18.427 -3.329 1.00 0.00 H new ATOM 0 HB3 LYS A 59 115.227 17.436 -2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 59 114.909 19.430 -0.750 1.00 0.00 H new ATOM 0 HG3 LYS A 59 115.835 20.409 -1.871 1.00 0.00 H new ATOM 0 HD2 LYS A 59 114.174 19.774 -3.701 1.00 0.00 H new ATOM 0 HD3 LYS A 59 113.214 18.954 -2.486 1.00 0.00 H new ATOM 0 HE2 LYS A 59 112.214 21.091 -2.492 1.00 0.00 H new ATOM 0 HE3 LYS A 59 113.357 21.256 -1.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 113.517 23.120 -2.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 114.963 22.229 -2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 113.855 22.070 -4.001 1.00 0.00 H new ATOM 866 N ASN A 60 116.251 16.450 0.249 1.00 0.00 N ATOM 867 CA ASN A 60 115.788 16.050 1.574 1.00 0.00 C ATOM 868 C ASN A 60 116.193 14.612 1.889 1.00 0.00 C ATOM 869 O ASN A 60 116.473 13.822 0.987 1.00 0.00 O ATOM 870 CB ASN A 60 114.265 16.196 1.659 1.00 0.00 C ATOM 871 CG ASN A 60 113.572 15.249 0.680 1.00 0.00 C ATOM 872 OD1 ASN A 60 114.195 14.761 -0.263 1.00 0.00 O ATOM 873 ND2 ASN A 60 112.311 14.958 0.852 1.00 0.00 N ATOM 0 H ASN A 60 116.239 15.708 -0.451 1.00 0.00 H new ATOM 0 HA ASN A 60 116.257 16.703 2.310 1.00 0.00 H new ATOM 0 HB2 ASN A 60 113.931 15.984 2.675 1.00 0.00 H new ATOM 0 HB3 ASN A 60 113.981 17.225 1.439 1.00 0.00 H new ATOM 0 HD21 ASN A 60 111.841 14.326 0.205 1.00 0.00 H new ATOM 0 HD22 ASN A 60 111.796 15.363 1.634 1.00 0.00 H new ATOM 880 N GLN A 61 116.224 14.281 3.178 1.00 0.00 N ATOM 881 CA GLN A 61 116.566 12.931 3.615 1.00 0.00 C ATOM 882 C GLN A 61 115.472 12.382 4.523 1.00 0.00 C ATOM 883 O GLN A 61 114.842 13.137 5.261 1.00 0.00 O ATOM 884 CB GLN A 61 117.896 12.950 4.372 1.00 0.00 C ATOM 885 CG GLN A 61 119.017 13.385 3.424 1.00 0.00 C ATOM 886 CD GLN A 61 120.342 13.499 4.176 1.00 0.00 C ATOM 887 OE1 GLN A 61 120.363 13.590 5.404 1.00 0.00 O ATOM 888 NE2 GLN A 61 121.460 13.500 3.502 1.00 0.00 N ATOM 0 H GLN A 61 116.016 14.930 3.937 1.00 0.00 H new ATOM 0 HA GLN A 61 116.658 12.291 2.738 1.00 0.00 H new ATOM 0 HB2 GLN A 61 117.835 13.634 5.218 1.00 0.00 H new ATOM 0 HB3 GLN A 61 118.111 11.961 4.776 1.00 0.00 H new ATOM 0 HG2 GLN A 61 119.114 12.664 2.612 1.00 0.00 H new ATOM 0 HG3 GLN A 61 118.766 14.344 2.971 1.00 0.00 H new ATOM 0 HE21 GLN A 61 121.442 13.425 2.485 1.00 0.00 H new ATOM 0 HE22 GLN A 61 122.351 13.576 3.992 1.00 0.00 H new ATOM 897 N TYR A 62 115.262 11.066 4.474 1.00 0.00 N ATOM 898 CA TYR A 62 114.227 10.430 5.287 1.00 0.00 C ATOM 899 C TYR A 62 114.820 9.326 6.158 1.00 0.00 C ATOM 900 O TYR A 62 115.633 8.523 5.701 1.00 0.00 O ATOM 901 CB TYR A 62 113.148 9.829 4.386 1.00 0.00 C ATOM 902 CG TYR A 62 111.955 9.302 5.149 1.00 0.00 C ATOM 903 CD1 TYR A 62 110.867 10.144 5.417 1.00 0.00 C ATOM 904 CD2 TYR A 62 111.935 7.974 5.585 1.00 0.00 C ATOM 905 CE1 TYR A 62 109.762 9.656 6.122 1.00 0.00 C ATOM 906 CE2 TYR A 62 110.829 7.485 6.292 1.00 0.00 C ATOM 907 CZ TYR A 62 109.743 8.326 6.560 1.00 0.00 C ATOM 908 OH TYR A 62 108.652 7.844 7.255 1.00 0.00 O ATOM 0 H TYR A 62 115.791 10.424 3.884 1.00 0.00 H new ATOM 0 HA TYR A 62 113.789 11.193 5.931 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.812 10.587 3.679 1.00 0.00 H new ATOM 0 HB3 TYR A 62 113.583 9.018 3.801 1.00 0.00 H new ATOM 0 HD1 TYR A 62 110.882 11.170 5.079 1.00 0.00 H new ATOM 0 HD2 TYR A 62 112.773 7.325 5.377 1.00 0.00 H new ATOM 0 HE1 TYR A 62 108.924 10.305 6.329 1.00 0.00 H new ATOM 0 HE2 TYR A 62 110.814 6.459 6.630 1.00 0.00 H new ATOM 0 HH TYR A 62 108.800 6.903 7.484 1.00 0.00 H new ATOM 918 N TYR A 63 114.399 9.302 7.417 1.00 0.00 N ATOM 919 CA TYR A 63 114.835 8.276 8.356 1.00 0.00 C ATOM 920 C TYR A 63 113.613 7.654 9.023 1.00 0.00 C ATOM 921 O TYR A 63 112.850 8.365 9.675 1.00 0.00 O ATOM 922 CB TYR A 63 115.728 8.926 9.414 1.00 0.00 C ATOM 923 CG TYR A 63 116.268 7.970 10.450 1.00 0.00 C ATOM 924 CD1 TYR A 63 115.517 7.689 11.598 1.00 0.00 C ATOM 925 CD2 TYR A 63 117.523 7.379 10.271 1.00 0.00 C ATOM 926 CE1 TYR A 63 116.022 6.816 12.568 1.00 0.00 C ATOM 927 CE2 TYR A 63 118.028 6.505 11.242 1.00 0.00 C ATOM 928 CZ TYR A 63 117.278 6.223 12.389 1.00 0.00 C ATOM 929 OH TYR A 63 117.776 5.363 13.346 1.00 0.00 O ATOM 0 H TYR A 63 113.753 9.985 7.812 1.00 0.00 H new ATOM 0 HA TYR A 63 115.392 7.499 7.833 1.00 0.00 H new ATOM 0 HB2 TYR A 63 116.566 9.412 8.915 1.00 0.00 H new ATOM 0 HB3 TYR A 63 115.161 9.708 9.920 1.00 0.00 H new ATOM 0 HD1 TYR A 63 114.548 8.146 11.735 1.00 0.00 H new ATOM 0 HD2 TYR A 63 118.102 7.596 9.385 1.00 0.00 H new ATOM 0 HE1 TYR A 63 115.444 6.600 13.454 1.00 0.00 H new ATOM 0 HE2 TYR A 63 118.997 6.048 11.105 1.00 0.00 H new ATOM 0 HH TYR A 63 118.658 5.038 13.067 1.00 0.00 H new ATOM 939 N GLY A 64 113.404 6.346 8.853 1.00 0.00 N ATOM 940 CA GLY A 64 112.211 5.704 9.407 1.00 0.00 C ATOM 941 C GLY A 64 112.547 4.448 10.200 1.00 0.00 C ATOM 942 O GLY A 64 113.345 3.621 9.756 1.00 0.00 O ATOM 0 H GLY A 64 114.032 5.722 8.347 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.688 6.410 10.052 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.529 5.448 8.596 1.00 0.00 H new ATOM 946 N ILE A 65 111.926 4.317 11.371 1.00 0.00 N ATOM 947 CA ILE A 65 112.049 3.101 12.175 1.00 0.00 C ATOM 948 C ILE A 65 110.654 2.551 12.448 1.00 0.00 C ATOM 949 O ILE A 65 109.832 3.225 13.070 1.00 0.00 O ATOM 950 CB ILE A 65 112.761 3.404 13.498 1.00 0.00 C ATOM 951 CG1 ILE A 65 114.133 4.021 13.212 1.00 0.00 C ATOM 952 CG2 ILE A 65 112.947 2.107 14.291 1.00 0.00 C ATOM 953 CD1 ILE A 65 114.781 4.468 14.526 1.00 0.00 C ATOM 0 H ILE A 65 111.333 5.037 11.784 1.00 0.00 H new ATOM 0 HA ILE A 65 112.639 2.364 11.631 1.00 0.00 H new ATOM 0 HB ILE A 65 112.159 4.103 14.078 1.00 0.00 H new ATOM 0 HG12 ILE A 65 114.771 3.295 12.709 1.00 0.00 H new ATOM 0 HG13 ILE A 65 114.027 4.872 12.539 1.00 0.00 H new ATOM 0 HG21 ILE A 65 113.453 2.325 15.231 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.973 1.664 14.498 1.00 0.00 H new ATOM 0 HG23 ILE A 65 113.547 1.408 13.709 1.00 0.00 H new ATOM 0 HD11 ILE A 65 115.757 4.907 14.319 1.00 0.00 H new ATOM 0 HD12 ILE A 65 114.146 5.209 15.011 1.00 0.00 H new ATOM 0 HD13 ILE A 65 114.902 3.607 15.183 1.00 0.00 H new ATOM 965 N THR A 66 110.378 1.345 11.956 1.00 0.00 N ATOM 966 CA THR A 66 109.042 0.760 12.079 1.00 0.00 C ATOM 967 C THR A 66 109.106 -0.592 12.785 1.00 0.00 C ATOM 968 O THR A 66 110.090 -1.315 12.651 1.00 0.00 O ATOM 969 CB THR A 66 108.434 0.590 10.684 1.00 0.00 C ATOM 970 OG1 THR A 66 108.801 1.691 9.866 1.00 0.00 O ATOM 971 CG2 THR A 66 106.911 0.539 10.792 1.00 0.00 C ATOM 0 H THR A 66 111.056 0.756 11.471 1.00 0.00 H new ATOM 0 HA THR A 66 108.419 1.427 12.674 1.00 0.00 H new ATOM 0 HB THR A 66 108.804 -0.336 10.244 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.412 1.579 8.973 1.00 0.00 H new ATOM 0 HG21 THR A 66 106.480 0.418 9.798 1.00 0.00 H new ATOM 0 HG22 THR A 66 106.619 -0.303 11.419 1.00 0.00 H new ATOM 0 HG23 THR A 66 106.546 1.466 11.235 1.00 0.00 H new ATOM 979 N ALA A 67 108.053 -0.938 13.522 1.00 0.00 N ATOM 980 CA ALA A 67 107.991 -2.240 14.183 1.00 0.00 C ATOM 981 C ALA A 67 106.552 -2.751 14.194 1.00 0.00 C ATOM 982 O ALA A 67 105.622 -1.950 14.270 1.00 0.00 O ATOM 983 CB ALA A 67 108.510 -2.127 15.618 1.00 0.00 C ATOM 0 H ALA A 67 107.239 -0.343 13.676 1.00 0.00 H new ATOM 0 HA ALA A 67 108.617 -2.943 13.633 1.00 0.00 H new ATOM 0 HB1 ALA A 67 108.459 -3.103 16.101 1.00 0.00 H new ATOM 0 HB2 ALA A 67 109.544 -1.782 15.605 1.00 0.00 H new ATOM 0 HB3 ALA A 67 107.897 -1.416 16.172 1.00 0.00 H new ATOM 989 N GLY A 68 106.366 -4.069 14.083 1.00 0.00 N ATOM 990 CA GLY A 68 105.010 -4.620 14.083 1.00 0.00 C ATOM 991 C GLY A 68 104.980 -6.143 14.239 1.00 0.00 C ATOM 992 O GLY A 68 106.023 -6.793 14.155 1.00 0.00 O ATOM 0 H GLY A 68 107.114 -4.757 13.994 1.00 0.00 H new ATOM 0 HA2 GLY A 68 104.440 -4.166 14.894 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.513 -4.346 13.152 1.00 0.00 H new ATOM 996 N PRO A 69 103.819 -6.725 14.475 1.00 0.00 N ATOM 997 CA PRO A 69 103.670 -8.203 14.579 1.00 0.00 C ATOM 998 C PRO A 69 103.166 -8.847 13.286 1.00 0.00 C ATOM 999 O PRO A 69 102.168 -8.410 12.703 1.00 0.00 O ATOM 1000 CB PRO A 69 102.634 -8.350 15.694 1.00 0.00 C ATOM 1001 CG PRO A 69 101.781 -7.121 15.621 1.00 0.00 C ATOM 1002 CD PRO A 69 102.511 -6.097 14.745 1.00 0.00 C ATOM 0 HA PRO A 69 104.620 -8.701 14.774 1.00 0.00 H new ATOM 0 HB2 PRO A 69 102.036 -9.250 15.556 1.00 0.00 H new ATOM 0 HB3 PRO A 69 103.116 -8.434 16.668 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.804 -7.358 15.199 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.607 -6.716 16.618 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.965 -5.900 13.822 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.625 -5.142 15.258 1.00 0.00 H new ATOM 1010 N ALA A 70 103.950 -9.794 12.773 1.00 0.00 N ATOM 1011 CA ALA A 70 103.533 -10.641 11.659 1.00 0.00 C ATOM 1012 C ALA A 70 102.644 -11.789 12.136 1.00 0.00 C ATOM 1013 O ALA A 70 102.860 -12.328 13.223 1.00 0.00 O ATOM 1014 CB ALA A 70 104.764 -11.206 10.944 1.00 0.00 C ATOM 0 H ALA A 70 104.889 -9.995 13.117 1.00 0.00 H new ATOM 0 HA ALA A 70 102.956 -10.027 10.968 1.00 0.00 H new ATOM 0 HB1 ALA A 70 104.445 -11.837 10.114 1.00 0.00 H new ATOM 0 HB2 ALA A 70 105.372 -10.385 10.563 1.00 0.00 H new ATOM 0 HB3 ALA A 70 105.352 -11.798 11.645 1.00 0.00 H new ATOM 1020 N TYR A 71 101.686 -12.190 11.301 1.00 0.00 N ATOM 1021 CA TYR A 71 100.893 -13.388 11.558 1.00 0.00 C ATOM 1022 C TYR A 71 101.077 -14.352 10.391 1.00 0.00 C ATOM 1023 O TYR A 71 100.895 -13.965 9.236 1.00 0.00 O ATOM 1024 CB TYR A 71 99.415 -13.024 11.702 1.00 0.00 C ATOM 1025 CG TYR A 71 98.538 -14.200 12.061 1.00 0.00 C ATOM 1026 CD1 TYR A 71 98.390 -14.583 13.400 1.00 0.00 C ATOM 1027 CD2 TYR A 71 97.873 -14.909 11.054 1.00 0.00 C ATOM 1028 CE1 TYR A 71 97.578 -15.674 13.731 1.00 0.00 C ATOM 1029 CE2 TYR A 71 97.059 -16.001 11.385 1.00 0.00 C ATOM 1030 CZ TYR A 71 96.913 -16.383 12.724 1.00 0.00 C ATOM 1031 OH TYR A 71 96.111 -17.457 13.051 1.00 0.00 O ATOM 0 H TYR A 71 101.441 -11.701 10.440 1.00 0.00 H new ATOM 0 HA TYR A 71 101.224 -13.855 12.485 1.00 0.00 H new ATOM 0 HB2 TYR A 71 99.311 -12.256 12.468 1.00 0.00 H new ATOM 0 HB3 TYR A 71 99.063 -12.590 10.766 1.00 0.00 H new ATOM 0 HD1 TYR A 71 98.903 -14.036 14.178 1.00 0.00 H new ATOM 0 HD2 TYR A 71 97.987 -14.614 10.021 1.00 0.00 H new ATOM 0 HE1 TYR A 71 97.465 -15.969 14.764 1.00 0.00 H new ATOM 0 HE2 TYR A 71 96.545 -16.547 10.608 1.00 0.00 H new ATOM 0 HH TYR A 71 95.723 -17.836 12.235 1.00 0.00 H new ATOM 1041 N ARG A 72 101.412 -15.603 10.693 1.00 0.00 N ATOM 1042 CA ARG A 72 101.802 -16.544 9.647 1.00 0.00 C ATOM 1043 C ARG A 72 100.637 -17.412 9.187 1.00 0.00 C ATOM 1044 O ARG A 72 100.171 -18.294 9.908 1.00 0.00 O ATOM 1045 CB ARG A 72 102.925 -17.451 10.157 1.00 0.00 C ATOM 1046 CG ARG A 72 104.181 -16.618 10.424 1.00 0.00 C ATOM 1047 CD ARG A 72 105.338 -17.545 10.808 1.00 0.00 C ATOM 1048 NE ARG A 72 104.978 -18.351 11.979 1.00 0.00 N ATOM 1049 CZ ARG A 72 105.515 -19.552 12.241 1.00 0.00 C ATOM 1050 NH1 ARG A 72 106.413 -20.104 11.461 1.00 0.00 N ATOM 1051 NH2 ARG A 72 105.127 -20.195 13.311 1.00 0.00 N ATOM 0 H ARG A 72 101.422 -15.985 11.639 1.00 0.00 H new ATOM 0 HA ARG A 72 102.142 -15.955 8.795 1.00 0.00 H new ATOM 0 HB2 ARG A 72 102.611 -17.956 11.071 1.00 0.00 H new ATOM 0 HB3 ARG A 72 103.141 -18.227 9.422 1.00 0.00 H new ATOM 0 HG2 ARG A 72 104.443 -16.041 9.537 1.00 0.00 H new ATOM 0 HG3 ARG A 72 103.993 -15.903 11.225 1.00 0.00 H new ATOM 0 HD2 ARG A 72 105.583 -18.198 9.970 1.00 0.00 H new ATOM 0 HD3 ARG A 72 106.229 -16.955 11.024 1.00 0.00 H new ATOM 0 HE ARG A 72 104.284 -17.979 12.627 1.00 0.00 H new ATOM 0 HH11 ARG A 72 106.727 -19.618 10.621 1.00 0.00 H new ATOM 0 HH12 ARG A 72 106.798 -21.019 11.694 1.00 0.00 H new ATOM 0 HH21 ARG A 72 104.428 -19.782 13.929 1.00 0.00 H new ATOM 0 HH22 ARG A 72 105.523 -21.110 13.528 1.00 0.00 H new ATOM 1065 N ILE A 73 100.177 -17.142 7.970 1.00 0.00 N ATOM 1066 CA ILE A 73 99.200 -17.995 7.305 1.00 0.00 C ATOM 1067 C ILE A 73 99.929 -18.964 6.378 1.00 0.00 C ATOM 1068 O ILE A 73 100.785 -18.551 5.596 1.00 0.00 O ATOM 1069 CB ILE A 73 98.196 -17.142 6.521 1.00 0.00 C ATOM 1070 CG1 ILE A 73 97.497 -16.177 7.487 1.00 0.00 C ATOM 1071 CG2 ILE A 73 97.147 -18.044 5.867 1.00 0.00 C ATOM 1072 CD1 ILE A 73 96.653 -15.154 6.718 1.00 0.00 C ATOM 0 H ILE A 73 100.468 -16.333 7.421 1.00 0.00 H new ATOM 0 HA ILE A 73 98.645 -18.565 8.050 1.00 0.00 H new ATOM 0 HB ILE A 73 98.723 -16.582 5.748 1.00 0.00 H new ATOM 0 HG12 ILE A 73 96.862 -16.738 8.172 1.00 0.00 H new ATOM 0 HG13 ILE A 73 98.241 -15.660 8.093 1.00 0.00 H new ATOM 0 HG21 ILE A 73 96.436 -17.432 5.311 1.00 0.00 H new ATOM 0 HG22 ILE A 73 97.638 -18.739 5.186 1.00 0.00 H new ATOM 0 HG23 ILE A 73 96.618 -18.605 6.638 1.00 0.00 H new ATOM 0 HD11 ILE A 73 96.167 -14.480 7.423 1.00 0.00 H new ATOM 0 HD12 ILE A 73 97.296 -14.579 6.051 1.00 0.00 H new ATOM 0 HD13 ILE A 73 95.895 -15.674 6.132 1.00 0.00 H new ATOM 1084 N ASN A 74 99.593 -20.248 6.465 1.00 0.00 N ATOM 1085 CA ASN A 74 100.313 -21.263 5.698 1.00 0.00 C ATOM 1086 C ASN A 74 100.181 -21.016 4.196 1.00 0.00 C ATOM 1087 O ASN A 74 101.118 -21.270 3.438 1.00 0.00 O ATOM 1088 CB ASN A 74 99.769 -22.652 6.034 1.00 0.00 C ATOM 1089 CG ASN A 74 100.040 -22.991 7.499 1.00 0.00 C ATOM 1090 OD1 ASN A 74 100.936 -22.414 8.118 1.00 0.00 O ATOM 1091 ND2 ASN A 74 99.316 -23.899 8.093 1.00 0.00 N ATOM 0 H ASN A 74 98.838 -20.608 7.049 1.00 0.00 H new ATOM 0 HA ASN A 74 101.368 -21.204 5.967 1.00 0.00 H new ATOM 0 HB2 ASN A 74 98.697 -22.687 5.839 1.00 0.00 H new ATOM 0 HB3 ASN A 74 100.235 -23.398 5.390 1.00 0.00 H new ATOM 0 HD21 ASN A 74 99.491 -24.132 9.070 1.00 0.00 H new ATOM 0 HD22 ASN A 74 98.575 -24.376 7.580 1.00 0.00 H new ATOM 1098 N ASP A 75 99.025 -20.521 3.764 1.00 0.00 N ATOM 1099 CA ASP A 75 98.846 -20.129 2.372 1.00 0.00 C ATOM 1100 C ASP A 75 99.679 -18.881 2.088 1.00 0.00 C ATOM 1101 O ASP A 75 100.386 -18.393 2.968 1.00 0.00 O ATOM 1102 CB ASP A 75 97.368 -19.845 2.098 1.00 0.00 C ATOM 1103 CG ASP A 75 97.059 -20.028 0.617 1.00 0.00 C ATOM 1104 OD1 ASP A 75 96.896 -21.164 0.201 1.00 0.00 O ATOM 1105 OD2 ASP A 75 96.990 -19.030 -0.082 1.00 0.00 O ATOM 0 H ASP A 75 98.204 -20.383 4.354 1.00 0.00 H new ATOM 0 HA ASP A 75 99.175 -20.939 1.721 1.00 0.00 H new ATOM 0 HB2 ASP A 75 96.746 -20.515 2.692 1.00 0.00 H new ATOM 0 HB3 ASP A 75 97.123 -18.828 2.404 1.00 0.00 H new ATOM 1110 N TRP A 76 99.601 -18.365 0.864 1.00 0.00 N ATOM 1111 CA TRP A 76 100.323 -17.144 0.512 1.00 0.00 C ATOM 1112 C TRP A 76 99.488 -15.905 0.843 1.00 0.00 C ATOM 1113 O TRP A 76 99.456 -14.937 0.083 1.00 0.00 O ATOM 1114 CB TRP A 76 100.676 -17.161 -0.978 1.00 0.00 C ATOM 1115 CG TRP A 76 99.483 -17.111 -1.881 1.00 0.00 C ATOM 1116 CD1 TRP A 76 98.685 -18.163 -2.172 1.00 0.00 C ATOM 1117 CD2 TRP A 76 98.947 -15.972 -2.617 1.00 0.00 C ATOM 1118 NE1 TRP A 76 97.690 -17.743 -3.038 1.00 0.00 N ATOM 1119 CE2 TRP A 76 97.809 -16.402 -3.343 1.00 0.00 C ATOM 1120 CE3 TRP A 76 99.331 -14.625 -2.725 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 97.078 -15.523 -4.146 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 98.600 -13.739 -3.531 1.00 0.00 C ATOM 1123 CH2 TRP A 76 97.477 -14.185 -4.240 1.00 0.00 C ATOM 0 H TRP A 76 99.051 -18.768 0.105 1.00 0.00 H new ATOM 0 HA TRP A 76 101.241 -17.102 1.098 1.00 0.00 H new ATOM 0 HB2 TRP A 76 101.323 -16.312 -1.198 1.00 0.00 H new ATOM 0 HB3 TRP A 76 101.248 -18.063 -1.196 1.00 0.00 H new ATOM 0 HD1 TRP A 76 98.804 -19.167 -1.791 1.00 0.00 H new ATOM 0 HE1 TRP A 76 96.958 -18.351 -3.406 1.00 0.00 H new ATOM 0 HE3 TRP A 76 100.195 -14.269 -2.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 96.213 -15.873 -4.689 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 98.905 -12.706 -3.605 1.00 0.00 H new ATOM 0 HH2 TRP A 76 96.920 -13.497 -4.858 1.00 0.00 H new ATOM 1134 N ALA A 77 98.818 -15.941 1.992 1.00 0.00 N ATOM 1135 CA ALA A 77 97.900 -14.877 2.390 1.00 0.00 C ATOM 1136 C ALA A 77 98.286 -14.250 3.732 1.00 0.00 C ATOM 1137 O ALA A 77 97.434 -13.649 4.388 1.00 0.00 O ATOM 1138 CB ALA A 77 96.479 -15.436 2.489 1.00 0.00 C ATOM 0 H ALA A 77 98.895 -16.701 2.668 1.00 0.00 H new ATOM 0 HA ALA A 77 97.955 -14.099 1.629 1.00 0.00 H new ATOM 0 HB1 ALA A 77 95.795 -14.641 2.786 1.00 0.00 H new ATOM 0 HB2 ALA A 77 96.176 -15.832 1.520 1.00 0.00 H new ATOM 0 HB3 ALA A 77 96.453 -16.234 3.232 1.00 0.00 H new ATOM 1144 N SER A 78 99.552 -14.363 4.141 1.00 0.00 N ATOM 1145 CA SER A 78 99.935 -13.960 5.490 1.00 0.00 C ATOM 1146 C SER A 78 99.827 -12.450 5.615 1.00 0.00 C ATOM 1147 O SER A 78 99.704 -11.759 4.603 1.00 0.00 O ATOM 1148 CB SER A 78 101.368 -14.404 5.782 1.00 0.00 C ATOM 1149 OG SER A 78 102.259 -13.617 5.005 1.00 0.00 O ATOM 0 H SER A 78 100.314 -14.724 3.567 1.00 0.00 H new ATOM 0 HA SER A 78 99.267 -14.433 6.210 1.00 0.00 H new ATOM 0 HB2 SER A 78 101.590 -14.289 6.843 1.00 0.00 H new ATOM 0 HB3 SER A 78 101.492 -15.460 5.543 1.00 0.00 H new ATOM 0 HG SER A 78 102.665 -14.174 4.308 1.00 0.00 H new ATOM 1155 N ILE A 79 99.841 -11.939 6.845 1.00 0.00 N ATOM 1156 CA ILE A 79 99.606 -10.514 7.050 1.00 0.00 C ATOM 1157 C ILE A 79 100.454 -9.993 8.203 1.00 0.00 C ATOM 1158 O ILE A 79 100.476 -10.577 9.282 1.00 0.00 O ATOM 1159 CB ILE A 79 98.114 -10.275 7.321 1.00 0.00 C ATOM 1160 CG1 ILE A 79 97.840 -8.776 7.478 1.00 0.00 C ATOM 1161 CG2 ILE A 79 97.687 -11.009 8.596 1.00 0.00 C ATOM 1162 CD1 ILE A 79 96.333 -8.522 7.407 1.00 0.00 C ATOM 0 H ILE A 79 100.009 -12.477 7.695 1.00 0.00 H new ATOM 0 HA ILE A 79 99.894 -9.970 6.150 1.00 0.00 H new ATOM 0 HB ILE A 79 97.541 -10.658 6.476 1.00 0.00 H new ATOM 0 HG12 ILE A 79 98.235 -8.421 8.430 1.00 0.00 H new ATOM 0 HG13 ILE A 79 98.351 -8.218 6.693 1.00 0.00 H new ATOM 0 HG21 ILE A 79 96.627 -10.833 8.779 1.00 0.00 H new ATOM 0 HG22 ILE A 79 97.862 -12.078 8.476 1.00 0.00 H new ATOM 0 HG23 ILE A 79 98.268 -10.639 9.441 1.00 0.00 H new ATOM 0 HD11 ILE A 79 96.138 -7.455 7.519 1.00 0.00 H new ATOM 0 HD12 ILE A 79 95.952 -8.862 6.444 1.00 0.00 H new ATOM 0 HD13 ILE A 79 95.834 -9.068 8.208 1.00 0.00 H new ATOM 1174 N TYR A 80 101.162 -8.898 7.961 1.00 0.00 N ATOM 1175 CA TYR A 80 101.867 -8.204 9.032 1.00 0.00 C ATOM 1176 C TYR A 80 101.551 -6.715 8.968 1.00 0.00 C ATOM 1177 O TYR A 80 101.475 -6.142 7.882 1.00 0.00 O ATOM 1178 CB TYR A 80 103.377 -8.450 8.927 1.00 0.00 C ATOM 1179 CG TYR A 80 104.070 -7.745 7.782 1.00 0.00 C ATOM 1180 CD1 TYR A 80 104.595 -6.460 7.971 1.00 0.00 C ATOM 1181 CD2 TYR A 80 104.196 -8.377 6.542 1.00 0.00 C ATOM 1182 CE1 TYR A 80 105.248 -5.809 6.918 1.00 0.00 C ATOM 1183 CE2 TYR A 80 104.845 -7.725 5.487 1.00 0.00 C ATOM 1184 CZ TYR A 80 105.373 -6.442 5.675 1.00 0.00 C ATOM 1185 OH TYR A 80 106.018 -5.801 4.639 1.00 0.00 O ATOM 0 H TYR A 80 101.264 -8.473 7.039 1.00 0.00 H new ATOM 0 HA TYR A 80 101.533 -8.592 9.994 1.00 0.00 H new ATOM 0 HB2 TYR A 80 103.845 -8.138 9.861 1.00 0.00 H new ATOM 0 HB3 TYR A 80 103.548 -9.522 8.828 1.00 0.00 H new ATOM 0 HD1 TYR A 80 104.496 -5.972 8.929 1.00 0.00 H new ATOM 0 HD2 TYR A 80 103.793 -9.368 6.398 1.00 0.00 H new ATOM 0 HE1 TYR A 80 105.655 -4.819 7.064 1.00 0.00 H new ATOM 0 HE2 TYR A 80 104.938 -8.212 4.528 1.00 0.00 H new ATOM 0 HH TYR A 80 106.205 -6.443 3.923 1.00 0.00 H new ATOM 1195 N GLY A 81 101.370 -6.102 10.136 1.00 0.00 N ATOM 1196 CA GLY A 81 101.086 -4.670 10.201 1.00 0.00 C ATOM 1197 C GLY A 81 102.128 -3.975 11.062 1.00 0.00 C ATOM 1198 O GLY A 81 102.489 -4.477 12.123 1.00 0.00 O ATOM 0 H GLY A 81 101.414 -6.569 11.042 1.00 0.00 H new ATOM 0 HA2 GLY A 81 101.088 -4.244 9.198 1.00 0.00 H new ATOM 0 HA3 GLY A 81 100.091 -4.506 10.615 1.00 0.00 H new ATOM 1202 N VAL A 82 102.594 -2.811 10.618 1.00 0.00 N ATOM 1203 CA VAL A 82 103.691 -2.132 11.302 1.00 0.00 C ATOM 1204 C VAL A 82 103.412 -0.638 11.432 1.00 0.00 C ATOM 1205 O VAL A 82 102.708 -0.057 10.609 1.00 0.00 O ATOM 1206 CB VAL A 82 104.995 -2.343 10.523 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.339 -3.833 10.464 1.00 0.00 C ATOM 1208 CG2 VAL A 82 104.836 -1.813 9.095 1.00 0.00 C ATOM 0 H VAL A 82 102.235 -2.323 9.798 1.00 0.00 H new ATOM 0 HA VAL A 82 103.785 -2.555 12.302 1.00 0.00 H new ATOM 0 HB VAL A 82 105.795 -1.805 11.031 1.00 0.00 H new ATOM 0 HG11 VAL A 82 106.267 -3.971 9.908 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.462 -4.218 11.476 1.00 0.00 H new ATOM 0 HG13 VAL A 82 104.534 -4.373 9.965 1.00 0.00 H new ATOM 0 HG21 VAL A 82 105.765 -1.965 8.545 1.00 0.00 H new ATOM 0 HG22 VAL A 82 104.027 -2.348 8.596 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.602 -0.749 9.126 1.00 0.00 H new ATOM 1218 N VAL A 83 103.987 -0.025 12.462 1.00 0.00 N ATOM 1219 CA VAL A 83 103.894 1.419 12.643 1.00 0.00 C ATOM 1220 C VAL A 83 105.275 1.959 12.985 1.00 0.00 C ATOM 1221 O VAL A 83 106.024 1.307 13.711 1.00 0.00 O ATOM 1222 CB VAL A 83 102.903 1.749 13.763 1.00 0.00 C ATOM 1223 CG1 VAL A 83 101.509 1.252 13.372 1.00 0.00 C ATOM 1224 CG2 VAL A 83 103.339 1.064 15.061 1.00 0.00 C ATOM 0 H VAL A 83 104.523 -0.506 13.184 1.00 0.00 H new ATOM 0 HA VAL A 83 103.536 1.883 11.724 1.00 0.00 H new ATOM 0 HB VAL A 83 102.880 2.828 13.915 1.00 0.00 H new ATOM 0 HG11 VAL A 83 100.803 1.486 14.168 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.193 1.742 12.451 1.00 0.00 H new ATOM 0 HG13 VAL A 83 101.537 0.173 13.218 1.00 0.00 H new ATOM 0 HG21 VAL A 83 102.630 1.302 15.854 1.00 0.00 H new ATOM 0 HG22 VAL A 83 103.367 -0.015 14.911 1.00 0.00 H new ATOM 0 HG23 VAL A 83 104.331 1.417 15.343 1.00 0.00 H new ATOM 1234 N GLY A 84 105.625 3.125 12.448 1.00 0.00 N ATOM 1235 CA GLY A 84 106.960 3.667 12.664 1.00 0.00 C ATOM 1236 C GLY A 84 106.945 5.186 12.714 1.00 0.00 C ATOM 1237 O GLY A 84 105.922 5.817 12.452 1.00 0.00 O ATOM 0 H GLY A 84 105.014 3.703 11.870 1.00 0.00 H new ATOM 0 HA2 GLY A 84 107.366 3.276 13.597 1.00 0.00 H new ATOM 0 HA3 GLY A 84 107.622 3.335 11.864 1.00 0.00 H new ATOM 1241 N VAL A 85 108.101 5.762 13.011 1.00 0.00 N ATOM 1242 CA VAL A 85 108.238 7.212 13.052 1.00 0.00 C ATOM 1243 C VAL A 85 109.126 7.647 11.895 1.00 0.00 C ATOM 1244 O VAL A 85 110.169 7.041 11.659 1.00 0.00 O ATOM 1245 CB VAL A 85 108.862 7.654 14.381 1.00 0.00 C ATOM 1246 CG1 VAL A 85 108.921 9.182 14.439 1.00 0.00 C ATOM 1247 CG2 VAL A 85 108.010 7.140 15.546 1.00 0.00 C ATOM 0 H VAL A 85 108.956 5.250 13.227 1.00 0.00 H new ATOM 0 HA VAL A 85 107.255 7.674 12.966 1.00 0.00 H new ATOM 0 HB VAL A 85 109.870 7.245 14.456 1.00 0.00 H new ATOM 0 HG11 VAL A 85 109.365 9.493 15.385 1.00 0.00 H new ATOM 0 HG12 VAL A 85 109.528 9.554 13.613 1.00 0.00 H new ATOM 0 HG13 VAL A 85 107.913 9.588 14.360 1.00 0.00 H new ATOM 0 HG21 VAL A 85 108.456 7.455 16.489 1.00 0.00 H new ATOM 0 HG22 VAL A 85 107.002 7.547 15.467 1.00 0.00 H new ATOM 0 HG23 VAL A 85 107.966 6.051 15.512 1.00 0.00 H new ATOM 1257 N GLY A 86 108.697 8.673 11.164 1.00 0.00 N ATOM 1258 CA GLY A 86 109.471 9.164 10.028 1.00 0.00 C ATOM 1259 C GLY A 86 109.930 10.595 10.265 1.00 0.00 C ATOM 1260 O GLY A 86 109.140 11.450 10.665 1.00 0.00 O ATOM 0 H GLY A 86 107.826 9.176 11.336 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.337 8.522 9.867 1.00 0.00 H new ATOM 0 HA3 GLY A 86 108.866 9.117 9.122 1.00 0.00 H new ATOM 1264 N TYR A 87 111.216 10.838 10.033 1.00 0.00 N ATOM 1265 CA TYR A 87 111.790 12.166 10.206 1.00 0.00 C ATOM 1266 C TYR A 87 112.256 12.703 8.857 1.00 0.00 C ATOM 1267 O TYR A 87 112.925 11.997 8.104 1.00 0.00 O ATOM 1268 CB TYR A 87 112.987 12.089 11.156 1.00 0.00 C ATOM 1269 CG TYR A 87 112.682 11.394 12.462 1.00 0.00 C ATOM 1270 CD1 TYR A 87 112.862 10.012 12.574 1.00 0.00 C ATOM 1271 CD2 TYR A 87 112.228 12.134 13.561 1.00 0.00 C ATOM 1272 CE1 TYR A 87 112.585 9.366 13.786 1.00 0.00 C ATOM 1273 CE2 TYR A 87 111.952 11.488 14.771 1.00 0.00 C ATOM 1274 CZ TYR A 87 112.130 10.103 14.884 1.00 0.00 C ATOM 1275 OH TYR A 87 111.857 9.468 16.078 1.00 0.00 O ATOM 0 H TYR A 87 111.881 10.130 9.724 1.00 0.00 H new ATOM 0 HA TYR A 87 111.033 12.831 10.623 1.00 0.00 H new ATOM 0 HB2 TYR A 87 113.802 11.565 10.657 1.00 0.00 H new ATOM 0 HB3 TYR A 87 113.339 13.099 11.366 1.00 0.00 H new ATOM 0 HD1 TYR A 87 113.214 9.443 11.727 1.00 0.00 H new ATOM 0 HD2 TYR A 87 112.091 13.202 13.475 1.00 0.00 H new ATOM 0 HE1 TYR A 87 112.723 8.298 13.872 1.00 0.00 H new ATOM 0 HE2 TYR A 87 111.601 12.058 15.619 1.00 0.00 H new ATOM 0 HH TYR A 87 111.552 10.127 16.736 1.00 0.00 H new ATOM 1285 N GLY A 88 111.891 13.945 8.558 1.00 0.00 N ATOM 1286 CA GLY A 88 112.309 14.587 7.315 1.00 0.00 C ATOM 1287 C GLY A 88 113.201 15.789 7.603 1.00 0.00 C ATOM 1288 O GLY A 88 112.839 16.665 8.388 1.00 0.00 O ATOM 0 H GLY A 88 111.307 14.528 9.158 1.00 0.00 H new ATOM 0 HA2 GLY A 88 112.845 13.871 6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 88 111.432 14.905 6.751 1.00 0.00 H new ATOM 1292 N LYS A 89 114.369 15.826 6.965 1.00 0.00 N ATOM 1293 CA LYS A 89 115.316 16.919 7.182 1.00 0.00 C ATOM 1294 C LYS A 89 115.711 17.552 5.854 1.00 0.00 C ATOM 1295 O LYS A 89 115.820 16.863 4.839 1.00 0.00 O ATOM 1296 CB LYS A 89 116.572 16.397 7.886 1.00 0.00 C ATOM 1297 CG LYS A 89 116.193 15.710 9.203 1.00 0.00 C ATOM 1298 CD LYS A 89 115.587 16.735 10.165 1.00 0.00 C ATOM 1299 CE LYS A 89 115.400 16.101 11.544 1.00 0.00 C ATOM 1300 NZ LYS A 89 114.083 15.403 11.593 1.00 0.00 N ATOM 0 H LYS A 89 114.681 15.119 6.299 1.00 0.00 H new ATOM 0 HA LYS A 89 114.834 17.670 7.808 1.00 0.00 H new ATOM 0 HB2 LYS A 89 117.095 15.694 7.238 1.00 0.00 H new ATOM 0 HB3 LYS A 89 117.258 17.222 8.081 1.00 0.00 H new ATOM 0 HG2 LYS A 89 115.479 14.908 9.014 1.00 0.00 H new ATOM 0 HG3 LYS A 89 117.074 15.252 9.652 1.00 0.00 H new ATOM 0 HD2 LYS A 89 116.238 17.606 10.240 1.00 0.00 H new ATOM 0 HD3 LYS A 89 114.628 17.085 9.782 1.00 0.00 H new ATOM 0 HE2 LYS A 89 116.206 15.395 11.744 1.00 0.00 H new ATOM 0 HE3 LYS A 89 115.447 16.867 12.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 114.045 14.793 12.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 113.319 16.107 11.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 113.966 14.822 10.738 1.00 0.00 H new ATOM 1314 N PHE A 90 115.928 18.863 5.873 1.00 0.00 N ATOM 1315 CA PHE A 90 116.337 19.582 4.672 1.00 0.00 C ATOM 1316 C PHE A 90 117.857 19.574 4.551 1.00 0.00 C ATOM 1317 O PHE A 90 118.566 19.632 5.555 1.00 0.00 O ATOM 1318 CB PHE A 90 115.832 21.024 4.729 1.00 0.00 C ATOM 1319 CG PHE A 90 116.099 21.806 3.464 1.00 0.00 C ATOM 1320 CD1 PHE A 90 115.208 21.724 2.387 1.00 0.00 C ATOM 1321 CD2 PHE A 90 117.239 22.615 3.368 1.00 0.00 C ATOM 1322 CE1 PHE A 90 115.455 22.448 1.216 1.00 0.00 C ATOM 1323 CE2 PHE A 90 117.485 23.339 2.196 1.00 0.00 C ATOM 1324 CZ PHE A 90 116.594 23.257 1.120 1.00 0.00 C ATOM 0 H PHE A 90 115.828 19.447 6.703 1.00 0.00 H new ATOM 0 HA PHE A 90 115.907 19.087 3.802 1.00 0.00 H new ATOM 0 HB2 PHE A 90 114.759 21.018 4.923 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.305 21.533 5.568 1.00 0.00 H new ATOM 0 HD1 PHE A 90 114.329 21.101 2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.927 22.680 4.198 1.00 0.00 H new ATOM 0 HE1 PHE A 90 114.767 22.383 0.386 1.00 0.00 H new ATOM 0 HE2 PHE A 90 118.364 23.962 2.122 1.00 0.00 H new ATOM 0 HZ PHE A 90 116.785 23.817 0.216 1.00 0.00 H new ATOM 1334 N GLN A 91 118.351 19.504 3.318 1.00 0.00 N ATOM 1335 CA GLN A 91 119.790 19.458 3.091 1.00 0.00 C ATOM 1336 C GLN A 91 120.323 20.852 2.772 1.00 0.00 C ATOM 1337 O GLN A 91 119.940 21.464 1.775 1.00 0.00 O ATOM 1338 CB GLN A 91 120.104 18.509 1.932 1.00 0.00 C ATOM 1339 CG GLN A 91 121.621 18.334 1.804 1.00 0.00 C ATOM 1340 CD GLN A 91 122.139 17.443 2.927 1.00 0.00 C ATOM 1341 OE1 GLN A 91 121.784 16.268 3.003 1.00 0.00 O ATOM 1342 NE2 GLN A 91 122.964 17.937 3.812 1.00 0.00 N ATOM 0 H GLN A 91 117.783 19.478 2.471 1.00 0.00 H new ATOM 0 HA GLN A 91 120.274 19.095 3.997 1.00 0.00 H new ATOM 0 HB2 GLN A 91 119.630 17.542 2.102 1.00 0.00 H new ATOM 0 HB3 GLN A 91 119.694 18.906 1.003 1.00 0.00 H new ATOM 0 HG2 GLN A 91 121.864 17.893 0.837 1.00 0.00 H new ATOM 0 HG3 GLN A 91 122.112 19.306 1.844 1.00 0.00 H new ATOM 0 HE21 GLN A 91 123.257 18.912 3.747 1.00 0.00 H new ATOM 0 HE22 GLN A 91 123.315 17.348 4.567 1.00 0.00 H new ATOM 1351 N THR A 92 121.211 21.342 3.631 1.00 0.00 N ATOM 1352 CA THR A 92 121.793 22.668 3.457 1.00 0.00 C ATOM 1353 C THR A 92 123.253 22.555 3.029 1.00 0.00 C ATOM 1354 O THR A 92 123.947 21.606 3.397 1.00 0.00 O ATOM 1355 CB THR A 92 121.702 23.453 4.768 1.00 0.00 C ATOM 1356 OG1 THR A 92 120.356 23.467 5.215 1.00 0.00 O ATOM 1357 CG2 THR A 92 122.183 24.889 4.547 1.00 0.00 C ATOM 0 H THR A 92 121.543 20.841 4.455 1.00 0.00 H new ATOM 0 HA THR A 92 121.236 23.193 2.681 1.00 0.00 H new ATOM 0 HB THR A 92 122.332 22.976 5.519 1.00 0.00 H new ATOM 0 HG1 THR A 92 120.296 23.968 6.055 1.00 0.00 H new ATOM 0 HG21 THR A 92 122.116 25.443 5.483 1.00 0.00 H new ATOM 0 HG22 THR A 92 123.218 24.878 4.205 1.00 0.00 H new ATOM 0 HG23 THR A 92 121.558 25.370 3.795 1.00 0.00 H new ATOM 1365 N THR A 93 123.713 23.530 2.253 1.00 0.00 N ATOM 1366 CA THR A 93 125.098 23.536 1.789 1.00 0.00 C ATOM 1367 C THR A 93 126.050 23.529 2.982 1.00 0.00 C ATOM 1368 O THR A 93 125.713 24.018 4.060 1.00 0.00 O ATOM 1369 CB THR A 93 125.351 24.769 0.921 1.00 0.00 C ATOM 1370 OG1 THR A 93 124.360 24.842 -0.092 1.00 0.00 O ATOM 1371 CG2 THR A 93 126.735 24.666 0.273 1.00 0.00 C ATOM 0 H THR A 93 123.154 24.321 1.933 1.00 0.00 H new ATOM 0 HA THR A 93 125.276 22.641 1.193 1.00 0.00 H new ATOM 0 HB THR A 93 125.308 25.664 1.541 1.00 0.00 H new ATOM 0 HG1 THR A 93 124.519 25.633 -0.649 1.00 0.00 H new ATOM 0 HG21 THR A 93 126.914 25.546 -0.345 1.00 0.00 H new ATOM 0 HG22 THR A 93 127.497 24.608 1.050 1.00 0.00 H new ATOM 0 HG23 THR A 93 126.781 23.771 -0.348 1.00 0.00 H new ATOM 1379 N GLU A 94 127.234 22.957 2.787 1.00 0.00 N ATOM 1380 CA GLU A 94 128.194 22.815 3.877 1.00 0.00 C ATOM 1381 C GLU A 94 128.631 24.170 4.432 1.00 0.00 C ATOM 1382 O GLU A 94 128.818 24.315 5.639 1.00 0.00 O ATOM 1383 CB GLU A 94 129.424 22.049 3.387 1.00 0.00 C ATOM 1384 CG GLU A 94 129.014 20.633 2.969 1.00 0.00 C ATOM 1385 CD GLU A 94 128.440 19.844 4.149 1.00 0.00 C ATOM 1386 OE1 GLU A 94 128.666 20.230 5.286 1.00 0.00 O ATOM 1387 OE2 GLU A 94 127.776 18.853 3.894 1.00 0.00 O ATOM 0 H GLU A 94 127.551 22.586 1.891 1.00 0.00 H new ATOM 0 HA GLU A 94 127.702 22.265 4.679 1.00 0.00 H new ATOM 0 HB2 GLU A 94 129.878 22.571 2.545 1.00 0.00 H new ATOM 0 HB3 GLU A 94 130.175 22.003 4.176 1.00 0.00 H new ATOM 0 HG2 GLU A 94 128.273 20.688 2.172 1.00 0.00 H new ATOM 0 HG3 GLU A 94 129.879 20.107 2.564 1.00 0.00 H new ATOM 1394 N TYR A 95 128.790 25.159 3.555 1.00 0.00 N ATOM 1395 CA TYR A 95 129.268 26.471 3.985 1.00 0.00 C ATOM 1396 C TYR A 95 128.376 27.049 5.087 1.00 0.00 C ATOM 1397 O TYR A 95 128.879 27.394 6.156 1.00 0.00 O ATOM 1398 CB TYR A 95 129.349 27.428 2.792 1.00 0.00 C ATOM 1399 CG TYR A 95 130.654 27.336 2.036 1.00 0.00 C ATOM 1400 CD1 TYR A 95 131.158 26.085 1.661 1.00 0.00 C ATOM 1401 CD2 TYR A 95 131.357 28.501 1.706 1.00 0.00 C ATOM 1402 CE1 TYR A 95 132.366 25.999 0.959 1.00 0.00 C ATOM 1403 CE2 TYR A 95 132.565 28.415 1.005 1.00 0.00 C ATOM 1404 CZ TYR A 95 133.070 27.164 0.630 1.00 0.00 C ATOM 1405 OH TYR A 95 134.260 27.078 -0.061 1.00 0.00 O ATOM 0 H TYR A 95 128.598 25.080 2.556 1.00 0.00 H new ATOM 0 HA TYR A 95 130.269 26.349 4.398 1.00 0.00 H new ATOM 0 HB2 TYR A 95 128.526 27.216 2.109 1.00 0.00 H new ATOM 0 HB3 TYR A 95 129.214 28.450 3.146 1.00 0.00 H new ATOM 0 HD1 TYR A 95 130.615 25.186 1.913 1.00 0.00 H new ATOM 0 HD2 TYR A 95 130.967 29.466 1.993 1.00 0.00 H new ATOM 0 HE1 TYR A 95 132.755 25.034 0.671 1.00 0.00 H new ATOM 0 HE2 TYR A 95 133.108 29.314 0.753 1.00 0.00 H new ATOM 0 HH TYR A 95 134.618 27.978 -0.209 1.00 0.00 H new ATOM 1415 N PRO A 96 127.080 27.177 4.872 1.00 0.00 N ATOM 1416 CA PRO A 96 126.140 27.629 5.946 1.00 0.00 C ATOM 1417 C PRO A 96 126.429 26.991 7.305 1.00 0.00 C ATOM 1418 O PRO A 96 126.512 25.769 7.426 1.00 0.00 O ATOM 1419 CB PRO A 96 124.769 27.189 5.434 1.00 0.00 C ATOM 1420 CG PRO A 96 124.878 27.183 3.947 1.00 0.00 C ATOM 1421 CD PRO A 96 126.355 26.990 3.599 1.00 0.00 C ATOM 0 HA PRO A 96 126.225 28.702 6.120 1.00 0.00 H new ATOM 0 HB2 PRO A 96 124.509 26.200 5.812 1.00 0.00 H new ATOM 0 HB3 PRO A 96 123.988 27.873 5.767 1.00 0.00 H new ATOM 0 HG2 PRO A 96 124.275 26.381 3.521 1.00 0.00 H new ATOM 0 HG3 PRO A 96 124.504 28.118 3.531 1.00 0.00 H new ATOM 0 HD2 PRO A 96 126.536 25.998 3.185 1.00 0.00 H new ATOM 0 HD3 PRO A 96 126.681 27.712 2.850 1.00 0.00 H new ATOM 1429 N THR A 97 126.580 27.832 8.322 1.00 0.00 N ATOM 1430 CA THR A 97 126.891 27.353 9.664 1.00 0.00 C ATOM 1431 C THR A 97 125.803 26.418 10.186 1.00 0.00 C ATOM 1432 O THR A 97 126.097 25.433 10.865 1.00 0.00 O ATOM 1433 CB THR A 97 127.040 28.544 10.616 1.00 0.00 C ATOM 1434 OG1 THR A 97 127.979 29.463 10.076 1.00 0.00 O ATOM 1435 CG2 THR A 97 127.532 28.054 11.980 1.00 0.00 C ATOM 0 H THR A 97 126.493 28.845 8.244 1.00 0.00 H new ATOM 0 HA THR A 97 127.827 26.796 9.615 1.00 0.00 H new ATOM 0 HB THR A 97 126.075 29.035 10.736 1.00 0.00 H new ATOM 0 HG1 THR A 97 128.075 30.227 10.682 1.00 0.00 H new ATOM 0 HG21 THR A 97 127.637 28.903 12.655 1.00 0.00 H new ATOM 0 HG22 THR A 97 126.812 27.348 12.394 1.00 0.00 H new ATOM 0 HG23 THR A 97 128.497 27.562 11.863 1.00 0.00 H new ATOM 1443 N TYR A 98 124.549 26.726 9.869 1.00 0.00 N ATOM 1444 CA TYR A 98 123.431 25.944 10.383 1.00 0.00 C ATOM 1445 C TYR A 98 123.074 24.802 9.436 1.00 0.00 C ATOM 1446 O TYR A 98 123.011 24.982 8.221 1.00 0.00 O ATOM 1447 CB TYR A 98 122.209 26.845 10.575 1.00 0.00 C ATOM 1448 CG TYR A 98 121.046 26.147 11.240 1.00 0.00 C ATOM 1449 CD1 TYR A 98 120.977 26.080 12.637 1.00 0.00 C ATOM 1450 CD2 TYR A 98 120.038 25.567 10.461 1.00 0.00 C ATOM 1451 CE1 TYR A 98 119.900 25.433 13.253 1.00 0.00 C ATOM 1452 CE2 TYR A 98 118.962 24.920 11.076 1.00 0.00 C ATOM 1453 CZ TYR A 98 118.892 24.852 12.473 1.00 0.00 C ATOM 1454 OH TYR A 98 117.830 24.215 13.082 1.00 0.00 O ATOM 0 H TYR A 98 124.284 27.504 9.265 1.00 0.00 H new ATOM 0 HA TYR A 98 123.731 25.518 11.341 1.00 0.00 H new ATOM 0 HB2 TYR A 98 122.495 27.709 11.174 1.00 0.00 H new ATOM 0 HB3 TYR A 98 121.889 27.222 9.604 1.00 0.00 H new ATOM 0 HD1 TYR A 98 121.754 26.527 13.239 1.00 0.00 H new ATOM 0 HD2 TYR A 98 120.092 25.619 9.384 1.00 0.00 H new ATOM 0 HE1 TYR A 98 119.846 25.382 14.330 1.00 0.00 H new ATOM 0 HE2 TYR A 98 118.185 24.473 10.474 1.00 0.00 H new ATOM 0 HH TYR A 98 117.220 23.869 12.398 1.00 0.00 H new ATOM 1464 N LYS A 99 122.842 23.623 10.009 1.00 0.00 N ATOM 1465 CA LYS A 99 122.462 22.449 9.230 1.00 0.00 C ATOM 1466 C LYS A 99 121.032 22.030 9.561 1.00 0.00 C ATOM 1467 O LYS A 99 120.523 22.341 10.639 1.00 0.00 O ATOM 1468 CB LYS A 99 123.415 21.292 9.532 1.00 0.00 C ATOM 1469 CG LYS A 99 124.827 21.657 9.065 1.00 0.00 C ATOM 1470 CD LYS A 99 125.823 20.580 9.509 1.00 0.00 C ATOM 1471 CE LYS A 99 125.675 19.327 8.642 1.00 0.00 C ATOM 1472 NZ LYS A 99 126.590 19.425 7.470 1.00 0.00 N ATOM 0 H LYS A 99 122.911 23.456 11.013 1.00 0.00 H new ATOM 0 HA LYS A 99 122.521 22.702 8.171 1.00 0.00 H new ATOM 0 HB2 LYS A 99 123.418 21.079 10.601 1.00 0.00 H new ATOM 0 HB3 LYS A 99 123.076 20.387 9.028 1.00 0.00 H new ATOM 0 HG2 LYS A 99 124.845 21.755 7.980 1.00 0.00 H new ATOM 0 HG3 LYS A 99 125.117 22.623 9.478 1.00 0.00 H new ATOM 0 HD2 LYS A 99 126.841 20.964 9.434 1.00 0.00 H new ATOM 0 HD3 LYS A 99 125.653 20.328 10.556 1.00 0.00 H new ATOM 0 HE2 LYS A 99 125.909 18.437 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 99 124.644 19.225 8.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 126.491 18.574 6.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 126.346 20.266 6.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 127.572 19.503 7.802 1.00 0.00 H new ATOM 1486 N HIS A 100 120.389 21.332 8.631 1.00 0.00 N ATOM 1487 CA HIS A 100 119.016 20.880 8.840 1.00 0.00 C ATOM 1488 C HIS A 100 118.090 22.081 9.035 1.00 0.00 C ATOM 1489 O HIS A 100 117.603 22.344 10.136 1.00 0.00 O ATOM 1490 CB HIS A 100 118.948 19.949 10.053 1.00 0.00 C ATOM 1491 CG HIS A 100 119.945 18.824 10.000 1.00 0.00 C ATOM 1492 ND1 HIS A 100 119.823 17.769 9.110 1.00 0.00 N ATOM 1493 CD2 HIS A 100 121.087 18.573 10.722 1.00 0.00 C ATOM 1494 CE1 HIS A 100 120.862 16.941 9.315 1.00 0.00 C ATOM 1495 NE2 HIS A 100 121.665 17.383 10.286 1.00 0.00 N ATOM 0 H HIS A 100 120.791 21.068 7.732 1.00 0.00 H new ATOM 0 HA HIS A 100 118.687 20.328 7.959 1.00 0.00 H new ATOM 0 HB2 HIS A 100 119.117 20.532 10.959 1.00 0.00 H new ATOM 0 HB3 HIS A 100 117.944 19.531 10.125 1.00 0.00 H new ATOM 0 HD2 HIS A 100 121.477 19.203 11.508 1.00 0.00 H new ATOM 0 HE1 HIS A 100 121.027 16.029 8.761 1.00 0.00 H new ATOM 0 HE2 HIS A 100 122.518 16.944 10.633 1.00 0.00 H new ATOM 1503 N ASP A 101 117.860 22.815 7.952 1.00 0.00 N ATOM 1504 CA ASP A 101 117.052 24.028 8.019 1.00 0.00 C ATOM 1505 C ASP A 101 115.667 23.745 8.594 1.00 0.00 C ATOM 1506 O ASP A 101 115.152 24.525 9.394 1.00 0.00 O ATOM 1507 CB ASP A 101 116.909 24.633 6.621 1.00 0.00 C ATOM 1508 CG ASP A 101 116.228 25.995 6.710 1.00 0.00 C ATOM 1509 OD1 ASP A 101 116.922 26.967 6.960 1.00 0.00 O ATOM 1510 OD2 ASP A 101 115.023 26.046 6.526 1.00 0.00 O ATOM 0 H ASP A 101 118.219 22.594 7.023 1.00 0.00 H new ATOM 0 HA ASP A 101 117.559 24.732 8.679 1.00 0.00 H new ATOM 0 HB2 ASP A 101 117.891 24.737 6.159 1.00 0.00 H new ATOM 0 HB3 ASP A 101 116.326 23.967 5.985 1.00 0.00 H new ATOM 1515 N THR A 102 115.061 22.629 8.185 1.00 0.00 N ATOM 1516 CA THR A 102 113.713 22.295 8.643 1.00 0.00 C ATOM 1517 C THR A 102 113.642 20.853 9.137 1.00 0.00 C ATOM 1518 O THR A 102 114.418 19.998 8.711 1.00 0.00 O ATOM 1519 CB THR A 102 112.709 22.487 7.502 1.00 0.00 C ATOM 1520 OG1 THR A 102 113.018 21.588 6.447 1.00 0.00 O ATOM 1521 CG2 THR A 102 112.776 23.927 6.988 1.00 0.00 C ATOM 0 H THR A 102 115.476 21.950 7.547 1.00 0.00 H new ATOM 0 HA THR A 102 113.465 22.961 9.470 1.00 0.00 H new ATOM 0 HB THR A 102 111.702 22.287 7.869 1.00 0.00 H new ATOM 0 HG1 THR A 102 112.376 21.708 5.716 1.00 0.00 H new ATOM 0 HG21 THR A 102 112.060 24.057 6.177 1.00 0.00 H new ATOM 0 HG22 THR A 102 112.535 24.614 7.799 1.00 0.00 H new ATOM 0 HG23 THR A 102 113.781 24.136 6.622 1.00 0.00 H new ATOM 1529 N SER A 103 112.698 20.596 10.039 1.00 0.00 N ATOM 1530 CA SER A 103 112.471 19.245 10.540 1.00 0.00 C ATOM 1531 C SER A 103 110.975 18.991 10.708 1.00 0.00 C ATOM 1532 O SER A 103 110.224 19.898 11.066 1.00 0.00 O ATOM 1533 CB SER A 103 113.179 19.059 11.880 1.00 0.00 C ATOM 1534 OG SER A 103 114.574 19.266 11.706 1.00 0.00 O ATOM 0 H SER A 103 112.080 21.304 10.436 1.00 0.00 H new ATOM 0 HA SER A 103 112.874 18.532 9.820 1.00 0.00 H new ATOM 0 HB2 SER A 103 112.784 19.762 12.614 1.00 0.00 H new ATOM 0 HB3 SER A 103 112.994 18.057 12.266 1.00 0.00 H new ATOM 0 HG SER A 103 115.032 19.149 12.565 1.00 0.00 H new ATOM 1540 N ASP A 104 110.548 17.759 10.451 1.00 0.00 N ATOM 1541 CA ASP A 104 109.141 17.408 10.596 1.00 0.00 C ATOM 1542 C ASP A 104 108.989 15.940 10.977 1.00 0.00 C ATOM 1543 O ASP A 104 109.736 15.090 10.493 1.00 0.00 O ATOM 1544 CB ASP A 104 108.396 17.678 9.287 1.00 0.00 C ATOM 1545 CG ASP A 104 106.897 17.473 9.485 1.00 0.00 C ATOM 1546 OD1 ASP A 104 106.247 18.402 9.934 1.00 0.00 O ATOM 1547 OD2 ASP A 104 106.423 16.390 9.185 1.00 0.00 O ATOM 0 H ASP A 104 111.149 16.994 10.144 1.00 0.00 H new ATOM 0 HA ASP A 104 108.715 18.022 11.389 1.00 0.00 H new ATOM 0 HB2 ASP A 104 108.591 18.697 8.952 1.00 0.00 H new ATOM 0 HB3 ASP A 104 108.762 17.011 8.507 1.00 0.00 H new ATOM 1552 N TYR A 105 108.023 15.649 11.845 1.00 0.00 N ATOM 1553 CA TYR A 105 107.762 14.275 12.264 1.00 0.00 C ATOM 1554 C TYR A 105 106.447 13.782 11.671 1.00 0.00 C ATOM 1555 O TYR A 105 105.488 14.546 11.562 1.00 0.00 O ATOM 1556 CB TYR A 105 107.679 14.211 13.790 1.00 0.00 C ATOM 1557 CG TYR A 105 108.894 14.777 14.485 1.00 0.00 C ATOM 1558 CD1 TYR A 105 108.938 16.135 14.824 1.00 0.00 C ATOM 1559 CD2 TYR A 105 109.976 13.945 14.792 1.00 0.00 C ATOM 1560 CE1 TYR A 105 110.063 16.659 15.471 1.00 0.00 C ATOM 1561 CE2 TYR A 105 111.102 14.468 15.439 1.00 0.00 C ATOM 1562 CZ TYR A 105 111.145 15.826 15.778 1.00 0.00 C ATOM 1563 OH TYR A 105 112.256 16.344 16.414 1.00 0.00 O ATOM 0 H TYR A 105 107.410 16.344 12.271 1.00 0.00 H new ATOM 0 HA TYR A 105 108.575 13.641 11.910 1.00 0.00 H new ATOM 0 HB2 TYR A 105 106.795 14.756 14.121 1.00 0.00 H new ATOM 0 HB3 TYR A 105 107.547 13.173 14.095 1.00 0.00 H new ATOM 0 HD1 TYR A 105 108.104 16.778 14.586 1.00 0.00 H new ATOM 0 HD2 TYR A 105 109.943 12.898 14.530 1.00 0.00 H new ATOM 0 HE1 TYR A 105 110.096 17.706 15.733 1.00 0.00 H new ATOM 0 HE2 TYR A 105 111.937 13.825 15.676 1.00 0.00 H new ATOM 0 HH TYR A 105 112.914 15.632 16.554 1.00 0.00 H new ATOM 1573 N GLY A 106 106.401 12.507 11.287 1.00 0.00 N ATOM 1574 CA GLY A 106 105.168 11.930 10.765 1.00 0.00 C ATOM 1575 C GLY A 106 105.007 10.495 11.248 1.00 0.00 C ATOM 1576 O GLY A 106 105.973 9.872 11.680 1.00 0.00 O ATOM 0 H GLY A 106 107.192 11.864 11.327 1.00 0.00 H new ATOM 0 HA2 GLY A 106 104.315 12.527 11.087 1.00 0.00 H new ATOM 0 HA3 GLY A 106 105.180 11.954 9.675 1.00 0.00 H new ATOM 1580 N PHE A 107 103.791 9.971 11.161 1.00 0.00 N ATOM 1581 CA PHE A 107 103.537 8.587 11.555 1.00 0.00 C ATOM 1582 C PHE A 107 103.277 7.744 10.314 1.00 0.00 C ATOM 1583 O PHE A 107 102.404 8.069 9.509 1.00 0.00 O ATOM 1584 CB PHE A 107 102.330 8.522 12.490 1.00 0.00 C ATOM 1585 CG PHE A 107 102.583 9.154 13.839 1.00 0.00 C ATOM 1586 CD1 PHE A 107 103.089 8.380 14.890 1.00 0.00 C ATOM 1587 CD2 PHE A 107 102.316 10.515 14.037 1.00 0.00 C ATOM 1588 CE1 PHE A 107 103.328 8.964 16.139 1.00 0.00 C ATOM 1589 CE2 PHE A 107 102.554 11.098 15.288 1.00 0.00 C ATOM 1590 CZ PHE A 107 103.059 10.324 16.338 1.00 0.00 C ATOM 0 H PHE A 107 102.971 10.476 10.825 1.00 0.00 H new ATOM 0 HA PHE A 107 104.410 8.198 12.079 1.00 0.00 H new ATOM 0 HB2 PHE A 107 101.485 9.021 12.016 1.00 0.00 H new ATOM 0 HB3 PHE A 107 102.046 7.479 12.633 1.00 0.00 H new ATOM 0 HD1 PHE A 107 103.295 7.331 14.737 1.00 0.00 H new ATOM 0 HD2 PHE A 107 101.927 11.114 13.226 1.00 0.00 H new ATOM 0 HE1 PHE A 107 103.720 8.366 16.949 1.00 0.00 H new ATOM 0 HE2 PHE A 107 102.347 12.147 15.442 1.00 0.00 H new ATOM 0 HZ PHE A 107 103.241 10.775 17.302 1.00 0.00 H new ATOM 1600 N SER A 108 104.034 6.659 10.162 1.00 0.00 N ATOM 1601 CA SER A 108 103.885 5.805 8.985 1.00 0.00 C ATOM 1602 C SER A 108 103.240 4.478 9.363 1.00 0.00 C ATOM 1603 O SER A 108 103.574 3.888 10.389 1.00 0.00 O ATOM 1604 CB SER A 108 105.261 5.547 8.367 1.00 0.00 C ATOM 1605 OG SER A 108 105.912 6.791 8.148 1.00 0.00 O ATOM 0 H SER A 108 104.745 6.354 10.826 1.00 0.00 H new ATOM 0 HA SER A 108 103.243 6.311 8.264 1.00 0.00 H new ATOM 0 HB2 SER A 108 105.859 4.921 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 108 105.156 5.007 7.426 1.00 0.00 H new ATOM 0 HG SER A 108 106.828 6.631 7.838 1.00 0.00 H new ATOM 1611 N TYR A 109 102.313 4.018 8.527 1.00 0.00 N ATOM 1612 CA TYR A 109 101.645 2.738 8.749 1.00 0.00 C ATOM 1613 C TYR A 109 101.792 1.879 7.501 1.00 0.00 C ATOM 1614 O TYR A 109 101.677 2.396 6.391 1.00 0.00 O ATOM 1615 CB TYR A 109 100.160 2.965 9.039 1.00 0.00 C ATOM 1616 CG TYR A 109 99.905 3.845 10.240 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.858 5.238 10.090 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.711 3.271 11.502 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.618 6.053 11.202 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.472 4.086 12.614 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.426 5.478 12.464 1.00 0.00 C ATOM 1622 OH TYR A 109 99.191 6.283 13.561 1.00 0.00 O ATOM 0 H TYR A 109 102.007 4.513 7.689 1.00 0.00 H new ATOM 0 HA TYR A 109 102.100 2.236 9.603 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.692 3.415 8.163 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.678 2.000 9.197 1.00 0.00 H new ATOM 0 HD1 TYR A 109 100.007 5.682 9.117 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.746 2.198 11.617 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.581 7.126 11.087 1.00 0.00 H new ATOM 0 HE2 TYR A 109 99.323 3.642 13.587 1.00 0.00 H new ATOM 0 HH TYR A 109 99.079 5.725 14.358 1.00 0.00 H new ATOM 1632 N GLY A 110 102.052 0.584 7.670 1.00 0.00 N ATOM 1633 CA GLY A 110 102.263 -0.282 6.515 1.00 0.00 C ATOM 1634 C GLY A 110 101.710 -1.679 6.747 1.00 0.00 C ATOM 1635 O GLY A 110 101.547 -2.114 7.885 1.00 0.00 O ATOM 0 H GLY A 110 102.120 0.120 8.576 1.00 0.00 H new ATOM 0 HA2 GLY A 110 101.785 0.157 5.639 1.00 0.00 H new ATOM 0 HA3 GLY A 110 103.329 -0.345 6.298 1.00 0.00 H new ATOM 1639 N ALA A 111 101.435 -2.373 5.651 1.00 0.00 N ATOM 1640 CA ALA A 111 101.002 -3.760 5.725 1.00 0.00 C ATOM 1641 C ALA A 111 101.523 -4.524 4.516 1.00 0.00 C ATOM 1642 O ALA A 111 101.664 -3.956 3.434 1.00 0.00 O ATOM 1643 CB ALA A 111 99.473 -3.835 5.763 1.00 0.00 C ATOM 0 H ALA A 111 101.504 -2.000 4.704 1.00 0.00 H new ATOM 0 HA ALA A 111 101.400 -4.207 6.636 1.00 0.00 H new ATOM 0 HB1 ALA A 111 99.161 -4.878 5.818 1.00 0.00 H new ATOM 0 HB2 ALA A 111 99.104 -3.299 6.637 1.00 0.00 H new ATOM 0 HB3 ALA A 111 99.064 -3.381 4.860 1.00 0.00 H new ATOM 1649 N GLY A 112 101.793 -5.813 4.699 1.00 0.00 N ATOM 1650 CA GLY A 112 102.329 -6.618 3.606 1.00 0.00 C ATOM 1651 C GLY A 112 101.904 -8.077 3.707 1.00 0.00 C ATOM 1652 O GLY A 112 101.518 -8.551 4.776 1.00 0.00 O ATOM 0 H GLY A 112 101.653 -6.315 5.576 1.00 0.00 H new ATOM 0 HA2 GLY A 112 101.991 -6.207 2.654 1.00 0.00 H new ATOM 0 HA3 GLY A 112 103.417 -6.557 3.611 1.00 0.00 H new ATOM 1656 N LEU A 113 101.995 -8.773 2.576 1.00 0.00 N ATOM 1657 CA LEU A 113 101.674 -10.194 2.510 1.00 0.00 C ATOM 1658 C LEU A 113 102.955 -10.973 2.249 1.00 0.00 C ATOM 1659 O LEU A 113 103.839 -10.467 1.556 1.00 0.00 O ATOM 1660 CB LEU A 113 100.663 -10.468 1.393 1.00 0.00 C ATOM 1661 CG LEU A 113 99.347 -9.745 1.697 1.00 0.00 C ATOM 1662 CD1 LEU A 113 99.420 -8.304 1.192 1.00 0.00 C ATOM 1663 CD2 LEU A 113 98.193 -10.471 0.996 1.00 0.00 C ATOM 0 H LEU A 113 102.291 -8.370 1.687 1.00 0.00 H new ATOM 0 HA LEU A 113 101.230 -10.507 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 113 101.062 -10.129 0.437 1.00 0.00 H new ATOM 0 HB3 LEU A 113 100.488 -11.540 1.303 1.00 0.00 H new ATOM 0 HG LEU A 113 99.179 -9.742 2.774 1.00 0.00 H new ATOM 0 HD11 LEU A 113 98.482 -7.794 1.410 1.00 0.00 H new ATOM 0 HD12 LEU A 113 100.239 -7.785 1.689 1.00 0.00 H new ATOM 0 HD13 LEU A 113 99.591 -8.304 0.115 1.00 0.00 H new ATOM 0 HD21 LEU A 113 97.256 -9.958 1.211 1.00 0.00 H new ATOM 0 HD22 LEU A 113 98.366 -10.475 -0.080 1.00 0.00 H new ATOM 0 HD23 LEU A 113 98.136 -11.498 1.358 1.00 0.00 H new ATOM 1675 N GLN A 114 103.062 -12.190 2.784 1.00 0.00 N ATOM 1676 CA GLN A 114 104.314 -12.938 2.669 1.00 0.00 C ATOM 1677 C GLN A 114 104.072 -14.405 2.340 1.00 0.00 C ATOM 1678 O GLN A 114 103.137 -15.027 2.844 1.00 0.00 O ATOM 1679 CB GLN A 114 105.104 -12.840 3.977 1.00 0.00 C ATOM 1680 CG GLN A 114 105.503 -11.383 4.226 1.00 0.00 C ATOM 1681 CD GLN A 114 106.214 -11.244 5.571 1.00 0.00 C ATOM 1682 OE1 GLN A 114 106.109 -12.119 6.432 1.00 0.00 O ATOM 1683 NE2 GLN A 114 106.939 -10.186 5.804 1.00 0.00 N ATOM 0 H GLN A 114 102.317 -12.669 3.289 1.00 0.00 H new ATOM 0 HA GLN A 114 104.883 -12.495 1.851 1.00 0.00 H new ATOM 0 HB2 GLN A 114 104.501 -13.210 4.807 1.00 0.00 H new ATOM 0 HB3 GLN A 114 105.994 -13.468 3.925 1.00 0.00 H new ATOM 0 HG2 GLN A 114 106.157 -11.037 3.425 1.00 0.00 H new ATOM 0 HG3 GLN A 114 104.616 -10.749 4.210 1.00 0.00 H new ATOM 0 HE21 GLN A 114 107.027 -9.461 5.092 1.00 0.00 H new ATOM 0 HE22 GLN A 114 107.419 -10.083 6.698 1.00 0.00 H new ATOM 1692 N PHE A 115 104.933 -14.940 1.483 1.00 0.00 N ATOM 1693 CA PHE A 115 104.952 -16.372 1.213 1.00 0.00 C ATOM 1694 C PHE A 115 106.396 -16.835 1.274 1.00 0.00 C ATOM 1695 O PHE A 115 107.223 -16.373 0.487 1.00 0.00 O ATOM 1696 CB PHE A 115 104.364 -16.669 -0.167 1.00 0.00 C ATOM 1697 CG PHE A 115 104.346 -18.143 -0.499 1.00 0.00 C ATOM 1698 CD1 PHE A 115 103.358 -18.972 0.049 1.00 0.00 C ATOM 1699 CD2 PHE A 115 105.315 -18.680 -1.353 1.00 0.00 C ATOM 1700 CE1 PHE A 115 103.342 -20.337 -0.259 1.00 0.00 C ATOM 1701 CE2 PHE A 115 105.300 -20.046 -1.660 1.00 0.00 C ATOM 1702 CZ PHE A 115 104.313 -20.875 -1.113 1.00 0.00 C ATOM 0 H PHE A 115 105.627 -14.403 0.963 1.00 0.00 H new ATOM 0 HA PHE A 115 104.348 -16.899 1.951 1.00 0.00 H new ATOM 0 HB2 PHE A 115 103.347 -16.280 -0.213 1.00 0.00 H new ATOM 0 HB3 PHE A 115 104.943 -16.139 -0.924 1.00 0.00 H new ATOM 0 HD1 PHE A 115 102.610 -18.558 0.708 1.00 0.00 H new ATOM 0 HD2 PHE A 115 106.075 -18.040 -1.776 1.00 0.00 H new ATOM 0 HE1 PHE A 115 102.580 -20.976 0.162 1.00 0.00 H new ATOM 0 HE2 PHE A 115 106.049 -20.460 -2.318 1.00 0.00 H new ATOM 0 HZ PHE A 115 104.300 -21.929 -1.350 1.00 0.00 H new ATOM 1712 N ASN A 116 106.716 -17.709 2.229 1.00 0.00 N ATOM 1713 CA ASN A 116 108.113 -18.069 2.463 1.00 0.00 C ATOM 1714 C ASN A 116 108.381 -19.554 2.215 1.00 0.00 C ATOM 1715 O ASN A 116 107.729 -20.414 2.808 1.00 0.00 O ATOM 1716 CB ASN A 116 108.466 -17.758 3.920 1.00 0.00 C ATOM 1717 CG ASN A 116 108.218 -16.283 4.219 1.00 0.00 C ATOM 1718 OD1 ASN A 116 109.128 -15.463 4.105 1.00 0.00 O ATOM 1719 ND2 ASN A 116 107.029 -15.894 4.596 1.00 0.00 N ATOM 0 H ASN A 116 106.043 -18.171 2.840 1.00 0.00 H new ATOM 0 HA ASN A 116 108.722 -17.492 1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 116 107.867 -18.378 4.587 1.00 0.00 H new ATOM 0 HB3 ASN A 116 109.511 -18.004 4.109 1.00 0.00 H new ATOM 0 HD21 ASN A 116 106.854 -14.909 4.796 1.00 0.00 H new ATOM 0 HD22 ASN A 116 106.276 -16.575 4.690 1.00 0.00 H new ATOM 1726 N PRO A 117 109.318 -19.873 1.355 1.00 0.00 N ATOM 1727 CA PRO A 117 110.011 -21.180 1.363 1.00 0.00 C ATOM 1728 C PRO A 117 111.433 -20.997 1.884 1.00 0.00 C ATOM 1729 O PRO A 117 111.850 -19.867 2.148 1.00 0.00 O ATOM 1730 CB PRO A 117 110.011 -21.572 -0.117 1.00 0.00 C ATOM 1731 CG PRO A 117 109.873 -20.293 -0.885 1.00 0.00 C ATOM 1732 CD PRO A 117 109.710 -19.159 0.132 1.00 0.00 C ATOM 0 HA PRO A 117 109.544 -21.933 1.998 1.00 0.00 H new ATOM 0 HB2 PRO A 117 110.933 -22.089 -0.383 1.00 0.00 H new ATOM 0 HB3 PRO A 117 109.188 -22.251 -0.340 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.750 -20.124 -1.509 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.011 -20.337 -1.551 1.00 0.00 H new ATOM 0 HD2 PRO A 117 110.637 -18.602 0.268 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.950 -18.442 -0.179 1.00 0.00 H new ATOM 1740 N MET A 118 112.174 -22.090 2.030 1.00 0.00 N ATOM 1741 CA MET A 118 113.556 -21.995 2.489 1.00 0.00 C ATOM 1742 C MET A 118 114.372 -21.131 1.529 1.00 0.00 C ATOM 1743 O MET A 118 113.888 -20.759 0.460 1.00 0.00 O ATOM 1744 CB MET A 118 114.176 -23.391 2.574 1.00 0.00 C ATOM 1745 CG MET A 118 113.451 -24.208 3.646 1.00 0.00 C ATOM 1746 SD MET A 118 114.258 -25.819 3.825 1.00 0.00 S ATOM 1747 CE MET A 118 113.093 -26.526 5.014 1.00 0.00 C ATOM 0 H MET A 118 111.848 -23.038 1.841 1.00 0.00 H new ATOM 0 HA MET A 118 113.564 -21.536 3.478 1.00 0.00 H new ATOM 0 HB2 MET A 118 114.103 -23.892 1.609 1.00 0.00 H new ATOM 0 HB3 MET A 118 115.236 -23.315 2.815 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.465 -23.675 4.596 1.00 0.00 H new ATOM 0 HG3 MET A 118 112.405 -24.342 3.371 1.00 0.00 H new ATOM 0 HE1 MET A 118 113.404 -27.539 5.270 1.00 0.00 H new ATOM 0 HE2 MET A 118 113.076 -25.913 5.915 1.00 0.00 H new ATOM 0 HE3 MET A 118 112.096 -26.553 4.574 1.00 0.00 H new ATOM 1757 N GLU A 119 115.596 -20.795 1.934 1.00 0.00 N ATOM 1758 CA GLU A 119 116.529 -20.068 1.074 1.00 0.00 C ATOM 1759 C GLU A 119 116.031 -18.649 0.756 1.00 0.00 C ATOM 1760 O GLU A 119 115.047 -18.179 1.326 1.00 0.00 O ATOM 1761 CB GLU A 119 116.761 -20.865 -0.220 1.00 0.00 C ATOM 1762 CG GLU A 119 117.325 -22.247 0.128 1.00 0.00 C ATOM 1763 CD GLU A 119 118.689 -22.138 0.816 1.00 0.00 C ATOM 1764 OE1 GLU A 119 119.322 -21.098 0.716 1.00 0.00 O ATOM 1765 OE2 GLU A 119 119.085 -23.112 1.438 1.00 0.00 O ATOM 0 H GLU A 119 115.966 -21.016 2.858 1.00 0.00 H new ATOM 0 HA GLU A 119 117.472 -19.961 1.610 1.00 0.00 H new ATOM 0 HB2 GLU A 119 115.825 -20.970 -0.769 1.00 0.00 H new ATOM 0 HB3 GLU A 119 117.454 -20.331 -0.870 1.00 0.00 H new ATOM 0 HG2 GLU A 119 116.628 -22.772 0.781 1.00 0.00 H new ATOM 0 HG3 GLU A 119 117.421 -22.842 -0.780 1.00 0.00 H new ATOM 1772 N ASN A 120 116.732 -17.984 -0.165 1.00 0.00 N ATOM 1773 CA ASN A 120 116.424 -16.619 -0.609 1.00 0.00 C ATOM 1774 C ASN A 120 115.041 -16.475 -1.260 1.00 0.00 C ATOM 1775 O ASN A 120 114.574 -15.360 -1.481 1.00 0.00 O ATOM 1776 CB ASN A 120 117.489 -16.159 -1.606 1.00 0.00 C ATOM 1777 CG ASN A 120 118.859 -16.110 -0.936 1.00 0.00 C ATOM 1778 OD1 ASN A 120 118.955 -16.017 0.289 1.00 0.00 O ATOM 1779 ND2 ASN A 120 119.935 -16.169 -1.672 1.00 0.00 N ATOM 0 H ASN A 120 117.545 -18.385 -0.633 1.00 0.00 H new ATOM 0 HA ASN A 120 116.418 -15.999 0.287 1.00 0.00 H new ATOM 0 HB2 ASN A 120 117.517 -16.839 -2.457 1.00 0.00 H new ATOM 0 HB3 ASN A 120 117.231 -15.174 -1.994 1.00 0.00 H new ATOM 0 HD21 ASN A 120 120.855 -16.138 -1.233 1.00 0.00 H new ATOM 0 HD22 ASN A 120 119.856 -16.246 -2.686 1.00 0.00 H new ATOM 1786 N VAL A 121 114.388 -17.593 -1.560 1.00 0.00 N ATOM 1787 CA VAL A 121 113.237 -17.630 -2.469 1.00 0.00 C ATOM 1788 C VAL A 121 111.938 -17.149 -1.793 1.00 0.00 C ATOM 1789 O VAL A 121 110.844 -17.405 -2.302 1.00 0.00 O ATOM 1790 CB VAL A 121 113.049 -19.054 -3.055 1.00 0.00 C ATOM 1791 CG1 VAL A 121 112.081 -19.011 -4.247 1.00 0.00 C ATOM 1792 CG2 VAL A 121 114.387 -19.635 -3.546 1.00 0.00 C ATOM 0 H VAL A 121 114.640 -18.506 -1.180 1.00 0.00 H new ATOM 0 HA VAL A 121 113.451 -16.936 -3.282 1.00 0.00 H new ATOM 0 HB VAL A 121 112.650 -19.684 -2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 121 111.956 -20.016 -4.651 1.00 0.00 H new ATOM 0 HG12 VAL A 121 111.115 -18.630 -3.917 1.00 0.00 H new ATOM 0 HG13 VAL A 121 112.484 -18.357 -5.020 1.00 0.00 H new ATOM 0 HG21 VAL A 121 114.223 -20.634 -3.951 1.00 0.00 H new ATOM 0 HG22 VAL A 121 114.800 -18.991 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 121 115.087 -19.692 -2.712 1.00 0.00 H new ATOM 1802 N ALA A 122 112.029 -16.427 -0.665 1.00 0.00 N ATOM 1803 CA ALA A 122 110.823 -15.985 0.039 1.00 0.00 C ATOM 1804 C ALA A 122 110.588 -14.499 -0.227 1.00 0.00 C ATOM 1805 O ALA A 122 111.530 -13.712 -0.220 1.00 0.00 O ATOM 1806 CB ALA A 122 111.008 -16.197 1.543 1.00 0.00 C ATOM 0 H ALA A 122 112.907 -16.143 -0.231 1.00 0.00 H new ATOM 0 HA ALA A 122 109.968 -16.561 -0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 122 110.112 -15.869 2.070 1.00 0.00 H new ATOM 0 HB2 ALA A 122 111.180 -17.255 1.743 1.00 0.00 H new ATOM 0 HB3 ALA A 122 111.865 -15.619 1.889 1.00 0.00 H new ATOM 1812 N LEU A 123 109.329 -14.121 -0.472 1.00 0.00 N ATOM 1813 CA LEU A 123 109.029 -12.782 -0.992 1.00 0.00 C ATOM 1814 C LEU A 123 107.961 -12.070 -0.165 1.00 0.00 C ATOM 1815 O LEU A 123 107.065 -12.705 0.389 1.00 0.00 O ATOM 1816 CB LEU A 123 108.547 -12.886 -2.443 1.00 0.00 C ATOM 1817 CG LEU A 123 109.592 -13.608 -3.301 1.00 0.00 C ATOM 1818 CD1 LEU A 123 109.056 -13.771 -4.723 1.00 0.00 C ATOM 1819 CD2 LEU A 123 110.885 -12.789 -3.342 1.00 0.00 C ATOM 0 H LEU A 123 108.512 -14.713 -0.322 1.00 0.00 H new ATOM 0 HA LEU A 123 109.948 -12.199 -0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 123 107.600 -13.425 -2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 123 108.363 -11.889 -2.844 1.00 0.00 H new ATOM 0 HG LEU A 123 109.797 -14.587 -2.868 1.00 0.00 H new ATOM 0 HD11 LEU A 123 109.798 -14.284 -5.335 1.00 0.00 H new ATOM 0 HD12 LEU A 123 108.137 -14.356 -4.700 1.00 0.00 H new ATOM 0 HD13 LEU A 123 108.851 -12.789 -5.149 1.00 0.00 H new ATOM 0 HD21 LEU A 123 111.624 -13.307 -3.953 1.00 0.00 H new ATOM 0 HD22 LEU A 123 110.681 -11.808 -3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 123 111.271 -12.668 -2.330 1.00 0.00 H new ATOM 1831 N ASP A 124 108.067 -10.742 -0.107 1.00 0.00 N ATOM 1832 CA ASP A 124 107.093 -9.924 0.612 1.00 0.00 C ATOM 1833 C ASP A 124 106.729 -8.679 -0.196 1.00 0.00 C ATOM 1834 O ASP A 124 107.590 -8.094 -0.853 1.00 0.00 O ATOM 1835 CB ASP A 124 107.673 -9.499 1.965 1.00 0.00 C ATOM 1836 CG ASP A 124 106.663 -8.673 2.763 1.00 0.00 C ATOM 1837 OD1 ASP A 124 105.474 -8.830 2.538 1.00 0.00 O ATOM 1838 OD2 ASP A 124 107.097 -7.891 3.591 1.00 0.00 O ATOM 0 H ASP A 124 108.817 -10.211 -0.549 1.00 0.00 H new ATOM 0 HA ASP A 124 106.192 -10.518 0.766 1.00 0.00 H new ATOM 0 HB2 ASP A 124 107.957 -10.383 2.536 1.00 0.00 H new ATOM 0 HB3 ASP A 124 108.581 -8.916 1.808 1.00 0.00 H new ATOM 1843 N PHE A 125 105.456 -8.286 -0.152 1.00 0.00 N ATOM 1844 CA PHE A 125 105.015 -7.055 -0.810 1.00 0.00 C ATOM 1845 C PHE A 125 104.283 -6.174 0.198 1.00 0.00 C ATOM 1846 O PHE A 125 103.411 -6.661 0.913 1.00 0.00 O ATOM 1847 CB PHE A 125 104.081 -7.389 -1.975 1.00 0.00 C ATOM 1848 CG PHE A 125 104.743 -8.203 -3.062 1.00 0.00 C ATOM 1849 CD1 PHE A 125 105.480 -7.564 -4.066 1.00 0.00 C ATOM 1850 CD2 PHE A 125 104.620 -9.598 -3.064 1.00 0.00 C ATOM 1851 CE1 PHE A 125 106.094 -8.318 -5.073 1.00 0.00 C ATOM 1852 CE2 PHE A 125 105.234 -10.353 -4.071 1.00 0.00 C ATOM 1853 CZ PHE A 125 105.971 -9.712 -5.075 1.00 0.00 C ATOM 0 H PHE A 125 104.716 -8.798 0.329 1.00 0.00 H new ATOM 0 HA PHE A 125 105.885 -6.523 -1.195 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.220 -7.938 -1.594 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.703 -6.461 -2.405 1.00 0.00 H new ATOM 0 HD1 PHE A 125 105.575 -6.488 -4.064 1.00 0.00 H new ATOM 0 HD2 PHE A 125 104.052 -10.091 -2.289 1.00 0.00 H new ATOM 0 HE1 PHE A 125 106.662 -7.824 -5.848 1.00 0.00 H new ATOM 0 HE2 PHE A 125 105.139 -11.429 -4.074 1.00 0.00 H new ATOM 0 HZ PHE A 125 106.445 -10.294 -5.851 1.00 0.00 H new ATOM 1863 N SER A 126 104.629 -4.885 0.253 1.00 0.00 N ATOM 1864 CA SER A 126 104.062 -4.009 1.279 1.00 0.00 C ATOM 1865 C SER A 126 103.730 -2.628 0.726 1.00 0.00 C ATOM 1866 O SER A 126 104.328 -2.178 -0.250 1.00 0.00 O ATOM 1867 CB SER A 126 105.049 -3.865 2.436 1.00 0.00 C ATOM 1868 OG SER A 126 104.347 -3.445 3.598 1.00 0.00 O ATOM 0 H SER A 126 105.284 -4.433 -0.385 1.00 0.00 H new ATOM 0 HA SER A 126 103.135 -4.465 1.627 1.00 0.00 H new ATOM 0 HB2 SER A 126 105.550 -4.815 2.623 1.00 0.00 H new ATOM 0 HB3 SER A 126 105.823 -3.141 2.182 1.00 0.00 H new ATOM 0 HG SER A 126 103.382 -3.512 3.439 1.00 0.00 H new ATOM 1874 N TYR A 127 102.767 -1.965 1.362 1.00 0.00 N ATOM 1875 CA TYR A 127 102.421 -0.591 1.021 1.00 0.00 C ATOM 1876 C TYR A 127 102.481 0.269 2.281 1.00 0.00 C ATOM 1877 O TYR A 127 102.088 -0.183 3.357 1.00 0.00 O ATOM 1878 CB TYR A 127 101.013 -0.533 0.426 1.00 0.00 C ATOM 1879 CG TYR A 127 100.612 0.848 -0.037 1.00 0.00 C ATOM 1880 CD1 TYR A 127 99.973 1.725 0.847 1.00 0.00 C ATOM 1881 CD2 TYR A 127 100.884 1.253 -1.349 1.00 0.00 C ATOM 1882 CE1 TYR A 127 99.602 3.005 0.420 1.00 0.00 C ATOM 1883 CE2 TYR A 127 100.512 2.534 -1.778 1.00 0.00 C ATOM 1884 CZ TYR A 127 99.872 3.409 -0.893 1.00 0.00 C ATOM 1885 OH TYR A 127 99.508 4.671 -1.314 1.00 0.00 O ATOM 0 H TYR A 127 102.211 -2.361 2.120 1.00 0.00 H new ATOM 0 HA TYR A 127 103.130 -0.215 0.283 1.00 0.00 H new ATOM 0 HB2 TYR A 127 100.954 -1.222 -0.417 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.297 -0.880 1.171 1.00 0.00 H new ATOM 0 HD1 TYR A 127 99.766 1.413 1.860 1.00 0.00 H new ATOM 0 HD2 TYR A 127 101.381 0.578 -2.031 1.00 0.00 H new ATOM 0 HE1 TYR A 127 99.108 3.680 1.103 1.00 0.00 H new ATOM 0 HE2 TYR A 127 100.719 2.846 -2.791 1.00 0.00 H new ATOM 0 HH TYR A 127 99.769 4.791 -2.251 1.00 0.00 H new ATOM 1895 N GLU A 128 102.989 1.492 2.142 1.00 0.00 N ATOM 1896 CA GLU A 128 103.153 2.386 3.286 1.00 0.00 C ATOM 1897 C GLU A 128 102.376 3.675 3.058 1.00 0.00 C ATOM 1898 O GLU A 128 102.330 4.193 1.942 1.00 0.00 O ATOM 1899 CB GLU A 128 104.636 2.716 3.477 1.00 0.00 C ATOM 1900 CG GLU A 128 104.833 3.428 4.817 1.00 0.00 C ATOM 1901 CD GLU A 128 104.649 2.456 5.982 1.00 0.00 C ATOM 1902 OE1 GLU A 128 104.869 1.270 5.794 1.00 0.00 O ATOM 1903 OE2 GLU A 128 104.286 2.913 7.054 1.00 0.00 O ATOM 0 H GLU A 128 103.293 1.885 1.251 1.00 0.00 H new ATOM 0 HA GLU A 128 102.771 1.889 4.178 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.229 1.802 3.448 1.00 0.00 H new ATOM 0 HB3 GLU A 128 104.986 3.349 2.662 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.830 3.866 4.858 1.00 0.00 H new ATOM 0 HG3 GLU A 128 104.121 4.248 4.906 1.00 0.00 H new ATOM 1910 N GLN A 129 101.765 4.197 4.119 1.00 0.00 N ATOM 1911 CA GLN A 129 100.976 5.419 4.019 1.00 0.00 C ATOM 1912 C GLN A 129 101.455 6.450 5.033 1.00 0.00 C ATOM 1913 O GLN A 129 101.668 6.130 6.202 1.00 0.00 O ATOM 1914 CB GLN A 129 99.499 5.104 4.269 1.00 0.00 C ATOM 1915 CG GLN A 129 98.653 6.346 3.987 1.00 0.00 C ATOM 1916 CD GLN A 129 98.546 6.575 2.483 1.00 0.00 C ATOM 1917 OE1 GLN A 129 97.971 5.752 1.768 1.00 0.00 O ATOM 1918 NE2 GLN A 129 99.069 7.649 1.955 1.00 0.00 N ATOM 0 H GLN A 129 101.802 3.793 5.055 1.00 0.00 H new ATOM 0 HA GLN A 129 101.098 5.829 3.016 1.00 0.00 H new ATOM 0 HB2 GLN A 129 99.179 4.281 3.629 1.00 0.00 H new ATOM 0 HB3 GLN A 129 99.355 4.781 5.300 1.00 0.00 H new ATOM 0 HG2 GLN A 129 97.658 6.224 4.416 1.00 0.00 H new ATOM 0 HG3 GLN A 129 99.101 7.217 4.465 1.00 0.00 H new ATOM 0 HE21 GLN A 129 99.545 8.329 2.548 1.00 0.00 H new ATOM 0 HE22 GLN A 129 99.002 7.808 0.950 1.00 0.00 H new ATOM 1927 N SER A 130 101.636 7.679 4.563 1.00 0.00 N ATOM 1928 CA SER A 130 101.961 8.805 5.432 1.00 0.00 C ATOM 1929 C SER A 130 100.813 9.799 5.372 1.00 0.00 C ATOM 1930 O SER A 130 100.317 10.088 4.279 1.00 0.00 O ATOM 1931 CB SER A 130 103.254 9.488 4.989 1.00 0.00 C ATOM 1932 OG SER A 130 104.244 8.501 4.737 1.00 0.00 O ATOM 0 H SER A 130 101.562 7.923 3.575 1.00 0.00 H new ATOM 0 HA SER A 130 102.106 8.443 6.450 1.00 0.00 H new ATOM 0 HB2 SER A 130 103.077 10.080 4.091 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.598 10.176 5.761 1.00 0.00 H new ATOM 0 HG SER A 130 105.074 8.936 4.451 1.00 0.00 H new ATOM 1938 N ARG A 131 100.530 10.445 6.501 1.00 0.00 N ATOM 1939 CA ARG A 131 99.251 11.119 6.707 1.00 0.00 C ATOM 1940 C ARG A 131 99.353 12.551 6.213 1.00 0.00 C ATOM 1941 O ARG A 131 100.405 13.181 6.310 1.00 0.00 O ATOM 1942 CB ARG A 131 98.866 11.112 8.189 1.00 0.00 C ATOM 1943 CG ARG A 131 98.672 9.670 8.664 1.00 0.00 C ATOM 1944 CD ARG A 131 98.134 9.662 10.099 1.00 0.00 C ATOM 1945 NE ARG A 131 99.019 10.420 10.989 1.00 0.00 N ATOM 1946 CZ ARG A 131 98.854 11.721 11.271 1.00 0.00 C ATOM 1947 NH1 ARG A 131 97.893 12.441 10.741 1.00 0.00 N ATOM 1948 NH2 ARG A 131 99.684 12.298 12.095 1.00 0.00 N ATOM 0 H ARG A 131 101.173 10.516 7.290 1.00 0.00 H new ATOM 0 HA ARG A 131 98.481 10.588 6.148 1.00 0.00 H new ATOM 0 HB2 ARG A 131 99.643 11.598 8.779 1.00 0.00 H new ATOM 0 HB3 ARG A 131 97.949 11.681 8.339 1.00 0.00 H new ATOM 0 HG2 ARG A 131 97.978 9.150 8.003 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.619 9.132 8.618 1.00 0.00 H new ATOM 0 HD2 ARG A 131 97.133 10.093 10.120 1.00 0.00 H new ATOM 0 HD3 ARG A 131 98.046 8.635 10.454 1.00 0.00 H new ATOM 0 HE ARG A 131 99.804 9.930 11.418 1.00 0.00 H new ATOM 0 HH11 ARG A 131 97.237 12.014 10.088 1.00 0.00 H new ATOM 0 HH12 ARG A 131 97.803 13.428 10.982 1.00 0.00 H new ATOM 0 HH21 ARG A 131 100.443 11.761 12.513 1.00 0.00 H new ATOM 0 HH22 ARG A 131 99.574 13.287 12.321 1.00 0.00 H new ATOM 1962 N ILE A 132 98.248 13.060 5.679 1.00 0.00 N ATOM 1963 CA ILE A 132 98.327 14.013 4.584 1.00 0.00 C ATOM 1964 C ILE A 132 98.456 15.469 5.043 1.00 0.00 C ATOM 1965 O ILE A 132 97.513 16.135 5.470 1.00 0.00 O ATOM 1966 CB ILE A 132 97.101 13.835 3.670 1.00 0.00 C ATOM 1967 CG1 ILE A 132 97.229 14.741 2.439 1.00 0.00 C ATOM 1968 CG2 ILE A 132 95.803 14.166 4.417 1.00 0.00 C ATOM 1969 CD1 ILE A 132 96.411 14.159 1.285 1.00 0.00 C ATOM 0 H ILE A 132 97.301 12.832 5.983 1.00 0.00 H new ATOM 0 HA ILE A 132 99.244 13.799 4.035 1.00 0.00 H new ATOM 0 HB ILE A 132 97.063 12.792 3.355 1.00 0.00 H new ATOM 0 HG12 ILE A 132 96.878 15.745 2.676 1.00 0.00 H new ATOM 0 HG13 ILE A 132 98.276 14.830 2.148 1.00 0.00 H new ATOM 0 HG21 ILE A 132 94.953 14.032 3.747 1.00 0.00 H new ATOM 0 HG22 ILE A 132 95.697 13.502 5.275 1.00 0.00 H new ATOM 0 HG23 ILE A 132 95.834 15.200 4.760 1.00 0.00 H new ATOM 0 HD11 ILE A 132 96.504 14.805 0.412 1.00 0.00 H new ATOM 0 HD12 ILE A 132 96.782 13.164 1.042 1.00 0.00 H new ATOM 0 HD13 ILE A 132 95.363 14.094 1.578 1.00 0.00 H new ATOM 1981 N ARG A 133 99.704 15.911 4.957 1.00 0.00 N ATOM 1982 CA ARG A 133 100.073 17.317 4.865 1.00 0.00 C ATOM 1983 C ARG A 133 100.108 17.681 3.377 1.00 0.00 C ATOM 1984 O ARG A 133 99.755 16.857 2.523 1.00 0.00 O ATOM 1985 CB ARG A 133 101.450 17.556 5.490 1.00 0.00 C ATOM 1986 CG ARG A 133 101.461 17.065 6.940 1.00 0.00 C ATOM 1987 CD ARG A 133 100.521 17.927 7.787 1.00 0.00 C ATOM 1988 NE ARG A 133 100.627 17.550 9.200 1.00 0.00 N ATOM 1989 CZ ARG A 133 101.593 18.002 10.017 1.00 0.00 C ATOM 1990 NH1 ARG A 133 102.525 18.828 9.608 1.00 0.00 N ATOM 1991 NH2 ARG A 133 101.602 17.606 11.259 1.00 0.00 N ATOM 0 H ARG A 133 100.509 15.284 4.949 1.00 0.00 H new ATOM 0 HA ARG A 133 99.352 17.933 5.403 1.00 0.00 H new ATOM 0 HB2 ARG A 133 102.215 17.034 4.915 1.00 0.00 H new ATOM 0 HB3 ARG A 133 101.695 18.618 5.455 1.00 0.00 H new ATOM 0 HG2 ARG A 133 101.149 16.021 6.982 1.00 0.00 H new ATOM 0 HG3 ARG A 133 102.473 17.112 7.342 1.00 0.00 H new ATOM 0 HD2 ARG A 133 100.772 18.981 7.664 1.00 0.00 H new ATOM 0 HD3 ARG A 133 99.494 17.802 7.445 1.00 0.00 H new ATOM 0 HE ARG A 133 99.930 16.911 9.583 1.00 0.00 H new ATOM 0 HH11 ARG A 133 102.533 19.149 8.640 1.00 0.00 H new ATOM 0 HH12 ARG A 133 103.242 19.150 10.258 1.00 0.00 H new ATOM 0 HH21 ARG A 133 100.884 16.964 11.595 1.00 0.00 H new ATOM 0 HH22 ARG A 133 102.327 17.938 11.895 1.00 0.00 H new ATOM 2005 N SER A 134 100.491 18.912 3.048 1.00 0.00 N ATOM 2006 CA SER A 134 100.455 19.356 1.649 1.00 0.00 C ATOM 2007 C SER A 134 101.190 18.383 0.706 1.00 0.00 C ATOM 2008 O SER A 134 101.031 18.477 -0.511 1.00 0.00 O ATOM 2009 CB SER A 134 101.086 20.743 1.533 1.00 0.00 C ATOM 2010 OG SER A 134 102.480 20.646 1.801 1.00 0.00 O ATOM 0 H SER A 134 100.824 19.611 3.712 1.00 0.00 H new ATOM 0 HA SER A 134 99.409 19.386 1.345 1.00 0.00 H new ATOM 0 HB2 SER A 134 100.923 21.148 0.534 1.00 0.00 H new ATOM 0 HB3 SER A 134 100.615 21.430 2.236 1.00 0.00 H new ATOM 0 HG SER A 134 102.890 21.533 1.726 1.00 0.00 H new ATOM 2016 N VAL A 135 101.989 17.455 1.246 1.00 0.00 N ATOM 2017 CA VAL A 135 102.495 16.326 0.467 1.00 0.00 C ATOM 2018 C VAL A 135 102.045 15.009 1.111 1.00 0.00 C ATOM 2019 O VAL A 135 102.181 14.823 2.320 1.00 0.00 O ATOM 2020 CB VAL A 135 104.026 16.397 0.387 1.00 0.00 C ATOM 2021 CG1 VAL A 135 104.632 16.305 1.790 1.00 0.00 C ATOM 2022 CG2 VAL A 135 104.552 15.246 -0.474 1.00 0.00 C ATOM 0 H VAL A 135 102.297 17.466 2.218 1.00 0.00 H new ATOM 0 HA VAL A 135 102.093 16.371 -0.545 1.00 0.00 H new ATOM 0 HB VAL A 135 104.312 17.348 -0.063 1.00 0.00 H new ATOM 0 HG11 VAL A 135 105.719 16.356 1.721 1.00 0.00 H new ATOM 0 HG12 VAL A 135 104.267 17.132 2.399 1.00 0.00 H new ATOM 0 HG13 VAL A 135 104.342 15.361 2.250 1.00 0.00 H new ATOM 0 HG21 VAL A 135 105.639 15.300 -0.528 1.00 0.00 H new ATOM 0 HG22 VAL A 135 104.258 14.295 -0.030 1.00 0.00 H new ATOM 0 HG23 VAL A 135 104.134 15.322 -1.478 1.00 0.00 H new ATOM 2032 N ASP A 136 101.512 14.099 0.295 1.00 0.00 N ATOM 2033 CA ASP A 136 101.014 12.811 0.786 1.00 0.00 C ATOM 2034 C ASP A 136 101.852 11.671 0.213 1.00 0.00 C ATOM 2035 O ASP A 136 102.209 11.708 -0.966 1.00 0.00 O ATOM 2036 CB ASP A 136 99.553 12.622 0.375 1.00 0.00 C ATOM 2037 CG ASP A 136 98.984 11.367 1.029 1.00 0.00 C ATOM 2038 OD1 ASP A 136 98.561 11.458 2.170 1.00 0.00 O ATOM 2039 OD2 ASP A 136 98.983 10.335 0.380 1.00 0.00 O ATOM 0 H ASP A 136 101.413 14.229 -0.712 1.00 0.00 H new ATOM 0 HA ASP A 136 101.088 12.802 1.873 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.968 13.493 0.671 1.00 0.00 H new ATOM 0 HB3 ASP A 136 99.479 12.542 -0.710 1.00 0.00 H new ATOM 2044 N VAL A 137 102.169 10.657 1.025 1.00 0.00 N ATOM 2045 CA VAL A 137 103.114 9.622 0.580 1.00 0.00 C ATOM 2046 C VAL A 137 102.410 8.296 0.297 1.00 0.00 C ATOM 2047 O VAL A 137 101.672 7.778 1.135 1.00 0.00 O ATOM 2048 CB VAL A 137 104.207 9.379 1.631 1.00 0.00 C ATOM 2049 CG1 VAL A 137 105.285 8.463 1.046 1.00 0.00 C ATOM 2050 CG2 VAL A 137 104.858 10.704 2.048 1.00 0.00 C ATOM 0 H VAL A 137 101.799 10.530 1.967 1.00 0.00 H new ATOM 0 HA VAL A 137 103.564 9.992 -0.341 1.00 0.00 H new ATOM 0 HB VAL A 137 103.749 8.914 2.504 1.00 0.00 H new ATOM 0 HG11 VAL A 137 106.060 8.291 1.792 1.00 0.00 H new ATOM 0 HG12 VAL A 137 104.838 7.511 0.761 1.00 0.00 H new ATOM 0 HG13 VAL A 137 105.725 8.934 0.167 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.630 10.512 2.793 1.00 0.00 H new ATOM 0 HG22 VAL A 137 105.306 11.180 1.176 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.101 11.364 2.472 1.00 0.00 H new ATOM 2060 N GLY A 138 102.651 7.757 -0.897 1.00 0.00 N ATOM 2061 CA GLY A 138 102.219 6.403 -1.232 1.00 0.00 C ATOM 2062 C GLY A 138 103.422 5.599 -1.711 1.00 0.00 C ATOM 2063 O GLY A 138 104.029 5.950 -2.722 1.00 0.00 O ATOM 0 H GLY A 138 103.144 8.239 -1.649 1.00 0.00 H new ATOM 0 HA2 GLY A 138 101.770 5.925 -0.361 1.00 0.00 H new ATOM 0 HA3 GLY A 138 101.454 6.434 -2.008 1.00 0.00 H new ATOM 2067 N THR A 139 103.794 4.550 -0.975 1.00 0.00 N ATOM 2068 CA THR A 139 104.996 3.783 -1.302 1.00 0.00 C ATOM 2069 C THR A 139 104.682 2.298 -1.443 1.00 0.00 C ATOM 2070 O THR A 139 103.979 1.732 -0.610 1.00 0.00 O ATOM 2071 CB THR A 139 106.044 3.985 -0.203 1.00 0.00 C ATOM 2072 OG1 THR A 139 106.272 5.375 -0.021 1.00 0.00 O ATOM 2073 CG2 THR A 139 107.354 3.301 -0.597 1.00 0.00 C ATOM 0 H THR A 139 103.286 4.215 -0.157 1.00 0.00 H new ATOM 0 HA THR A 139 105.382 4.141 -2.256 1.00 0.00 H new ATOM 0 HB THR A 139 105.679 3.547 0.726 1.00 0.00 H new ATOM 0 HG1 THR A 139 106.941 5.507 0.683 1.00 0.00 H new ATOM 0 HG21 THR A 139 108.093 3.450 0.190 1.00 0.00 H new ATOM 0 HG22 THR A 139 107.180 2.234 -0.735 1.00 0.00 H new ATOM 0 HG23 THR A 139 107.724 3.731 -1.528 1.00 0.00 H new ATOM 2081 N TRP A 140 105.199 1.673 -2.498 1.00 0.00 N ATOM 2082 CA TRP A 140 105.043 0.227 -2.677 1.00 0.00 C ATOM 2083 C TRP A 140 106.421 -0.414 -2.786 1.00 0.00 C ATOM 2084 O TRP A 140 107.272 0.087 -3.518 1.00 0.00 O ATOM 2085 CB TRP A 140 104.226 -0.068 -3.934 1.00 0.00 C ATOM 2086 CG TRP A 140 104.872 0.406 -5.198 1.00 0.00 C ATOM 2087 CD1 TRP A 140 104.727 1.641 -5.727 1.00 0.00 C ATOM 2088 CD2 TRP A 140 105.755 -0.325 -6.099 1.00 0.00 C ATOM 2089 NE1 TRP A 140 105.463 1.717 -6.896 1.00 0.00 N ATOM 2090 CE2 TRP A 140 106.117 0.532 -7.167 1.00 0.00 C ATOM 2091 CE3 TRP A 140 106.274 -1.632 -6.091 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 106.962 0.104 -8.193 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 107.124 -2.065 -7.121 1.00 0.00 C ATOM 2094 CH2 TRP A 140 107.467 -1.200 -8.168 1.00 0.00 C ATOM 0 H TRP A 140 105.726 2.138 -3.238 1.00 0.00 H new ATOM 0 HA TRP A 140 104.514 -0.188 -1.819 1.00 0.00 H new ATOM 0 HB2 TRP A 140 104.058 -1.143 -4.003 1.00 0.00 H new ATOM 0 HB3 TRP A 140 103.247 0.402 -3.839 1.00 0.00 H new ATOM 0 HD1 TRP A 140 104.133 2.439 -5.306 1.00 0.00 H new ATOM 0 HE1 TRP A 140 105.516 2.548 -7.486 1.00 0.00 H new ATOM 0 HE3 TRP A 140 106.017 -2.307 -5.288 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.223 0.774 -8.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 107.516 -3.071 -7.106 1.00 0.00 H new ATOM 0 HH2 TRP A 140 108.122 -1.540 -8.957 1.00 0.00 H new ATOM 2105 N ILE A 141 106.639 -1.517 -2.064 1.00 0.00 N ATOM 2106 CA ILE A 141 107.970 -2.116 -1.982 1.00 0.00 C ATOM 2107 C ILE A 141 107.917 -3.622 -2.238 1.00 0.00 C ATOM 2108 O ILE A 141 106.954 -4.289 -1.860 1.00 0.00 O ATOM 2109 CB ILE A 141 108.566 -1.835 -0.594 1.00 0.00 C ATOM 2110 CG1 ILE A 141 109.995 -2.386 -0.511 1.00 0.00 C ATOM 2111 CG2 ILE A 141 107.709 -2.484 0.496 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.708 -1.782 0.697 1.00 0.00 C ATOM 0 H ILE A 141 105.918 -2.007 -1.534 1.00 0.00 H new ATOM 0 HA ILE A 141 108.601 -1.671 -2.752 1.00 0.00 H new ATOM 0 HB ILE A 141 108.584 -0.756 -0.441 1.00 0.00 H new ATOM 0 HG12 ILE A 141 109.972 -3.472 -0.427 1.00 0.00 H new ATOM 0 HG13 ILE A 141 110.541 -2.149 -1.424 1.00 0.00 H new ATOM 0 HG21 ILE A 141 108.144 -2.276 1.473 1.00 0.00 H new ATOM 0 HG22 ILE A 141 106.699 -2.077 0.455 1.00 0.00 H new ATOM 0 HG23 ILE A 141 107.673 -3.562 0.337 1.00 0.00 H new ATOM 0 HD11 ILE A 141 111.723 -2.175 0.754 1.00 0.00 H new ATOM 0 HD12 ILE A 141 110.744 -0.698 0.594 1.00 0.00 H new ATOM 0 HD13 ILE A 141 110.167 -2.042 1.607 1.00 0.00 H new ATOM 2124 N ALA A 142 108.970 -4.140 -2.863 1.00 0.00 N ATOM 2125 CA ALA A 142 109.116 -5.580 -3.058 1.00 0.00 C ATOM 2126 C ALA A 142 110.444 -6.028 -2.461 1.00 0.00 C ATOM 2127 O ALA A 142 111.466 -5.374 -2.679 1.00 0.00 O ATOM 2128 CB ALA A 142 109.078 -5.917 -4.549 1.00 0.00 C ATOM 0 H ALA A 142 109.736 -3.584 -3.244 1.00 0.00 H new ATOM 0 HA ALA A 142 108.295 -6.099 -2.563 1.00 0.00 H new ATOM 0 HB1 ALA A 142 109.188 -6.993 -4.682 1.00 0.00 H new ATOM 0 HB2 ALA A 142 108.126 -5.595 -4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 142 109.893 -5.404 -5.059 1.00 0.00 H new ATOM 2134 N GLY A 143 110.435 -7.121 -1.700 1.00 0.00 N ATOM 2135 CA GLY A 143 111.647 -7.560 -1.010 1.00 0.00 C ATOM 2136 C GLY A 143 111.842 -9.068 -1.099 1.00 0.00 C ATOM 2137 O GLY A 143 110.879 -9.827 -1.209 1.00 0.00 O ATOM 0 H GLY A 143 109.617 -7.710 -1.547 1.00 0.00 H new ATOM 0 HA2 GLY A 143 112.512 -7.057 -1.442 1.00 0.00 H new ATOM 0 HA3 GLY A 143 111.595 -7.263 0.037 1.00 0.00 H new ATOM 2141 N VAL A 144 113.104 -9.480 -1.019 1.00 0.00 N ATOM 2142 CA VAL A 144 113.470 -10.891 -1.059 1.00 0.00 C ATOM 2143 C VAL A 144 114.163 -11.243 0.252 1.00 0.00 C ATOM 2144 O VAL A 144 114.932 -10.436 0.772 1.00 0.00 O ATOM 2145 CB VAL A 144 114.415 -11.163 -2.234 1.00 0.00 C ATOM 2146 CG1 VAL A 144 114.716 -12.662 -2.311 1.00 0.00 C ATOM 2147 CG2 VAL A 144 113.758 -10.713 -3.544 1.00 0.00 C ATOM 0 H VAL A 144 113.898 -8.847 -0.925 1.00 0.00 H new ATOM 0 HA VAL A 144 112.576 -11.500 -1.191 1.00 0.00 H new ATOM 0 HB VAL A 144 115.341 -10.608 -2.083 1.00 0.00 H new ATOM 0 HG11 VAL A 144 115.388 -12.856 -3.147 1.00 0.00 H new ATOM 0 HG12 VAL A 144 115.188 -12.987 -1.383 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.787 -13.213 -2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 144 114.434 -10.909 -4.376 1.00 0.00 H new ATOM 0 HG22 VAL A 144 112.830 -11.264 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A 144 113.542 -9.646 -3.495 1.00 0.00 H new ATOM 2157 N GLY A 145 113.873 -12.421 0.800 1.00 0.00 N ATOM 2158 CA GLY A 145 114.378 -12.767 2.126 1.00 0.00 C ATOM 2159 C GLY A 145 114.859 -14.209 2.233 1.00 0.00 C ATOM 2160 O GLY A 145 114.522 -15.069 1.412 1.00 0.00 O ATOM 0 H GLY A 145 113.302 -13.140 0.356 1.00 0.00 H new ATOM 0 HA2 GLY A 145 115.200 -12.098 2.380 1.00 0.00 H new ATOM 0 HA3 GLY A 145 113.591 -12.599 2.862 1.00 0.00 H new ATOM 2164 N TYR A 146 115.620 -14.437 3.303 1.00 0.00 N ATOM 2165 CA TYR A 146 116.209 -15.734 3.615 1.00 0.00 C ATOM 2166 C TYR A 146 115.983 -16.034 5.096 1.00 0.00 C ATOM 2167 O TYR A 146 115.879 -15.110 5.901 1.00 0.00 O ATOM 2168 CB TYR A 146 117.713 -15.689 3.318 1.00 0.00 C ATOM 2169 CG TYR A 146 118.469 -16.929 3.733 1.00 0.00 C ATOM 2170 CD1 TYR A 146 118.624 -17.994 2.839 1.00 0.00 C ATOM 2171 CD2 TYR A 146 119.022 -17.006 5.017 1.00 0.00 C ATOM 2172 CE1 TYR A 146 119.331 -19.138 3.231 1.00 0.00 C ATOM 2173 CE2 TYR A 146 119.727 -18.151 5.408 1.00 0.00 C ATOM 2174 CZ TYR A 146 119.882 -19.216 4.515 1.00 0.00 C ATOM 2175 OH TYR A 146 120.577 -20.343 4.899 1.00 0.00 O ATOM 0 H TYR A 146 115.846 -13.714 3.986 1.00 0.00 H new ATOM 0 HA TYR A 146 115.746 -16.513 3.009 1.00 0.00 H new ATOM 0 HB2 TYR A 146 117.855 -15.533 2.249 1.00 0.00 H new ATOM 0 HB3 TYR A 146 118.146 -14.827 3.826 1.00 0.00 H new ATOM 0 HD1 TYR A 146 118.199 -17.934 1.848 1.00 0.00 H new ATOM 0 HD2 TYR A 146 118.905 -16.182 5.706 1.00 0.00 H new ATOM 0 HE1 TYR A 146 119.451 -19.961 2.542 1.00 0.00 H new ATOM 0 HE2 TYR A 146 120.151 -18.212 6.399 1.00 0.00 H new ATOM 0 HH TYR A 146 120.894 -20.234 5.820 1.00 0.00 H new ATOM 2185 N ARG A 147 115.917 -17.313 5.453 1.00 0.00 N ATOM 2186 CA ARG A 147 115.697 -17.698 6.845 1.00 0.00 C ATOM 2187 C ARG A 147 116.612 -18.852 7.250 1.00 0.00 C ATOM 2188 O ARG A 147 116.967 -19.694 6.427 1.00 0.00 O ATOM 2189 CB ARG A 147 114.224 -18.075 7.058 1.00 0.00 C ATOM 2190 CG ARG A 147 113.861 -19.322 6.245 1.00 0.00 C ATOM 2191 CD ARG A 147 112.351 -19.559 6.324 1.00 0.00 C ATOM 2192 NE ARG A 147 111.999 -20.818 5.663 1.00 0.00 N ATOM 2193 CZ ARG A 147 110.759 -21.330 5.660 1.00 0.00 C ATOM 2194 NH1 ARG A 147 109.755 -20.739 6.260 1.00 0.00 N ATOM 2195 NH2 ARG A 147 110.546 -22.460 5.041 1.00 0.00 N ATOM 0 H ARG A 147 116.012 -18.095 4.805 1.00 0.00 H new ATOM 0 HA ARG A 147 115.939 -16.846 7.479 1.00 0.00 H new ATOM 0 HB2 ARG A 147 114.040 -18.259 8.117 1.00 0.00 H new ATOM 0 HB3 ARG A 147 113.584 -17.243 6.763 1.00 0.00 H new ATOM 0 HG2 ARG A 147 114.166 -19.194 5.206 1.00 0.00 H new ATOM 0 HG3 ARG A 147 114.397 -20.189 6.630 1.00 0.00 H new ATOM 0 HD2 ARG A 147 112.034 -19.587 7.367 1.00 0.00 H new ATOM 0 HD3 ARG A 147 111.821 -18.732 5.852 1.00 0.00 H new ATOM 0 HE ARG A 147 112.735 -21.332 5.180 1.00 0.00 H new ATOM 0 HH11 ARG A 147 109.902 -19.858 6.752 1.00 0.00 H new ATOM 0 HH12 ARG A 147 108.826 -21.160 6.235 1.00 0.00 H new ATOM 0 HH21 ARG A 147 111.315 -22.937 4.571 1.00 0.00 H new ATOM 0 HH22 ARG A 147 109.610 -22.866 5.027 1.00 0.00 H new ATOM 2209 N PHE A 148 116.989 -18.882 8.525 1.00 0.00 N ATOM 2210 CA PHE A 148 117.869 -19.932 9.027 1.00 0.00 C ATOM 2211 C PHE A 148 117.053 -21.088 9.593 1.00 0.00 C ATOM 2212 O PHE A 148 116.298 -20.857 10.523 1.00 0.00 O ATOM 2213 CB PHE A 148 118.785 -19.372 10.114 1.00 0.00 C ATOM 2214 CG PHE A 148 119.741 -18.317 9.609 1.00 0.00 C ATOM 2215 CD1 PHE A 148 119.370 -16.968 9.620 1.00 0.00 C ATOM 2216 CD2 PHE A 148 121.004 -18.689 9.129 1.00 0.00 C ATOM 2217 CE1 PHE A 148 120.256 -15.991 9.152 1.00 0.00 C ATOM 2218 CE2 PHE A 148 121.891 -17.713 8.662 1.00 0.00 C ATOM 2219 CZ PHE A 148 121.517 -16.364 8.673 1.00 0.00 C ATOM 2220 OXT PHE A 148 117.194 -22.191 9.089 1.00 0.00 O ATOM 0 H PHE A 148 116.702 -18.197 9.224 1.00 0.00 H new ATOM 0 HA PHE A 148 118.474 -20.300 8.198 1.00 0.00 H new ATOM 0 HB2 PHE A 148 118.174 -18.947 10.910 1.00 0.00 H new ATOM 0 HB3 PHE A 148 119.357 -20.189 10.553 1.00 0.00 H new ATOM 0 HD1 PHE A 148 118.397 -16.680 9.991 1.00 0.00 H new ATOM 0 HD2 PHE A 148 121.293 -19.730 9.120 1.00 0.00 H new ATOM 0 HE1 PHE A 148 119.967 -14.950 9.160 1.00 0.00 H new ATOM 0 HE2 PHE A 148 122.864 -18.000 8.293 1.00 0.00 H new ATOM 0 HZ PHE A 148 122.202 -15.611 8.312 1.00 0.00 H new TER 2230 PHE A 148