USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1038 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 85 SER OG : rot -49:sc= -1.1 USER MOD Set 1.2: A 87 ASN : amide:sc= -2.66 K(o=-3.8,f=-14!) USER MOD Set 2.1: A 63 SER OG : rot -57:sc= 1.11 USER MOD Set 2.2: A 66 ASN : amide:sc= 1.43 K(o=2.5,f=-8.4!) USER MOD Set 3.1: A 0 HIS : no HD1:sc= 0 X(o=0,f=0.086) USER MOD Set 3.2: A -2 HIS : no HD1:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A -3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl -154:sc= -0.164 (180deg=-1.33) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -152:sc= 0.0187 (180deg=-1.48) USER MOD Single : A 22 GLN : amide:sc= -0.0195 K(o=-0.019,f=-0.87) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0.0121 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0791) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0.0577 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -12:sc= -0.84 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -0.913 K(o=-0.91,f=-2.4!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -76:sc= 0.205 USER MOD Single : A 77 HIS : no HD1:sc= -2 K(o=-2,f=-4.3!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 168:sc= 0.0307 USER MOD Single : A 101 ASN : amide:sc= -2.32 K(o=-2.3,f=-7.5!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc=-0.00516 X(o=-0.0052,f=-0.11) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 171:sc= -0.748 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 76:sc= 0.369 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 82:sc= -0.391 USER MOD Single : A 136 ASN : amide:sc= -0.0134 K(o=-0.013,f=-1.4!) USER MOD Single : A 140 LYS NZ :NH3+ 140:sc= -0.142 (180deg=-0.977) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 122.282 37.970 -29.362 1.00 0.00 N ATOM 2 CA HIS A -5 121.456 37.177 -28.409 1.00 0.00 C ATOM 3 C HIS A -5 119.982 37.499 -28.629 1.00 0.00 C ATOM 4 O HIS A -5 119.514 38.583 -28.277 1.00 0.00 O ATOM 5 CB HIS A -5 121.859 37.526 -26.976 1.00 0.00 C ATOM 6 CG HIS A -5 121.164 36.689 -25.938 1.00 0.00 C ATOM 7 ND1 HIS A -5 121.385 35.326 -25.818 1.00 0.00 N ATOM 8 CD2 HIS A -5 120.249 37.007 -24.963 1.00 0.00 C ATOM 9 CE1 HIS A -5 120.620 34.878 -24.806 1.00 0.00 C ATOM 10 NE2 HIS A -5 119.909 35.861 -24.249 1.00 0.00 N ATOM 0 H1 HIS A -5 123.288 37.752 -29.214 1.00 0.00 H new ATOM 0 H2 HIS A -5 122.015 37.728 -30.338 1.00 0.00 H new ATOM 0 H3 HIS A -5 122.120 38.985 -29.201 1.00 0.00 H new ATOM 0 HA HIS A -5 121.619 36.112 -28.577 1.00 0.00 H new ATOM 0 HB2 HIS A -5 122.937 37.402 -26.869 1.00 0.00 H new ATOM 0 HB3 HIS A -5 121.639 38.577 -26.791 1.00 0.00 H new ATOM 0 HD2 HIS A -5 119.854 37.995 -24.779 1.00 0.00 H new ATOM 0 HE1 HIS A -5 120.585 33.848 -24.483 1.00 0.00 H new ATOM 0 HE2 HIS A -5 119.257 35.788 -23.468 1.00 0.00 H new ATOM 20 N HIS A -4 119.254 36.552 -29.213 1.00 0.00 N ATOM 21 CA HIS A -4 117.829 36.737 -29.482 1.00 0.00 C ATOM 22 C HIS A -4 117.005 35.690 -28.741 1.00 0.00 C ATOM 23 O HIS A -4 117.399 34.527 -28.647 1.00 0.00 O ATOM 24 CB HIS A -4 117.566 36.622 -30.985 1.00 0.00 C ATOM 25 CG HIS A -4 118.230 37.703 -31.794 1.00 0.00 C ATOM 26 ND1 HIS A -4 119.494 37.544 -32.342 1.00 0.00 N ATOM 27 CD2 HIS A -4 117.820 38.962 -32.155 1.00 0.00 C ATOM 28 CE1 HIS A -4 119.796 38.679 -32.997 1.00 0.00 C ATOM 29 NE2 HIS A -4 118.811 39.577 -32.915 1.00 0.00 N ATOM 0 H HIS A -4 119.625 35.649 -29.509 1.00 0.00 H new ATOM 0 HA HIS A -4 117.536 37.728 -29.134 1.00 0.00 H new ATOM 0 HB2 HIS A -4 117.916 35.651 -31.334 1.00 0.00 H new ATOM 0 HB3 HIS A -4 116.491 36.655 -31.161 1.00 0.00 H new ATOM 0 HD2 HIS A -4 116.873 39.408 -31.890 1.00 0.00 H new ATOM 0 HE1 HIS A -4 120.723 38.844 -33.526 1.00 0.00 H new ATOM 0 HE2 HIS A -4 118.789 40.512 -33.322 1.00 0.00 H new ATOM 37 N HIS A -3 115.857 36.110 -28.215 1.00 0.00 N ATOM 38 CA HIS A -3 114.976 35.207 -27.479 1.00 0.00 C ATOM 39 C HIS A -3 113.581 35.204 -28.095 1.00 0.00 C ATOM 40 O HIS A -3 113.045 36.254 -28.450 1.00 0.00 O ATOM 41 CB HIS A -3 114.886 35.646 -26.017 1.00 0.00 C ATOM 42 CG HIS A -3 114.058 34.724 -25.165 1.00 0.00 C ATOM 43 ND1 HIS A -3 114.443 33.419 -24.899 1.00 0.00 N ATOM 44 CD2 HIS A -3 112.863 34.902 -24.511 1.00 0.00 C ATOM 45 CE1 HIS A -3 113.498 32.868 -24.118 1.00 0.00 C ATOM 46 NE2 HIS A -3 112.511 33.727 -23.850 1.00 0.00 N ATOM 0 H HIS A -3 115.515 37.069 -28.285 1.00 0.00 H new ATOM 0 HA HIS A -3 115.389 34.200 -27.533 1.00 0.00 H new ATOM 0 HB2 HIS A -3 115.892 35.707 -25.601 1.00 0.00 H new ATOM 0 HB3 HIS A -3 114.461 36.649 -25.972 1.00 0.00 H new ATOM 0 HD2 HIS A -3 112.284 35.814 -24.509 1.00 0.00 H new ATOM 0 HE1 HIS A -3 113.533 31.853 -23.751 1.00 0.00 H new ATOM 0 HE2 HIS A -3 111.679 33.559 -23.284 1.00 0.00 H new ATOM 54 N HIS A -2 112.998 34.015 -28.221 1.00 0.00 N ATOM 55 CA HIS A -2 111.663 33.875 -28.799 1.00 0.00 C ATOM 56 C HIS A -2 110.745 33.121 -27.841 1.00 0.00 C ATOM 57 O HIS A -2 111.179 32.206 -27.142 1.00 0.00 O ATOM 58 CB HIS A -2 111.748 33.120 -30.126 1.00 0.00 C ATOM 59 CG HIS A -2 110.442 33.071 -30.871 1.00 0.00 C ATOM 60 ND1 HIS A -2 109.547 32.022 -30.729 1.00 0.00 N ATOM 61 CD2 HIS A -2 109.865 33.935 -31.769 1.00 0.00 C ATOM 62 CE1 HIS A -2 108.492 32.278 -31.522 1.00 0.00 C ATOM 63 NE2 HIS A -2 108.633 33.432 -32.179 1.00 0.00 N ATOM 0 H HIS A -2 113.427 33.136 -27.932 1.00 0.00 H new ATOM 0 HA HIS A -2 111.253 34.870 -28.972 1.00 0.00 H new ATOM 0 HB2 HIS A -2 112.500 33.593 -30.757 1.00 0.00 H new ATOM 0 HB3 HIS A -2 112.087 32.102 -29.935 1.00 0.00 H new ATOM 0 HD2 HIS A -2 110.301 34.864 -32.106 1.00 0.00 H new ATOM 0 HE1 HIS A -2 107.634 31.629 -31.616 1.00 0.00 H new ATOM 0 HE2 HIS A -2 107.979 33.854 -32.839 1.00 0.00 H new ATOM 71 N HIS A -1 109.474 33.513 -27.816 1.00 0.00 N ATOM 72 CA HIS A -1 108.497 32.884 -26.929 1.00 0.00 C ATOM 73 C HIS A -1 107.376 32.240 -27.739 1.00 0.00 C ATOM 74 O HIS A -1 106.903 32.807 -28.724 1.00 0.00 O ATOM 75 CB HIS A -1 107.906 33.930 -25.985 1.00 0.00 C ATOM 76 CG HIS A -1 106.909 33.363 -25.011 1.00 0.00 C ATOM 77 ND1 HIS A -1 105.546 33.365 -25.262 1.00 0.00 N ATOM 78 CD2 HIS A -1 107.062 32.771 -23.780 1.00 0.00 C ATOM 79 CE1 HIS A -1 104.937 32.792 -24.208 1.00 0.00 C ATOM 80 NE2 HIS A -1 105.814 32.411 -23.275 1.00 0.00 N ATOM 0 H HIS A -1 109.096 34.261 -28.398 1.00 0.00 H new ATOM 0 HA HIS A -1 109.002 32.112 -26.349 1.00 0.00 H new ATOM 0 HB2 HIS A -1 108.715 34.405 -25.430 1.00 0.00 H new ATOM 0 HB3 HIS A -1 107.423 34.709 -26.575 1.00 0.00 H new ATOM 0 HD2 HIS A -1 108.006 32.609 -23.280 1.00 0.00 H new ATOM 0 HE1 HIS A -1 103.869 32.656 -24.126 1.00 0.00 H new ATOM 0 HE2 HIS A -1 105.613 31.955 -22.385 1.00 0.00 H new ATOM 88 N HIS A 0 106.955 31.051 -27.316 1.00 0.00 N ATOM 89 CA HIS A 0 105.888 30.328 -28.003 1.00 0.00 C ATOM 90 C HIS A 0 104.642 30.258 -27.127 1.00 0.00 C ATOM 91 O HIS A 0 104.734 30.059 -25.915 1.00 0.00 O ATOM 92 CB HIS A 0 106.353 28.910 -28.337 1.00 0.00 C ATOM 93 CG HIS A 0 107.509 28.868 -29.300 1.00 0.00 C ATOM 94 ND1 HIS A 0 108.825 28.801 -28.872 1.00 0.00 N ATOM 95 CD2 HIS A 0 107.562 28.881 -30.673 1.00 0.00 C ATOM 96 CE1 HIS A 0 109.607 28.776 -29.965 1.00 0.00 C ATOM 97 NE2 HIS A 0 108.889 28.822 -31.090 1.00 0.00 N ATOM 0 H HIS A 0 107.336 30.568 -26.502 1.00 0.00 H new ATOM 0 HA HIS A 0 105.646 30.860 -28.923 1.00 0.00 H new ATOM 0 HB2 HIS A 0 106.640 28.404 -27.415 1.00 0.00 H new ATOM 0 HB3 HIS A 0 105.517 28.352 -28.760 1.00 0.00 H new ATOM 0 HD2 HIS A 0 106.705 28.930 -31.329 1.00 0.00 H new ATOM 0 HE1 HIS A 0 110.685 28.725 -29.937 1.00 0.00 H new ATOM 0 HE2 HIS A 0 109.238 28.815 -32.049 1.00 0.00 H new ATOM 105 N SER A 1 103.477 30.421 -27.748 1.00 0.00 N ATOM 106 CA SER A 1 102.209 30.376 -27.023 1.00 0.00 C ATOM 107 C SER A 1 101.365 29.198 -27.496 1.00 0.00 C ATOM 108 O SER A 1 101.348 28.870 -28.682 1.00 0.00 O ATOM 109 CB SER A 1 101.438 31.677 -27.246 1.00 0.00 C ATOM 110 OG SER A 1 100.265 31.667 -26.442 1.00 0.00 O ATOM 0 H SER A 1 103.384 30.585 -28.750 1.00 0.00 H new ATOM 0 HA SER A 1 102.421 30.254 -25.961 1.00 0.00 H new ATOM 0 HB2 SER A 1 102.062 32.533 -26.989 1.00 0.00 H new ATOM 0 HB3 SER A 1 101.172 31.781 -28.298 1.00 0.00 H new ATOM 0 HG SER A 1 99.767 32.500 -26.579 1.00 0.00 H new ATOM 116 N SER A 2 100.665 28.563 -26.559 1.00 0.00 N ATOM 117 CA SER A 2 99.823 27.419 -26.891 1.00 0.00 C ATOM 118 C SER A 2 98.519 27.467 -26.101 1.00 0.00 C ATOM 119 O SER A 2 98.420 28.161 -25.089 1.00 0.00 O ATOM 120 CB SER A 2 100.565 26.119 -26.577 1.00 0.00 C ATOM 121 OG SER A 2 100.717 25.998 -25.169 1.00 0.00 O ATOM 0 H SER A 2 100.664 28.819 -25.572 1.00 0.00 H new ATOM 0 HA SER A 2 99.591 27.457 -27.955 1.00 0.00 H new ATOM 0 HB2 SER A 2 100.012 25.266 -26.970 1.00 0.00 H new ATOM 0 HB3 SER A 2 101.541 26.117 -27.062 1.00 0.00 H new ATOM 0 HG SER A 2 101.191 25.165 -24.961 1.00 0.00 H new ATOM 127 N GLY A 3 97.522 26.723 -26.570 1.00 0.00 N ATOM 128 CA GLY A 3 96.230 26.684 -25.896 1.00 0.00 C ATOM 129 C GLY A 3 95.393 25.508 -26.390 1.00 0.00 C ATOM 130 O GLY A 3 95.842 24.722 -27.224 1.00 0.00 O ATOM 0 H GLY A 3 97.583 26.144 -27.407 1.00 0.00 H new ATOM 0 HA2 GLY A 3 96.379 26.602 -24.819 1.00 0.00 H new ATOM 0 HA3 GLY A 3 95.694 27.617 -26.074 1.00 0.00 H new ATOM 134 N LEU A 4 94.175 25.394 -25.868 1.00 0.00 N ATOM 135 CA LEU A 4 93.283 24.307 -26.257 1.00 0.00 C ATOM 136 C LEU A 4 92.228 24.807 -27.239 1.00 0.00 C ATOM 137 O LEU A 4 91.559 25.810 -26.988 1.00 0.00 O ATOM 138 CB LEU A 4 92.597 23.730 -25.017 1.00 0.00 C ATOM 139 CG LEU A 4 91.782 22.495 -25.407 1.00 0.00 C ATOM 140 CD1 LEU A 4 92.730 21.342 -25.743 1.00 0.00 C ATOM 141 CD2 LEU A 4 90.884 22.089 -24.237 1.00 0.00 C ATOM 0 H LEU A 4 93.785 26.037 -25.179 1.00 0.00 H new ATOM 0 HA LEU A 4 93.874 23.529 -26.741 1.00 0.00 H new ATOM 0 HB2 LEU A 4 93.343 23.464 -24.268 1.00 0.00 H new ATOM 0 HB3 LEU A 4 91.946 24.480 -24.567 1.00 0.00 H new ATOM 0 HG LEU A 4 91.167 22.725 -26.277 1.00 0.00 H new ATOM 0 HD11 LEU A 4 92.149 20.462 -26.021 1.00 0.00 H new ATOM 0 HD12 LEU A 4 93.373 21.630 -26.575 1.00 0.00 H new ATOM 0 HD13 LEU A 4 93.345 21.111 -24.873 1.00 0.00 H new ATOM 0 HD21 LEU A 4 90.302 21.209 -24.513 1.00 0.00 H new ATOM 0 HD22 LEU A 4 91.500 21.859 -23.368 1.00 0.00 H new ATOM 0 HD23 LEU A 4 90.208 22.909 -23.995 1.00 0.00 H new ATOM 153 N VAL A 5 92.085 24.102 -28.356 1.00 0.00 N ATOM 154 CA VAL A 5 91.099 24.475 -29.365 1.00 0.00 C ATOM 155 C VAL A 5 90.418 23.230 -29.938 1.00 0.00 C ATOM 156 O VAL A 5 90.974 22.134 -29.853 1.00 0.00 O ATOM 157 CB VAL A 5 91.772 25.259 -30.495 1.00 0.00 C ATOM 158 CG1 VAL A 5 92.370 26.550 -29.934 1.00 0.00 C ATOM 159 CG2 VAL A 5 92.886 24.412 -31.116 1.00 0.00 C ATOM 0 H VAL A 5 92.635 23.274 -28.585 1.00 0.00 H new ATOM 0 HA VAL A 5 90.344 25.102 -28.891 1.00 0.00 H new ATOM 0 HB VAL A 5 91.031 25.500 -31.258 1.00 0.00 H new ATOM 0 HG11 VAL A 5 92.849 27.108 -30.738 1.00 0.00 H new ATOM 0 HG12 VAL A 5 91.579 27.156 -29.493 1.00 0.00 H new ATOM 0 HG13 VAL A 5 93.109 26.307 -29.171 1.00 0.00 H new ATOM 0 HG21 VAL A 5 93.364 24.972 -31.920 1.00 0.00 H new ATOM 0 HG22 VAL A 5 93.626 24.169 -30.354 1.00 0.00 H new ATOM 0 HG23 VAL A 5 92.462 23.491 -31.517 1.00 0.00 H new ATOM 169 N PRO A 6 89.240 23.359 -30.513 1.00 0.00 N ATOM 170 CA PRO A 6 88.528 22.191 -31.108 1.00 0.00 C ATOM 171 C PRO A 6 88.965 21.923 -32.545 1.00 0.00 C ATOM 172 O PRO A 6 89.004 22.834 -33.371 1.00 0.00 O ATOM 173 CB PRO A 6 87.060 22.610 -31.052 1.00 0.00 C ATOM 174 CG PRO A 6 87.071 24.096 -31.179 1.00 0.00 C ATOM 175 CD PRO A 6 88.431 24.587 -30.671 1.00 0.00 C ATOM 0 HA PRO A 6 88.736 21.263 -30.575 1.00 0.00 H new ATOM 0 HB2 PRO A 6 86.489 22.150 -31.858 1.00 0.00 H new ATOM 0 HB3 PRO A 6 86.597 22.298 -30.116 1.00 0.00 H new ATOM 0 HG2 PRO A 6 86.918 24.394 -32.216 1.00 0.00 H new ATOM 0 HG3 PRO A 6 86.261 24.537 -30.598 1.00 0.00 H new ATOM 0 HD2 PRO A 6 88.892 25.276 -31.378 1.00 0.00 H new ATOM 0 HD3 PRO A 6 88.331 25.120 -29.725 1.00 0.00 H new ATOM 183 N ARG A 7 89.295 20.666 -32.835 1.00 0.00 N ATOM 184 CA ARG A 7 89.733 20.282 -34.175 1.00 0.00 C ATOM 185 C ARG A 7 88.857 19.160 -34.723 1.00 0.00 C ATOM 186 O ARG A 7 88.385 18.304 -33.975 1.00 0.00 O ATOM 187 CB ARG A 7 91.189 19.817 -34.134 1.00 0.00 C ATOM 188 CG ARG A 7 92.084 20.978 -33.691 1.00 0.00 C ATOM 189 CD ARG A 7 93.549 20.542 -33.746 1.00 0.00 C ATOM 190 NE ARG A 7 94.404 21.566 -33.137 1.00 0.00 N ATOM 191 CZ ARG A 7 94.699 22.733 -33.731 1.00 0.00 C ATOM 192 NH1 ARG A 7 94.238 23.050 -34.917 1.00 0.00 N ATOM 193 NH2 ARG A 7 95.470 23.580 -33.107 1.00 0.00 N ATOM 0 H ARG A 7 89.268 19.899 -32.163 1.00 0.00 H new ATOM 0 HA ARG A 7 89.646 21.150 -34.828 1.00 0.00 H new ATOM 0 HB2 ARG A 7 91.295 18.979 -33.445 1.00 0.00 H new ATOM 0 HB3 ARG A 7 91.496 19.462 -35.118 1.00 0.00 H new ATOM 0 HG2 ARG A 7 91.926 21.841 -34.338 1.00 0.00 H new ATOM 0 HG3 ARG A 7 91.823 21.287 -32.679 1.00 0.00 H new ATOM 0 HD2 ARG A 7 93.674 19.594 -33.222 1.00 0.00 H new ATOM 0 HD3 ARG A 7 93.848 20.376 -34.781 1.00 0.00 H new ATOM 0 HE ARG A 7 94.795 21.382 -32.213 1.00 0.00 H new ATOM 0 HH11 ARG A 7 93.634 22.400 -35.420 1.00 0.00 H new ATOM 0 HH12 ARG A 7 94.484 23.946 -35.337 1.00 0.00 H new ATOM 0 HH21 ARG A 7 95.838 23.350 -32.184 1.00 0.00 H new ATOM 0 HH22 ARG A 7 95.705 24.472 -33.542 1.00 0.00 H new ATOM 207 N GLY A 8 88.646 19.171 -36.035 1.00 0.00 N ATOM 208 CA GLY A 8 87.833 18.145 -36.679 1.00 0.00 C ATOM 209 C GLY A 8 87.717 18.405 -38.177 1.00 0.00 C ATOM 210 O GLY A 8 88.315 19.345 -38.701 1.00 0.00 O ATOM 0 H GLY A 8 89.024 19.874 -36.670 1.00 0.00 H new ATOM 0 HA2 GLY A 8 88.277 17.164 -36.509 1.00 0.00 H new ATOM 0 HA3 GLY A 8 86.840 18.128 -36.231 1.00 0.00 H new ATOM 214 N SER A 9 86.943 17.568 -38.862 1.00 0.00 N ATOM 215 CA SER A 9 86.750 17.723 -40.299 1.00 0.00 C ATOM 216 C SER A 9 85.292 17.474 -40.674 1.00 0.00 C ATOM 217 O SER A 9 84.567 16.787 -39.955 1.00 0.00 O ATOM 218 CB SER A 9 87.648 16.744 -41.055 1.00 0.00 C ATOM 219 OG SER A 9 87.203 15.417 -40.807 1.00 0.00 O ATOM 0 H SER A 9 86.443 16.781 -38.448 1.00 0.00 H new ATOM 0 HA SER A 9 87.014 18.744 -40.574 1.00 0.00 H new ATOM 0 HB2 SER A 9 87.620 16.956 -42.124 1.00 0.00 H new ATOM 0 HB3 SER A 9 88.683 16.859 -40.734 1.00 0.00 H new ATOM 0 HG SER A 9 87.774 14.785 -41.291 1.00 0.00 H new ATOM 225 N GLY A 10 84.873 18.034 -41.803 1.00 0.00 N ATOM 226 CA GLY A 10 83.502 17.858 -42.268 1.00 0.00 C ATOM 227 C GLY A 10 83.114 18.958 -43.251 1.00 0.00 C ATOM 228 O GLY A 10 83.933 19.806 -43.604 1.00 0.00 O ATOM 0 H GLY A 10 85.458 18.609 -42.409 1.00 0.00 H new ATOM 0 HA2 GLY A 10 83.399 16.884 -42.747 1.00 0.00 H new ATOM 0 HA3 GLY A 10 82.821 17.869 -41.417 1.00 0.00 H new ATOM 232 N MET A 11 81.858 18.936 -43.688 1.00 0.00 N ATOM 233 CA MET A 11 81.358 19.945 -44.619 1.00 0.00 C ATOM 234 C MET A 11 80.056 20.541 -44.094 1.00 0.00 C ATOM 235 O MET A 11 79.314 19.887 -43.361 1.00 0.00 O ATOM 236 CB MET A 11 81.109 19.311 -45.992 1.00 0.00 C ATOM 237 CG MET A 11 82.398 18.683 -46.535 1.00 0.00 C ATOM 238 SD MET A 11 83.707 19.930 -46.664 1.00 0.00 S ATOM 239 CE MET A 11 82.897 20.993 -47.885 1.00 0.00 C ATOM 0 H MET A 11 81.170 18.234 -43.414 1.00 0.00 H new ATOM 0 HA MET A 11 82.104 20.734 -44.714 1.00 0.00 H new ATOM 0 HB2 MET A 11 80.332 18.550 -45.912 1.00 0.00 H new ATOM 0 HB3 MET A 11 80.745 20.067 -46.688 1.00 0.00 H new ATOM 0 HG2 MET A 11 82.721 17.875 -45.878 1.00 0.00 H new ATOM 0 HG3 MET A 11 82.210 18.242 -47.514 1.00 0.00 H new ATOM 0 HE1 MET A 11 83.652 21.541 -48.448 1.00 0.00 H new ATOM 0 HE2 MET A 11 82.309 20.380 -48.568 1.00 0.00 H new ATOM 0 HE3 MET A 11 82.241 21.699 -47.375 1.00 0.00 H new ATOM 249 N LYS A 12 79.784 21.785 -44.473 1.00 0.00 N ATOM 250 CA LYS A 12 78.569 22.458 -44.026 1.00 0.00 C ATOM 251 C LYS A 12 77.465 22.325 -45.071 1.00 0.00 C ATOM 252 O LYS A 12 77.702 22.504 -46.266 1.00 0.00 O ATOM 253 CB LYS A 12 78.856 23.938 -43.768 1.00 0.00 C ATOM 254 CG LYS A 12 79.854 24.070 -42.616 1.00 0.00 C ATOM 255 CD LYS A 12 80.060 25.550 -42.285 1.00 0.00 C ATOM 256 CE LYS A 12 81.147 25.689 -41.218 1.00 0.00 C ATOM 257 NZ LYS A 12 81.183 27.096 -40.726 1.00 0.00 N ATOM 0 H LYS A 12 80.381 22.344 -45.083 1.00 0.00 H new ATOM 0 HA LYS A 12 78.235 21.987 -43.102 1.00 0.00 H new ATOM 0 HB2 LYS A 12 79.259 24.404 -44.667 1.00 0.00 H new ATOM 0 HB3 LYS A 12 77.932 24.462 -43.524 1.00 0.00 H new ATOM 0 HG2 LYS A 12 79.485 23.538 -41.739 1.00 0.00 H new ATOM 0 HG3 LYS A 12 80.804 23.612 -42.890 1.00 0.00 H new ATOM 0 HD2 LYS A 12 80.345 26.098 -43.183 1.00 0.00 H new ATOM 0 HD3 LYS A 12 79.127 25.987 -41.928 1.00 0.00 H new ATOM 0 HE2 LYS A 12 80.948 25.008 -40.390 1.00 0.00 H new ATOM 0 HE3 LYS A 12 82.116 25.413 -41.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 81.922 27.191 -40.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 81.392 27.736 -41.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 80.260 27.344 -40.315 1.00 0.00 H new ATOM 271 N GLU A 13 76.258 22.011 -44.609 1.00 0.00 N ATOM 272 CA GLU A 13 75.110 21.868 -45.501 1.00 0.00 C ATOM 273 C GLU A 13 73.977 22.789 -45.061 1.00 0.00 C ATOM 274 O GLU A 13 73.925 23.213 -43.906 1.00 0.00 O ATOM 275 CB GLU A 13 74.622 20.418 -45.492 1.00 0.00 C ATOM 276 CG GLU A 13 75.734 19.498 -46.009 1.00 0.00 C ATOM 277 CD GLU A 13 75.271 18.041 -46.103 1.00 0.00 C ATOM 278 OE1 GLU A 13 74.203 17.720 -45.602 1.00 0.00 O ATOM 279 OE2 GLU A 13 76.003 17.256 -46.683 1.00 0.00 O ATOM 0 H GLU A 13 76.049 21.851 -43.624 1.00 0.00 H new ATOM 0 HA GLU A 13 75.418 22.142 -46.510 1.00 0.00 H new ATOM 0 HB2 GLU A 13 74.335 20.126 -44.482 1.00 0.00 H new ATOM 0 HB3 GLU A 13 73.734 20.319 -46.116 1.00 0.00 H new ATOM 0 HG2 GLU A 13 76.060 19.839 -46.991 1.00 0.00 H new ATOM 0 HG3 GLU A 13 76.597 19.563 -45.346 1.00 0.00 H new ATOM 286 N THR A 14 73.073 23.095 -45.985 1.00 0.00 N ATOM 287 CA THR A 14 71.942 23.961 -45.671 1.00 0.00 C ATOM 288 C THR A 14 70.940 23.224 -44.789 1.00 0.00 C ATOM 289 O THR A 14 70.602 22.069 -45.048 1.00 0.00 O ATOM 290 CB THR A 14 71.257 24.414 -46.962 1.00 0.00 C ATOM 291 OG1 THR A 14 72.219 25.008 -47.823 1.00 0.00 O ATOM 292 CG2 THR A 14 70.166 25.435 -46.633 1.00 0.00 C ATOM 0 H THR A 14 73.100 22.760 -46.948 1.00 0.00 H new ATOM 0 HA THR A 14 72.311 24.835 -45.133 1.00 0.00 H new ATOM 0 HB THR A 14 70.808 23.553 -47.456 1.00 0.00 H new ATOM 0 HG1 THR A 14 71.782 25.297 -48.651 1.00 0.00 H new ATOM 0 HG21 THR A 14 69.679 25.757 -47.554 1.00 0.00 H new ATOM 0 HG22 THR A 14 69.428 24.979 -45.973 1.00 0.00 H new ATOM 0 HG23 THR A 14 70.612 26.298 -46.138 1.00 0.00 H new ATOM 300 N ALA A 15 70.466 23.900 -43.747 1.00 0.00 N ATOM 301 CA ALA A 15 69.518 23.291 -42.822 1.00 0.00 C ATOM 302 C ALA A 15 68.558 24.339 -42.268 1.00 0.00 C ATOM 303 O ALA A 15 68.847 25.536 -42.294 1.00 0.00 O ATOM 304 CB ALA A 15 70.270 22.625 -41.668 1.00 0.00 C ATOM 0 H ALA A 15 70.721 24.862 -43.523 1.00 0.00 H new ATOM 0 HA ALA A 15 68.943 22.540 -43.364 1.00 0.00 H new ATOM 0 HB1 ALA A 15 69.555 22.172 -40.981 1.00 0.00 H new ATOM 0 HB2 ALA A 15 70.933 21.854 -42.062 1.00 0.00 H new ATOM 0 HB3 ALA A 15 70.859 23.373 -41.138 1.00 0.00 H new ATOM 310 N ALA A 16 67.415 23.881 -41.769 1.00 0.00 N ATOM 311 CA ALA A 16 66.421 24.785 -41.204 1.00 0.00 C ATOM 312 C ALA A 16 67.024 25.597 -40.064 1.00 0.00 C ATOM 313 O ALA A 16 67.920 25.130 -39.361 1.00 0.00 O ATOM 314 CB ALA A 16 65.222 23.987 -40.687 1.00 0.00 C ATOM 0 H ALA A 16 67.155 22.895 -41.744 1.00 0.00 H new ATOM 0 HA ALA A 16 66.091 25.468 -41.987 1.00 0.00 H new ATOM 0 HB1 ALA A 16 64.484 24.670 -40.267 1.00 0.00 H new ATOM 0 HB2 ALA A 16 64.774 23.430 -41.510 1.00 0.00 H new ATOM 0 HB3 ALA A 16 65.553 23.291 -39.916 1.00 0.00 H new ATOM 320 N ALA A 17 66.526 26.818 -39.885 1.00 0.00 N ATOM 321 CA ALA A 17 67.034 27.695 -38.836 1.00 0.00 C ATOM 322 C ALA A 17 66.917 27.027 -37.470 1.00 0.00 C ATOM 323 O ALA A 17 65.982 26.264 -37.219 1.00 0.00 O ATOM 324 CB ALA A 17 66.253 29.009 -38.831 1.00 0.00 C ATOM 0 H ALA A 17 65.777 27.220 -40.449 1.00 0.00 H new ATOM 0 HA ALA A 17 68.086 27.897 -39.038 1.00 0.00 H new ATOM 0 HB1 ALA A 17 66.638 29.658 -38.045 1.00 0.00 H new ATOM 0 HB2 ALA A 17 66.365 29.502 -39.796 1.00 0.00 H new ATOM 0 HB3 ALA A 17 65.198 28.805 -38.648 1.00 0.00 H new ATOM 330 N LYS A 18 67.871 27.318 -36.591 1.00 0.00 N ATOM 331 CA LYS A 18 67.882 26.736 -35.251 1.00 0.00 C ATOM 332 C LYS A 18 68.016 27.828 -34.196 1.00 0.00 C ATOM 333 O LYS A 18 68.786 28.774 -34.361 1.00 0.00 O ATOM 334 CB LYS A 18 69.047 25.753 -35.120 1.00 0.00 C ATOM 335 CG LYS A 18 68.957 25.030 -33.774 1.00 0.00 C ATOM 336 CD LYS A 18 70.168 24.108 -33.608 1.00 0.00 C ATOM 337 CE LYS A 18 70.000 23.269 -32.340 1.00 0.00 C ATOM 338 NZ LYS A 18 70.019 24.163 -31.147 1.00 0.00 N ATOM 0 H LYS A 18 68.646 27.953 -36.781 1.00 0.00 H new ATOM 0 HA LYS A 18 66.941 26.208 -35.095 1.00 0.00 H new ATOM 0 HB2 LYS A 18 69.020 25.030 -35.935 1.00 0.00 H new ATOM 0 HB3 LYS A 18 69.995 26.285 -35.196 1.00 0.00 H new ATOM 0 HG2 LYS A 18 68.925 25.755 -32.961 1.00 0.00 H new ATOM 0 HG3 LYS A 18 68.035 24.451 -33.721 1.00 0.00 H new ATOM 0 HD2 LYS A 18 70.265 23.457 -34.477 1.00 0.00 H new ATOM 0 HD3 LYS A 18 71.082 24.698 -33.548 1.00 0.00 H new ATOM 0 HE2 LYS A 18 69.061 22.716 -32.379 1.00 0.00 H new ATOM 0 HE3 LYS A 18 70.801 22.533 -32.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 70.376 23.636 -30.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 70.640 24.977 -31.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 69.055 24.500 -30.951 1.00 0.00 H new ATOM 352 N PHE A 19 67.260 27.691 -33.111 1.00 0.00 N ATOM 353 CA PHE A 19 67.290 28.681 -32.041 1.00 0.00 C ATOM 354 C PHE A 19 68.704 28.844 -31.495 1.00 0.00 C ATOM 355 O PHE A 19 69.516 27.921 -31.555 1.00 0.00 O ATOM 356 CB PHE A 19 66.348 28.258 -30.911 1.00 0.00 C ATOM 357 CG PHE A 19 66.737 26.949 -30.264 1.00 0.00 C ATOM 358 CD1 PHE A 19 66.313 25.738 -30.824 1.00 0.00 C ATOM 359 CD2 PHE A 19 67.519 26.948 -29.102 1.00 0.00 C ATOM 360 CE1 PHE A 19 66.671 24.525 -30.222 1.00 0.00 C ATOM 361 CE2 PHE A 19 67.877 25.735 -28.501 1.00 0.00 C ATOM 362 CZ PHE A 19 67.453 24.524 -29.062 1.00 0.00 C ATOM 0 H PHE A 19 66.624 26.910 -32.950 1.00 0.00 H new ATOM 0 HA PHE A 19 66.962 29.637 -32.449 1.00 0.00 H new ATOM 0 HB2 PHE A 19 66.330 29.039 -30.151 1.00 0.00 H new ATOM 0 HB3 PHE A 19 65.335 28.173 -31.305 1.00 0.00 H new ATOM 0 HD1 PHE A 19 65.710 25.739 -31.720 1.00 0.00 H new ATOM 0 HD2 PHE A 19 67.846 27.882 -28.670 1.00 0.00 H new ATOM 0 HE1 PHE A 19 66.343 23.591 -30.653 1.00 0.00 H new ATOM 0 HE2 PHE A 19 68.480 25.733 -27.605 1.00 0.00 H new ATOM 0 HZ PHE A 19 67.730 23.589 -28.599 1.00 0.00 H new ATOM 372 N GLU A 20 68.991 30.028 -30.962 1.00 0.00 N ATOM 373 CA GLU A 20 70.316 30.319 -30.425 1.00 0.00 C ATOM 374 C GLU A 20 70.539 29.576 -29.111 1.00 0.00 C ATOM 375 O GLU A 20 69.618 29.426 -28.307 1.00 0.00 O ATOM 376 CB GLU A 20 70.462 31.825 -30.199 1.00 0.00 C ATOM 377 CG GLU A 20 71.899 32.152 -29.779 1.00 0.00 C ATOM 378 CD GLU A 20 72.871 31.935 -30.940 1.00 0.00 C ATOM 379 OE1 GLU A 20 72.447 32.021 -32.083 1.00 0.00 O ATOM 380 OE2 GLU A 20 74.033 31.687 -30.667 1.00 0.00 O ATOM 0 H GLU A 20 68.327 30.799 -30.891 1.00 0.00 H new ATOM 0 HA GLU A 20 71.064 29.985 -31.144 1.00 0.00 H new ATOM 0 HB2 GLU A 20 70.209 32.365 -31.111 1.00 0.00 H new ATOM 0 HB3 GLU A 20 69.765 32.155 -29.429 1.00 0.00 H new ATOM 0 HG2 GLU A 20 71.956 33.186 -29.440 1.00 0.00 H new ATOM 0 HG3 GLU A 20 72.187 31.524 -28.936 1.00 0.00 H new ATOM 387 N ARG A 21 71.767 29.112 -28.901 1.00 0.00 N ATOM 388 CA ARG A 21 72.108 28.377 -27.686 1.00 0.00 C ATOM 389 C ARG A 21 72.942 29.248 -26.753 1.00 0.00 C ATOM 390 O ARG A 21 73.543 30.233 -27.179 1.00 0.00 O ATOM 391 CB ARG A 21 72.896 27.115 -28.047 1.00 0.00 C ATOM 392 CG ARG A 21 72.019 26.191 -28.895 1.00 0.00 C ATOM 393 CD ARG A 21 72.797 24.918 -29.232 1.00 0.00 C ATOM 394 NE ARG A 21 72.992 24.107 -28.026 1.00 0.00 N ATOM 395 CZ ARG A 21 73.423 22.837 -28.049 1.00 0.00 C ATOM 396 NH1 ARG A 21 73.711 22.216 -29.169 1.00 0.00 N ATOM 397 NH2 ARG A 21 73.564 22.198 -26.920 1.00 0.00 N ATOM 0 H ARG A 21 72.541 29.231 -29.554 1.00 0.00 H new ATOM 0 HA ARG A 21 71.185 28.098 -27.178 1.00 0.00 H new ATOM 0 HB2 ARG A 21 73.799 27.382 -28.596 1.00 0.00 H new ATOM 0 HB3 ARG A 21 73.215 26.601 -27.140 1.00 0.00 H new ATOM 0 HG2 ARG A 21 71.107 25.940 -28.354 1.00 0.00 H new ATOM 0 HG3 ARG A 21 71.717 26.699 -29.811 1.00 0.00 H new ATOM 0 HD2 ARG A 21 72.257 24.341 -29.983 1.00 0.00 H new ATOM 0 HD3 ARG A 21 73.763 25.178 -29.664 1.00 0.00 H new ATOM 0 HE ARG A 21 72.789 24.531 -27.121 1.00 0.00 H new ATOM 0 HH11 ARG A 21 73.610 22.700 -30.061 1.00 0.00 H new ATOM 0 HH12 ARG A 21 74.036 21.250 -29.147 1.00 0.00 H new ATOM 0 HH21 ARG A 21 73.348 22.665 -26.039 1.00 0.00 H new ATOM 0 HH22 ARG A 21 73.891 21.232 -26.918 1.00 0.00 H new ATOM 411 N GLN A 22 72.974 28.878 -25.475 1.00 0.00 N ATOM 412 CA GLN A 22 73.714 29.646 -24.478 1.00 0.00 C ATOM 413 C GLN A 22 74.485 28.724 -23.536 1.00 0.00 C ATOM 414 O GLN A 22 74.235 27.520 -23.486 1.00 0.00 O ATOM 415 CB GLN A 22 72.745 30.543 -23.694 1.00 0.00 C ATOM 416 CG GLN A 22 71.762 29.695 -22.877 1.00 0.00 C ATOM 417 CD GLN A 22 70.639 30.574 -22.337 1.00 0.00 C ATOM 418 OE1 GLN A 22 70.135 31.444 -23.047 1.00 0.00 O ATOM 419 NE2 GLN A 22 70.215 30.398 -21.116 1.00 0.00 N ATOM 0 H GLN A 22 72.498 28.054 -25.107 1.00 0.00 H new ATOM 0 HA GLN A 22 74.443 30.274 -24.990 1.00 0.00 H new ATOM 0 HB2 GLN A 22 73.306 31.200 -23.029 1.00 0.00 H new ATOM 0 HB3 GLN A 22 72.195 31.183 -24.384 1.00 0.00 H new ATOM 0 HG2 GLN A 22 71.347 28.903 -23.500 1.00 0.00 H new ATOM 0 HG3 GLN A 22 72.285 29.211 -22.052 1.00 0.00 H new ATOM 0 HE21 GLN A 22 70.634 29.676 -20.530 1.00 0.00 H new ATOM 0 HE22 GLN A 22 69.464 30.982 -20.748 1.00 0.00 H new ATOM 428 N HIS A 23 75.425 29.301 -22.789 1.00 0.00 N ATOM 429 CA HIS A 23 76.252 28.526 -21.867 1.00 0.00 C ATOM 430 C HIS A 23 76.181 29.115 -20.461 1.00 0.00 C ATOM 431 O HIS A 23 75.616 30.189 -20.254 1.00 0.00 O ATOM 432 CB HIS A 23 77.705 28.528 -22.347 1.00 0.00 C ATOM 433 CG HIS A 23 77.869 28.029 -23.756 1.00 0.00 C ATOM 434 ND1 HIS A 23 77.700 26.695 -24.093 1.00 0.00 N ATOM 435 CD2 HIS A 23 78.189 28.673 -24.926 1.00 0.00 C ATOM 436 CE1 HIS A 23 77.916 26.580 -25.415 1.00 0.00 C ATOM 437 NE2 HIS A 23 78.217 27.755 -25.973 1.00 0.00 N ATOM 0 H HIS A 23 75.632 30.300 -22.804 1.00 0.00 H new ATOM 0 HA HIS A 23 75.876 27.503 -21.841 1.00 0.00 H new ATOM 0 HB2 HIS A 23 78.101 29.541 -22.280 1.00 0.00 H new ATOM 0 HB3 HIS A 23 78.302 27.908 -21.678 1.00 0.00 H new ATOM 0 HD2 HIS A 23 78.389 29.730 -25.020 1.00 0.00 H new ATOM 0 HE1 HIS A 23 77.854 25.650 -25.960 1.00 0.00 H new ATOM 0 HE2 HIS A 23 78.423 27.940 -26.955 1.00 0.00 H new ATOM 445 N MET A 24 76.758 28.402 -19.498 1.00 0.00 N ATOM 446 CA MET A 24 76.743 28.847 -18.108 1.00 0.00 C ATOM 447 C MET A 24 78.118 29.363 -17.692 1.00 0.00 C ATOM 448 O MET A 24 79.130 29.028 -18.307 1.00 0.00 O ATOM 449 CB MET A 24 76.336 27.688 -17.196 1.00 0.00 C ATOM 450 CG MET A 24 74.885 27.295 -17.484 1.00 0.00 C ATOM 451 SD MET A 24 74.370 26.001 -16.328 1.00 0.00 S ATOM 452 CE MET A 24 72.729 25.708 -17.035 1.00 0.00 C ATOM 0 H MET A 24 77.240 27.517 -19.654 1.00 0.00 H new ATOM 0 HA MET A 24 76.021 29.658 -18.014 1.00 0.00 H new ATOM 0 HB2 MET A 24 76.994 26.835 -17.360 1.00 0.00 H new ATOM 0 HB3 MET A 24 76.444 27.979 -16.151 1.00 0.00 H new ATOM 0 HG2 MET A 24 74.235 28.165 -17.386 1.00 0.00 H new ATOM 0 HG3 MET A 24 74.790 26.940 -18.510 1.00 0.00 H new ATOM 0 HE1 MET A 24 72.221 24.930 -16.466 1.00 0.00 H new ATOM 0 HE2 MET A 24 72.145 26.628 -16.993 1.00 0.00 H new ATOM 0 HE3 MET A 24 72.831 25.390 -18.073 1.00 0.00 H new ATOM 462 N ASP A 25 78.144 30.178 -16.643 1.00 0.00 N ATOM 463 CA ASP A 25 79.396 30.747 -16.157 1.00 0.00 C ATOM 464 C ASP A 25 80.310 29.655 -15.609 1.00 0.00 C ATOM 465 O ASP A 25 79.845 28.676 -15.027 1.00 0.00 O ATOM 466 CB ASP A 25 79.110 31.775 -15.058 1.00 0.00 C ATOM 467 CG ASP A 25 78.303 32.946 -15.615 1.00 0.00 C ATOM 468 OD1 ASP A 25 78.463 33.257 -16.785 1.00 0.00 O ATOM 469 OD2 ASP A 25 77.532 33.516 -14.860 1.00 0.00 O ATOM 0 H ASP A 25 77.317 30.458 -16.115 1.00 0.00 H new ATOM 0 HA ASP A 25 79.897 31.236 -16.993 1.00 0.00 H new ATOM 0 HB2 ASP A 25 78.561 31.302 -14.244 1.00 0.00 H new ATOM 0 HB3 ASP A 25 80.048 32.139 -14.640 1.00 0.00 H new ATOM 474 N SER A 26 81.613 29.834 -15.799 1.00 0.00 N ATOM 475 CA SER A 26 82.588 28.860 -15.323 1.00 0.00 C ATOM 476 C SER A 26 82.626 28.835 -13.793 1.00 0.00 C ATOM 477 O SER A 26 82.293 29.837 -13.157 1.00 0.00 O ATOM 478 CB SER A 26 83.977 29.205 -15.862 1.00 0.00 C ATOM 479 OG SER A 26 83.859 29.648 -17.207 1.00 0.00 O ATOM 0 H SER A 26 82.017 30.640 -16.277 1.00 0.00 H new ATOM 0 HA SER A 26 82.291 27.875 -15.683 1.00 0.00 H new ATOM 0 HB2 SER A 26 84.435 29.981 -15.250 1.00 0.00 H new ATOM 0 HB3 SER A 26 84.628 28.332 -15.810 1.00 0.00 H new ATOM 0 HG SER A 26 84.747 29.872 -17.557 1.00 0.00 H new ATOM 485 N PRO A 27 83.015 27.733 -13.185 1.00 0.00 N ATOM 486 CA PRO A 27 83.067 27.638 -11.697 1.00 0.00 C ATOM 487 C PRO A 27 84.363 28.207 -11.124 1.00 0.00 C ATOM 488 O PRO A 27 85.188 28.758 -11.854 1.00 0.00 O ATOM 489 CB PRO A 27 82.966 26.137 -11.434 1.00 0.00 C ATOM 490 CG PRO A 27 83.597 25.489 -12.620 1.00 0.00 C ATOM 491 CD PRO A 27 83.446 26.458 -13.797 1.00 0.00 C ATOM 0 HA PRO A 27 82.275 28.217 -11.221 1.00 0.00 H new ATOM 0 HB2 PRO A 27 83.482 25.863 -10.514 1.00 0.00 H new ATOM 0 HB3 PRO A 27 81.927 25.826 -11.321 1.00 0.00 H new ATOM 0 HG2 PRO A 27 84.649 25.277 -12.429 1.00 0.00 H new ATOM 0 HG3 PRO A 27 83.115 24.537 -12.841 1.00 0.00 H new ATOM 0 HD2 PRO A 27 84.386 26.576 -14.335 1.00 0.00 H new ATOM 0 HD3 PRO A 27 82.711 26.096 -14.516 1.00 0.00 H new ATOM 499 N ASP A 28 84.534 28.066 -9.814 1.00 0.00 N ATOM 500 CA ASP A 28 85.727 28.572 -9.145 1.00 0.00 C ATOM 501 C ASP A 28 86.881 27.583 -9.280 1.00 0.00 C ATOM 502 O ASP A 28 86.755 26.414 -8.917 1.00 0.00 O ATOM 503 CB ASP A 28 85.432 28.816 -7.664 1.00 0.00 C ATOM 504 CG ASP A 28 86.636 29.468 -6.993 1.00 0.00 C ATOM 505 OD1 ASP A 28 86.752 30.679 -7.078 1.00 0.00 O ATOM 506 OD2 ASP A 28 87.425 28.747 -6.405 1.00 0.00 O ATOM 0 H ASP A 28 83.864 27.607 -9.196 1.00 0.00 H new ATOM 0 HA ASP A 28 86.013 29.511 -9.618 1.00 0.00 H new ATOM 0 HB2 ASP A 28 84.556 29.456 -7.560 1.00 0.00 H new ATOM 0 HB3 ASP A 28 85.197 27.873 -7.171 1.00 0.00 H new ATOM 511 N LEU A 29 88.006 28.061 -9.802 1.00 0.00 N ATOM 512 CA LEU A 29 89.177 27.211 -9.983 1.00 0.00 C ATOM 513 C LEU A 29 89.954 27.082 -8.676 1.00 0.00 C ATOM 514 O LEU A 29 89.944 27.990 -7.844 1.00 0.00 O ATOM 515 CB LEU A 29 90.090 27.792 -11.066 1.00 0.00 C ATOM 516 CG LEU A 29 89.314 27.956 -12.377 1.00 0.00 C ATOM 517 CD1 LEU A 29 90.213 28.622 -13.420 1.00 0.00 C ATOM 518 CD2 LEU A 29 88.878 26.583 -12.895 1.00 0.00 C ATOM 0 H LEU A 29 88.131 29.027 -10.106 1.00 0.00 H new ATOM 0 HA LEU A 29 88.836 26.222 -10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 29 90.482 28.757 -10.743 1.00 0.00 H new ATOM 0 HB3 LEU A 29 90.946 27.136 -11.221 1.00 0.00 H new ATOM 0 HG LEU A 29 88.434 28.574 -12.198 1.00 0.00 H new ATOM 0 HD11 LEU A 29 89.662 28.739 -14.353 1.00 0.00 H new ATOM 0 HD12 LEU A 29 90.527 29.601 -13.058 1.00 0.00 H new ATOM 0 HD13 LEU A 29 91.092 28.001 -13.593 1.00 0.00 H new ATOM 0 HD21 LEU A 29 88.327 26.704 -13.827 1.00 0.00 H new ATOM 0 HD22 LEU A 29 89.758 25.965 -13.072 1.00 0.00 H new ATOM 0 HD23 LEU A 29 88.239 26.101 -12.155 1.00 0.00 H new ATOM 530 N GLY A 30 90.624 25.948 -8.502 1.00 0.00 N ATOM 531 CA GLY A 30 91.379 25.691 -7.280 1.00 0.00 C ATOM 532 C GLY A 30 92.380 26.807 -7.001 1.00 0.00 C ATOM 533 O GLY A 30 92.793 27.527 -7.910 1.00 0.00 O ATOM 0 H GLY A 30 90.660 25.194 -9.188 1.00 0.00 H new ATOM 0 HA2 GLY A 30 90.692 25.597 -6.439 1.00 0.00 H new ATOM 0 HA3 GLY A 30 91.906 24.741 -7.369 1.00 0.00 H new ATOM 537 N THR A 31 92.766 26.942 -5.735 1.00 0.00 N ATOM 538 CA THR A 31 93.709 27.980 -5.324 1.00 0.00 C ATOM 539 C THR A 31 94.922 27.358 -4.639 1.00 0.00 C ATOM 540 O THR A 31 94.931 26.165 -4.333 1.00 0.00 O ATOM 541 CB THR A 31 93.029 28.960 -4.363 1.00 0.00 C ATOM 542 OG1 THR A 31 92.650 28.272 -3.180 1.00 0.00 O ATOM 543 CG2 THR A 31 91.791 29.566 -5.026 1.00 0.00 C ATOM 0 H THR A 31 92.440 26.345 -4.975 1.00 0.00 H new ATOM 0 HA THR A 31 94.038 28.516 -6.214 1.00 0.00 H new ATOM 0 HB THR A 31 93.725 29.761 -4.112 1.00 0.00 H new ATOM 0 HG1 THR A 31 92.216 28.897 -2.563 1.00 0.00 H new ATOM 0 HG21 THR A 31 91.313 30.262 -4.337 1.00 0.00 H new ATOM 0 HG22 THR A 31 92.086 30.097 -5.931 1.00 0.00 H new ATOM 0 HG23 THR A 31 91.091 28.772 -5.284 1.00 0.00 H new ATOM 551 N ASP A 32 95.944 28.174 -4.402 1.00 0.00 N ATOM 552 CA ASP A 32 97.163 27.692 -3.763 1.00 0.00 C ATOM 553 C ASP A 32 96.846 27.074 -2.403 1.00 0.00 C ATOM 554 O ASP A 32 95.895 27.478 -1.734 1.00 0.00 O ATOM 555 CB ASP A 32 98.152 28.848 -3.582 1.00 0.00 C ATOM 556 CG ASP A 32 98.583 29.401 -4.938 1.00 0.00 C ATOM 557 OD1 ASP A 32 98.624 28.638 -5.890 1.00 0.00 O ATOM 558 OD2 ASP A 32 98.865 30.586 -5.005 1.00 0.00 O ATOM 0 H ASP A 32 95.953 29.166 -4.641 1.00 0.00 H new ATOM 0 HA ASP A 32 97.609 26.930 -4.402 1.00 0.00 H new ATOM 0 HB2 ASP A 32 97.691 29.639 -2.990 1.00 0.00 H new ATOM 0 HB3 ASP A 32 99.026 28.503 -3.029 1.00 0.00 H new ATOM 563 N ASP A 33 97.649 26.094 -2.005 1.00 0.00 N ATOM 564 CA ASP A 33 97.424 25.400 -0.742 1.00 0.00 C ATOM 565 C ASP A 33 97.750 26.300 0.447 1.00 0.00 C ATOM 566 O ASP A 33 98.291 27.393 0.282 1.00 0.00 O ATOM 567 CB ASP A 33 98.282 24.130 -0.683 1.00 0.00 C ATOM 568 CG ASP A 33 99.773 24.449 -0.828 1.00 0.00 C ATOM 569 OD1 ASP A 33 100.157 25.593 -0.638 1.00 0.00 O ATOM 570 OD2 ASP A 33 100.517 23.531 -1.130 1.00 0.00 O ATOM 0 H ASP A 33 98.456 25.764 -2.534 1.00 0.00 H new ATOM 0 HA ASP A 33 96.369 25.130 -0.687 1.00 0.00 H new ATOM 0 HB2 ASP A 33 98.109 23.617 0.263 1.00 0.00 H new ATOM 0 HB3 ASP A 33 97.977 23.447 -1.476 1.00 0.00 H new ATOM 575 N ASP A 34 97.414 25.828 1.643 1.00 0.00 N ATOM 576 CA ASP A 34 97.659 26.597 2.858 1.00 0.00 C ATOM 577 C ASP A 34 99.151 26.675 3.160 1.00 0.00 C ATOM 578 O ASP A 34 99.911 25.763 2.833 1.00 0.00 O ATOM 579 CB ASP A 34 96.932 25.947 4.040 1.00 0.00 C ATOM 580 CG ASP A 34 95.421 25.977 3.820 1.00 0.00 C ATOM 581 OD1 ASP A 34 94.945 26.899 3.177 1.00 0.00 O ATOM 582 OD2 ASP A 34 94.760 25.071 4.300 1.00 0.00 O ATOM 0 H ASP A 34 96.973 24.921 1.797 1.00 0.00 H new ATOM 0 HA ASP A 34 97.281 27.608 2.705 1.00 0.00 H new ATOM 0 HB2 ASP A 34 97.268 24.917 4.159 1.00 0.00 H new ATOM 0 HB3 ASP A 34 97.182 26.472 4.962 1.00 0.00 H new ATOM 587 N ASP A 35 99.565 27.773 3.786 1.00 0.00 N ATOM 588 CA ASP A 35 100.966 27.960 4.143 1.00 0.00 C ATOM 589 C ASP A 35 101.412 26.889 5.135 1.00 0.00 C ATOM 590 O ASP A 35 100.602 26.356 5.893 1.00 0.00 O ATOM 591 CB ASP A 35 101.167 29.346 4.760 1.00 0.00 C ATOM 592 CG ASP A 35 100.845 30.439 3.743 1.00 0.00 C ATOM 593 OD1 ASP A 35 101.042 30.206 2.561 1.00 0.00 O ATOM 594 OD2 ASP A 35 100.404 31.495 4.162 1.00 0.00 O ATOM 0 H ASP A 35 98.953 28.543 4.055 1.00 0.00 H new ATOM 0 HA ASP A 35 101.568 27.875 3.238 1.00 0.00 H new ATOM 0 HB2 ASP A 35 100.527 29.457 5.636 1.00 0.00 H new ATOM 0 HB3 ASP A 35 102.196 29.452 5.102 1.00 0.00 H new ATOM 599 N LYS A 36 102.705 26.581 5.124 1.00 0.00 N ATOM 600 CA LYS A 36 103.243 25.558 6.013 1.00 0.00 C ATOM 601 C LYS A 36 103.297 26.067 7.450 1.00 0.00 C ATOM 602 O LYS A 36 103.491 27.259 7.691 1.00 0.00 O ATOM 603 CB LYS A 36 104.648 25.158 5.559 1.00 0.00 C ATOM 604 CG LYS A 36 104.575 24.512 4.175 1.00 0.00 C ATOM 605 CD LYS A 36 105.964 24.017 3.766 1.00 0.00 C ATOM 606 CE LYS A 36 105.915 23.481 2.334 1.00 0.00 C ATOM 607 NZ LYS A 36 105.186 22.182 2.315 1.00 0.00 N ATOM 0 H LYS A 36 103.395 27.021 4.515 1.00 0.00 H new ATOM 0 HA LYS A 36 102.586 24.689 5.973 1.00 0.00 H new ATOM 0 HB2 LYS A 36 105.295 26.035 5.529 1.00 0.00 H new ATOM 0 HB3 LYS A 36 105.088 24.462 6.274 1.00 0.00 H new ATOM 0 HG2 LYS A 36 103.871 23.680 4.187 1.00 0.00 H new ATOM 0 HG3 LYS A 36 104.205 25.232 3.445 1.00 0.00 H new ATOM 0 HD2 LYS A 36 106.687 24.830 3.836 1.00 0.00 H new ATOM 0 HD3 LYS A 36 106.298 23.234 4.447 1.00 0.00 H new ATOM 0 HE2 LYS A 36 105.417 24.199 1.682 1.00 0.00 H new ATOM 0 HE3 LYS A 36 106.926 23.349 1.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 105.297 21.735 1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 105.575 21.555 3.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 104.176 22.348 2.502 1.00 0.00 H new ATOM 621 N THR A 37 103.124 25.153 8.401 1.00 0.00 N ATOM 622 CA THR A 37 103.133 25.507 9.818 1.00 0.00 C ATOM 623 C THR A 37 104.209 24.720 10.559 1.00 0.00 C ATOM 624 O THR A 37 104.794 23.785 10.014 1.00 0.00 O ATOM 625 CB THR A 37 101.767 25.212 10.445 1.00 0.00 C ATOM 626 OG1 THR A 37 101.512 23.816 10.382 1.00 0.00 O ATOM 627 CG2 THR A 37 100.672 25.969 9.689 1.00 0.00 C ATOM 0 H THR A 37 102.976 24.161 8.216 1.00 0.00 H new ATOM 0 HA THR A 37 103.349 26.572 9.902 1.00 0.00 H new ATOM 0 HB THR A 37 101.770 25.537 11.486 1.00 0.00 H new ATOM 0 HG1 THR A 37 100.639 23.624 10.784 1.00 0.00 H new ATOM 0 HG21 THR A 37 99.703 25.754 10.140 1.00 0.00 H new ATOM 0 HG22 THR A 37 100.868 27.040 9.741 1.00 0.00 H new ATOM 0 HG23 THR A 37 100.664 25.652 8.646 1.00 0.00 H new ATOM 635 N GLY A 38 104.465 25.107 11.805 1.00 0.00 N ATOM 636 CA GLY A 38 105.480 24.437 12.610 1.00 0.00 C ATOM 637 C GLY A 38 104.978 23.083 13.102 1.00 0.00 C ATOM 638 O GLY A 38 103.927 22.608 12.673 1.00 0.00 O ATOM 0 H GLY A 38 103.987 25.875 12.276 1.00 0.00 H new ATOM 0 HA2 GLY A 38 106.386 24.301 12.020 1.00 0.00 H new ATOM 0 HA3 GLY A 38 105.745 25.063 13.462 1.00 0.00 H new ATOM 642 N GLY A 39 105.735 22.467 14.005 1.00 0.00 N ATOM 643 CA GLY A 39 105.375 21.152 14.526 1.00 0.00 C ATOM 644 C GLY A 39 103.960 21.149 15.095 1.00 0.00 C ATOM 645 O GLY A 39 103.643 21.913 16.008 1.00 0.00 O ATOM 0 H GLY A 39 106.597 22.854 14.390 1.00 0.00 H new ATOM 0 HA2 GLY A 39 105.451 20.410 13.731 1.00 0.00 H new ATOM 0 HA3 GLY A 39 106.082 20.860 15.303 1.00 0.00 H new ATOM 649 N GLY A 40 103.114 20.282 14.548 1.00 0.00 N ATOM 650 CA GLY A 40 101.730 20.185 14.998 1.00 0.00 C ATOM 651 C GLY A 40 101.590 19.173 16.130 1.00 0.00 C ATOM 652 O GLY A 40 102.583 18.684 16.667 1.00 0.00 O ATOM 0 H GLY A 40 103.361 19.639 13.796 1.00 0.00 H new ATOM 0 HA2 GLY A 40 101.385 21.162 15.335 1.00 0.00 H new ATOM 0 HA3 GLY A 40 101.093 19.892 14.164 1.00 0.00 H new ATOM 656 N ARG A 41 100.347 18.864 16.485 1.00 0.00 N ATOM 657 CA ARG A 41 100.077 17.899 17.544 1.00 0.00 C ATOM 658 C ARG A 41 100.734 16.559 17.229 1.00 0.00 C ATOM 659 O ARG A 41 100.964 16.229 16.066 1.00 0.00 O ATOM 660 CB ARG A 41 98.567 17.703 17.696 1.00 0.00 C ATOM 661 CG ARG A 41 97.924 19.014 18.156 1.00 0.00 C ATOM 662 CD ARG A 41 96.434 18.789 18.428 1.00 0.00 C ATOM 663 NE ARG A 41 95.770 18.263 17.231 1.00 0.00 N ATOM 664 CZ ARG A 41 94.444 18.080 17.141 1.00 0.00 C ATOM 665 NH1 ARG A 41 93.629 18.361 18.129 1.00 0.00 N ATOM 666 NH2 ARG A 41 93.948 17.604 16.031 1.00 0.00 N ATOM 0 H ARG A 41 99.514 19.266 16.056 1.00 0.00 H new ATOM 0 HA ARG A 41 100.491 18.284 18.476 1.00 0.00 H new ATOM 0 HB2 ARG A 41 98.134 17.387 16.747 1.00 0.00 H new ATOM 0 HB3 ARG A 41 98.363 16.913 18.419 1.00 0.00 H new ATOM 0 HG2 ARG A 41 98.418 19.376 19.058 1.00 0.00 H new ATOM 0 HG3 ARG A 41 98.053 19.781 17.392 1.00 0.00 H new ATOM 0 HD2 ARG A 41 96.310 18.092 19.256 1.00 0.00 H new ATOM 0 HD3 ARG A 41 95.967 19.727 18.728 1.00 0.00 H new ATOM 0 HE ARG A 41 96.347 18.024 16.424 1.00 0.00 H new ATOM 0 HH11 ARG A 41 93.998 18.733 19.004 1.00 0.00 H new ATOM 0 HH12 ARG A 41 92.626 18.208 18.022 1.00 0.00 H new ATOM 0 HH21 ARG A 41 94.566 17.378 15.252 1.00 0.00 H new ATOM 0 HH22 ARG A 41 92.942 17.458 15.943 1.00 0.00 H new ATOM 680 N ALA A 42 101.035 15.790 18.272 1.00 0.00 N ATOM 681 CA ALA A 42 101.673 14.489 18.099 1.00 0.00 C ATOM 682 C ALA A 42 100.858 13.605 17.159 1.00 0.00 C ATOM 683 O ALA A 42 99.631 13.699 17.114 1.00 0.00 O ATOM 684 CB ALA A 42 101.819 13.795 19.454 1.00 0.00 C ATOM 0 H ALA A 42 100.848 16.044 19.242 1.00 0.00 H new ATOM 0 HA ALA A 42 102.659 14.648 17.662 1.00 0.00 H new ATOM 0 HB1 ALA A 42 102.296 12.825 19.316 1.00 0.00 H new ATOM 0 HB2 ALA A 42 102.431 14.410 20.114 1.00 0.00 H new ATOM 0 HB3 ALA A 42 100.834 13.655 19.899 1.00 0.00 H new ATOM 690 N ASP A 43 101.546 12.749 16.411 1.00 0.00 N ATOM 691 CA ASP A 43 100.875 11.896 15.437 1.00 0.00 C ATOM 692 C ASP A 43 99.825 11.019 16.133 1.00 0.00 C ATOM 693 O ASP A 43 100.137 10.434 17.172 1.00 0.00 O ATOM 694 CB ASP A 43 101.906 10.994 14.755 1.00 0.00 C ATOM 695 CG ASP A 43 102.755 11.811 13.786 1.00 0.00 C ATOM 696 OD1 ASP A 43 103.555 12.604 14.254 1.00 0.00 O ATOM 697 OD2 ASP A 43 102.592 11.632 12.591 1.00 0.00 O ATOM 0 H ASP A 43 102.558 12.628 16.459 1.00 0.00 H new ATOM 0 HA ASP A 43 100.382 12.527 14.697 1.00 0.00 H new ATOM 0 HB2 ASP A 43 102.544 10.526 15.505 1.00 0.00 H new ATOM 0 HB3 ASP A 43 101.401 10.190 14.220 1.00 0.00 H new ATOM 702 N PRO A 44 98.611 10.900 15.622 1.00 0.00 N ATOM 703 CA PRO A 44 97.602 9.979 16.229 1.00 0.00 C ATOM 704 C PRO A 44 97.927 8.515 15.935 1.00 0.00 C ATOM 705 O PRO A 44 99.004 8.196 15.434 1.00 0.00 O ATOM 706 CB PRO A 44 96.253 10.388 15.611 1.00 0.00 C ATOM 707 CG PRO A 44 96.521 11.564 14.734 1.00 0.00 C ATOM 708 CD PRO A 44 98.023 11.599 14.465 1.00 0.00 C ATOM 0 HA PRO A 44 97.590 10.062 17.316 1.00 0.00 H new ATOM 0 HB2 PRO A 44 95.826 9.566 15.036 1.00 0.00 H new ATOM 0 HB3 PRO A 44 95.532 10.642 16.388 1.00 0.00 H new ATOM 0 HG2 PRO A 44 95.965 11.481 13.800 1.00 0.00 H new ATOM 0 HG3 PRO A 44 96.196 12.485 15.217 1.00 0.00 H new ATOM 0 HD2 PRO A 44 98.272 11.100 13.529 1.00 0.00 H new ATOM 0 HD3 PRO A 44 98.391 12.622 14.388 1.00 0.00 H new ATOM 716 N ALA A 45 96.984 7.632 16.252 1.00 0.00 N ATOM 717 CA ALA A 45 97.161 6.207 15.990 1.00 0.00 C ATOM 718 C ALA A 45 97.429 5.969 14.507 1.00 0.00 C ATOM 719 O ALA A 45 97.105 6.807 13.667 1.00 0.00 O ATOM 720 CB ALA A 45 95.909 5.438 16.415 1.00 0.00 C ATOM 0 H ALA A 45 96.095 7.876 16.688 1.00 0.00 H new ATOM 0 HA ALA A 45 98.016 5.852 16.566 1.00 0.00 H new ATOM 0 HB1 ALA A 45 96.050 4.376 16.216 1.00 0.00 H new ATOM 0 HB2 ALA A 45 95.734 5.588 17.480 1.00 0.00 H new ATOM 0 HB3 ALA A 45 95.050 5.802 15.852 1.00 0.00 H new ATOM 726 N HIS A 46 98.021 4.821 14.192 1.00 0.00 N ATOM 727 CA HIS A 46 98.362 4.508 12.808 1.00 0.00 C ATOM 728 C HIS A 46 97.109 4.473 11.939 1.00 0.00 C ATOM 729 O HIS A 46 96.019 4.148 12.410 1.00 0.00 O ATOM 730 CB HIS A 46 99.075 3.158 12.737 1.00 0.00 C ATOM 731 CG HIS A 46 100.466 3.185 13.313 1.00 0.00 C ATOM 732 ND1 HIS A 46 101.524 3.796 12.659 1.00 0.00 N ATOM 733 CD2 HIS A 46 100.987 2.682 14.479 1.00 0.00 C ATOM 734 CE1 HIS A 46 102.617 3.648 13.427 1.00 0.00 C ATOM 735 NE2 HIS A 46 102.346 2.976 14.549 1.00 0.00 N ATOM 0 H HIS A 46 98.272 4.099 14.867 1.00 0.00 H new ATOM 0 HA HIS A 46 99.025 5.288 12.434 1.00 0.00 H new ATOM 0 HB2 HIS A 46 98.483 2.414 13.271 1.00 0.00 H new ATOM 0 HB3 HIS A 46 99.127 2.837 11.697 1.00 0.00 H new ATOM 0 HD2 HIS A 46 100.428 2.141 15.228 1.00 0.00 H new ATOM 0 HE1 HIS A 46 103.595 4.026 13.168 1.00 0.00 H new ATOM 0 HE2 HIS A 46 102.995 2.731 15.297 1.00 0.00 H new ATOM 743 N ARG A 47 97.281 4.812 10.665 1.00 0.00 N ATOM 744 CA ARG A 47 96.163 4.869 9.728 1.00 0.00 C ATOM 745 C ARG A 47 96.497 4.089 8.460 1.00 0.00 C ATOM 746 O ARG A 47 97.661 3.992 8.071 1.00 0.00 O ATOM 747 CB ARG A 47 95.870 6.331 9.377 1.00 0.00 C ATOM 748 CG ARG A 47 94.611 6.426 8.513 1.00 0.00 C ATOM 749 CD ARG A 47 94.355 7.888 8.143 1.00 0.00 C ATOM 750 NE ARG A 47 93.092 8.013 7.409 1.00 0.00 N ATOM 751 CZ ARG A 47 91.902 8.178 8.007 1.00 0.00 C ATOM 752 NH1 ARG A 47 91.775 8.238 9.311 1.00 0.00 N ATOM 753 NH2 ARG A 47 90.834 8.283 7.265 1.00 0.00 N ATOM 0 H ARG A 47 98.185 5.052 10.257 1.00 0.00 H new ATOM 0 HA ARG A 47 95.284 4.421 10.192 1.00 0.00 H new ATOM 0 HB2 ARG A 47 95.738 6.912 10.290 1.00 0.00 H new ATOM 0 HB3 ARG A 47 96.718 6.762 8.845 1.00 0.00 H new ATOM 0 HG2 ARG A 47 94.731 5.827 7.610 1.00 0.00 H new ATOM 0 HG3 ARG A 47 93.755 6.021 9.053 1.00 0.00 H new ATOM 0 HD2 ARG A 47 94.321 8.498 9.046 1.00 0.00 H new ATOM 0 HD3 ARG A 47 95.176 8.265 7.534 1.00 0.00 H new ATOM 0 HE ARG A 47 93.119 7.972 6.390 1.00 0.00 H new ATOM 0 HH11 ARG A 47 92.598 8.158 9.908 1.00 0.00 H new ATOM 0 HH12 ARG A 47 90.853 8.364 9.728 1.00 0.00 H new ATOM 0 HH21 ARG A 47 90.913 8.239 6.249 1.00 0.00 H new ATOM 0 HH22 ARG A 47 89.920 8.409 7.701 1.00 0.00 H new ATOM 767 N SER A 48 95.471 3.533 7.816 1.00 0.00 N ATOM 768 CA SER A 48 95.656 2.786 6.570 1.00 0.00 C ATOM 769 C SER A 48 96.433 3.626 5.551 1.00 0.00 C ATOM 770 O SER A 48 96.603 4.829 5.766 1.00 0.00 O ATOM 771 CB SER A 48 94.297 2.393 5.982 1.00 0.00 C ATOM 772 OG SER A 48 93.374 2.136 7.034 1.00 0.00 O ATOM 0 H SER A 48 94.504 3.585 8.135 1.00 0.00 H new ATOM 0 HA SER A 48 96.226 1.884 6.793 1.00 0.00 H new ATOM 0 HB2 SER A 48 93.922 3.193 5.343 1.00 0.00 H new ATOM 0 HB3 SER A 48 94.404 1.508 5.355 1.00 0.00 H new ATOM 0 HG SER A 48 92.506 1.887 6.654 1.00 0.00 H new ATOM 778 N PRO A 49 96.909 3.046 4.468 1.00 0.00 N ATOM 779 CA PRO A 49 97.782 3.793 3.513 1.00 0.00 C ATOM 780 C PRO A 49 97.171 5.132 3.107 1.00 0.00 C ATOM 781 O PRO A 49 96.019 5.194 2.679 1.00 0.00 O ATOM 782 CB PRO A 49 97.907 2.865 2.301 1.00 0.00 C ATOM 783 CG PRO A 49 97.617 1.495 2.815 1.00 0.00 C ATOM 784 CD PRO A 49 96.668 1.665 4.000 1.00 0.00 C ATOM 0 HA PRO A 49 98.746 4.037 3.959 1.00 0.00 H new ATOM 0 HB2 PRO A 49 97.204 3.147 1.517 1.00 0.00 H new ATOM 0 HB3 PRO A 49 98.906 2.918 1.868 1.00 0.00 H new ATOM 0 HG2 PRO A 49 97.162 0.879 2.040 1.00 0.00 H new ATOM 0 HG3 PRO A 49 98.535 0.994 3.123 1.00 0.00 H new ATOM 0 HD2 PRO A 49 95.630 1.522 3.701 1.00 0.00 H new ATOM 0 HD3 PRO A 49 96.877 0.937 4.784 1.00 0.00 H new ATOM 792 N VAL A 50 97.951 6.198 3.246 1.00 0.00 N ATOM 793 CA VAL A 50 97.480 7.527 2.870 1.00 0.00 C ATOM 794 C VAL A 50 97.836 7.797 1.402 1.00 0.00 C ATOM 795 O VAL A 50 99.028 7.793 1.085 1.00 0.00 O ATOM 796 CB VAL A 50 98.147 8.586 3.758 1.00 0.00 C ATOM 797 CG1 VAL A 50 97.597 9.973 3.415 1.00 0.00 C ATOM 798 CG2 VAL A 50 97.855 8.287 5.231 1.00 0.00 C ATOM 0 H VAL A 50 98.903 6.170 3.612 1.00 0.00 H new ATOM 0 HA VAL A 50 96.399 7.576 3.001 1.00 0.00 H new ATOM 0 HB VAL A 50 99.223 8.564 3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 50 98.074 10.721 4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 50 97.804 10.198 2.369 1.00 0.00 H new ATOM 0 HG13 VAL A 50 96.520 9.989 3.583 1.00 0.00 H new ATOM 0 HG21 VAL A 50 98.331 9.042 5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 50 96.778 8.303 5.399 1.00 0.00 H new ATOM 0 HG23 VAL A 50 98.248 7.303 5.487 1.00 0.00 H new ATOM 808 N PRO A 51 96.894 8.063 0.513 1.00 0.00 N ATOM 809 CA PRO A 51 97.242 8.336 -0.917 1.00 0.00 C ATOM 810 C PRO A 51 98.306 9.424 -1.026 1.00 0.00 C ATOM 811 O PRO A 51 98.420 10.280 -0.148 1.00 0.00 O ATOM 812 CB PRO A 51 95.928 8.793 -1.554 1.00 0.00 C ATOM 813 CG PRO A 51 94.856 8.216 -0.697 1.00 0.00 C ATOM 814 CD PRO A 51 95.433 8.134 0.716 1.00 0.00 C ATOM 0 HA PRO A 51 97.659 7.459 -1.412 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.864 9.881 -1.586 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.844 8.438 -2.581 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.964 8.842 -0.717 1.00 0.00 H new ATOM 0 HG3 PRO A 51 94.561 7.229 -1.054 1.00 0.00 H new ATOM 0 HD2 PRO A 51 95.156 9.005 1.309 1.00 0.00 H new ATOM 0 HD3 PRO A 51 95.062 7.257 1.246 1.00 0.00 H new ATOM 822 N LEU A 52 99.082 9.390 -2.105 1.00 0.00 N ATOM 823 CA LEU A 52 100.179 10.336 -2.266 1.00 0.00 C ATOM 824 C LEU A 52 99.641 11.765 -2.371 1.00 0.00 C ATOM 825 O LEU A 52 98.516 11.958 -2.835 1.00 0.00 O ATOM 826 CB LEU A 52 100.982 10.005 -3.526 1.00 0.00 C ATOM 827 CG LEU A 52 101.515 8.574 -3.441 1.00 0.00 C ATOM 828 CD1 LEU A 52 102.202 8.211 -4.759 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.526 8.470 -2.297 1.00 0.00 C ATOM 0 H LEU A 52 98.973 8.726 -2.872 1.00 0.00 H new ATOM 0 HA LEU A 52 100.827 10.260 -1.393 1.00 0.00 H new ATOM 0 HB2 LEU A 52 100.353 10.116 -4.409 1.00 0.00 H new ATOM 0 HB3 LEU A 52 101.810 10.705 -3.635 1.00 0.00 H new ATOM 0 HG LEU A 52 100.688 7.889 -3.257 1.00 0.00 H new ATOM 0 HD11 LEU A 52 102.583 7.191 -4.702 1.00 0.00 H new ATOM 0 HD12 LEU A 52 101.484 8.285 -5.576 1.00 0.00 H new ATOM 0 HD13 LEU A 52 103.029 8.898 -4.940 1.00 0.00 H new ATOM 0 HD21 LEU A 52 102.905 7.450 -2.238 1.00 0.00 H new ATOM 0 HD22 LEU A 52 103.354 9.155 -2.480 1.00 0.00 H new ATOM 0 HD23 LEU A 52 102.040 8.732 -1.357 1.00 0.00 H new ATOM 841 N PRO A 53 100.397 12.762 -1.959 1.00 0.00 N ATOM 842 CA PRO A 53 99.937 14.177 -2.058 1.00 0.00 C ATOM 843 C PRO A 53 100.153 14.738 -3.458 1.00 0.00 C ATOM 844 O PRO A 53 100.938 14.195 -4.240 1.00 0.00 O ATOM 845 CB PRO A 53 100.801 14.909 -1.033 1.00 0.00 C ATOM 846 CG PRO A 53 102.080 14.145 -0.983 1.00 0.00 C ATOM 847 CD PRO A 53 101.754 12.700 -1.372 1.00 0.00 C ATOM 0 HA PRO A 53 98.869 14.284 -1.867 1.00 0.00 H new ATOM 0 HB2 PRO A 53 100.972 15.944 -1.329 1.00 0.00 H new ATOM 0 HB3 PRO A 53 100.318 14.933 -0.056 1.00 0.00 H new ATOM 0 HG2 PRO A 53 102.812 14.573 -1.668 1.00 0.00 H new ATOM 0 HG3 PRO A 53 102.515 14.187 0.015 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.477 12.311 -2.089 1.00 0.00 H new ATOM 0 HD3 PRO A 53 101.779 12.042 -0.504 1.00 0.00 H new ATOM 855 N SER A 54 99.491 15.855 -3.756 1.00 0.00 N ATOM 856 CA SER A 54 99.576 16.448 -5.088 1.00 0.00 C ATOM 857 C SER A 54 101.039 16.719 -5.450 1.00 0.00 C ATOM 858 O SER A 54 101.803 17.163 -4.591 1.00 0.00 O ATOM 859 CB SER A 54 98.787 17.758 -5.129 1.00 0.00 C ATOM 860 OG SER A 54 97.479 17.531 -4.621 1.00 0.00 O ATOM 0 H SER A 54 98.896 16.362 -3.101 1.00 0.00 H new ATOM 0 HA SER A 54 99.152 15.750 -5.810 1.00 0.00 H new ATOM 0 HB2 SER A 54 99.293 18.520 -4.537 1.00 0.00 H new ATOM 0 HB3 SER A 54 98.733 18.132 -6.151 1.00 0.00 H new ATOM 0 HG SER A 54 96.970 18.368 -4.643 1.00 0.00 H new ATOM 866 N PRO A 55 101.448 16.479 -6.676 1.00 0.00 N ATOM 867 CA PRO A 55 102.896 16.513 -7.024 1.00 0.00 C ATOM 868 C PRO A 55 103.426 17.926 -7.232 1.00 0.00 C ATOM 869 O PRO A 55 102.955 18.656 -8.105 1.00 0.00 O ATOM 870 CB PRO A 55 102.969 15.709 -8.322 1.00 0.00 C ATOM 871 CG PRO A 55 101.648 15.915 -8.983 1.00 0.00 C ATOM 872 CD PRO A 55 100.631 16.206 -7.876 1.00 0.00 C ATOM 0 HA PRO A 55 103.512 16.108 -6.221 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.785 16.057 -8.955 1.00 0.00 H new ATOM 0 HB3 PRO A 55 103.149 14.653 -8.122 1.00 0.00 H new ATOM 0 HG2 PRO A 55 101.696 16.744 -9.690 1.00 0.00 H new ATOM 0 HG3 PRO A 55 101.358 15.030 -9.549 1.00 0.00 H new ATOM 0 HD2 PRO A 55 100.003 17.060 -8.130 1.00 0.00 H new ATOM 0 HD3 PRO A 55 99.966 15.357 -7.717 1.00 0.00 H new ATOM 880 N THR A 56 104.408 18.303 -6.424 1.00 0.00 N ATOM 881 CA THR A 56 105.142 19.535 -6.671 1.00 0.00 C ATOM 882 C THR A 56 106.099 19.290 -7.829 1.00 0.00 C ATOM 883 O THR A 56 106.441 18.140 -8.111 1.00 0.00 O ATOM 884 CB THR A 56 105.916 19.956 -5.418 1.00 0.00 C ATOM 885 OG1 THR A 56 106.867 18.954 -5.085 1.00 0.00 O ATOM 886 CG2 THR A 56 104.941 20.144 -4.254 1.00 0.00 C ATOM 0 H THR A 56 104.711 17.781 -5.602 1.00 0.00 H new ATOM 0 HA THR A 56 104.450 20.340 -6.920 1.00 0.00 H new ATOM 0 HB THR A 56 106.435 20.895 -5.612 1.00 0.00 H new ATOM 0 HG1 THR A 56 106.688 18.146 -5.609 1.00 0.00 H new ATOM 0 HG21 THR A 56 105.492 20.444 -3.363 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.215 20.916 -4.508 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.420 19.206 -4.061 1.00 0.00 H new ATOM 894 N SER A 57 106.564 20.352 -8.481 1.00 0.00 N ATOM 895 CA SER A 57 107.328 20.184 -9.715 1.00 0.00 C ATOM 896 C SER A 57 108.514 19.239 -9.523 1.00 0.00 C ATOM 897 O SER A 57 109.349 19.431 -8.641 1.00 0.00 O ATOM 898 CB SER A 57 107.836 21.543 -10.197 1.00 0.00 C ATOM 899 OG SER A 57 106.726 22.379 -10.493 1.00 0.00 O ATOM 0 H SER A 57 106.430 21.319 -8.185 1.00 0.00 H new ATOM 0 HA SER A 57 106.663 19.746 -10.459 1.00 0.00 H new ATOM 0 HB2 SER A 57 108.460 22.004 -9.431 1.00 0.00 H new ATOM 0 HB3 SER A 57 108.459 21.418 -11.083 1.00 0.00 H new ATOM 0 HG SER A 57 107.047 23.252 -10.801 1.00 0.00 H new ATOM 905 N ASN A 58 108.565 18.215 -10.372 1.00 0.00 N ATOM 906 CA ASN A 58 109.718 17.323 -10.456 1.00 0.00 C ATOM 907 C ASN A 58 109.974 16.523 -9.176 1.00 0.00 C ATOM 908 O ASN A 58 111.024 15.889 -9.072 1.00 0.00 O ATOM 909 CB ASN A 58 110.970 18.134 -10.795 1.00 0.00 C ATOM 910 CG ASN A 58 110.774 18.868 -12.118 1.00 0.00 C ATOM 911 OD1 ASN A 58 110.200 18.315 -13.056 1.00 0.00 O ATOM 912 ND2 ASN A 58 111.219 20.087 -12.250 1.00 0.00 N ATOM 0 H ASN A 58 107.811 17.981 -11.018 1.00 0.00 H new ATOM 0 HA ASN A 58 109.489 16.601 -11.240 1.00 0.00 H new ATOM 0 HB2 ASN A 58 111.176 18.850 -9.999 1.00 0.00 H new ATOM 0 HB3 ASN A 58 111.834 17.473 -10.861 1.00 0.00 H new ATOM 0 HD21 ASN A 58 111.092 20.584 -13.132 1.00 0.00 H new ATOM 0 HD22 ASN A 58 111.694 20.543 -11.472 1.00 0.00 H new ATOM 919 N LYS A 59 109.044 16.528 -8.216 1.00 0.00 N ATOM 920 CA LYS A 59 109.280 15.813 -6.959 1.00 0.00 C ATOM 921 C LYS A 59 107.993 15.493 -6.189 1.00 0.00 C ATOM 922 O LYS A 59 106.952 16.118 -6.396 1.00 0.00 O ATOM 923 CB LYS A 59 110.247 16.625 -6.084 1.00 0.00 C ATOM 924 CG LYS A 59 109.589 17.920 -5.593 1.00 0.00 C ATOM 925 CD LYS A 59 110.616 18.762 -4.836 1.00 0.00 C ATOM 926 CE LYS A 59 109.901 19.887 -4.086 1.00 0.00 C ATOM 927 NZ LYS A 59 110.908 20.830 -3.525 1.00 0.00 N ATOM 0 H LYS A 59 108.145 17.005 -8.281 1.00 0.00 H new ATOM 0 HA LYS A 59 109.722 14.850 -7.214 1.00 0.00 H new ATOM 0 HB2 LYS A 59 110.560 16.025 -5.229 1.00 0.00 H new ATOM 0 HB3 LYS A 59 111.146 16.863 -6.653 1.00 0.00 H new ATOM 0 HG2 LYS A 59 109.195 18.483 -6.439 1.00 0.00 H new ATOM 0 HG3 LYS A 59 108.745 17.687 -4.944 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.168 18.137 -4.135 1.00 0.00 H new ATOM 0 HD3 LYS A 59 111.344 19.180 -5.532 1.00 0.00 H new ATOM 0 HE2 LYS A 59 109.227 20.417 -4.760 1.00 0.00 H new ATOM 0 HE3 LYS A 59 109.289 19.473 -3.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 110.421 21.595 -3.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 111.534 20.320 -2.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 111.473 21.235 -4.298 1.00 0.00 H new ATOM 941 N GLN A 60 108.094 14.508 -5.297 1.00 0.00 N ATOM 942 CA GLN A 60 107.018 14.182 -4.359 1.00 0.00 C ATOM 943 C GLN A 60 107.600 13.740 -3.020 1.00 0.00 C ATOM 944 O GLN A 60 108.713 13.217 -2.962 1.00 0.00 O ATOM 945 CB GLN A 60 106.126 13.054 -4.884 1.00 0.00 C ATOM 946 CG GLN A 60 105.324 13.527 -6.096 1.00 0.00 C ATOM 947 CD GLN A 60 104.338 12.439 -6.516 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.718 11.495 -7.207 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.089 12.499 -6.130 1.00 0.00 N ATOM 0 H GLN A 60 108.919 13.916 -5.204 1.00 0.00 H new ATOM 0 HA GLN A 60 106.419 15.085 -4.240 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.739 12.195 -5.158 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.447 12.723 -4.098 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.787 14.444 -5.854 1.00 0.00 H new ATOM 0 HG3 GLN A 60 105.997 13.760 -6.921 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.769 13.280 -5.557 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.435 11.765 -6.402 1.00 0.00 H new ATOM 958 N ASP A 61 106.841 13.939 -1.948 1.00 0.00 N ATOM 959 CA ASP A 61 107.247 13.441 -0.638 1.00 0.00 C ATOM 960 C ASP A 61 106.640 12.062 -0.396 1.00 0.00 C ATOM 961 O ASP A 61 105.429 11.884 -0.513 1.00 0.00 O ATOM 962 CB ASP A 61 106.785 14.407 0.458 1.00 0.00 C ATOM 963 CG ASP A 61 107.460 15.766 0.292 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.580 15.804 -0.192 1.00 0.00 O ATOM 965 OD2 ASP A 61 106.843 16.755 0.654 1.00 0.00 O ATOM 0 H ASP A 61 105.950 14.436 -1.958 1.00 0.00 H new ATOM 0 HA ASP A 61 108.334 13.365 -0.611 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.702 14.524 0.415 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.022 13.994 1.439 1.00 0.00 H new ATOM 970 N ILE A 62 107.482 11.085 -0.058 1.00 0.00 N ATOM 971 CA ILE A 62 107.010 9.716 0.157 1.00 0.00 C ATOM 972 C ILE A 62 107.465 9.204 1.525 1.00 0.00 C ATOM 973 O ILE A 62 108.579 9.496 1.957 1.00 0.00 O ATOM 974 CB ILE A 62 107.532 8.819 -0.976 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.919 7.422 -0.858 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.060 8.716 -0.928 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.487 7.446 -1.392 1.00 0.00 C ATOM 0 H ILE A 62 108.485 11.213 0.072 1.00 0.00 H new ATOM 0 HA ILE A 62 105.920 9.697 0.146 1.00 0.00 H new ATOM 0 HB ILE A 62 107.243 9.265 -1.928 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.516 6.703 -1.419 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.925 7.098 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.407 8.076 -1.739 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.495 9.709 -1.038 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.366 8.289 0.027 1.00 0.00 H new ATOM 0 HD11 ILE A 62 105.051 6.451 -1.308 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.894 8.153 -0.811 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.494 7.752 -2.438 1.00 0.00 H new ATOM 989 N SER A 63 106.611 8.434 2.200 1.00 0.00 N ATOM 990 CA SER A 63 106.933 7.967 3.546 1.00 0.00 C ATOM 991 C SER A 63 106.375 6.572 3.814 1.00 0.00 C ATOM 992 O SER A 63 105.509 6.073 3.092 1.00 0.00 O ATOM 993 CB SER A 63 106.377 8.943 4.585 1.00 0.00 C ATOM 994 OG SER A 63 104.964 8.808 4.645 1.00 0.00 O ATOM 0 H SER A 63 105.706 8.125 1.844 1.00 0.00 H new ATOM 0 HA SER A 63 108.019 7.917 3.623 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.815 8.741 5.562 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.646 9.966 4.321 1.00 0.00 H new ATOM 0 HG SER A 63 104.583 8.956 3.754 1.00 0.00 H new ATOM 1000 N GLU A 64 106.881 5.946 4.871 1.00 0.00 N ATOM 1001 CA GLU A 64 106.417 4.621 5.262 1.00 0.00 C ATOM 1002 C GLU A 64 104.905 4.607 5.474 1.00 0.00 C ATOM 1003 O GLU A 64 104.243 3.627 5.142 1.00 0.00 O ATOM 1004 CB GLU A 64 107.125 4.174 6.544 1.00 0.00 C ATOM 1005 CG GLU A 64 106.875 5.193 7.661 1.00 0.00 C ATOM 1006 CD GLU A 64 107.655 4.847 8.935 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.255 3.784 9.000 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.632 5.661 9.843 1.00 0.00 O ATOM 0 H GLU A 64 107.610 6.333 5.470 1.00 0.00 H new ATOM 0 HA GLU A 64 106.656 3.928 4.455 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.761 3.192 6.847 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.195 4.075 6.363 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.163 6.186 7.317 1.00 0.00 H new ATOM 0 HG3 GLU A 64 105.809 5.230 7.887 1.00 0.00 H new ATOM 1015 N ALA A 65 104.357 5.702 5.995 1.00 0.00 N ATOM 1016 CA ALA A 65 102.918 5.778 6.228 1.00 0.00 C ATOM 1017 C ALA A 65 102.152 5.590 4.922 1.00 0.00 C ATOM 1018 O ALA A 65 101.119 4.920 4.890 1.00 0.00 O ATOM 1019 CB ALA A 65 102.554 7.133 6.838 1.00 0.00 C ATOM 0 H ALA A 65 104.879 6.537 6.260 1.00 0.00 H new ATOM 0 HA ALA A 65 102.642 4.982 6.919 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.478 7.179 7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.076 7.257 7.787 1.00 0.00 H new ATOM 0 HB3 ALA A 65 102.848 7.930 6.155 1.00 0.00 H new ATOM 1025 N ASN A 66 102.660 6.182 3.846 1.00 0.00 N ATOM 1026 CA ASN A 66 101.978 6.114 2.558 1.00 0.00 C ATOM 1027 C ASN A 66 101.955 4.691 2.010 1.00 0.00 C ATOM 1028 O ASN A 66 100.914 4.210 1.560 1.00 0.00 O ATOM 1029 CB ASN A 66 102.682 7.019 1.546 1.00 0.00 C ATOM 1030 CG ASN A 66 102.723 8.456 2.053 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.779 8.947 2.448 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.630 9.167 2.052 1.00 0.00 N ATOM 0 H ASN A 66 103.533 6.709 3.839 1.00 0.00 H new ATOM 0 HA ASN A 66 100.951 6.446 2.714 1.00 0.00 H new ATOM 0 HB2 ASN A 66 103.696 6.660 1.372 1.00 0.00 H new ATOM 0 HB3 ASN A 66 102.161 6.979 0.589 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.650 10.133 2.379 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.755 8.757 1.724 1.00 0.00 H new ATOM 1039 N LEU A 67 103.103 4.017 2.050 1.00 0.00 N ATOM 1040 CA LEU A 67 103.208 2.690 1.437 1.00 0.00 C ATOM 1041 C LEU A 67 102.888 1.539 2.400 1.00 0.00 C ATOM 1042 O LEU A 67 102.799 0.392 1.965 1.00 0.00 O ATOM 1043 CB LEU A 67 104.611 2.481 0.846 1.00 0.00 C ATOM 1044 CG LEU A 67 105.011 3.644 -0.084 1.00 0.00 C ATOM 1045 CD1 LEU A 67 106.404 3.393 -0.698 1.00 0.00 C ATOM 1046 CD2 LEU A 67 103.975 3.818 -1.207 1.00 0.00 C ATOM 0 H LEU A 67 103.958 4.357 2.490 1.00 0.00 H new ATOM 0 HA LEU A 67 102.455 2.667 0.650 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.338 2.393 1.654 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.637 1.544 0.290 1.00 0.00 H new ATOM 0 HG LEU A 67 105.045 4.556 0.512 1.00 0.00 H new ATOM 0 HD11 LEU A 67 106.669 4.224 -1.351 1.00 0.00 H new ATOM 0 HD12 LEU A 67 107.143 3.308 0.099 1.00 0.00 H new ATOM 0 HD13 LEU A 67 106.386 2.469 -1.276 1.00 0.00 H new ATOM 0 HD21 LEU A 67 104.274 4.643 -1.853 1.00 0.00 H new ATOM 0 HD22 LEU A 67 103.916 2.901 -1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 67 102.999 4.033 -0.772 1.00 0.00 H new ATOM 1058 N ALA A 68 102.719 1.825 3.691 1.00 0.00 N ATOM 1059 CA ALA A 68 102.389 0.783 4.660 1.00 0.00 C ATOM 1060 C ALA A 68 103.514 -0.267 4.695 1.00 0.00 C ATOM 1061 O ALA A 68 104.673 0.091 4.488 1.00 0.00 O ATOM 1062 CB ALA A 68 101.020 0.186 4.301 1.00 0.00 C ATOM 0 H ALA A 68 102.804 2.761 4.086 1.00 0.00 H new ATOM 0 HA ALA A 68 102.314 1.194 5.667 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.764 -0.594 5.018 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.263 0.969 4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 68 101.061 -0.242 3.299 1.00 0.00 H new ATOM 1068 N TYR A 69 103.207 -1.547 4.924 1.00 0.00 N ATOM 1069 CA TYR A 69 104.248 -2.566 5.067 1.00 0.00 C ATOM 1070 C TYR A 69 105.169 -2.639 3.843 1.00 0.00 C ATOM 1071 O TYR A 69 106.310 -3.088 3.953 1.00 0.00 O ATOM 1072 CB TYR A 69 103.602 -3.933 5.295 1.00 0.00 C ATOM 1073 CG TYR A 69 102.805 -4.013 6.577 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.456 -4.263 7.791 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.416 -3.838 6.550 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.719 -4.337 8.978 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.679 -3.913 7.738 1.00 0.00 C ATOM 1078 CZ TYR A 69 101.330 -4.162 8.952 1.00 0.00 C ATOM 1079 OH TYR A 69 100.603 -4.236 10.122 1.00 0.00 O ATOM 0 H TYR A 69 102.254 -1.899 5.014 1.00 0.00 H new ATOM 0 HA TYR A 69 104.860 -2.284 5.924 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.948 -4.162 4.454 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.380 -4.696 5.311 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.527 -4.399 7.811 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.914 -3.645 5.614 1.00 0.00 H new ATOM 0 HE1 TYR A 69 103.222 -4.529 9.914 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.608 -3.779 7.718 1.00 0.00 H new ATOM 0 HH TYR A 69 99.654 -4.090 9.927 1.00 0.00 H new ATOM 1089 N LEU A 70 104.680 -2.202 2.685 1.00 0.00 N ATOM 1090 CA LEU A 70 105.481 -2.243 1.460 1.00 0.00 C ATOM 1091 C LEU A 70 106.780 -1.435 1.584 1.00 0.00 C ATOM 1092 O LEU A 70 107.736 -1.683 0.849 1.00 0.00 O ATOM 1093 CB LEU A 70 104.667 -1.715 0.277 1.00 0.00 C ATOM 1094 CG LEU A 70 103.608 -2.746 -0.121 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.385 -2.610 0.786 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.191 -2.510 -1.575 1.00 0.00 C ATOM 0 H LEU A 70 103.742 -1.818 2.567 1.00 0.00 H new ATOM 0 HA LEU A 70 105.751 -3.286 1.293 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.189 -0.773 0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 70 105.325 -1.511 -0.568 1.00 0.00 H new ATOM 0 HG LEU A 70 104.024 -3.748 -0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.635 -3.346 0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 70 102.680 -2.778 1.822 1.00 0.00 H new ATOM 0 HD13 LEU A 70 101.967 -1.608 0.686 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.437 -3.243 -1.861 1.00 0.00 H new ATOM 0 HD22 LEU A 70 102.778 -1.506 -1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 70 104.061 -2.612 -2.224 1.00 0.00 H new ATOM 1108 N TRP A 71 106.819 -0.476 2.508 1.00 0.00 N ATOM 1109 CA TRP A 71 107.992 0.373 2.683 1.00 0.00 C ATOM 1110 C TRP A 71 109.239 -0.489 2.935 1.00 0.00 C ATOM 1111 O TRP A 71 109.369 -1.052 4.024 1.00 0.00 O ATOM 1112 CB TRP A 71 107.767 1.285 3.889 1.00 0.00 C ATOM 1113 CG TRP A 71 108.741 2.414 3.972 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.704 2.538 4.913 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.865 3.579 3.103 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.402 3.706 4.684 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.932 4.381 3.577 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.166 4.015 1.966 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.292 5.572 2.941 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.526 5.209 1.324 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.586 5.985 1.807 1.00 0.00 C ATOM 0 H TRP A 71 106.051 -0.269 3.146 1.00 0.00 H new ATOM 0 HA TRP A 71 108.144 0.965 1.780 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.756 1.690 3.844 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.833 0.691 4.801 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.895 1.838 5.713 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.175 4.032 5.265 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.345 3.427 1.583 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.108 6.168 3.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 107.981 5.532 0.450 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.858 6.901 1.305 1.00 0.00 H new ATOM 1132 N PRO A 72 110.153 -0.616 1.994 1.00 0.00 N ATOM 1133 CA PRO A 72 111.321 -1.536 2.149 1.00 0.00 C ATOM 1134 C PRO A 72 112.527 -0.905 2.846 1.00 0.00 C ATOM 1135 O PRO A 72 113.466 -1.612 3.209 1.00 0.00 O ATOM 1136 CB PRO A 72 111.665 -1.891 0.705 1.00 0.00 C ATOM 1137 CG PRO A 72 111.346 -0.660 -0.071 1.00 0.00 C ATOM 1138 CD PRO A 72 110.219 0.054 0.678 1.00 0.00 C ATOM 0 HA PRO A 72 111.072 -2.386 2.784 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.716 -2.163 0.603 1.00 0.00 H new ATOM 0 HB3 PRO A 72 111.080 -2.742 0.356 1.00 0.00 H new ATOM 0 HG2 PRO A 72 112.223 -0.018 -0.155 1.00 0.00 H new ATOM 0 HG3 PRO A 72 111.037 -0.912 -1.086 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.429 1.118 0.786 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.273 -0.031 0.143 1.00 0.00 H new ATOM 1146 N LEU A 73 112.531 0.418 2.991 1.00 0.00 N ATOM 1147 CA LEU A 73 113.696 1.111 3.541 1.00 0.00 C ATOM 1148 C LEU A 73 113.639 1.187 5.064 1.00 0.00 C ATOM 1149 O LEU A 73 112.568 1.322 5.656 1.00 0.00 O ATOM 1150 CB LEU A 73 113.778 2.532 2.985 1.00 0.00 C ATOM 1151 CG LEU A 73 113.793 2.511 1.455 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.796 3.953 0.949 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.051 1.792 0.957 1.00 0.00 C ATOM 0 H LEU A 73 111.752 1.026 2.739 1.00 0.00 H new ATOM 0 HA LEU A 73 114.577 0.539 3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.928 3.116 3.338 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.678 3.022 3.356 1.00 0.00 H new ATOM 0 HG LEU A 73 112.914 1.984 1.084 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.807 3.956 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU A 73 112.902 4.465 1.305 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.682 4.468 1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.056 1.780 -0.133 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.936 2.315 1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.057 0.768 1.331 1.00 0.00 H new ATOM 1165 N THR A 74 114.810 1.099 5.684 1.00 0.00 N ATOM 1166 CA THR A 74 114.930 1.248 7.129 1.00 0.00 C ATOM 1167 C THR A 74 114.648 2.689 7.549 1.00 0.00 C ATOM 1168 O THR A 74 114.047 2.919 8.599 1.00 0.00 O ATOM 1169 CB THR A 74 116.337 0.850 7.584 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.289 1.721 6.988 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.627 -0.592 7.165 1.00 0.00 C ATOM 0 H THR A 74 115.694 0.924 5.206 1.00 0.00 H new ATOM 0 HA THR A 74 114.197 0.594 7.601 1.00 0.00 H new ATOM 0 HB THR A 74 116.402 0.927 8.669 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.409 1.479 6.046 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.629 -0.871 7.491 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.897 -1.258 7.625 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.562 -0.676 6.080 1.00 0.00 H new ATOM 1179 N VAL A 75 115.078 3.655 6.733 1.00 0.00 N ATOM 1180 CA VAL A 75 114.764 5.052 7.017 1.00 0.00 C ATOM 1181 C VAL A 75 113.263 5.243 6.866 1.00 0.00 C ATOM 1182 O VAL A 75 112.682 4.830 5.866 1.00 0.00 O ATOM 1183 CB VAL A 75 115.519 6.000 6.080 1.00 0.00 C ATOM 1184 CG1 VAL A 75 117.024 5.848 6.304 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.192 5.674 4.621 1.00 0.00 C ATOM 0 H VAL A 75 115.631 3.499 5.890 1.00 0.00 H new ATOM 0 HA VAL A 75 115.077 5.291 8.033 1.00 0.00 H new ATOM 0 HB VAL A 75 115.214 7.024 6.295 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.561 6.523 5.637 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.264 6.093 7.339 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.321 4.820 6.096 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.735 6.355 3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.487 4.648 4.403 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.121 5.787 4.454 1.00 0.00 H new ATOM 1195 N ASP A 76 112.636 5.851 7.863 1.00 0.00 N ATOM 1196 CA ASP A 76 111.179 5.875 7.921 1.00 0.00 C ATOM 1197 C ASP A 76 110.568 6.597 6.727 1.00 0.00 C ATOM 1198 O ASP A 76 109.469 6.248 6.297 1.00 0.00 O ATOM 1199 CB ASP A 76 110.712 6.534 9.222 1.00 0.00 C ATOM 1200 CG ASP A 76 111.141 5.703 10.429 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.239 4.493 10.297 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.365 6.293 11.474 1.00 0.00 O ATOM 0 H ASP A 76 113.104 6.328 8.633 1.00 0.00 H new ATOM 0 HA ASP A 76 110.838 4.840 7.891 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.130 7.538 9.298 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.627 6.640 9.213 1.00 0.00 H new ATOM 1207 N HIS A 77 111.256 7.612 6.210 1.00 0.00 N ATOM 1208 CA HIS A 77 110.728 8.352 5.070 1.00 0.00 C ATOM 1209 C HIS A 77 111.857 8.853 4.184 1.00 0.00 C ATOM 1210 O HIS A 77 113.032 8.652 4.489 1.00 0.00 O ATOM 1211 CB HIS A 77 109.872 9.526 5.550 1.00 0.00 C ATOM 1212 CG HIS A 77 110.575 10.438 6.518 1.00 0.00 C ATOM 1213 ND1 HIS A 77 111.067 9.991 7.733 1.00 0.00 N ATOM 1214 CD2 HIS A 77 110.862 11.781 6.468 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.618 11.044 8.361 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.521 12.161 7.634 1.00 0.00 N ATOM 0 H HIS A 77 112.160 7.935 6.554 1.00 0.00 H new ATOM 0 HA HIS A 77 110.104 7.678 4.483 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.552 10.107 4.685 1.00 0.00 H new ATOM 0 HB3 HIS A 77 108.971 9.136 6.023 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.614 12.441 5.650 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.083 10.993 9.335 1.00 0.00 H new ATOM 0 HE2 HIS A 77 111.857 13.092 7.880 1.00 0.00 H new ATOM 1224 N GLY A 78 111.484 9.441 3.056 1.00 0.00 N ATOM 1225 CA GLY A 78 112.446 10.052 2.154 1.00 0.00 C ATOM 1226 C GLY A 78 111.717 10.818 1.058 1.00 0.00 C ATOM 1227 O GLY A 78 110.520 10.626 0.835 1.00 0.00 O ATOM 0 H GLY A 78 110.515 9.507 2.744 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.099 10.726 2.708 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.081 9.284 1.712 1.00 0.00 H new ATOM 1231 N THR A 79 112.432 11.713 0.394 1.00 0.00 N ATOM 1232 CA THR A 79 111.850 12.494 -0.691 1.00 0.00 C ATOM 1233 C THR A 79 112.398 12.018 -2.030 1.00 0.00 C ATOM 1234 O THR A 79 113.582 11.716 -2.146 1.00 0.00 O ATOM 1235 CB THR A 79 112.174 13.974 -0.496 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.038 14.307 0.879 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.189 14.806 -1.317 1.00 0.00 C ATOM 0 H THR A 79 113.413 11.918 0.585 1.00 0.00 H new ATOM 0 HA THR A 79 110.768 12.360 -0.683 1.00 0.00 H new ATOM 0 HB THR A 79 113.194 14.178 -0.820 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.247 15.256 1.008 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.410 15.865 -1.186 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.281 14.544 -2.371 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.172 14.603 -0.980 1.00 0.00 H new ATOM 1245 N ILE A 80 111.539 11.949 -3.041 1.00 0.00 N ATOM 1246 CA ILE A 80 111.958 11.498 -4.366 1.00 0.00 C ATOM 1247 C ILE A 80 112.007 12.677 -5.327 1.00 0.00 C ATOM 1248 O ILE A 80 111.096 13.506 -5.347 1.00 0.00 O ATOM 1249 CB ILE A 80 110.998 10.424 -4.891 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.556 10.947 -4.882 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.103 9.187 -3.997 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.626 9.914 -5.520 1.00 0.00 C ATOM 0 H ILE A 80 110.552 12.198 -2.971 1.00 0.00 H new ATOM 0 HA ILE A 80 112.955 11.064 -4.290 1.00 0.00 H new ATOM 0 HB ILE A 80 111.267 10.168 -5.916 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.240 11.151 -3.859 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.498 11.889 -5.428 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.424 8.416 -4.361 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.125 8.809 -4.017 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.835 9.453 -2.975 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.603 10.291 -5.511 1.00 0.00 H new ATOM 0 HD12 ILE A 80 108.936 9.731 -6.549 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.675 8.983 -4.956 1.00 0.00 H new ATOM 1264 N GLU A 81 113.080 12.758 -6.109 1.00 0.00 N ATOM 1265 CA GLU A 81 113.261 13.893 -7.005 1.00 0.00 C ATOM 1266 C GLU A 81 113.957 13.492 -8.301 1.00 0.00 C ATOM 1267 O GLU A 81 114.847 12.642 -8.315 1.00 0.00 O ATOM 1268 CB GLU A 81 114.081 14.977 -6.300 1.00 0.00 C ATOM 1269 CG GLU A 81 114.121 16.243 -7.166 1.00 0.00 C ATOM 1270 CD GLU A 81 115.007 17.332 -6.549 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.594 17.104 -5.500 1.00 0.00 O ATOM 1272 OE2 GLU A 81 115.084 18.394 -7.143 1.00 0.00 O ATOM 0 H GLU A 81 113.826 12.063 -6.140 1.00 0.00 H new ATOM 0 HA GLU A 81 112.272 14.273 -7.262 1.00 0.00 H new ATOM 0 HB2 GLU A 81 113.642 15.204 -5.328 1.00 0.00 H new ATOM 0 HB3 GLU A 81 115.094 14.618 -6.117 1.00 0.00 H new ATOM 0 HG2 GLU A 81 114.494 15.992 -8.159 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.109 16.628 -7.293 1.00 0.00 H new ATOM 1279 N CYS A 82 113.517 14.111 -9.390 1.00 0.00 N ATOM 1280 CA CYS A 82 114.210 13.994 -10.667 1.00 0.00 C ATOM 1281 C CYS A 82 115.014 15.267 -10.911 1.00 0.00 C ATOM 1282 O CYS A 82 114.448 16.360 -10.984 1.00 0.00 O ATOM 1283 CB CYS A 82 113.199 13.787 -11.798 1.00 0.00 C ATOM 1284 SG CYS A 82 112.540 12.104 -11.717 1.00 0.00 S ATOM 0 H CYS A 82 112.684 14.699 -9.414 1.00 0.00 H new ATOM 0 HA CYS A 82 114.881 13.135 -10.642 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.389 14.511 -11.713 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.677 13.956 -12.763 1.00 0.00 H new ATOM 1289 N LEU A 83 116.330 15.128 -11.036 1.00 0.00 N ATOM 1290 CA LEU A 83 117.201 16.299 -11.120 1.00 0.00 C ATOM 1291 C LEU A 83 117.347 16.777 -12.566 1.00 0.00 C ATOM 1292 O LEU A 83 117.167 15.987 -13.492 1.00 0.00 O ATOM 1293 CB LEU A 83 118.584 15.976 -10.551 1.00 0.00 C ATOM 1294 CG LEU A 83 118.453 15.485 -9.107 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.791 14.912 -8.639 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.057 16.657 -8.205 1.00 0.00 C ATOM 0 H LEU A 83 116.813 14.231 -11.081 1.00 0.00 H new ATOM 0 HA LEU A 83 116.742 17.095 -10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 83 119.068 15.213 -11.161 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.217 16.862 -10.587 1.00 0.00 H new ATOM 0 HG LEU A 83 117.688 14.710 -9.055 1.00 0.00 H new ATOM 0 HD11 LEU A 83 119.697 14.562 -7.611 1.00 0.00 H new ATOM 0 HD12 LEU A 83 120.074 14.078 -9.281 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.556 15.686 -8.691 1.00 0.00 H new ATOM 0 HD21 LEU A 83 117.963 16.309 -7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 83 118.822 17.431 -8.258 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.103 17.066 -8.538 1.00 0.00 H new ATOM 1308 N PRO A 84 117.680 18.033 -12.790 1.00 0.00 N ATOM 1309 CA PRO A 84 117.881 18.549 -14.183 1.00 0.00 C ATOM 1310 C PRO A 84 118.850 17.698 -15.010 1.00 0.00 C ATOM 1311 O PRO A 84 118.864 17.789 -16.238 1.00 0.00 O ATOM 1312 CB PRO A 84 118.442 19.959 -13.988 1.00 0.00 C ATOM 1313 CG PRO A 84 117.992 20.381 -12.631 1.00 0.00 C ATOM 1314 CD PRO A 84 117.893 19.107 -11.796 1.00 0.00 C ATOM 0 HA PRO A 84 116.946 18.525 -14.742 1.00 0.00 H new ATOM 0 HB2 PRO A 84 119.530 19.962 -14.060 1.00 0.00 H new ATOM 0 HB3 PRO A 84 118.070 20.639 -14.754 1.00 0.00 H new ATOM 0 HG2 PRO A 84 118.699 21.082 -12.188 1.00 0.00 H new ATOM 0 HG3 PRO A 84 117.029 20.889 -12.681 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.802 18.939 -11.218 1.00 0.00 H new ATOM 0 HD3 PRO A 84 117.068 19.160 -11.085 1.00 0.00 H new ATOM 1322 N SER A 85 119.656 16.875 -14.344 1.00 0.00 N ATOM 1323 CA SER A 85 120.636 16.040 -15.043 1.00 0.00 C ATOM 1324 C SER A 85 120.011 14.811 -15.722 1.00 0.00 C ATOM 1325 O SER A 85 120.724 14.025 -16.345 1.00 0.00 O ATOM 1326 CB SER A 85 121.706 15.574 -14.055 1.00 0.00 C ATOM 1327 OG SER A 85 121.169 14.544 -13.236 1.00 0.00 O ATOM 0 H SER A 85 119.653 16.767 -13.330 1.00 0.00 H new ATOM 0 HA SER A 85 121.070 16.657 -15.830 1.00 0.00 H new ATOM 0 HB2 SER A 85 122.580 15.208 -14.593 1.00 0.00 H new ATOM 0 HB3 SER A 85 122.037 16.410 -13.439 1.00 0.00 H new ATOM 0 HG SER A 85 120.305 14.831 -12.874 1.00 0.00 H new ATOM 1333 N ASP A 86 118.692 14.637 -15.610 1.00 0.00 N ATOM 1334 CA ASP A 86 118.006 13.503 -16.221 1.00 0.00 C ATOM 1335 C ASP A 86 118.422 12.198 -15.542 1.00 0.00 C ATOM 1336 O ASP A 86 118.720 11.203 -16.205 1.00 0.00 O ATOM 1337 CB ASP A 86 118.292 13.447 -17.726 1.00 0.00 C ATOM 1338 CG ASP A 86 117.274 12.544 -18.415 1.00 0.00 C ATOM 1339 OD1 ASP A 86 116.220 13.040 -18.774 1.00 0.00 O ATOM 1340 OD2 ASP A 86 117.563 11.370 -18.575 1.00 0.00 O ATOM 0 H ASP A 86 118.078 15.271 -15.099 1.00 0.00 H new ATOM 0 HA ASP A 86 116.933 13.634 -16.084 1.00 0.00 H new ATOM 0 HB2 ASP A 86 118.248 14.450 -18.151 1.00 0.00 H new ATOM 0 HB3 ASP A 86 119.300 13.071 -17.900 1.00 0.00 H new ATOM 1345 N ASN A 87 118.470 12.231 -14.212 1.00 0.00 N ATOM 1346 CA ASN A 87 118.701 11.032 -13.410 1.00 0.00 C ATOM 1347 C ASN A 87 117.721 11.007 -12.238 1.00 0.00 C ATOM 1348 O ASN A 87 117.368 12.056 -11.696 1.00 0.00 O ATOM 1349 CB ASN A 87 120.151 11.003 -12.907 1.00 0.00 C ATOM 1350 CG ASN A 87 120.425 12.156 -11.943 1.00 0.00 C ATOM 1351 OD1 ASN A 87 119.646 13.105 -11.866 1.00 0.00 O ATOM 1352 ND2 ASN A 87 121.495 12.128 -11.196 1.00 0.00 N ATOM 0 H ASN A 87 118.351 13.083 -13.663 1.00 0.00 H new ATOM 0 HA ASN A 87 118.538 10.147 -14.025 1.00 0.00 H new ATOM 0 HB2 ASN A 87 120.346 10.054 -12.408 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.834 11.064 -13.754 1.00 0.00 H new ATOM 0 HD21 ASN A 87 121.685 12.893 -10.549 1.00 0.00 H new ATOM 0 HD22 ASN A 87 122.141 11.341 -11.260 1.00 0.00 H new ATOM 1359 N ALA A 88 117.278 9.813 -11.857 1.00 0.00 N ATOM 1360 CA ALA A 88 116.308 9.677 -10.773 1.00 0.00 C ATOM 1361 C ALA A 88 117.000 9.249 -9.482 1.00 0.00 C ATOM 1362 O ALA A 88 117.644 8.199 -9.434 1.00 0.00 O ATOM 1363 CB ALA A 88 115.249 8.642 -11.161 1.00 0.00 C ATOM 0 H ALA A 88 117.572 8.932 -12.278 1.00 0.00 H new ATOM 0 HA ALA A 88 115.832 10.643 -10.606 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.526 8.541 -10.352 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.737 8.967 -12.067 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.729 7.680 -11.341 1.00 0.00 H new ATOM 1369 N VAL A 89 116.833 10.043 -8.423 1.00 0.00 N ATOM 1370 CA VAL A 89 117.498 9.757 -7.152 1.00 0.00 C ATOM 1371 C VAL A 89 116.535 9.858 -5.968 1.00 0.00 C ATOM 1372 O VAL A 89 115.495 10.515 -6.037 1.00 0.00 O ATOM 1373 CB VAL A 89 118.658 10.731 -6.936 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.695 10.549 -8.045 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.135 12.169 -6.962 1.00 0.00 C ATOM 0 H VAL A 89 116.250 10.880 -8.420 1.00 0.00 H new ATOM 0 HA VAL A 89 117.870 8.734 -7.205 1.00 0.00 H new ATOM 0 HB VAL A 89 119.120 10.530 -5.969 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.520 11.244 -7.889 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.073 9.527 -8.026 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.232 10.747 -9.012 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.963 12.860 -6.808 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.670 12.370 -7.927 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.399 12.303 -6.170 1.00 0.00 H new ATOM 1385 N PHE A 90 116.923 9.203 -4.879 1.00 0.00 N ATOM 1386 CA PHE A 90 116.154 9.187 -3.638 1.00 0.00 C ATOM 1387 C PHE A 90 116.930 9.907 -2.536 1.00 0.00 C ATOM 1388 O PHE A 90 118.098 9.613 -2.305 1.00 0.00 O ATOM 1389 CB PHE A 90 115.917 7.729 -3.235 1.00 0.00 C ATOM 1390 CG PHE A 90 115.224 7.537 -1.905 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.844 7.747 -1.791 1.00 0.00 C ATOM 1392 CD2 PHE A 90 115.964 7.125 -0.791 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.205 7.544 -0.561 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.326 6.924 0.439 1.00 0.00 C ATOM 1395 CZ PHE A 90 113.947 7.132 0.553 1.00 0.00 C ATOM 0 H PHE A 90 117.787 8.663 -4.832 1.00 0.00 H new ATOM 0 HA PHE A 90 115.201 9.696 -3.784 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.322 7.246 -4.010 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.878 7.216 -3.204 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.273 8.065 -2.651 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.028 6.962 -0.880 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.141 7.705 -0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.898 6.609 1.299 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.454 6.975 1.501 1.00 0.00 H new ATOM 1405 N VAL A 91 116.282 10.848 -1.860 1.00 0.00 N ATOM 1406 CA VAL A 91 116.930 11.594 -0.782 1.00 0.00 C ATOM 1407 C VAL A 91 116.362 11.144 0.557 1.00 0.00 C ATOM 1408 O VAL A 91 115.147 11.096 0.731 1.00 0.00 O ATOM 1409 CB VAL A 91 116.679 13.099 -0.964 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.384 13.919 0.129 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.199 13.541 -2.336 1.00 0.00 C ATOM 0 H VAL A 91 115.313 11.114 -2.036 1.00 0.00 H new ATOM 0 HA VAL A 91 118.003 11.404 -0.808 1.00 0.00 H new ATOM 0 HB VAL A 91 115.606 13.275 -0.890 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.187 14.980 -0.028 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.007 13.621 1.107 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.458 13.739 0.083 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.021 14.609 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.268 13.341 -2.402 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.678 12.989 -3.118 1.00 0.00 H new ATOM 1421 N ALA A 92 117.240 10.838 1.508 1.00 0.00 N ATOM 1422 CA ALA A 92 116.786 10.428 2.839 1.00 0.00 C ATOM 1423 C ALA A 92 116.883 11.593 3.828 1.00 0.00 C ATOM 1424 O ALA A 92 117.684 12.502 3.620 1.00 0.00 O ATOM 1425 CB ALA A 92 117.633 9.258 3.342 1.00 0.00 C ATOM 0 H ALA A 92 118.253 10.864 1.389 1.00 0.00 H new ATOM 0 HA ALA A 92 115.744 10.118 2.765 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.289 8.959 4.332 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.536 8.417 2.655 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.678 9.563 3.398 1.00 0.00 H new ATOM 1431 N PRO A 93 116.100 11.601 4.890 1.00 0.00 N ATOM 1432 CA PRO A 93 116.149 12.710 5.892 1.00 0.00 C ATOM 1433 C PRO A 93 117.568 13.052 6.340 1.00 0.00 C ATOM 1434 O PRO A 93 117.847 14.186 6.728 1.00 0.00 O ATOM 1435 CB PRO A 93 115.330 12.193 7.078 1.00 0.00 C ATOM 1436 CG PRO A 93 114.414 11.160 6.522 1.00 0.00 C ATOM 1437 CD PRO A 93 115.069 10.607 5.256 1.00 0.00 C ATOM 0 HA PRO A 93 115.759 13.633 5.463 1.00 0.00 H new ATOM 0 HB2 PRO A 93 115.978 11.768 7.845 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.769 13.001 7.547 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.247 10.364 7.247 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.440 11.593 6.293 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.512 9.628 5.437 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.339 10.484 4.456 1.00 0.00 H new ATOM 1445 N ASP A 94 118.459 12.070 6.284 1.00 0.00 N ATOM 1446 CA ASP A 94 119.833 12.275 6.739 1.00 0.00 C ATOM 1447 C ASP A 94 120.594 13.309 5.894 1.00 0.00 C ATOM 1448 O ASP A 94 121.679 13.740 6.282 1.00 0.00 O ATOM 1449 CB ASP A 94 120.579 10.933 6.730 1.00 0.00 C ATOM 1450 CG ASP A 94 120.488 10.235 5.368 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.054 10.857 4.413 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.866 9.075 5.294 1.00 0.00 O ATOM 0 H ASP A 94 118.261 11.133 5.933 1.00 0.00 H new ATOM 0 HA ASP A 94 119.785 12.674 7.752 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.626 11.099 6.983 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.164 10.282 7.500 1.00 0.00 H new ATOM 1457 N GLY A 95 120.040 13.707 4.748 1.00 0.00 N ATOM 1458 CA GLY A 95 120.727 14.639 3.849 1.00 0.00 C ATOM 1459 C GLY A 95 121.635 13.928 2.833 1.00 0.00 C ATOM 1460 O GLY A 95 122.421 14.577 2.143 1.00 0.00 O ATOM 0 H GLY A 95 119.123 13.402 4.421 1.00 0.00 H new ATOM 0 HA2 GLY A 95 119.986 15.233 3.314 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.325 15.333 4.440 1.00 0.00 H new ATOM 1464 N THR A 96 121.529 12.603 2.742 1.00 0.00 N ATOM 1465 CA THR A 96 122.333 11.818 1.821 1.00 0.00 C ATOM 1466 C THR A 96 121.510 11.501 0.583 1.00 0.00 C ATOM 1467 O THR A 96 120.322 11.195 0.688 1.00 0.00 O ATOM 1468 CB THR A 96 122.750 10.511 2.499 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.430 10.806 3.711 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.670 9.710 1.576 1.00 0.00 C ATOM 0 H THR A 96 120.884 12.049 3.305 1.00 0.00 H new ATOM 0 HA THR A 96 123.221 12.382 1.537 1.00 0.00 H new ATOM 0 HB THR A 96 121.860 9.918 2.712 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.697 9.970 4.148 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.961 8.782 2.068 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.145 9.480 0.649 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.561 10.297 1.352 1.00 0.00 H new ATOM 1478 N THR A 97 122.138 11.578 -0.584 1.00 0.00 N ATOM 1479 CA THR A 97 121.447 11.257 -1.826 1.00 0.00 C ATOM 1480 C THR A 97 121.864 9.873 -2.313 1.00 0.00 C ATOM 1481 O THR A 97 123.050 9.556 -2.402 1.00 0.00 O ATOM 1482 CB THR A 97 121.778 12.300 -2.896 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.483 13.596 -2.395 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.942 12.033 -4.149 1.00 0.00 C ATOM 0 H THR A 97 123.113 11.856 -0.696 1.00 0.00 H new ATOM 0 HA THR A 97 120.373 11.263 -1.641 1.00 0.00 H new ATOM 0 HB THR A 97 122.836 12.239 -3.150 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.695 14.267 -3.077 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.179 12.777 -4.910 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.168 11.038 -4.532 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.883 12.094 -3.899 1.00 0.00 H new ATOM 1492 N TYR A 98 120.864 9.060 -2.622 1.00 0.00 N ATOM 1493 CA TYR A 98 121.083 7.710 -3.119 1.00 0.00 C ATOM 1494 C TYR A 98 120.534 7.603 -4.538 1.00 0.00 C ATOM 1495 O TYR A 98 119.587 8.301 -4.889 1.00 0.00 O ATOM 1496 CB TYR A 98 120.359 6.709 -2.214 1.00 0.00 C ATOM 1497 CG TYR A 98 120.802 6.739 -0.767 1.00 0.00 C ATOM 1498 CD1 TYR A 98 121.887 5.962 -0.346 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.120 7.542 0.157 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.289 5.987 0.997 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.522 7.568 1.498 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.606 6.791 1.920 1.00 0.00 C ATOM 1503 OH TYR A 98 122.004 6.815 3.243 1.00 0.00 O ATOM 0 H TYR A 98 119.881 9.317 -2.535 1.00 0.00 H new ATOM 0 HA TYR A 98 122.150 7.489 -3.121 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.288 6.907 -2.257 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.513 5.704 -2.608 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.415 5.343 -1.056 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.282 8.142 -0.166 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.126 5.386 1.321 1.00 0.00 H new ATOM 0 HE2 TYR A 98 119.995 8.189 2.207 1.00 0.00 H new ATOM 0 HH TYR A 98 121.563 7.559 3.704 1.00 0.00 H new ATOM 1513 N ALA A 99 121.120 6.733 -5.348 1.00 0.00 N ATOM 1514 CA ALA A 99 120.685 6.574 -6.731 1.00 0.00 C ATOM 1515 C ALA A 99 119.551 5.557 -6.827 1.00 0.00 C ATOM 1516 O ALA A 99 119.660 4.444 -6.313 1.00 0.00 O ATOM 1517 CB ALA A 99 121.865 6.112 -7.588 1.00 0.00 C ATOM 0 H ALA A 99 121.895 6.128 -5.075 1.00 0.00 H new ATOM 0 HA ALA A 99 120.320 7.535 -7.094 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.540 5.993 -8.621 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.661 6.855 -7.541 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.236 5.158 -7.213 1.00 0.00 H new ATOM 1523 N LEU A 100 118.463 5.944 -7.488 1.00 0.00 N ATOM 1524 CA LEU A 100 117.322 5.050 -7.652 1.00 0.00 C ATOM 1525 C LEU A 100 117.492 4.195 -8.899 1.00 0.00 C ATOM 1526 O LEU A 100 117.477 2.967 -8.834 1.00 0.00 O ATOM 1527 CB LEU A 100 116.026 5.851 -7.796 1.00 0.00 C ATOM 1528 CG LEU A 100 115.525 6.315 -6.430 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.548 7.471 -6.638 1.00 0.00 C ATOM 1530 CD2 LEU A 100 114.798 5.158 -5.741 1.00 0.00 C ATOM 0 H LEU A 100 118.348 6.863 -7.915 1.00 0.00 H new ATOM 0 HA LEU A 100 117.270 4.416 -6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.196 6.714 -8.439 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.265 5.238 -8.279 1.00 0.00 H new ATOM 0 HG LEU A 100 116.363 6.638 -5.812 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.180 7.815 -5.671 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.057 8.291 -7.145 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.709 7.133 -7.246 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.438 5.484 -4.765 1.00 0.00 H new ATOM 0 HD22 LEU A 100 113.953 4.844 -6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.485 4.321 -5.614 1.00 0.00 H new ATOM 1542 N ASN A 101 117.655 4.864 -10.038 1.00 0.00 N ATOM 1543 CA ASN A 101 117.729 4.165 -11.321 1.00 0.00 C ATOM 1544 C ASN A 101 119.161 4.122 -11.846 1.00 0.00 C ATOM 1545 O ASN A 101 120.005 4.938 -11.473 1.00 0.00 O ATOM 1546 CB ASN A 101 116.799 4.834 -12.342 1.00 0.00 C ATOM 1547 CG ASN A 101 117.275 6.240 -12.698 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.314 6.695 -12.223 1.00 0.00 O ATOM 1549 ND2 ASN A 101 116.564 6.966 -13.519 1.00 0.00 N ATOM 0 H ASN A 101 117.738 5.879 -10.101 1.00 0.00 H new ATOM 0 HA ASN A 101 117.402 3.137 -11.167 1.00 0.00 H new ATOM 0 HB2 ASN A 101 116.751 4.226 -13.245 1.00 0.00 H new ATOM 0 HB3 ASN A 101 115.788 4.883 -11.937 1.00 0.00 H new ATOM 0 HD21 ASN A 101 116.871 7.907 -13.764 1.00 0.00 H new ATOM 0 HD22 ASN A 101 115.702 6.592 -13.915 1.00 0.00 H new ATOM 1556 N ASP A 102 119.420 3.173 -12.746 1.00 0.00 N ATOM 1557 CA ASP A 102 120.772 2.926 -13.253 1.00 0.00 C ATOM 1558 C ASP A 102 121.476 4.218 -13.666 1.00 0.00 C ATOM 1559 O ASP A 102 122.683 4.365 -13.487 1.00 0.00 O ATOM 1560 CB ASP A 102 120.704 1.983 -14.457 1.00 0.00 C ATOM 1561 CG ASP A 102 122.105 1.532 -14.864 1.00 0.00 C ATOM 1562 OD1 ASP A 102 122.955 1.427 -13.994 1.00 0.00 O ATOM 1563 OD2 ASP A 102 122.306 1.292 -16.042 1.00 0.00 O ATOM 0 H ASP A 102 118.708 2.559 -13.141 1.00 0.00 H new ATOM 0 HA ASP A 102 121.348 2.474 -12.445 1.00 0.00 H new ATOM 0 HB2 ASP A 102 120.093 1.114 -14.212 1.00 0.00 H new ATOM 0 HB3 ASP A 102 120.220 2.487 -15.294 1.00 0.00 H new ATOM 1568 N ARG A 103 120.710 5.157 -14.204 1.00 0.00 N ATOM 1569 CA ARG A 103 121.273 6.420 -14.661 1.00 0.00 C ATOM 1570 C ARG A 103 121.909 7.181 -13.499 1.00 0.00 C ATOM 1571 O ARG A 103 123.019 7.698 -13.609 1.00 0.00 O ATOM 1572 CB ARG A 103 120.154 7.241 -15.300 1.00 0.00 C ATOM 1573 CG ARG A 103 119.661 6.506 -16.549 1.00 0.00 C ATOM 1574 CD ARG A 103 118.453 7.237 -17.130 1.00 0.00 C ATOM 1575 NE ARG A 103 118.849 8.567 -17.587 1.00 0.00 N ATOM 1576 CZ ARG A 103 119.460 8.804 -18.753 1.00 0.00 C ATOM 1577 NH1 ARG A 103 119.714 7.855 -19.620 1.00 0.00 N ATOM 1578 NH2 ARG A 103 119.804 10.032 -19.019 1.00 0.00 N ATOM 0 H ARG A 103 119.702 5.069 -14.334 1.00 0.00 H new ATOM 0 HA ARG A 103 122.058 6.232 -15.394 1.00 0.00 H new ATOM 0 HB2 ARG A 103 119.335 7.378 -14.594 1.00 0.00 H new ATOM 0 HB3 ARG A 103 120.517 8.234 -15.564 1.00 0.00 H new ATOM 0 HG2 ARG A 103 120.458 6.453 -17.291 1.00 0.00 H new ATOM 0 HG3 ARG A 103 119.392 5.480 -16.297 1.00 0.00 H new ATOM 0 HD2 ARG A 103 118.037 6.667 -17.960 1.00 0.00 H new ATOM 0 HD3 ARG A 103 117.670 7.320 -16.376 1.00 0.00 H new ATOM 0 HE ARG A 103 118.648 9.362 -16.981 1.00 0.00 H new ATOM 0 HH11 ARG A 103 119.444 6.893 -19.417 1.00 0.00 H new ATOM 0 HH12 ARG A 103 120.182 8.078 -20.498 1.00 0.00 H new ATOM 0 HH21 ARG A 103 119.605 10.774 -18.348 1.00 0.00 H new ATOM 0 HH22 ARG A 103 120.272 10.251 -19.898 1.00 0.00 H new ATOM 1592 N ALA A 104 121.211 7.226 -12.371 1.00 0.00 N ATOM 1593 CA ALA A 104 121.749 7.862 -11.172 1.00 0.00 C ATOM 1594 C ALA A 104 123.072 7.220 -10.745 1.00 0.00 C ATOM 1595 O ALA A 104 123.972 7.915 -10.263 1.00 0.00 O ATOM 1596 CB ALA A 104 120.730 7.770 -10.035 1.00 0.00 C ATOM 0 H ALA A 104 120.277 6.833 -12.260 1.00 0.00 H new ATOM 0 HA ALA A 104 121.944 8.909 -11.402 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.137 8.246 -9.143 1.00 0.00 H new ATOM 0 HB2 ALA A 104 119.810 8.276 -10.329 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.516 6.723 -9.822 1.00 0.00 H new ATOM 1602 N GLU A 105 123.188 5.898 -10.892 1.00 0.00 N ATOM 1603 CA GLU A 105 124.470 5.240 -10.623 1.00 0.00 C ATOM 1604 C GLU A 105 125.543 5.713 -11.598 1.00 0.00 C ATOM 1605 O GLU A 105 126.687 5.934 -11.206 1.00 0.00 O ATOM 1606 CB GLU A 105 124.374 3.709 -10.673 1.00 0.00 C ATOM 1607 CG GLU A 105 123.766 3.169 -9.372 1.00 0.00 C ATOM 1608 CD GLU A 105 122.250 3.331 -9.345 1.00 0.00 C ATOM 1609 OE1 GLU A 105 121.659 3.404 -10.407 1.00 0.00 O ATOM 1610 OE2 GLU A 105 121.700 3.368 -8.257 1.00 0.00 O ATOM 0 H GLU A 105 122.435 5.277 -11.187 1.00 0.00 H new ATOM 0 HA GLU A 105 124.747 5.523 -9.608 1.00 0.00 H new ATOM 0 HB2 GLU A 105 123.762 3.404 -11.522 1.00 0.00 H new ATOM 0 HB3 GLU A 105 125.365 3.281 -10.824 1.00 0.00 H new ATOM 0 HG2 GLU A 105 124.021 2.115 -9.262 1.00 0.00 H new ATOM 0 HG3 GLU A 105 124.203 3.693 -8.522 1.00 0.00 H new ATOM 1617 N LYS A 106 125.172 5.899 -12.862 1.00 0.00 N ATOM 1618 CA LYS A 106 126.111 6.429 -13.852 1.00 0.00 C ATOM 1619 C LYS A 106 126.640 7.804 -13.428 1.00 0.00 C ATOM 1620 O LYS A 106 127.793 8.144 -13.698 1.00 0.00 O ATOM 1621 CB LYS A 106 125.430 6.540 -15.217 1.00 0.00 C ATOM 1622 CG LYS A 106 126.462 6.938 -16.275 1.00 0.00 C ATOM 1623 CD LYS A 106 125.762 7.130 -17.622 1.00 0.00 C ATOM 1624 CE LYS A 106 126.807 7.373 -18.713 1.00 0.00 C ATOM 1625 NZ LYS A 106 126.140 7.390 -20.045 1.00 0.00 N ATOM 0 H LYS A 106 124.241 5.694 -13.224 1.00 0.00 H new ATOM 0 HA LYS A 106 126.953 5.740 -13.921 1.00 0.00 H new ATOM 0 HB2 LYS A 106 124.970 5.589 -15.483 1.00 0.00 H new ATOM 0 HB3 LYS A 106 124.631 7.281 -15.177 1.00 0.00 H new ATOM 0 HG2 LYS A 106 126.965 7.859 -15.980 1.00 0.00 H new ATOM 0 HG3 LYS A 106 127.229 6.168 -16.358 1.00 0.00 H new ATOM 0 HD2 LYS A 106 125.168 6.249 -17.863 1.00 0.00 H new ATOM 0 HD3 LYS A 106 125.074 7.974 -17.569 1.00 0.00 H new ATOM 0 HE2 LYS A 106 127.317 8.320 -18.538 1.00 0.00 H new ATOM 0 HE3 LYS A 106 127.566 6.592 -18.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 126.850 7.555 -20.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 125.672 6.476 -20.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 125.431 8.151 -20.069 1.00 0.00 H new ATOM 1639 N ALA A 107 125.792 8.587 -12.765 1.00 0.00 N ATOM 1640 CA ALA A 107 126.187 9.903 -12.255 1.00 0.00 C ATOM 1641 C ALA A 107 127.120 9.821 -11.035 1.00 0.00 C ATOM 1642 O ALA A 107 127.519 10.853 -10.497 1.00 0.00 O ATOM 1643 CB ALA A 107 124.936 10.698 -11.874 1.00 0.00 C ATOM 0 H ALA A 107 124.824 8.334 -12.567 1.00 0.00 H new ATOM 0 HA ALA A 107 126.739 10.399 -13.053 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.229 11.677 -11.495 1.00 0.00 H new ATOM 0 HB2 ALA A 107 124.303 10.824 -12.753 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.384 10.160 -11.103 1.00 0.00 H new ATOM 1649 N GLY A 108 127.468 8.611 -10.601 1.00 0.00 N ATOM 1650 CA GLY A 108 128.389 8.435 -9.484 1.00 0.00 C ATOM 1651 C GLY A 108 127.731 8.637 -8.120 1.00 0.00 C ATOM 1652 O GLY A 108 128.419 8.951 -7.147 1.00 0.00 O ATOM 0 H GLY A 108 127.126 7.740 -11.007 1.00 0.00 H new ATOM 0 HA2 GLY A 108 128.816 7.433 -9.529 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.215 9.139 -9.589 1.00 0.00 H new ATOM 1656 N HIS A 109 126.410 8.466 -8.040 1.00 0.00 N ATOM 1657 CA HIS A 109 125.731 8.517 -6.749 1.00 0.00 C ATOM 1658 C HIS A 109 125.674 7.111 -6.140 1.00 0.00 C ATOM 1659 O HIS A 109 125.500 6.144 -6.883 1.00 0.00 O ATOM 1660 CB HIS A 109 124.313 9.062 -6.925 1.00 0.00 C ATOM 1661 CG HIS A 109 124.268 10.542 -7.187 1.00 0.00 C ATOM 1662 ND1 HIS A 109 124.902 11.459 -6.364 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.670 11.281 -8.179 1.00 0.00 C ATOM 1664 CE1 HIS A 109 124.673 12.684 -6.868 1.00 0.00 C ATOM 1665 NE2 HIS A 109 123.926 12.634 -7.975 1.00 0.00 N ATOM 0 H HIS A 109 125.800 8.294 -8.840 1.00 0.00 H new ATOM 0 HA HIS A 109 126.284 9.177 -6.081 1.00 0.00 H new ATOM 0 HB2 HIS A 109 123.831 8.540 -7.752 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.734 8.842 -6.028 1.00 0.00 H new ATOM 0 HD2 HIS A 109 123.089 10.874 -8.994 1.00 0.00 H new ATOM 0 HE1 HIS A 109 125.047 13.598 -6.431 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.611 13.418 -8.547 1.00 0.00 H new ATOM 1673 N PRO A 110 125.810 6.958 -4.837 1.00 0.00 N ATOM 1674 CA PRO A 110 125.780 5.601 -4.207 1.00 0.00 C ATOM 1675 C PRO A 110 124.358 5.037 -4.171 1.00 0.00 C ATOM 1676 O PRO A 110 123.411 5.809 -4.052 1.00 0.00 O ATOM 1677 CB PRO A 110 126.312 5.836 -2.793 1.00 0.00 C ATOM 1678 CG PRO A 110 125.974 7.253 -2.479 1.00 0.00 C ATOM 1679 CD PRO A 110 125.968 8.008 -3.809 1.00 0.00 C ATOM 0 HA PRO A 110 126.371 4.873 -4.762 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.850 5.154 -2.080 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.388 5.668 -2.744 1.00 0.00 H new ATOM 0 HG2 PRO A 110 125.001 7.320 -1.991 1.00 0.00 H new ATOM 0 HG3 PRO A 110 126.705 7.682 -1.793 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.152 8.729 -3.851 1.00 0.00 H new ATOM 0 HD3 PRO A 110 126.894 8.566 -3.952 1.00 0.00 H new ATOM 1687 N PRO A 111 124.172 3.736 -4.268 1.00 0.00 N ATOM 1688 CA PRO A 111 122.798 3.148 -4.322 1.00 0.00 C ATOM 1689 C PRO A 111 122.115 3.104 -2.956 1.00 0.00 C ATOM 1690 O PRO A 111 122.775 3.150 -1.918 1.00 0.00 O ATOM 1691 CB PRO A 111 123.020 1.739 -4.875 1.00 0.00 C ATOM 1692 CG PRO A 111 124.418 1.375 -4.504 1.00 0.00 C ATOM 1693 CD PRO A 111 125.201 2.678 -4.331 1.00 0.00 C ATOM 0 HA PRO A 111 122.130 3.751 -4.938 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.306 1.034 -4.449 1.00 0.00 H new ATOM 0 HB3 PRO A 111 122.884 1.717 -5.956 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.431 0.794 -3.582 1.00 0.00 H new ATOM 0 HG3 PRO A 111 124.871 0.755 -5.278 1.00 0.00 H new ATOM 0 HD2 PRO A 111 125.804 2.659 -3.423 1.00 0.00 H new ATOM 0 HD3 PRO A 111 125.885 2.841 -5.164 1.00 0.00 H new ATOM 1701 N ILE A 112 120.785 3.017 -2.968 1.00 0.00 N ATOM 1702 CA ILE A 112 120.008 2.962 -1.727 1.00 0.00 C ATOM 1703 C ILE A 112 120.360 1.733 -0.870 1.00 0.00 C ATOM 1704 O ILE A 112 119.989 1.693 0.300 1.00 0.00 O ATOM 1705 CB ILE A 112 118.499 2.984 -2.049 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.171 4.281 -2.795 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.664 2.935 -0.758 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.731 4.257 -3.317 1.00 0.00 C ATOM 0 H ILE A 112 120.224 2.983 -3.819 1.00 0.00 H new ATOM 0 HA ILE A 112 120.266 3.843 -1.139 1.00 0.00 H new ATOM 0 HB ILE A 112 118.259 2.113 -2.659 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.308 5.133 -2.130 1.00 0.00 H new ATOM 0 HG13 ILE A 112 118.863 4.412 -3.627 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.604 2.952 -1.010 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.893 2.020 -0.211 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.903 3.798 -0.137 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.519 5.188 -3.843 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.606 3.417 -4.000 1.00 0.00 H new ATOM 0 HD13 ILE A 112 116.042 4.149 -2.479 1.00 0.00 H new ATOM 1720 N THR A 113 121.108 0.766 -1.413 1.00 0.00 N ATOM 1721 CA THR A 113 121.347 -0.501 -0.720 1.00 0.00 C ATOM 1722 C THR A 113 121.682 -0.387 0.779 1.00 0.00 C ATOM 1723 O THR A 113 121.150 -1.199 1.540 1.00 0.00 O ATOM 1724 CB THR A 113 122.382 -1.361 -1.473 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.223 -2.716 -1.077 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.829 -0.936 -1.198 1.00 0.00 C ATOM 0 H THR A 113 121.556 0.838 -2.327 1.00 0.00 H new ATOM 0 HA THR A 113 120.383 -1.009 -0.735 1.00 0.00 H new ATOM 0 HB THR A 113 122.201 -1.227 -2.539 1.00 0.00 H new ATOM 0 HG1 THR A 113 122.875 -3.274 -1.550 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.509 -1.579 -1.756 1.00 0.00 H new ATOM 0 HG22 THR A 113 123.970 0.099 -1.510 1.00 0.00 H new ATOM 0 HG23 THR A 113 124.038 -1.025 -0.132 1.00 0.00 H new ATOM 1734 N PRO A 114 122.468 0.566 1.260 1.00 0.00 N ATOM 1735 CA PRO A 114 122.864 0.575 2.708 1.00 0.00 C ATOM 1736 C PRO A 114 121.656 0.653 3.643 1.00 0.00 C ATOM 1737 O PRO A 114 121.683 0.110 4.748 1.00 0.00 O ATOM 1738 CB PRO A 114 123.765 1.805 2.868 1.00 0.00 C ATOM 1739 CG PRO A 114 124.186 2.168 1.486 1.00 0.00 C ATOM 1740 CD PRO A 114 123.027 1.755 0.585 1.00 0.00 C ATOM 0 HA PRO A 114 123.373 -0.350 2.980 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.229 2.626 3.344 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.628 1.581 3.496 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.385 3.237 1.404 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.104 1.651 1.207 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.287 2.550 0.495 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.367 1.520 -0.424 1.00 0.00 H new ATOM 1748 N ILE A 115 120.600 1.329 3.199 1.00 0.00 N ATOM 1749 CA ILE A 115 119.379 1.455 4.002 1.00 0.00 C ATOM 1750 C ILE A 115 118.283 0.460 3.599 1.00 0.00 C ATOM 1751 O ILE A 115 117.180 0.529 4.132 1.00 0.00 O ATOM 1752 CB ILE A 115 118.811 2.881 3.921 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.671 3.328 2.457 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.728 3.849 4.672 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.887 4.644 2.362 1.00 0.00 C ATOM 0 H ILE A 115 120.561 1.797 2.293 1.00 0.00 H new ATOM 0 HA ILE A 115 119.677 1.226 5.025 1.00 0.00 H new ATOM 0 HB ILE A 115 117.823 2.886 4.381 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.659 3.455 2.015 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.162 2.554 1.883 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.320 4.858 4.611 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.797 3.548 5.717 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.721 3.831 4.223 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.800 4.941 1.317 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.891 4.506 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.412 5.421 2.918 1.00 0.00 H new ATOM 1767 N ARG A 116 118.566 -0.457 2.674 1.00 0.00 N ATOM 1768 CA ARG A 116 117.558 -1.408 2.215 1.00 0.00 C ATOM 1769 C ARG A 116 117.396 -2.550 3.215 1.00 0.00 C ATOM 1770 O ARG A 116 118.380 -3.095 3.715 1.00 0.00 O ATOM 1771 CB ARG A 116 117.976 -1.963 0.851 1.00 0.00 C ATOM 1772 CG ARG A 116 116.845 -2.807 0.261 1.00 0.00 C ATOM 1773 CD ARG A 116 117.220 -3.232 -1.160 1.00 0.00 C ATOM 1774 NE ARG A 116 118.334 -4.185 -1.130 1.00 0.00 N ATOM 1775 CZ ARG A 116 118.819 -4.791 -2.224 1.00 0.00 C ATOM 1776 NH1 ARG A 116 118.328 -4.574 -3.421 1.00 0.00 N ATOM 1777 NH2 ARG A 116 119.815 -5.624 -2.093 1.00 0.00 N ATOM 0 H ARG A 116 119.479 -0.560 2.231 1.00 0.00 H new ATOM 0 HA ARG A 116 116.600 -0.895 2.127 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.220 -1.144 0.175 1.00 0.00 H new ATOM 0 HB3 ARG A 116 118.876 -2.569 0.956 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.670 -3.686 0.882 1.00 0.00 H new ATOM 0 HG3 ARG A 116 115.917 -2.235 0.249 1.00 0.00 H new ATOM 0 HD2 ARG A 116 116.358 -3.685 -1.650 1.00 0.00 H new ATOM 0 HD3 ARG A 116 117.497 -2.357 -1.747 1.00 0.00 H new ATOM 0 HE ARG A 116 118.763 -4.398 -0.229 1.00 0.00 H new ATOM 0 HH11 ARG A 116 117.550 -3.925 -3.543 1.00 0.00 H new ATOM 0 HH12 ARG A 116 118.724 -5.054 -4.229 1.00 0.00 H new ATOM 0 HH21 ARG A 116 120.211 -5.805 -1.170 1.00 0.00 H new ATOM 0 HH22 ARG A 116 120.198 -6.095 -2.913 1.00 0.00 H new ATOM 1791 N ALA A 117 116.147 -2.909 3.500 1.00 0.00 N ATOM 1792 CA ALA A 117 115.853 -3.952 4.476 1.00 0.00 C ATOM 1793 C ALA A 117 116.063 -5.345 3.892 1.00 0.00 C ATOM 1794 O ALA A 117 115.869 -5.569 2.697 1.00 0.00 O ATOM 1795 CB ALA A 117 114.401 -3.826 4.935 1.00 0.00 C ATOM 0 H ALA A 117 115.322 -2.492 3.068 1.00 0.00 H new ATOM 0 HA ALA A 117 116.536 -3.823 5.316 1.00 0.00 H new ATOM 0 HB1 ALA A 117 114.181 -4.605 5.664 1.00 0.00 H new ATOM 0 HB2 ALA A 117 114.247 -2.848 5.391 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.737 -3.934 4.077 1.00 0.00 H new ATOM 1801 N LYS A 118 116.439 -6.285 4.754 1.00 0.00 N ATOM 1802 CA LYS A 118 116.567 -7.677 4.342 1.00 0.00 C ATOM 1803 C LYS A 118 115.211 -8.366 4.451 1.00 0.00 C ATOM 1804 O LYS A 118 114.450 -8.099 5.380 1.00 0.00 O ATOM 1805 CB LYS A 118 117.575 -8.395 5.242 1.00 0.00 C ATOM 1806 CG LYS A 118 118.953 -7.748 5.090 1.00 0.00 C ATOM 1807 CD LYS A 118 119.979 -8.535 5.909 1.00 0.00 C ATOM 1808 CE LYS A 118 121.332 -7.819 5.880 1.00 0.00 C ATOM 1809 NZ LYS A 118 121.392 -6.828 6.992 1.00 0.00 N ATOM 0 H LYS A 118 116.659 -6.109 5.734 1.00 0.00 H new ATOM 0 HA LYS A 118 116.916 -7.714 3.310 1.00 0.00 H new ATOM 0 HB2 LYS A 118 117.251 -8.343 6.281 1.00 0.00 H new ATOM 0 HB3 LYS A 118 117.627 -9.451 4.976 1.00 0.00 H new ATOM 0 HG2 LYS A 118 119.245 -7.732 4.040 1.00 0.00 H new ATOM 0 HG3 LYS A 118 118.920 -6.712 5.428 1.00 0.00 H new ATOM 0 HD2 LYS A 118 119.634 -8.637 6.938 1.00 0.00 H new ATOM 0 HD3 LYS A 118 120.083 -9.543 5.506 1.00 0.00 H new ATOM 0 HE2 LYS A 118 122.141 -8.543 5.979 1.00 0.00 H new ATOM 0 HE3 LYS A 118 121.469 -7.316 4.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 122.311 -6.341 6.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 120.628 -6.131 6.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 121.279 -7.320 7.902 1.00 0.00 H new ATOM 1823 N GLY A 119 114.908 -9.250 3.505 1.00 0.00 N ATOM 1824 CA GLY A 119 113.620 -9.939 3.505 1.00 0.00 C ATOM 1825 C GLY A 119 113.744 -11.355 4.056 1.00 0.00 C ATOM 1826 O GLY A 119 114.833 -11.927 4.082 1.00 0.00 O ATOM 0 H GLY A 119 115.528 -9.505 2.736 1.00 0.00 H new ATOM 0 HA2 GLY A 119 112.905 -9.376 4.104 1.00 0.00 H new ATOM 0 HA3 GLY A 119 113.226 -9.976 2.489 1.00 0.00 H new ATOM 1830 N SER A 120 112.621 -11.915 4.496 1.00 0.00 N ATOM 1831 CA SER A 120 112.615 -13.280 5.010 1.00 0.00 C ATOM 1832 C SER A 120 113.144 -14.254 3.960 1.00 0.00 C ATOM 1833 O SER A 120 113.872 -15.194 4.283 1.00 0.00 O ATOM 1834 CB SER A 120 111.194 -13.681 5.407 1.00 0.00 C ATOM 1835 OG SER A 120 110.675 -12.720 6.318 1.00 0.00 O ATOM 0 H SER A 120 111.713 -11.451 4.507 1.00 0.00 H new ATOM 0 HA SER A 120 113.264 -13.320 5.885 1.00 0.00 H new ATOM 0 HB2 SER A 120 110.560 -13.741 4.523 1.00 0.00 H new ATOM 0 HB3 SER A 120 111.197 -14.670 5.865 1.00 0.00 H new ATOM 0 HG SER A 120 109.763 -12.971 6.575 1.00 0.00 H new ATOM 1841 N GLY A 121 112.775 -14.025 2.703 1.00 0.00 N ATOM 1842 CA GLY A 121 113.261 -14.851 1.606 1.00 0.00 C ATOM 1843 C GLY A 121 113.449 -14.012 0.348 1.00 0.00 C ATOM 1844 O GLY A 121 112.935 -12.897 0.253 1.00 0.00 O ATOM 0 H GLY A 121 112.143 -13.276 2.421 1.00 0.00 H new ATOM 0 HA2 GLY A 121 114.207 -15.316 1.885 1.00 0.00 H new ATOM 0 HA3 GLY A 121 112.555 -15.658 1.410 1.00 0.00 H new ATOM 1848 N GLY A 122 114.186 -14.551 -0.617 1.00 0.00 N ATOM 1849 CA GLY A 122 114.421 -13.840 -1.870 1.00 0.00 C ATOM 1850 C GLY A 122 115.442 -12.717 -1.700 1.00 0.00 C ATOM 1851 O GLY A 122 115.339 -11.676 -2.349 1.00 0.00 O ATOM 0 H GLY A 122 114.627 -15.469 -0.558 1.00 0.00 H new ATOM 0 HA2 GLY A 122 114.774 -14.542 -2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 122 113.481 -13.425 -2.235 1.00 0.00 H new ATOM 1855 N GLY A 123 116.426 -12.927 -0.831 1.00 0.00 N ATOM 1856 CA GLY A 123 117.480 -11.938 -0.633 1.00 0.00 C ATOM 1857 C GLY A 123 116.953 -10.683 0.058 1.00 0.00 C ATOM 1858 O GLY A 123 116.455 -10.732 1.182 1.00 0.00 O ATOM 0 H GLY A 123 116.516 -13.766 -0.257 1.00 0.00 H new ATOM 0 HA2 GLY A 123 118.281 -12.374 -0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 123 117.912 -11.669 -1.597 1.00 0.00 H new ATOM 1862 N TYR A 124 117.079 -9.546 -0.619 1.00 0.00 N ATOM 1863 CA TYR A 124 116.679 -8.269 -0.036 1.00 0.00 C ATOM 1864 C TYR A 124 115.356 -7.802 -0.636 1.00 0.00 C ATOM 1865 O TYR A 124 114.959 -8.248 -1.713 1.00 0.00 O ATOM 1866 CB TYR A 124 117.763 -7.219 -0.284 1.00 0.00 C ATOM 1867 CG TYR A 124 118.994 -7.397 0.578 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.624 -8.646 0.665 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.516 -6.305 1.284 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.770 -8.801 1.453 1.00 0.00 C ATOM 1871 CE2 TYR A 124 120.660 -6.461 2.074 1.00 0.00 C ATOM 1872 CZ TYR A 124 121.288 -7.710 2.158 1.00 0.00 C ATOM 1873 OH TYR A 124 122.420 -7.864 2.932 1.00 0.00 O ATOM 0 H TYR A 124 117.452 -9.482 -1.566 1.00 0.00 H new ATOM 0 HA TYR A 124 116.549 -8.401 1.038 1.00 0.00 H new ATOM 0 HB2 TYR A 124 118.057 -7.255 -1.333 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.345 -6.229 -0.104 1.00 0.00 H new ATOM 0 HD1 TYR A 124 119.224 -9.490 0.123 1.00 0.00 H new ATOM 0 HD2 TYR A 124 119.034 -5.341 1.218 1.00 0.00 H new ATOM 0 HE1 TYR A 124 121.255 -9.764 1.517 1.00 0.00 H new ATOM 0 HE2 TYR A 124 121.059 -5.618 2.619 1.00 0.00 H new ATOM 0 HH TYR A 124 122.730 -6.986 3.237 1.00 0.00 H new ATOM 1883 N ILE A 125 114.679 -6.903 0.069 1.00 0.00 N ATOM 1884 CA ILE A 125 113.353 -6.459 -0.345 1.00 0.00 C ATOM 1885 C ILE A 125 113.461 -5.479 -1.512 1.00 0.00 C ATOM 1886 O ILE A 125 114.219 -4.511 -1.462 1.00 0.00 O ATOM 1887 CB ILE A 125 112.643 -5.826 0.860 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.489 -6.883 1.961 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.252 -5.321 0.464 1.00 0.00 C ATOM 1890 CD1 ILE A 125 112.126 -6.220 3.292 1.00 0.00 C ATOM 0 H ILE A 125 115.024 -6.469 0.925 1.00 0.00 H new ATOM 0 HA ILE A 125 112.766 -7.310 -0.691 1.00 0.00 H new ATOM 0 HB ILE A 125 113.238 -4.985 1.215 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.716 -7.598 1.681 1.00 0.00 H new ATOM 0 HG13 ILE A 125 113.418 -7.443 2.068 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.766 -4.876 1.332 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.347 -4.572 -0.322 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.652 -6.155 0.100 1.00 0.00 H new ATOM 0 HD11 ILE A 125 112.020 -6.984 4.062 1.00 0.00 H new ATOM 0 HD12 ILE A 125 112.914 -5.523 3.578 1.00 0.00 H new ATOM 0 HD13 ILE A 125 111.185 -5.680 3.185 1.00 0.00 H new ATOM 1902 N SER A 126 112.685 -5.744 -2.560 1.00 0.00 N ATOM 1903 CA SER A 126 112.761 -4.965 -3.792 1.00 0.00 C ATOM 1904 C SER A 126 112.382 -3.506 -3.571 1.00 0.00 C ATOM 1905 O SER A 126 111.448 -3.192 -2.832 1.00 0.00 O ATOM 1906 CB SER A 126 111.828 -5.571 -4.840 1.00 0.00 C ATOM 1907 OG SER A 126 112.206 -6.922 -5.076 1.00 0.00 O ATOM 0 H SER A 126 111.995 -6.495 -2.580 1.00 0.00 H new ATOM 0 HA SER A 126 113.795 -4.996 -4.136 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.795 -5.525 -4.495 1.00 0.00 H new ATOM 0 HB3 SER A 126 111.881 -4.999 -5.766 1.00 0.00 H new ATOM 0 HG SER A 126 111.610 -7.316 -5.746 1.00 0.00 H new ATOM 1913 N LEU A 127 113.127 -2.624 -4.227 1.00 0.00 N ATOM 1914 CA LEU A 127 112.784 -1.201 -4.264 1.00 0.00 C ATOM 1915 C LEU A 127 111.953 -0.839 -5.508 1.00 0.00 C ATOM 1916 O LEU A 127 111.734 0.340 -5.782 1.00 0.00 O ATOM 1917 CB LEU A 127 114.062 -0.355 -4.269 1.00 0.00 C ATOM 1918 CG LEU A 127 114.952 -0.712 -3.074 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.248 0.097 -3.147 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.226 -0.376 -1.770 1.00 0.00 C ATOM 0 H LEU A 127 113.974 -2.866 -4.742 1.00 0.00 H new ATOM 0 HA LEU A 127 112.187 -0.992 -3.376 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.609 -0.518 -5.198 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.804 0.703 -4.233 1.00 0.00 H new ATOM 0 HG LEU A 127 115.178 -1.778 -3.101 1.00 0.00 H new ATOM 0 HD11 LEU A 127 116.883 -0.155 -2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.772 -0.138 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 127 116.014 1.161 -3.122 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.863 -0.632 -0.923 1.00 0.00 H new ATOM 0 HD22 LEU A 127 113.998 0.690 -1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.299 -0.946 -1.712 1.00 0.00 H new ATOM 1932 N GLY A 128 111.491 -1.836 -6.267 1.00 0.00 N ATOM 1933 CA GLY A 128 110.818 -1.583 -7.539 1.00 0.00 C ATOM 1934 C GLY A 128 109.726 -0.520 -7.433 1.00 0.00 C ATOM 1935 O GLY A 128 109.654 0.375 -8.273 1.00 0.00 O ATOM 0 H GLY A 128 111.571 -2.823 -6.022 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.555 -1.267 -8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.379 -2.512 -7.903 1.00 0.00 H new ATOM 1939 N ALA A 129 108.893 -0.602 -6.400 1.00 0.00 N ATOM 1940 CA ALA A 129 107.771 0.326 -6.271 1.00 0.00 C ATOM 1941 C ALA A 129 108.265 1.768 -6.216 1.00 0.00 C ATOM 1942 O ALA A 129 107.797 2.628 -6.967 1.00 0.00 O ATOM 1943 CB ALA A 129 106.974 0.009 -5.004 1.00 0.00 C ATOM 0 H ALA A 129 108.970 -1.289 -5.650 1.00 0.00 H new ATOM 0 HA ALA A 129 107.129 0.210 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.140 0.705 -4.915 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.592 -1.010 -5.060 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.622 0.106 -4.133 1.00 0.00 H new ATOM 1949 N LEU A 130 109.235 2.024 -5.347 1.00 0.00 N ATOM 1950 CA LEU A 130 109.771 3.371 -5.196 1.00 0.00 C ATOM 1951 C LEU A 130 110.340 3.871 -6.521 1.00 0.00 C ATOM 1952 O LEU A 130 110.127 5.020 -6.909 1.00 0.00 O ATOM 1953 CB LEU A 130 110.866 3.360 -4.127 1.00 0.00 C ATOM 1954 CG LEU A 130 111.376 4.780 -3.880 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.297 5.596 -3.169 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.630 4.719 -3.001 1.00 0.00 C ATOM 0 H LEU A 130 109.663 1.324 -4.741 1.00 0.00 H new ATOM 0 HA LEU A 130 108.969 4.043 -4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.476 2.940 -3.200 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.689 2.720 -4.445 1.00 0.00 H new ATOM 0 HG LEU A 130 111.616 5.252 -4.833 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.662 6.608 -2.994 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.402 5.636 -3.790 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.056 5.127 -2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 130 112.998 5.729 -2.822 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.385 4.248 -2.049 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.400 4.136 -3.506 1.00 0.00 H new ATOM 1968 N LEU A 131 111.039 2.991 -7.229 1.00 0.00 N ATOM 1969 CA LEU A 131 111.658 3.366 -8.493 1.00 0.00 C ATOM 1970 C LEU A 131 110.603 3.826 -9.492 1.00 0.00 C ATOM 1971 O LEU A 131 110.776 4.843 -10.160 1.00 0.00 O ATOM 1972 CB LEU A 131 112.423 2.168 -9.061 1.00 0.00 C ATOM 1973 CG LEU A 131 113.190 2.577 -10.322 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.415 3.407 -9.932 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.639 1.317 -11.067 1.00 0.00 C ATOM 0 H LEU A 131 111.190 2.021 -6.952 1.00 0.00 H new ATOM 0 HA LEU A 131 112.348 4.191 -8.316 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.117 1.783 -8.314 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.728 1.362 -9.295 1.00 0.00 H new ATOM 0 HG LEU A 131 112.544 3.173 -10.966 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.959 3.697 -10.831 1.00 0.00 H new ATOM 0 HD12 LEU A 131 114.094 4.301 -9.398 1.00 0.00 H new ATOM 0 HD13 LEU A 131 115.066 2.815 -9.289 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.186 1.601 -11.966 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.286 0.724 -10.421 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.765 0.728 -11.345 1.00 0.00 H new ATOM 1987 N SER A 132 109.497 3.094 -9.566 1.00 0.00 N ATOM 1988 CA SER A 132 108.454 3.412 -10.532 1.00 0.00 C ATOM 1989 C SER A 132 107.913 4.816 -10.294 1.00 0.00 C ATOM 1990 O SER A 132 107.753 5.595 -11.235 1.00 0.00 O ATOM 1991 CB SER A 132 107.315 2.398 -10.427 1.00 0.00 C ATOM 1992 OG SER A 132 107.844 1.087 -10.575 1.00 0.00 O ATOM 0 H SER A 132 109.301 2.286 -8.976 1.00 0.00 H new ATOM 0 HA SER A 132 108.887 3.367 -11.531 1.00 0.00 H new ATOM 0 HB2 SER A 132 106.813 2.494 -9.464 1.00 0.00 H new ATOM 0 HB3 SER A 132 106.568 2.591 -11.197 1.00 0.00 H new ATOM 0 HG SER A 132 108.296 0.821 -9.747 1.00 0.00 H new ATOM 1998 N THR A 133 107.670 5.152 -9.030 1.00 0.00 N ATOM 1999 CA THR A 133 107.109 6.459 -8.706 1.00 0.00 C ATOM 2000 C THR A 133 108.042 7.572 -9.174 1.00 0.00 C ATOM 2001 O THR A 133 107.615 8.524 -9.830 1.00 0.00 O ATOM 2002 CB THR A 133 106.886 6.573 -7.197 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.099 5.477 -6.752 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.162 7.883 -6.882 1.00 0.00 C ATOM 0 H THR A 133 107.849 4.549 -8.227 1.00 0.00 H new ATOM 0 HA THR A 133 106.154 6.562 -9.220 1.00 0.00 H new ATOM 0 HB THR A 133 107.849 6.561 -6.686 1.00 0.00 H new ATOM 0 HG1 THR A 133 105.957 5.548 -5.785 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.004 7.962 -5.806 1.00 0.00 H new ATOM 0 HG22 THR A 133 106.766 8.724 -7.223 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.199 7.898 -7.392 1.00 0.00 H new ATOM 2012 N THR A 134 109.327 7.427 -8.868 1.00 0.00 N ATOM 2013 CA THR A 134 110.293 8.462 -9.213 1.00 0.00 C ATOM 2014 C THR A 134 110.391 8.636 -10.727 1.00 0.00 C ATOM 2015 O THR A 134 110.468 9.758 -11.225 1.00 0.00 O ATOM 2016 CB THR A 134 111.661 8.119 -8.626 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.506 7.805 -7.250 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.594 9.322 -8.771 1.00 0.00 C ATOM 0 H THR A 134 109.719 6.616 -8.389 1.00 0.00 H new ATOM 0 HA THR A 134 109.952 9.406 -8.787 1.00 0.00 H new ATOM 0 HB THR A 134 112.087 7.266 -9.155 1.00 0.00 H new ATOM 0 HG1 THR A 134 111.221 6.872 -7.157 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.570 9.078 -8.352 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.704 9.572 -9.826 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.174 10.175 -8.238 1.00 0.00 H new ATOM 2026 N LEU A 135 110.368 7.527 -11.461 1.00 0.00 N ATOM 2027 CA LEU A 135 110.445 7.588 -12.918 1.00 0.00 C ATOM 2028 C LEU A 135 109.271 8.374 -13.494 1.00 0.00 C ATOM 2029 O LEU A 135 109.433 9.119 -14.462 1.00 0.00 O ATOM 2030 CB LEU A 135 110.459 6.176 -13.506 1.00 0.00 C ATOM 2031 CG LEU A 135 111.751 5.461 -13.107 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.655 3.982 -13.486 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.933 6.094 -13.844 1.00 0.00 C ATOM 0 H LEU A 135 110.297 6.585 -11.077 1.00 0.00 H new ATOM 0 HA LEU A 135 111.370 8.099 -13.186 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.596 5.614 -13.148 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.380 6.224 -14.592 1.00 0.00 H new ATOM 0 HG LEU A 135 111.898 5.554 -12.031 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.576 3.473 -13.201 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.813 3.527 -12.965 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.508 3.891 -14.562 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.854 5.585 -13.560 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.784 6.000 -14.920 1.00 0.00 H new ATOM 0 HD23 LEU A 135 113.005 7.149 -13.578 1.00 0.00 H new ATOM 2045 N ASN A 136 108.090 8.203 -12.906 1.00 0.00 N ATOM 2046 CA ASN A 136 106.912 8.929 -13.369 1.00 0.00 C ATOM 2047 C ASN A 136 107.153 10.433 -13.288 1.00 0.00 C ATOM 2048 O ASN A 136 106.794 11.180 -14.199 1.00 0.00 O ATOM 2049 CB ASN A 136 105.699 8.556 -12.514 1.00 0.00 C ATOM 2050 CG ASN A 136 105.361 7.078 -12.689 1.00 0.00 C ATOM 2051 OD1 ASN A 136 105.722 6.469 -13.697 1.00 0.00 O ATOM 2052 ND2 ASN A 136 104.683 6.460 -11.760 1.00 0.00 N ATOM 0 H ASN A 136 107.924 7.577 -12.118 1.00 0.00 H new ATOM 0 HA ASN A 136 106.719 8.656 -14.406 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.907 8.767 -11.465 1.00 0.00 H new ATOM 0 HB3 ASN A 136 104.843 9.168 -12.799 1.00 0.00 H new ATOM 0 HD21 ASN A 136 104.452 5.472 -11.869 1.00 0.00 H new ATOM 0 HD22 ASN A 136 104.384 6.965 -10.925 1.00 0.00 H new ATOM 2059 N LEU A 137 107.761 10.869 -12.189 1.00 0.00 N ATOM 2060 CA LEU A 137 108.090 12.283 -12.023 1.00 0.00 C ATOM 2061 C LEU A 137 109.096 12.741 -13.078 1.00 0.00 C ATOM 2062 O LEU A 137 109.002 13.854 -13.593 1.00 0.00 O ATOM 2063 CB LEU A 137 108.667 12.529 -10.626 1.00 0.00 C ATOM 2064 CG LEU A 137 107.659 12.097 -9.558 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.290 12.261 -8.174 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.404 12.969 -9.644 1.00 0.00 C ATOM 0 H LEU A 137 108.034 10.273 -11.408 1.00 0.00 H new ATOM 0 HA LEU A 137 107.172 12.858 -12.146 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.597 11.974 -10.505 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.908 13.585 -10.504 1.00 0.00 H new ATOM 0 HG LEU A 137 107.386 11.055 -9.722 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.576 11.955 -7.410 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.183 11.640 -8.106 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.561 13.305 -8.019 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.691 12.656 -8.881 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.674 14.013 -9.482 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.952 12.860 -10.630 1.00 0.00 H new ATOM 2078 N CYS A 138 110.055 11.878 -13.395 1.00 0.00 N ATOM 2079 CA CYS A 138 111.037 12.185 -14.434 1.00 0.00 C ATOM 2080 C CYS A 138 110.373 12.429 -15.795 1.00 0.00 C ATOM 2081 O CYS A 138 110.937 13.125 -16.640 1.00 0.00 O ATOM 2082 CB CYS A 138 112.037 11.031 -14.557 1.00 0.00 C ATOM 2083 SG CYS A 138 113.357 11.177 -13.320 1.00 0.00 S ATOM 0 H CYS A 138 110.175 10.967 -12.953 1.00 0.00 H new ATOM 0 HA CYS A 138 111.551 13.100 -14.141 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.518 10.081 -14.430 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.470 11.026 -15.557 1.00 0.00 H new ATOM 2088 N GLY A 139 109.186 11.863 -16.012 1.00 0.00 N ATOM 2089 CA GLY A 139 108.477 12.054 -17.276 1.00 0.00 C ATOM 2090 C GLY A 139 108.743 10.926 -18.279 1.00 0.00 C ATOM 2091 O GLY A 139 108.587 11.122 -19.485 1.00 0.00 O ATOM 0 H GLY A 139 108.699 11.274 -15.336 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.406 12.117 -17.082 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.777 13.005 -17.716 1.00 0.00 H new ATOM 2095 N LYS A 140 109.142 9.752 -17.791 1.00 0.00 N ATOM 2096 CA LYS A 140 109.396 8.617 -18.670 1.00 0.00 C ATOM 2097 C LYS A 140 108.082 7.997 -19.135 1.00 0.00 C ATOM 2098 O LYS A 140 107.175 7.771 -18.335 1.00 0.00 O ATOM 2099 CB LYS A 140 110.228 7.563 -17.936 1.00 0.00 C ATOM 2100 CG LYS A 140 110.628 6.458 -18.914 1.00 0.00 C ATOM 2101 CD LYS A 140 111.388 5.361 -18.163 1.00 0.00 C ATOM 2102 CE LYS A 140 111.923 4.334 -19.162 1.00 0.00 C ATOM 2103 NZ LYS A 140 112.840 5.009 -20.125 1.00 0.00 N ATOM 0 H LYS A 140 109.295 9.565 -16.800 1.00 0.00 H new ATOM 0 HA LYS A 140 109.947 8.972 -19.541 1.00 0.00 H new ATOM 0 HB2 LYS A 140 111.118 8.022 -17.505 1.00 0.00 H new ATOM 0 HB3 LYS A 140 109.655 7.142 -17.110 1.00 0.00 H new ATOM 0 HG2 LYS A 140 109.741 6.040 -19.390 1.00 0.00 H new ATOM 0 HG3 LYS A 140 111.252 6.869 -19.708 1.00 0.00 H new ATOM 0 HD2 LYS A 140 112.212 5.797 -17.597 1.00 0.00 H new ATOM 0 HD3 LYS A 140 110.729 4.875 -17.444 1.00 0.00 H new ATOM 0 HE2 LYS A 140 112.452 3.540 -18.635 1.00 0.00 H new ATOM 0 HE3 LYS A 140 111.096 3.866 -19.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 113.656 4.394 -20.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 112.333 5.198 -21.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 113.171 5.907 -19.718 1.00 0.00 H new ATOM 2117 N GLY A 141 107.987 7.726 -20.432 1.00 0.00 N ATOM 2118 CA GLY A 141 106.777 7.132 -20.991 1.00 0.00 C ATOM 2119 C GLY A 141 105.670 8.173 -21.122 1.00 0.00 C ATOM 2120 O GLY A 141 105.548 8.748 -22.191 1.00 0.00 O ATOM 2121 OXT GLY A 141 104.961 8.380 -20.152 1.00 0.00 O ATOM 0 H GLY A 141 108.726 7.906 -21.112 1.00 0.00 H new ATOM 0 HA2 GLY A 141 106.996 6.703 -21.969 1.00 0.00 H new ATOM 0 HA3 GLY A 141 106.440 6.315 -20.353 1.00 0.00 H new TER 2125 GLY A 141