USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1201 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 131 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 132 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 83 HIS : no HD1:sc= -0.678 K(o=-0.68,f=0.044) USER MOD Set 2.2: A 89 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 35 ASN : amide:sc= -0.378 K(o=0.055,f=-3.8!) USER MOD Set 3.2: A 77 TYR OH : rot 4:sc= 0.433 USER MOD Set 4.1: A 14 CYS SG : rot 12:sc= 0.268 USER MOD Set 4.2: A 113 SER OG : rot 77:sc= 1.41 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 160:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -41:sc= 0.929 USER MOD Single : A 34 ASN : amide:sc= -3.96! K(o=-4!,f=-1.8) USER MOD Single : A 40 MET CE :methyl 163:sc= -6.22! (180deg=-7.81!) USER MOD Single : A 41 LYS NZ :NH3+ -175:sc= 0.0172 (180deg=0.0152) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD Single : A 48 MET CE :methyl -142:sc= 0 (180deg=-0.58) USER MOD Single : A 56 GLN : amide:sc= -3.18 K(o=-3.2,f=-1.3) USER MOD Single : A 57 ASN : amide:sc= -4.11! C(o=-4.1!,f=-2.3!) USER MOD Single : A 59 SER OG : rot 180:sc= -0.467 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.284 X(o=-0.28,f=0) USER MOD Single : A 78 SER OG : rot -130:sc= -0.94 USER MOD Single : A 79 TYR OH : rot 180:sc= -1.71 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 175:sc= -4.17! USER MOD Single : A 93 CYS SG : rot -143:sc= -3.98! USER MOD Single : A 97 SER OG : rot -31:sc= -6.68! USER MOD Single : A 98 SER OG : rot -20:sc= 0.977 USER MOD Single : A 102 CYS SG : rot -170:sc= -2.32 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.027) USER MOD Single : A 107 GLN : amide:sc= 0.00193 X(o=0.0019,f=0) USER MOD Single : A 108 MET CE :methyl -157:sc= -0.0251 (180deg=-0.663) USER MOD Single : A 109 MET CE :methyl 177:sc= -1.37 (180deg=-1.41) USER MOD Single : A 110 TYR OH : rot 98:sc= 0.00958 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 GLN : amide:sc= -0.225 K(o=-0.22,f=-1.7!) USER MOD Single : A 120 THR OG1 : rot 81:sc= 1.15 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 THR OG1 : rot -65:sc= -0.203 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ -177:sc= -0.208 (180deg=-0.221) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 25:sc= 0.941 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.452 -18.314 23.332 1.00 43.04 N ATOM 2 CA GLY A 1 8.290 -17.788 22.640 1.00 51.32 C ATOM 3 C GLY A 1 8.611 -17.338 21.228 1.00 51.33 C ATOM 4 O GLY A 1 9.053 -18.134 20.401 1.00 61.45 O ATOM 0 H1 GLY A 1 9.181 -18.608 24.292 1.00 43.04 H new ATOM 0 H2 GLY A 1 9.825 -19.134 22.811 1.00 43.04 H new ATOM 0 H3 GLY A 1 10.185 -17.578 23.389 1.00 43.04 H new ATOM 0 HA2 GLY A 1 7.514 -18.552 22.607 1.00 51.32 H new ATOM 0 HA3 GLY A 1 7.885 -16.947 23.203 1.00 51.32 H new ATOM 8 N SER A 2 8.385 -16.057 20.951 1.00 23.13 N ATOM 9 CA SER A 2 8.648 -15.504 19.628 1.00 11.41 C ATOM 10 C SER A 2 9.467 -14.221 19.728 1.00 72.20 C ATOM 11 O SER A 2 9.109 -13.299 20.460 1.00 4.25 O ATOM 12 CB SER A 2 7.332 -15.226 18.898 1.00 63.30 C ATOM 13 OG SER A 2 7.561 -14.557 17.670 1.00 44.10 O ATOM 0 H SER A 2 8.021 -15.384 21.625 1.00 23.13 H new ATOM 0 HA SER A 2 9.222 -16.238 19.062 1.00 11.41 H new ATOM 0 HB2 SER A 2 6.810 -16.165 18.712 1.00 63.30 H new ATOM 0 HB3 SER A 2 6.683 -14.620 19.530 1.00 63.30 H new ATOM 0 HG SER A 2 6.705 -14.393 17.222 1.00 44.10 H new ATOM 19 N SER A 3 10.569 -14.170 18.986 1.00 22.25 N ATOM 20 CA SER A 3 11.443 -13.003 18.994 1.00 33.12 C ATOM 21 C SER A 3 11.767 -12.558 17.571 1.00 41.22 C ATOM 22 O SER A 3 12.357 -13.307 16.793 1.00 30.15 O ATOM 23 CB SER A 3 12.735 -13.312 19.751 1.00 1.32 C ATOM 24 OG SER A 3 12.668 -12.846 21.088 1.00 53.01 O ATOM 0 H SER A 3 10.878 -14.924 18.372 1.00 22.25 H new ATOM 0 HA SER A 3 10.920 -12.191 19.500 1.00 33.12 H new ATOM 0 HB2 SER A 3 12.915 -14.387 19.746 1.00 1.32 H new ATOM 0 HB3 SER A 3 13.579 -12.846 19.242 1.00 1.32 H new ATOM 0 HG SER A 3 13.506 -13.058 21.551 1.00 53.01 H new ATOM 30 N GLY A 4 11.377 -11.331 17.237 1.00 21.43 N ATOM 31 CA GLY A 4 11.635 -10.806 15.909 1.00 73.40 C ATOM 32 C GLY A 4 13.007 -10.175 15.791 1.00 12.42 C ATOM 33 O GLY A 4 13.148 -8.956 15.896 1.00 12.20 O ATOM 0 H GLY A 4 10.887 -10.692 17.863 1.00 21.43 H new ATOM 0 HA2 GLY A 4 11.545 -11.611 15.180 1.00 73.40 H new ATOM 0 HA3 GLY A 4 10.875 -10.065 15.661 1.00 73.40 H new ATOM 37 N SER A 5 14.023 -11.004 15.575 1.00 40.11 N ATOM 38 CA SER A 5 15.392 -10.519 15.449 1.00 20.32 C ATOM 39 C SER A 5 16.227 -11.467 14.592 1.00 41.13 C ATOM 40 O SER A 5 15.986 -12.674 14.567 1.00 52.21 O ATOM 41 CB SER A 5 16.031 -10.367 16.830 1.00 3.31 C ATOM 42 OG SER A 5 17.276 -9.696 16.745 1.00 2.50 O ATOM 0 H SER A 5 13.924 -12.015 15.484 1.00 40.11 H new ATOM 0 HA SER A 5 15.363 -9.545 14.961 1.00 20.32 H new ATOM 0 HB2 SER A 5 15.360 -9.813 17.486 1.00 3.31 H new ATOM 0 HB3 SER A 5 16.174 -11.350 17.278 1.00 3.31 H new ATOM 0 HG SER A 5 17.663 -9.610 17.641 1.00 2.50 H new ATOM 48 N SER A 6 17.209 -10.910 13.890 1.00 34.12 N ATOM 49 CA SER A 6 18.077 -11.704 13.029 1.00 42.31 C ATOM 50 C SER A 6 19.333 -10.921 12.656 1.00 63.32 C ATOM 51 O SER A 6 19.439 -9.727 12.929 1.00 53.14 O ATOM 52 CB SER A 6 17.330 -12.122 11.761 1.00 35.52 C ATOM 53 OG SER A 6 17.446 -13.516 11.538 1.00 32.35 O ATOM 0 H SER A 6 17.423 -9.913 13.901 1.00 34.12 H new ATOM 0 HA SER A 6 18.374 -12.597 13.579 1.00 42.31 H new ATOM 0 HB2 SER A 6 16.278 -11.851 11.849 1.00 35.52 H new ATOM 0 HB3 SER A 6 17.729 -11.579 10.904 1.00 35.52 H new ATOM 0 HG SER A 6 16.959 -13.759 10.723 1.00 32.35 H new ATOM 59 N GLY A 7 20.285 -11.606 12.030 1.00 24.53 N ATOM 60 CA GLY A 7 21.523 -10.962 11.630 1.00 13.25 C ATOM 61 C GLY A 7 21.510 -10.534 10.175 1.00 30.22 C ATOM 62 O GLY A 7 22.010 -11.249 9.308 1.00 60.54 O ATOM 0 H GLY A 7 20.221 -12.596 11.793 1.00 24.53 H new ATOM 0 HA2 GLY A 7 21.696 -10.090 12.261 1.00 13.25 H new ATOM 0 HA3 GLY A 7 22.355 -11.646 11.797 1.00 13.25 H new ATOM 66 N SER A 8 20.935 -9.366 9.909 1.00 31.13 N ATOM 67 CA SER A 8 20.853 -8.847 8.549 1.00 24.11 C ATOM 68 C SER A 8 22.121 -8.080 8.184 1.00 73.13 C ATOM 69 O SER A 8 22.814 -7.554 9.054 1.00 2.41 O ATOM 70 CB SER A 8 19.633 -7.937 8.399 1.00 2.55 C ATOM 71 OG SER A 8 18.474 -8.687 8.082 1.00 34.21 O ATOM 0 H SER A 8 20.519 -8.761 10.617 1.00 31.13 H new ATOM 0 HA SER A 8 20.751 -9.693 7.869 1.00 24.11 H new ATOM 0 HB2 SER A 8 19.471 -7.385 9.325 1.00 2.55 H new ATOM 0 HB3 SER A 8 19.819 -7.200 7.617 1.00 2.55 H new ATOM 0 HG SER A 8 17.708 -8.083 7.993 1.00 34.21 H new ATOM 77 N ASP A 9 22.417 -8.023 6.890 1.00 23.21 N ATOM 78 CA ASP A 9 23.600 -7.320 6.407 1.00 43.22 C ATOM 79 C ASP A 9 23.262 -6.452 5.199 1.00 64.35 C ATOM 80 O ASP A 9 23.355 -6.900 4.056 1.00 54.40 O ATOM 81 CB ASP A 9 24.699 -8.319 6.041 1.00 62.13 C ATOM 82 CG ASP A 9 26.020 -7.641 5.734 1.00 24.23 C ATOM 83 OD1 ASP A 9 25.998 -6.539 5.145 1.00 22.34 O ATOM 84 OD2 ASP A 9 27.074 -8.211 6.082 1.00 24.20 O ATOM 0 H ASP A 9 21.854 -8.455 6.157 1.00 23.21 H new ATOM 0 HA ASP A 9 23.959 -6.673 7.207 1.00 43.22 H new ATOM 0 HB2 ASP A 9 24.837 -9.021 6.864 1.00 62.13 H new ATOM 0 HB3 ASP A 9 24.383 -8.901 5.175 1.00 62.13 H new ATOM 89 N SER A 10 22.868 -5.211 5.460 1.00 1.43 N ATOM 90 CA SER A 10 22.510 -4.281 4.395 1.00 1.23 C ATOM 91 C SER A 10 21.422 -4.870 3.502 1.00 32.51 C ATOM 92 O SER A 10 21.157 -6.073 3.538 1.00 2.05 O ATOM 93 CB SER A 10 23.742 -3.936 3.556 1.00 34.13 C ATOM 94 OG SER A 10 23.571 -2.701 2.882 1.00 51.01 O ATOM 0 H SER A 10 22.788 -4.825 6.401 1.00 1.43 H new ATOM 0 HA SER A 10 22.125 -3.371 4.855 1.00 1.23 H new ATOM 0 HB2 SER A 10 24.621 -3.884 4.199 1.00 34.13 H new ATOM 0 HB3 SER A 10 23.925 -4.728 2.830 1.00 34.13 H new ATOM 0 HG SER A 10 24.373 -2.503 2.354 1.00 51.01 H new ATOM 100 N LEU A 11 20.794 -4.016 2.702 1.00 11.35 N ATOM 101 CA LEU A 11 19.734 -4.449 1.800 1.00 72.04 C ATOM 102 C LEU A 11 19.864 -3.771 0.440 1.00 4.44 C ATOM 103 O LEU A 11 20.856 -3.094 0.165 1.00 33.32 O ATOM 104 CB LEU A 11 18.363 -4.143 2.406 1.00 64.02 C ATOM 105 CG LEU A 11 18.112 -4.696 3.809 1.00 12.31 C ATOM 106 CD1 LEU A 11 17.114 -3.824 4.555 1.00 31.12 C ATOM 107 CD2 LEU A 11 17.617 -6.132 3.735 1.00 75.41 C ATOM 0 H LEU A 11 21.001 -3.018 2.660 1.00 11.35 H new ATOM 0 HA LEU A 11 19.830 -5.526 1.659 1.00 72.04 H new ATOM 0 HB2 LEU A 11 18.234 -3.061 2.435 1.00 64.02 H new ATOM 0 HB3 LEU A 11 17.597 -4.538 1.739 1.00 64.02 H new ATOM 0 HG LEU A 11 19.054 -4.685 4.357 1.00 12.31 H new ATOM 0 HD11 LEU A 11 16.947 -4.233 5.552 1.00 31.12 H new ATOM 0 HD12 LEU A 11 17.508 -2.811 4.639 1.00 31.12 H new ATOM 0 HD13 LEU A 11 16.171 -3.802 4.009 1.00 31.12 H new ATOM 0 HD21 LEU A 11 17.444 -6.509 4.743 1.00 75.41 H new ATOM 0 HD22 LEU A 11 16.686 -6.167 3.169 1.00 75.41 H new ATOM 0 HD23 LEU A 11 18.366 -6.750 3.240 1.00 75.41 H new ATOM 119 N VAL A 12 18.857 -3.954 -0.406 1.00 73.34 N ATOM 120 CA VAL A 12 18.856 -3.356 -1.736 1.00 64.22 C ATOM 121 C VAL A 12 17.908 -2.165 -1.804 1.00 1.43 C ATOM 122 O VAL A 12 17.131 -2.029 -2.749 1.00 60.43 O ATOM 123 CB VAL A 12 18.453 -4.382 -2.813 1.00 20.34 C ATOM 124 CG1 VAL A 12 16.990 -4.768 -2.660 1.00 30.32 C ATOM 125 CG2 VAL A 12 18.725 -3.829 -4.203 1.00 61.02 C ATOM 0 H VAL A 12 18.030 -4.512 -0.194 1.00 73.34 H new ATOM 0 HA VAL A 12 19.874 -3.017 -1.930 1.00 64.22 H new ATOM 0 HB VAL A 12 19.057 -5.280 -2.680 1.00 20.34 H new ATOM 0 HG11 VAL A 12 16.723 -5.493 -3.429 1.00 30.32 H new ATOM 0 HG12 VAL A 12 16.831 -5.208 -1.675 1.00 30.32 H new ATOM 0 HG13 VAL A 12 16.366 -3.880 -2.766 1.00 30.32 H new ATOM 0 HG21 VAL A 12 18.435 -4.567 -4.951 1.00 61.02 H new ATOM 0 HG22 VAL A 12 18.148 -2.916 -4.351 1.00 61.02 H new ATOM 0 HG23 VAL A 12 19.787 -3.608 -4.305 1.00 61.02 H new ATOM 135 N VAL A 13 17.977 -1.302 -0.795 1.00 21.32 N ATOM 136 CA VAL A 13 17.126 -0.120 -0.739 1.00 72.55 C ATOM 137 C VAL A 13 16.961 0.504 -2.122 1.00 22.43 C ATOM 138 O VAL A 13 17.937 0.701 -2.845 1.00 64.02 O ATOM 139 CB VAL A 13 17.696 0.938 0.224 1.00 71.33 C ATOM 140 CG1 VAL A 13 16.827 2.186 0.220 1.00 2.41 C ATOM 141 CG2 VAL A 13 17.817 0.368 1.629 1.00 73.25 C ATOM 0 H VAL A 13 18.614 -1.400 -0.005 1.00 21.32 H new ATOM 0 HA VAL A 13 16.153 -0.448 -0.372 1.00 72.55 H new ATOM 0 HB VAL A 13 18.693 1.217 -0.118 1.00 71.33 H new ATOM 0 HG11 VAL A 13 17.245 2.923 0.906 1.00 2.41 H new ATOM 0 HG12 VAL A 13 16.795 2.604 -0.786 1.00 2.41 H new ATOM 0 HG13 VAL A 13 15.817 1.927 0.537 1.00 2.41 H new ATOM 0 HG21 VAL A 13 18.221 1.129 2.297 1.00 73.25 H new ATOM 0 HG22 VAL A 13 16.833 0.061 1.983 1.00 73.25 H new ATOM 0 HG23 VAL A 13 18.484 -0.494 1.616 1.00 73.25 H new ATOM 151 N CYS A 14 15.720 0.811 -2.481 1.00 52.31 N ATOM 152 CA CYS A 14 15.426 1.413 -3.777 1.00 31.32 C ATOM 153 C CYS A 14 14.886 2.829 -3.609 1.00 73.12 C ATOM 154 O CYS A 14 14.384 3.189 -2.545 1.00 12.11 O ATOM 155 CB CYS A 14 14.417 0.556 -4.543 1.00 45.20 C ATOM 156 SG CYS A 14 14.826 -1.205 -4.585 1.00 53.24 S ATOM 0 H CYS A 14 14.901 0.653 -1.894 1.00 52.31 H new ATOM 0 HA CYS A 14 16.354 1.464 -4.346 1.00 31.32 H new ATOM 0 HB2 CYS A 14 13.434 0.679 -4.089 1.00 45.20 H new ATOM 0 HB3 CYS A 14 14.345 0.926 -5.566 1.00 45.20 H new ATOM 0 HG CYS A 14 15.786 -1.448 -3.743 1.00 53.24 H new ATOM 162 N GLU A 15 14.994 3.628 -4.667 1.00 13.13 N ATOM 163 CA GLU A 15 14.517 5.006 -4.634 1.00 23.41 C ATOM 164 C GLU A 15 13.030 5.076 -4.970 1.00 64.53 C ATOM 165 O GLU A 15 12.419 4.074 -5.342 1.00 64.23 O ATOM 166 CB GLU A 15 15.315 5.867 -5.616 1.00 15.10 C ATOM 167 CG GLU A 15 16.345 6.759 -4.946 1.00 0.04 C ATOM 168 CD GLU A 15 15.951 8.222 -4.964 1.00 44.53 C ATOM 169 OE1 GLU A 15 14.750 8.517 -4.787 1.00 63.14 O ATOM 170 OE2 GLU A 15 16.844 9.075 -5.156 1.00 4.24 O ATOM 0 H GLU A 15 15.407 3.345 -5.556 1.00 13.13 H new ATOM 0 HA GLU A 15 14.661 5.390 -3.624 1.00 23.41 H new ATOM 0 HB2 GLU A 15 15.820 5.216 -6.329 1.00 15.10 H new ATOM 0 HB3 GLU A 15 14.624 6.489 -6.185 1.00 15.10 H new ATOM 0 HG2 GLU A 15 16.483 6.437 -3.914 1.00 0.04 H new ATOM 0 HG3 GLU A 15 17.305 6.639 -5.448 1.00 0.04 H new ATOM 177 N VAL A 16 12.454 6.265 -4.835 1.00 2.21 N ATOM 178 CA VAL A 16 11.040 6.467 -5.124 1.00 12.52 C ATOM 179 C VAL A 16 10.846 7.124 -6.486 1.00 75.21 C ATOM 180 O VAL A 16 10.959 8.342 -6.621 1.00 70.05 O ATOM 181 CB VAL A 16 10.365 7.338 -4.046 1.00 31.41 C ATOM 182 CG1 VAL A 16 11.218 8.557 -3.734 1.00 5.52 C ATOM 183 CG2 VAL A 16 8.971 7.751 -4.492 1.00 11.43 C ATOM 0 H VAL A 16 12.945 7.104 -4.527 1.00 2.21 H new ATOM 0 HA VAL A 16 10.574 5.482 -5.129 1.00 12.52 H new ATOM 0 HB VAL A 16 10.270 6.749 -3.134 1.00 31.41 H new ATOM 0 HG11 VAL A 16 10.726 9.160 -2.971 1.00 5.52 H new ATOM 0 HG12 VAL A 16 12.193 8.235 -3.369 1.00 5.52 H new ATOM 0 HG13 VAL A 16 11.348 9.151 -4.638 1.00 5.52 H new ATOM 0 HG21 VAL A 16 8.509 8.365 -3.719 1.00 11.43 H new ATOM 0 HG22 VAL A 16 9.040 8.323 -5.417 1.00 11.43 H new ATOM 0 HG23 VAL A 16 8.364 6.861 -4.659 1.00 11.43 H new ATOM 193 N ASP A 17 10.551 6.308 -7.493 1.00 14.02 N ATOM 194 CA ASP A 17 10.339 6.810 -8.846 1.00 1.04 C ATOM 195 C ASP A 17 9.697 8.193 -8.818 1.00 71.32 C ATOM 196 O ASP A 17 8.812 8.478 -8.010 1.00 51.22 O ATOM 197 CB ASP A 17 9.460 5.842 -9.639 1.00 20.13 C ATOM 198 CG ASP A 17 9.526 6.091 -11.133 1.00 23.25 C ATOM 199 OD1 ASP A 17 10.504 5.642 -11.766 1.00 64.43 O ATOM 200 OD2 ASP A 17 8.601 6.736 -11.669 1.00 52.10 O ATOM 0 H ASP A 17 10.453 5.297 -7.398 1.00 14.02 H new ATOM 0 HA ASP A 17 11.310 6.890 -9.334 1.00 1.04 H new ATOM 0 HB2 ASP A 17 9.772 4.819 -9.430 1.00 20.13 H new ATOM 0 HB3 ASP A 17 8.427 5.936 -9.303 1.00 20.13 H new ATOM 205 N PRO A 18 10.151 9.075 -9.720 1.00 1.32 N ATOM 206 CA PRO A 18 9.635 10.443 -9.819 1.00 44.33 C ATOM 207 C PRO A 18 8.207 10.487 -10.352 1.00 4.42 C ATOM 208 O PRO A 18 7.399 11.306 -9.916 1.00 42.43 O ATOM 209 CB PRO A 18 10.595 11.113 -10.806 1.00 40.34 C ATOM 210 CG PRO A 18 11.134 9.994 -11.629 1.00 3.52 C ATOM 211 CD PRO A 18 11.204 8.804 -10.714 1.00 64.21 C ATOM 0 HA PRO A 18 9.590 10.933 -8.847 1.00 44.33 H new ATOM 0 HB2 PRO A 18 10.078 11.846 -11.425 1.00 40.34 H new ATOM 0 HB3 PRO A 18 11.393 11.641 -10.285 1.00 40.34 H new ATOM 0 HG2 PRO A 18 10.488 9.792 -12.484 1.00 3.52 H new ATOM 0 HG3 PRO A 18 12.119 10.240 -12.025 1.00 3.52 H new ATOM 0 HD2 PRO A 18 11.020 7.873 -11.251 1.00 64.21 H new ATOM 0 HD3 PRO A 18 12.184 8.714 -10.246 1.00 64.21 H new ATOM 219 N GLU A 19 7.905 9.602 -11.295 1.00 70.32 N ATOM 220 CA GLU A 19 6.573 9.541 -11.886 1.00 15.24 C ATOM 221 C GLU A 19 5.542 9.081 -10.859 1.00 61.42 C ATOM 222 O GLU A 19 4.359 9.410 -10.959 1.00 24.41 O ATOM 223 CB GLU A 19 6.568 8.596 -13.089 1.00 55.14 C ATOM 224 CG GLU A 19 6.258 7.152 -12.728 1.00 2.52 C ATOM 225 CD GLU A 19 4.844 6.749 -13.096 1.00 51.23 C ATOM 226 OE1 GLU A 19 3.946 7.615 -13.035 1.00 75.50 O ATOM 227 OE2 GLU A 19 4.635 5.568 -13.445 1.00 71.00 O ATOM 0 H GLU A 19 8.564 8.917 -11.667 1.00 70.32 H new ATOM 0 HA GLU A 19 6.305 10.544 -12.219 1.00 15.24 H new ATOM 0 HB2 GLU A 19 5.832 8.947 -13.813 1.00 55.14 H new ATOM 0 HB3 GLU A 19 7.541 8.639 -13.578 1.00 55.14 H new ATOM 0 HG2 GLU A 19 6.963 6.495 -13.237 1.00 2.52 H new ATOM 0 HG3 GLU A 19 6.405 7.009 -11.657 1.00 2.52 H new ATOM 234 N LEU A 20 5.999 8.318 -9.872 1.00 64.54 N ATOM 235 CA LEU A 20 5.118 7.811 -8.826 1.00 11.41 C ATOM 236 C LEU A 20 4.978 8.824 -7.694 1.00 64.24 C ATOM 237 O LEU A 20 3.871 9.124 -7.247 1.00 74.14 O ATOM 238 CB LEU A 20 5.654 6.487 -8.278 1.00 13.23 C ATOM 239 CG LEU A 20 4.604 5.494 -7.779 1.00 15.02 C ATOM 240 CD1 LEU A 20 5.243 4.145 -7.484 1.00 51.22 C ATOM 241 CD2 LEU A 20 3.902 6.035 -6.543 1.00 10.33 C ATOM 0 H LEU A 20 6.975 8.037 -9.774 1.00 64.54 H new ATOM 0 HA LEU A 20 4.134 7.644 -9.263 1.00 11.41 H new ATOM 0 HB2 LEU A 20 6.240 6.004 -9.060 1.00 13.23 H new ATOM 0 HB3 LEU A 20 6.337 6.706 -7.457 1.00 13.23 H new ATOM 0 HG LEU A 20 3.860 5.357 -8.564 1.00 15.02 H new ATOM 0 HD11 LEU A 20 4.481 3.451 -7.130 1.00 51.22 H new ATOM 0 HD12 LEU A 20 5.698 3.751 -8.393 1.00 51.22 H new ATOM 0 HD13 LEU A 20 6.009 4.265 -6.717 1.00 51.22 H new ATOM 0 HD21 LEU A 20 3.158 5.315 -6.202 1.00 10.33 H new ATOM 0 HD22 LEU A 20 4.634 6.202 -5.753 1.00 10.33 H new ATOM 0 HD23 LEU A 20 3.410 6.977 -6.787 1.00 10.33 H new ATOM 253 N LYS A 21 6.108 9.351 -7.235 1.00 42.20 N ATOM 254 CA LYS A 21 6.114 10.333 -6.158 1.00 35.14 C ATOM 255 C LYS A 21 4.902 11.255 -6.257 1.00 5.11 C ATOM 256 O LYS A 21 4.259 11.559 -5.253 1.00 61.11 O ATOM 257 CB LYS A 21 7.401 11.158 -6.198 1.00 52.30 C ATOM 258 CG LYS A 21 7.651 11.958 -4.932 1.00 11.44 C ATOM 259 CD LYS A 21 8.245 13.322 -5.242 1.00 4.53 C ATOM 260 CE LYS A 21 9.747 13.344 -5.003 1.00 21.32 C ATOM 261 NZ LYS A 21 10.182 14.590 -4.315 1.00 44.32 N ATOM 0 H LYS A 21 7.033 9.114 -7.593 1.00 42.20 H new ATOM 0 HA LYS A 21 6.065 9.797 -5.210 1.00 35.14 H new ATOM 0 HB2 LYS A 21 8.245 10.490 -6.368 1.00 52.30 H new ATOM 0 HB3 LYS A 21 7.359 11.841 -7.047 1.00 52.30 H new ATOM 0 HG2 LYS A 21 6.714 12.083 -4.389 1.00 11.44 H new ATOM 0 HG3 LYS A 21 8.327 11.406 -4.279 1.00 11.44 H new ATOM 0 HD2 LYS A 21 8.037 13.583 -6.280 1.00 4.53 H new ATOM 0 HD3 LYS A 21 7.766 14.078 -4.621 1.00 4.53 H new ATOM 0 HE2 LYS A 21 10.032 12.480 -4.403 1.00 21.32 H new ATOM 0 HE3 LYS A 21 10.268 13.255 -5.957 1.00 21.32 H new ATOM 0 HZ1 LYS A 21 11.212 14.566 -4.171 1.00 44.32 H new ATOM 0 HZ2 LYS A 21 9.934 15.414 -4.899 1.00 44.32 H new ATOM 0 HZ3 LYS A 21 9.705 14.662 -3.394 1.00 44.32 H new ATOM 275 N GLU A 22 4.598 11.696 -7.474 1.00 44.13 N ATOM 276 CA GLU A 22 3.464 12.584 -7.703 1.00 32.53 C ATOM 277 C GLU A 22 2.145 11.855 -7.458 1.00 32.30 C ATOM 278 O GLU A 22 1.229 12.395 -6.836 1.00 71.24 O ATOM 279 CB GLU A 22 3.498 13.134 -9.130 1.00 0.22 C ATOM 280 CG GLU A 22 4.864 13.648 -9.551 1.00 71.44 C ATOM 281 CD GLU A 22 4.779 14.734 -10.607 1.00 12.24 C ATOM 282 OE1 GLU A 22 4.175 14.483 -11.669 1.00 73.34 O ATOM 283 OE2 GLU A 22 5.317 15.836 -10.368 1.00 34.11 O ATOM 0 H GLU A 22 5.121 11.453 -8.316 1.00 44.13 H new ATOM 0 HA GLU A 22 3.537 13.414 -7.000 1.00 32.53 H new ATOM 0 HB2 GLU A 22 3.185 12.350 -9.820 1.00 0.22 H new ATOM 0 HB3 GLU A 22 2.772 13.943 -9.216 1.00 0.22 H new ATOM 0 HG2 GLU A 22 5.387 14.036 -8.677 1.00 71.44 H new ATOM 0 HG3 GLU A 22 5.458 12.818 -9.935 1.00 71.44 H new ATOM 290 N THR A 23 2.056 10.624 -7.952 1.00 55.21 N ATOM 291 CA THR A 23 0.850 9.821 -7.790 1.00 73.01 C ATOM 292 C THR A 23 0.363 9.845 -6.346 1.00 65.22 C ATOM 293 O THR A 23 -0.839 9.903 -6.086 1.00 34.30 O ATOM 294 CB THR A 23 1.087 8.359 -8.216 1.00 45.30 C ATOM 295 OG1 THR A 23 1.102 8.262 -9.645 1.00 4.04 O ATOM 296 CG2 THR A 23 0.006 7.450 -7.652 1.00 62.32 C ATOM 0 H THR A 23 2.805 10.161 -8.468 1.00 55.21 H new ATOM 0 HA THR A 23 0.089 10.261 -8.434 1.00 73.01 H new ATOM 0 HB THR A 23 2.051 8.039 -7.821 1.00 45.30 H new ATOM 0 HG1 THR A 23 1.558 7.436 -9.912 1.00 4.04 H new ATOM 0 HG21 THR A 23 0.194 6.423 -7.966 1.00 62.32 H new ATOM 0 HG22 THR A 23 0.016 7.505 -6.563 1.00 62.32 H new ATOM 0 HG23 THR A 23 -0.968 7.770 -8.022 1.00 62.32 H new ATOM 304 N LEU A 24 1.304 9.802 -5.409 1.00 70.15 N ATOM 305 CA LEU A 24 0.972 9.820 -3.988 1.00 75.05 C ATOM 306 C LEU A 24 0.536 11.213 -3.549 1.00 54.33 C ATOM 307 O LEU A 24 -0.524 11.382 -2.945 1.00 70.22 O ATOM 308 CB LEU A 24 2.171 9.362 -3.158 1.00 4.45 C ATOM 309 CG LEU A 24 2.929 8.144 -3.687 1.00 5.02 C ATOM 310 CD1 LEU A 24 4.065 7.772 -2.747 1.00 13.21 C ATOM 311 CD2 LEU A 24 1.983 6.967 -3.876 1.00 34.01 C ATOM 0 H LEU A 24 2.303 9.754 -5.608 1.00 70.15 H new ATOM 0 HA LEU A 24 0.142 9.132 -3.825 1.00 75.05 H new ATOM 0 HB2 LEU A 24 2.871 10.194 -3.078 1.00 4.45 H new ATOM 0 HB3 LEU A 24 1.825 9.139 -2.149 1.00 4.45 H new ATOM 0 HG LEU A 24 3.356 8.400 -4.657 1.00 5.02 H new ATOM 0 HD11 LEU A 24 4.593 6.903 -3.140 1.00 13.21 H new ATOM 0 HD12 LEU A 24 4.757 8.610 -2.663 1.00 13.21 H new ATOM 0 HD13 LEU A 24 3.660 7.536 -1.763 1.00 13.21 H new ATOM 0 HD21 LEU A 24 2.540 6.109 -4.253 1.00 34.01 H new ATOM 0 HD22 LEU A 24 1.525 6.711 -2.920 1.00 34.01 H new ATOM 0 HD23 LEU A 24 1.205 7.237 -4.590 1.00 34.01 H new ATOM 323 N ARG A 25 1.359 12.210 -3.858 1.00 61.24 N ATOM 324 CA ARG A 25 1.058 13.590 -3.496 1.00 4.34 C ATOM 325 C ARG A 25 -0.353 13.972 -3.936 1.00 5.50 C ATOM 326 O ARG A 25 -1.020 14.777 -3.286 1.00 12.43 O ATOM 327 CB ARG A 25 2.077 14.539 -4.128 1.00 53.20 C ATOM 328 CG ARG A 25 2.034 15.947 -3.556 1.00 64.41 C ATOM 329 CD ARG A 25 3.134 16.819 -4.141 1.00 45.44 C ATOM 330 NE ARG A 25 2.715 17.472 -5.379 1.00 60.52 N ATOM 331 CZ ARG A 25 2.797 16.899 -6.575 1.00 43.53 C ATOM 332 NH1 ARG A 25 3.280 15.671 -6.695 1.00 23.22 N ATOM 333 NH2 ARG A 25 2.395 17.558 -7.655 1.00 65.41 N ATOM 0 H ARG A 25 2.239 12.088 -4.358 1.00 61.24 H new ATOM 0 HA ARG A 25 1.117 13.676 -2.411 1.00 4.34 H new ATOM 0 HB2 ARG A 25 3.078 14.130 -3.989 1.00 53.20 H new ATOM 0 HB3 ARG A 25 1.899 14.587 -5.202 1.00 53.20 H new ATOM 0 HG2 ARG A 25 1.063 16.396 -3.764 1.00 64.41 H new ATOM 0 HG3 ARG A 25 2.140 15.904 -2.472 1.00 64.41 H new ATOM 0 HD2 ARG A 25 3.423 17.576 -3.412 1.00 45.44 H new ATOM 0 HD3 ARG A 25 4.016 16.209 -4.334 1.00 45.44 H new ATOM 0 HE ARG A 25 2.339 18.419 -5.322 1.00 60.52 H new ATOM 0 HH11 ARG A 25 3.591 15.162 -5.867 1.00 23.22 H new ATOM 0 HH12 ARG A 25 3.341 15.235 -7.615 1.00 23.22 H new ATOM 0 HH21 ARG A 25 2.023 18.504 -7.566 1.00 65.41 H new ATOM 0 HH22 ARG A 25 2.458 17.119 -8.573 1.00 65.41 H new ATOM 347 N LYS A 26 -0.798 13.391 -5.044 1.00 15.45 N ATOM 348 CA LYS A 26 -2.129 13.669 -5.572 1.00 13.20 C ATOM 349 C LYS A 26 -3.175 12.779 -4.909 1.00 12.43 C ATOM 350 O LYS A 26 -4.276 13.228 -4.590 1.00 40.34 O ATOM 351 CB LYS A 26 -2.152 13.461 -7.087 1.00 72.44 C ATOM 352 CG LYS A 26 -0.851 13.836 -7.774 1.00 24.23 C ATOM 353 CD LYS A 26 -1.078 14.850 -8.883 1.00 63.02 C ATOM 354 CE LYS A 26 0.052 14.824 -9.901 1.00 14.12 C ATOM 355 NZ LYS A 26 -0.460 14.726 -11.296 1.00 4.41 N ATOM 0 H LYS A 26 -0.257 12.724 -5.595 1.00 15.45 H new ATOM 0 HA LYS A 26 -2.371 14.709 -5.351 1.00 13.20 H new ATOM 0 HB2 LYS A 26 -2.376 12.415 -7.298 1.00 72.44 H new ATOM 0 HB3 LYS A 26 -2.962 14.053 -7.514 1.00 72.44 H new ATOM 0 HG2 LYS A 26 -0.157 14.247 -7.041 1.00 24.23 H new ATOM 0 HG3 LYS A 26 -0.386 12.941 -8.188 1.00 24.23 H new ATOM 0 HD2 LYS A 26 -2.024 14.639 -9.382 1.00 63.02 H new ATOM 0 HD3 LYS A 26 -1.160 15.849 -8.454 1.00 63.02 H new ATOM 0 HE2 LYS A 26 0.654 15.727 -9.798 1.00 14.12 H new ATOM 0 HE3 LYS A 26 0.707 13.978 -9.694 1.00 14.12 H new ATOM 0 HZ1 LYS A 26 0.341 14.711 -11.959 1.00 4.41 H new ATOM 0 HZ2 LYS A 26 -1.014 13.852 -11.402 1.00 4.41 H new ATOM 0 HZ3 LYS A 26 -1.065 15.546 -11.502 1.00 4.41 H new ATOM 369 N PHE A 27 -2.823 11.515 -4.702 1.00 33.41 N ATOM 370 CA PHE A 27 -3.731 10.561 -4.075 1.00 72.15 C ATOM 371 C PHE A 27 -4.178 11.056 -2.703 1.00 70.12 C ATOM 372 O PHE A 27 -5.221 10.646 -2.193 1.00 23.13 O ATOM 373 CB PHE A 27 -3.058 9.194 -3.942 1.00 63.13 C ATOM 374 CG PHE A 27 -4.029 8.056 -3.813 1.00 20.10 C ATOM 375 CD1 PHE A 27 -4.960 7.806 -4.808 1.00 14.31 C ATOM 376 CD2 PHE A 27 -4.012 7.236 -2.697 1.00 5.04 C ATOM 377 CE1 PHE A 27 -5.857 6.760 -4.693 1.00 30.03 C ATOM 378 CE2 PHE A 27 -4.905 6.188 -2.575 1.00 73.21 C ATOM 379 CZ PHE A 27 -5.829 5.950 -3.574 1.00 55.23 C ATOM 0 H PHE A 27 -1.915 11.127 -4.959 1.00 33.41 H new ATOM 0 HA PHE A 27 -4.611 10.464 -4.711 1.00 72.15 H new ATOM 0 HB2 PHE A 27 -2.425 9.024 -4.813 1.00 63.13 H new ATOM 0 HB3 PHE A 27 -2.404 9.203 -3.070 1.00 63.13 H new ATOM 0 HD1 PHE A 27 -4.985 8.436 -5.685 1.00 14.31 H new ATOM 0 HD2 PHE A 27 -3.292 7.418 -1.913 1.00 5.04 H new ATOM 0 HE1 PHE A 27 -6.578 6.577 -5.476 1.00 30.03 H new ATOM 0 HE2 PHE A 27 -4.880 5.556 -1.700 1.00 73.21 H new ATOM 0 HZ PHE A 27 -6.528 5.132 -3.480 1.00 55.23 H new ATOM 389 N ARG A 28 -3.381 11.939 -2.112 1.00 13.52 N ATOM 390 CA ARG A 28 -3.693 12.489 -0.798 1.00 2.21 C ATOM 391 C ARG A 28 -4.568 13.732 -0.923 1.00 13.43 C ATOM 392 O ARG A 28 -5.415 13.996 -0.069 1.00 14.23 O ATOM 393 CB ARG A 28 -2.405 12.833 -0.046 1.00 42.24 C ATOM 394 CG ARG A 28 -1.207 12.006 -0.483 1.00 1.24 C ATOM 395 CD ARG A 28 -0.386 11.543 0.711 1.00 71.25 C ATOM 396 NE ARG A 28 0.342 12.645 1.336 1.00 74.41 N ATOM 397 CZ ARG A 28 1.412 13.220 0.797 1.00 75.30 C ATOM 398 NH1 ARG A 28 1.874 12.800 -0.372 1.00 24.32 N ATOM 399 NH2 ARG A 28 2.018 14.218 1.427 1.00 24.54 N ATOM 0 H ARG A 28 -2.515 12.289 -2.521 1.00 13.52 H new ATOM 0 HA ARG A 28 -4.243 11.733 -0.237 1.00 2.21 H new ATOM 0 HB2 ARG A 28 -2.180 13.889 -0.192 1.00 42.24 H new ATOM 0 HB3 ARG A 28 -2.567 12.687 1.022 1.00 42.24 H new ATOM 0 HG2 ARG A 28 -1.548 11.140 -1.049 1.00 1.24 H new ATOM 0 HG3 ARG A 28 -0.580 12.596 -1.151 1.00 1.24 H new ATOM 0 HD2 ARG A 28 -1.045 11.081 1.446 1.00 71.25 H new ATOM 0 HD3 ARG A 28 0.321 10.778 0.390 1.00 71.25 H new ATOM 0 HE ARG A 28 0.011 12.992 2.236 1.00 74.41 H new ATOM 0 HH11 ARG A 28 1.408 12.034 -0.859 1.00 24.32 H new ATOM 0 HH12 ARG A 28 2.695 13.242 -0.784 1.00 24.32 H new ATOM 0 HH21 ARG A 28 1.663 14.544 2.326 1.00 24.54 H new ATOM 0 HH22 ARG A 28 2.839 14.659 1.013 1.00 24.54 H new ATOM 413 N PHE A 29 -4.358 14.493 -1.992 1.00 0.15 N ATOM 414 CA PHE A 29 -5.128 15.709 -2.228 1.00 3.14 C ATOM 415 C PHE A 29 -5.963 15.586 -3.498 1.00 45.51 C ATOM 416 O PHE A 29 -6.193 16.571 -4.200 1.00 73.03 O ATOM 417 CB PHE A 29 -4.193 16.917 -2.333 1.00 64.21 C ATOM 418 CG PHE A 29 -2.897 16.738 -1.594 1.00 41.15 C ATOM 419 CD1 PHE A 29 -2.888 16.280 -0.287 1.00 63.41 C ATOM 420 CD2 PHE A 29 -1.689 17.029 -2.208 1.00 74.13 C ATOM 421 CE1 PHE A 29 -1.696 16.113 0.395 1.00 31.11 C ATOM 422 CE2 PHE A 29 -0.496 16.865 -1.531 1.00 63.11 C ATOM 423 CZ PHE A 29 -0.499 16.408 -0.227 1.00 11.00 C ATOM 0 H PHE A 29 -3.661 14.289 -2.709 1.00 0.15 H new ATOM 0 HA PHE A 29 -5.803 15.852 -1.384 1.00 3.14 H new ATOM 0 HB2 PHE A 29 -3.979 17.110 -3.384 1.00 64.21 H new ATOM 0 HB3 PHE A 29 -4.705 17.797 -1.945 1.00 64.21 H new ATOM 0 HD1 PHE A 29 -3.822 16.051 0.205 1.00 63.41 H new ATOM 0 HD2 PHE A 29 -1.680 17.388 -3.227 1.00 74.13 H new ATOM 0 HE1 PHE A 29 -1.702 15.752 1.413 1.00 31.11 H new ATOM 0 HE2 PHE A 29 0.439 17.094 -2.021 1.00 63.11 H new ATOM 0 HZ PHE A 29 0.433 16.282 0.304 1.00 11.00 H new ATOM 433 N ARG A 30 -6.413 14.370 -3.788 1.00 63.32 N ATOM 434 CA ARG A 30 -7.222 14.117 -4.975 1.00 23.12 C ATOM 435 C ARG A 30 -8.702 14.345 -4.684 1.00 5.23 C ATOM 436 O ARG A 30 -9.072 14.771 -3.590 1.00 1.33 O ATOM 437 CB ARG A 30 -7.003 12.686 -5.471 1.00 53.54 C ATOM 438 CG ARG A 30 -7.164 11.634 -4.386 1.00 71.13 C ATOM 439 CD ARG A 30 -7.004 10.229 -4.944 1.00 70.05 C ATOM 440 NE ARG A 30 -8.287 9.545 -5.080 1.00 72.12 N ATOM 441 CZ ARG A 30 -8.876 8.883 -4.090 1.00 60.51 C ATOM 442 NH1 ARG A 30 -8.299 8.817 -2.898 1.00 71.44 N ATOM 443 NH2 ARG A 30 -10.044 8.286 -4.291 1.00 63.22 N ATOM 0 H ARG A 30 -6.231 13.544 -3.218 1.00 63.32 H new ATOM 0 HA ARG A 30 -6.911 14.816 -5.752 1.00 23.12 H new ATOM 0 HB2 ARG A 30 -7.709 12.477 -6.275 1.00 53.54 H new ATOM 0 HB3 ARG A 30 -6.002 12.607 -5.896 1.00 53.54 H new ATOM 0 HG2 ARG A 30 -6.425 11.802 -3.603 1.00 71.13 H new ATOM 0 HG3 ARG A 30 -8.146 11.734 -3.924 1.00 71.13 H new ATOM 0 HD2 ARG A 30 -6.515 10.279 -5.917 1.00 70.05 H new ATOM 0 HD3 ARG A 30 -6.353 9.651 -4.289 1.00 70.05 H new ATOM 0 HE ARG A 30 -8.757 9.577 -5.985 1.00 72.12 H new ATOM 0 HH11 ARG A 30 -7.401 9.275 -2.740 1.00 71.44 H new ATOM 0 HH12 ARG A 30 -8.753 8.308 -2.139 1.00 71.44 H new ATOM 0 HH21 ARG A 30 -10.491 8.335 -5.207 1.00 63.22 H new ATOM 0 HH22 ARG A 30 -10.495 7.778 -3.530 1.00 63.22 H new ATOM 457 N LYS A 31 -9.545 14.059 -5.670 1.00 3.31 N ATOM 458 CA LYS A 31 -10.985 14.232 -5.520 1.00 41.03 C ATOM 459 C LYS A 31 -11.545 13.261 -4.487 1.00 3.05 C ATOM 460 O LYS A 31 -12.660 13.436 -3.997 1.00 53.22 O ATOM 461 CB LYS A 31 -11.685 14.022 -6.865 1.00 15.44 C ATOM 462 CG LYS A 31 -11.456 15.152 -7.853 1.00 42.44 C ATOM 463 CD LYS A 31 -10.191 14.933 -8.666 1.00 14.40 C ATOM 464 CE LYS A 31 -10.267 15.635 -10.014 1.00 2.21 C ATOM 465 NZ LYS A 31 -10.753 14.725 -11.087 1.00 34.25 N ATOM 0 H LYS A 31 -9.256 13.706 -6.582 1.00 3.31 H new ATOM 0 HA LYS A 31 -11.171 15.249 -5.174 1.00 41.03 H new ATOM 0 HB2 LYS A 31 -11.334 13.089 -7.306 1.00 15.44 H new ATOM 0 HB3 LYS A 31 -12.756 13.911 -6.694 1.00 15.44 H new ATOM 0 HG2 LYS A 31 -12.312 15.229 -8.524 1.00 42.44 H new ATOM 0 HG3 LYS A 31 -11.385 16.098 -7.316 1.00 42.44 H new ATOM 0 HD2 LYS A 31 -9.330 15.304 -8.109 1.00 14.40 H new ATOM 0 HD3 LYS A 31 -10.036 13.865 -8.819 1.00 14.40 H new ATOM 0 HE2 LYS A 31 -10.932 16.495 -9.938 1.00 2.21 H new ATOM 0 HE3 LYS A 31 -9.281 16.017 -10.281 1.00 2.21 H new ATOM 0 HZ1 LYS A 31 -10.790 15.241 -11.989 1.00 34.25 H new ATOM 0 HZ2 LYS A 31 -10.105 13.917 -11.177 1.00 34.25 H new ATOM 0 HZ3 LYS A 31 -11.704 14.380 -10.846 1.00 34.25 H new ATOM 479 N GLU A 32 -10.762 12.238 -4.156 1.00 31.20 N ATOM 480 CA GLU A 32 -11.182 11.240 -3.179 1.00 32.11 C ATOM 481 C GLU A 32 -12.683 10.986 -3.272 1.00 74.02 C ATOM 482 O GLU A 32 -13.240 10.873 -4.365 1.00 32.43 O ATOM 483 CB GLU A 32 -10.817 11.695 -1.765 1.00 32.30 C ATOM 484 CG GLU A 32 -9.381 12.171 -1.630 1.00 42.31 C ATOM 485 CD GLU A 32 -8.995 12.465 -0.193 1.00 52.22 C ATOM 486 OE1 GLU A 32 -9.105 11.551 0.650 1.00 73.42 O ATOM 487 OE2 GLU A 32 -8.583 13.610 0.088 1.00 14.12 O ATOM 0 H GLU A 32 -9.835 12.079 -4.550 1.00 31.20 H new ATOM 0 HA GLU A 32 -10.660 10.309 -3.400 1.00 32.11 H new ATOM 0 HB2 GLU A 32 -11.487 12.501 -1.468 1.00 32.30 H new ATOM 0 HB3 GLU A 32 -10.984 10.870 -1.073 1.00 32.30 H new ATOM 0 HG2 GLU A 32 -8.711 11.412 -2.034 1.00 42.31 H new ATOM 0 HG3 GLU A 32 -9.242 13.070 -2.230 1.00 42.31 H new ATOM 494 N THR A 33 -13.335 10.895 -2.116 1.00 43.10 N ATOM 495 CA THR A 33 -14.771 10.653 -2.065 1.00 63.45 C ATOM 496 C THR A 33 -15.131 9.337 -2.747 1.00 24.42 C ATOM 497 O THR A 33 -16.304 9.048 -2.980 1.00 45.23 O ATOM 498 CB THR A 33 -15.558 11.796 -2.734 1.00 71.35 C ATOM 499 OG1 THR A 33 -15.565 11.619 -4.155 1.00 1.42 O ATOM 500 CG2 THR A 33 -14.950 13.146 -2.388 1.00 44.34 C ATOM 0 H THR A 33 -12.890 10.985 -1.203 1.00 43.10 H new ATOM 0 HA THR A 33 -15.045 10.601 -1.011 1.00 63.45 H new ATOM 0 HB THR A 33 -16.582 11.771 -2.360 1.00 71.35 H new ATOM 0 HG1 THR A 33 -14.679 11.325 -4.452 1.00 1.42 H new ATOM 0 HG21 THR A 33 -15.522 13.938 -2.872 1.00 44.34 H new ATOM 0 HG22 THR A 33 -14.973 13.289 -1.308 1.00 44.34 H new ATOM 0 HG23 THR A 33 -13.918 13.180 -2.736 1.00 44.34 H new ATOM 508 N ASN A 34 -14.113 8.542 -3.063 1.00 63.04 N ATOM 509 CA ASN A 34 -14.323 7.256 -3.718 1.00 12.12 C ATOM 510 C ASN A 34 -13.198 6.283 -3.380 1.00 5.35 C ATOM 511 O ASN A 34 -12.033 6.532 -3.691 1.00 54.41 O ATOM 512 CB ASN A 34 -14.414 7.441 -5.234 1.00 25.43 C ATOM 513 CG ASN A 34 -13.049 7.581 -5.882 1.00 35.22 C ATOM 514 OD1 ASN A 34 -12.601 8.687 -6.179 1.00 55.50 O ATOM 515 ND2 ASN A 34 -12.382 6.454 -6.104 1.00 65.03 N ATOM 0 H ASN A 34 -13.136 8.766 -2.876 1.00 63.04 H new ATOM 0 HA ASN A 34 -15.262 6.839 -3.352 1.00 12.12 H new ATOM 0 HB2 ASN A 34 -14.935 6.589 -5.671 1.00 25.43 H new ATOM 0 HB3 ASN A 34 -15.010 8.326 -5.454 1.00 25.43 H new ATOM 0 HD21 ASN A 34 -11.459 6.484 -6.537 1.00 65.03 H new ATOM 0 HD22 ASN A 34 -12.793 5.558 -5.841 1.00 65.03 H new ATOM 522 N ASN A 35 -13.554 5.174 -2.740 1.00 22.32 N ATOM 523 CA ASN A 35 -12.574 4.164 -2.358 1.00 24.41 C ATOM 524 C ASN A 35 -11.701 3.776 -3.549 1.00 4.45 C ATOM 525 O ASN A 35 -12.196 3.277 -4.558 1.00 22.33 O ATOM 526 CB ASN A 35 -13.278 2.923 -1.804 1.00 2.14 C ATOM 527 CG ASN A 35 -13.850 3.155 -0.418 1.00 3.02 C ATOM 528 OD1 ASN A 35 -13.610 4.193 0.199 1.00 41.23 O ATOM 529 ND2 ASN A 35 -14.610 2.185 0.077 1.00 31.32 N ATOM 0 H ASN A 35 -14.514 4.952 -2.475 1.00 22.32 H new ATOM 0 HA ASN A 35 -11.936 4.588 -1.583 1.00 24.41 H new ATOM 0 HB2 ASN A 35 -14.080 2.631 -2.481 1.00 2.14 H new ATOM 0 HB3 ASN A 35 -12.572 2.093 -1.769 1.00 2.14 H new ATOM 0 HD21 ASN A 35 -15.022 2.283 1.005 1.00 31.32 H new ATOM 0 HD22 ASN A 35 -14.782 1.342 -0.471 1.00 31.32 H new ATOM 536 N ALA A 36 -10.399 4.010 -3.420 1.00 63.54 N ATOM 537 CA ALA A 36 -9.456 3.683 -4.483 1.00 14.41 C ATOM 538 C ALA A 36 -8.206 3.015 -3.922 1.00 63.14 C ATOM 539 O ALA A 36 -7.937 3.086 -2.723 1.00 54.05 O ATOM 540 CB ALA A 36 -9.082 4.937 -5.261 1.00 32.11 C ATOM 0 H ALA A 36 -9.973 4.424 -2.591 1.00 63.54 H new ATOM 0 HA ALA A 36 -9.940 2.979 -5.160 1.00 14.41 H new ATOM 0 HB1 ALA A 36 -8.377 4.678 -6.051 1.00 32.11 H new ATOM 0 HB2 ALA A 36 -9.979 5.372 -5.702 1.00 32.11 H new ATOM 0 HB3 ALA A 36 -8.622 5.660 -4.587 1.00 32.11 H new ATOM 546 N ALA A 37 -7.445 2.363 -4.796 1.00 73.10 N ATOM 547 CA ALA A 37 -6.224 1.682 -4.388 1.00 2.21 C ATOM 548 C ALA A 37 -5.127 1.846 -5.435 1.00 42.10 C ATOM 549 O ALA A 37 -5.388 1.771 -6.636 1.00 42.24 O ATOM 550 CB ALA A 37 -6.500 0.208 -4.136 1.00 63.33 C ATOM 0 H ALA A 37 -7.654 2.293 -5.792 1.00 73.10 H new ATOM 0 HA ALA A 37 -5.876 2.138 -3.461 1.00 2.21 H new ATOM 0 HB1 ALA A 37 -5.578 -0.288 -3.832 1.00 63.33 H new ATOM 0 HB2 ALA A 37 -7.244 0.107 -3.346 1.00 63.33 H new ATOM 0 HB3 ALA A 37 -6.876 -0.253 -5.049 1.00 63.33 H new ATOM 556 N ILE A 38 -3.902 2.070 -4.973 1.00 74.20 N ATOM 557 CA ILE A 38 -2.767 2.245 -5.871 1.00 31.54 C ATOM 558 C ILE A 38 -1.686 1.203 -5.598 1.00 10.22 C ATOM 559 O ILE A 38 -1.006 1.255 -4.573 1.00 42.34 O ATOM 560 CB ILE A 38 -2.155 3.651 -5.738 1.00 24.22 C ATOM 561 CG1 ILE A 38 -3.248 4.718 -5.831 1.00 63.11 C ATOM 562 CG2 ILE A 38 -1.098 3.872 -6.810 1.00 64.13 C ATOM 563 CD1 ILE A 38 -2.714 6.133 -5.814 1.00 23.22 C ATOM 0 H ILE A 38 -3.670 2.135 -3.982 1.00 74.20 H new ATOM 0 HA ILE A 38 -3.144 2.118 -6.886 1.00 31.54 H new ATOM 0 HB ILE A 38 -1.677 3.732 -4.762 1.00 24.22 H new ATOM 0 HG12 ILE A 38 -3.818 4.564 -6.748 1.00 63.11 H new ATOM 0 HG13 ILE A 38 -3.941 4.590 -5.000 1.00 63.11 H new ATOM 0 HG21 ILE A 38 -0.674 4.871 -6.703 1.00 64.13 H new ATOM 0 HG22 ILE A 38 -0.308 3.129 -6.701 1.00 64.13 H new ATOM 0 HG23 ILE A 38 -1.553 3.775 -7.796 1.00 64.13 H new ATOM 0 HD11 ILE A 38 -3.544 6.836 -5.883 1.00 23.22 H new ATOM 0 HD12 ILE A 38 -2.169 6.305 -4.886 1.00 23.22 H new ATOM 0 HD13 ILE A 38 -2.043 6.279 -6.661 1.00 23.22 H new ATOM 575 N ILE A 39 -1.533 0.261 -6.522 1.00 52.22 N ATOM 576 CA ILE A 39 -0.533 -0.790 -6.383 1.00 54.41 C ATOM 577 C ILE A 39 0.785 -0.384 -7.036 1.00 34.55 C ATOM 578 O ILE A 39 0.849 -0.164 -8.244 1.00 34.31 O ATOM 579 CB ILE A 39 -1.016 -2.113 -7.007 1.00 44.24 C ATOM 580 CG1 ILE A 39 -2.457 -2.405 -6.585 1.00 12.55 C ATOM 581 CG2 ILE A 39 -0.097 -3.256 -6.602 1.00 12.11 C ATOM 582 CD1 ILE A 39 -3.345 -2.840 -7.729 1.00 53.25 C ATOM 0 H ILE A 39 -2.089 0.204 -7.375 1.00 52.22 H new ATOM 0 HA ILE A 39 -0.377 -0.938 -5.314 1.00 54.41 H new ATOM 0 HB ILE A 39 -0.988 -2.018 -8.092 1.00 44.24 H new ATOM 0 HG12 ILE A 39 -2.453 -3.184 -5.822 1.00 12.55 H new ATOM 0 HG13 ILE A 39 -2.881 -1.512 -6.126 1.00 12.55 H new ATOM 0 HG21 ILE A 39 -0.451 -4.184 -7.051 1.00 12.11 H new ATOM 0 HG22 ILE A 39 0.916 -3.049 -6.948 1.00 12.11 H new ATOM 0 HG23 ILE A 39 -0.096 -3.355 -5.517 1.00 12.11 H new ATOM 0 HD11 ILE A 39 -4.352 -3.030 -7.356 1.00 53.25 H new ATOM 0 HD12 ILE A 39 -3.379 -2.053 -8.482 1.00 53.25 H new ATOM 0 HD13 ILE A 39 -2.945 -3.751 -8.174 1.00 53.25 H new ATOM 594 N MET A 40 1.834 -0.288 -6.225 1.00 62.32 N ATOM 595 CA MET A 40 3.152 0.087 -6.724 1.00 33.01 C ATOM 596 C MET A 40 4.131 -1.077 -6.605 1.00 42.12 C ATOM 597 O MET A 40 4.010 -1.914 -5.711 1.00 63.10 O ATOM 598 CB MET A 40 3.685 1.298 -5.956 1.00 51.14 C ATOM 599 CG MET A 40 2.629 2.356 -5.680 1.00 2.00 C ATOM 600 SD MET A 40 2.875 3.187 -4.098 1.00 50.14 S ATOM 601 CE MET A 40 1.464 2.584 -3.176 1.00 23.33 C ATOM 0 H MET A 40 1.797 -0.464 -5.221 1.00 62.32 H new ATOM 0 HA MET A 40 3.053 0.348 -7.778 1.00 33.01 H new ATOM 0 HB2 MET A 40 4.106 0.961 -5.009 1.00 51.14 H new ATOM 0 HB3 MET A 40 4.499 1.748 -6.524 1.00 51.14 H new ATOM 0 HG2 MET A 40 2.643 3.096 -6.481 1.00 2.00 H new ATOM 0 HG3 MET A 40 1.643 1.892 -5.693 1.00 2.00 H new ATOM 0 HE1 MET A 40 1.626 2.753 -2.111 1.00 23.33 H new ATOM 0 HE2 MET A 40 0.567 3.114 -3.496 1.00 23.33 H new ATOM 0 HE3 MET A 40 1.339 1.517 -3.359 1.00 23.33 H new ATOM 611 N LYS A 41 5.100 -1.123 -7.513 1.00 21.40 N ATOM 612 CA LYS A 41 6.101 -2.184 -7.509 1.00 54.20 C ATOM 613 C LYS A 41 7.511 -1.602 -7.538 1.00 21.20 C ATOM 614 O LYS A 41 7.689 -0.386 -7.606 1.00 43.22 O ATOM 615 CB LYS A 41 5.896 -3.111 -8.710 1.00 24.21 C ATOM 616 CG LYS A 41 6.219 -2.459 -10.043 1.00 33.42 C ATOM 617 CD LYS A 41 6.259 -3.480 -11.168 1.00 34.11 C ATOM 618 CE LYS A 41 5.361 -3.070 -12.325 1.00 33.22 C ATOM 619 NZ LYS A 41 5.150 -4.188 -13.286 1.00 13.51 N ATOM 0 H LYS A 41 5.214 -0.439 -8.261 1.00 21.40 H new ATOM 0 HA LYS A 41 5.982 -2.758 -6.590 1.00 54.20 H new ATOM 0 HB2 LYS A 41 6.521 -3.995 -8.587 1.00 24.21 H new ATOM 0 HB3 LYS A 41 4.861 -3.452 -8.723 1.00 24.21 H new ATOM 0 HG2 LYS A 41 5.472 -1.698 -10.267 1.00 33.42 H new ATOM 0 HG3 LYS A 41 7.181 -1.951 -9.977 1.00 33.42 H new ATOM 0 HD2 LYS A 41 7.283 -3.592 -11.523 1.00 34.11 H new ATOM 0 HD3 LYS A 41 5.945 -4.453 -10.789 1.00 34.11 H new ATOM 0 HE2 LYS A 41 4.398 -2.738 -11.937 1.00 33.22 H new ATOM 0 HE3 LYS A 41 5.805 -2.222 -12.846 1.00 33.22 H new ATOM 0 HZ1 LYS A 41 4.604 -3.846 -14.102 1.00 13.51 H new ATOM 0 HZ2 LYS A 41 6.071 -4.545 -13.611 1.00 13.51 H new ATOM 0 HZ3 LYS A 41 4.628 -4.955 -12.817 1.00 13.51 H new ATOM 633 N VAL A 42 8.509 -2.478 -7.487 1.00 34.24 N ATOM 634 CA VAL A 42 9.903 -2.051 -7.509 1.00 41.44 C ATOM 635 C VAL A 42 10.696 -2.817 -8.563 1.00 14.23 C ATOM 636 O VAL A 42 10.814 -4.040 -8.498 1.00 31.24 O ATOM 637 CB VAL A 42 10.573 -2.247 -6.136 1.00 31.32 C ATOM 638 CG1 VAL A 42 10.048 -3.506 -5.461 1.00 23.01 C ATOM 639 CG2 VAL A 42 12.085 -2.303 -6.284 1.00 41.53 C ATOM 0 H VAL A 42 8.378 -3.488 -7.430 1.00 34.24 H new ATOM 0 HA VAL A 42 9.904 -0.990 -7.757 1.00 41.44 H new ATOM 0 HB VAL A 42 10.324 -1.394 -5.505 1.00 31.32 H new ATOM 0 HG11 VAL A 42 10.532 -3.628 -4.492 1.00 23.01 H new ATOM 0 HG12 VAL A 42 8.971 -3.421 -5.320 1.00 23.01 H new ATOM 0 HG13 VAL A 42 10.265 -4.372 -6.087 1.00 23.01 H new ATOM 0 HG21 VAL A 42 12.542 -2.442 -5.304 1.00 41.53 H new ATOM 0 HG22 VAL A 42 12.357 -3.136 -6.932 1.00 41.53 H new ATOM 0 HG23 VAL A 42 12.442 -1.371 -6.722 1.00 41.53 H new ATOM 649 N ASP A 43 11.236 -2.088 -9.533 1.00 71.52 N ATOM 650 CA ASP A 43 12.020 -2.699 -10.602 1.00 11.24 C ATOM 651 C ASP A 43 13.445 -2.979 -10.137 1.00 62.13 C ATOM 652 O ASP A 43 14.175 -2.067 -9.749 1.00 51.31 O ATOM 653 CB ASP A 43 12.040 -1.790 -11.831 1.00 4.31 C ATOM 654 CG ASP A 43 10.807 -1.958 -12.697 1.00 0.12 C ATOM 655 OD1 ASP A 43 9.987 -2.851 -12.394 1.00 14.55 O ATOM 656 OD2 ASP A 43 10.661 -1.198 -13.676 1.00 63.45 O ATOM 0 H ASP A 43 11.146 -1.074 -9.602 1.00 71.52 H new ATOM 0 HA ASP A 43 11.551 -3.646 -10.868 1.00 11.24 H new ATOM 0 HB2 ASP A 43 12.116 -0.751 -11.510 1.00 4.31 H new ATOM 0 HB3 ASP A 43 12.929 -2.006 -12.424 1.00 4.31 H new ATOM 661 N LYS A 44 13.837 -4.249 -10.178 1.00 14.33 N ATOM 662 CA LYS A 44 15.174 -4.652 -9.763 1.00 21.05 C ATOM 663 C LYS A 44 16.228 -4.121 -10.730 1.00 22.35 C ATOM 664 O LYS A 44 17.405 -4.017 -10.385 1.00 24.21 O ATOM 665 CB LYS A 44 15.267 -6.176 -9.677 1.00 33.42 C ATOM 666 CG LYS A 44 16.349 -6.669 -8.732 1.00 63.13 C ATOM 667 CD LYS A 44 17.539 -7.231 -9.492 1.00 24.43 C ATOM 668 CE LYS A 44 18.404 -8.111 -8.601 1.00 52.40 C ATOM 669 NZ LYS A 44 18.546 -9.488 -9.150 1.00 14.50 N ATOM 0 H LYS A 44 13.245 -5.017 -10.495 1.00 14.33 H new ATOM 0 HA LYS A 44 15.364 -4.227 -8.777 1.00 21.05 H new ATOM 0 HB2 LYS A 44 14.305 -6.572 -9.352 1.00 33.42 H new ATOM 0 HB3 LYS A 44 15.457 -6.576 -10.673 1.00 33.42 H new ATOM 0 HG2 LYS A 44 16.678 -5.849 -8.094 1.00 63.13 H new ATOM 0 HG3 LYS A 44 15.939 -7.437 -8.077 1.00 63.13 H new ATOM 0 HD2 LYS A 44 17.187 -7.810 -10.345 1.00 24.43 H new ATOM 0 HD3 LYS A 44 18.139 -6.412 -9.889 1.00 24.43 H new ATOM 0 HE2 LYS A 44 19.390 -7.660 -8.493 1.00 52.40 H new ATOM 0 HE3 LYS A 44 17.965 -8.161 -7.604 1.00 52.40 H new ATOM 0 HZ1 LYS A 44 19.142 -10.055 -8.514 1.00 14.50 H new ATOM 0 HZ2 LYS A 44 17.607 -9.929 -9.230 1.00 14.50 H new ATOM 0 HZ3 LYS A 44 18.988 -9.443 -10.090 1.00 14.50 H new ATOM 683 N ASP A 45 15.796 -3.786 -11.941 1.00 61.11 N ATOM 684 CA ASP A 45 16.703 -3.263 -12.957 1.00 75.41 C ATOM 685 C ASP A 45 17.073 -1.814 -12.661 1.00 41.34 C ATOM 686 O ASP A 45 18.221 -1.408 -12.843 1.00 2.32 O ATOM 687 CB ASP A 45 16.062 -3.366 -14.343 1.00 11.03 C ATOM 688 CG ASP A 45 16.863 -2.642 -15.406 1.00 44.21 C ATOM 689 OD1 ASP A 45 16.822 -1.394 -15.434 1.00 52.52 O ATOM 690 OD2 ASP A 45 17.533 -3.323 -16.210 1.00 71.14 O ATOM 0 H ASP A 45 14.825 -3.867 -12.243 1.00 61.11 H new ATOM 0 HA ASP A 45 17.614 -3.862 -12.940 1.00 75.41 H new ATOM 0 HB2 ASP A 45 15.965 -4.416 -14.618 1.00 11.03 H new ATOM 0 HB3 ASP A 45 15.055 -2.951 -14.306 1.00 11.03 H new ATOM 695 N ARG A 46 16.094 -1.039 -12.205 1.00 44.13 N ATOM 696 CA ARG A 46 16.318 0.366 -11.886 1.00 33.51 C ATOM 697 C ARG A 46 16.312 0.588 -10.377 1.00 3.33 C ATOM 698 O ARG A 46 16.311 1.726 -9.908 1.00 71.21 O ATOM 699 CB ARG A 46 15.247 1.237 -12.544 1.00 53.15 C ATOM 700 CG ARG A 46 15.020 0.918 -14.013 1.00 63.53 C ATOM 701 CD ARG A 46 13.752 1.572 -14.537 1.00 0.15 C ATOM 702 NE ARG A 46 14.029 2.825 -15.235 1.00 71.33 N ATOM 703 CZ ARG A 46 13.092 3.568 -15.812 1.00 70.31 C ATOM 704 NH1 ARG A 46 11.823 3.188 -15.772 1.00 53.04 N ATOM 705 NH2 ARG A 46 13.423 4.696 -16.429 1.00 30.53 N ATOM 0 H ARG A 46 15.139 -1.360 -12.048 1.00 44.13 H new ATOM 0 HA ARG A 46 17.296 0.649 -12.274 1.00 33.51 H new ATOM 0 HB2 ARG A 46 14.308 1.113 -12.005 1.00 53.15 H new ATOM 0 HB3 ARG A 46 15.533 2.284 -12.448 1.00 53.15 H new ATOM 0 HG2 ARG A 46 15.875 1.260 -14.597 1.00 63.53 H new ATOM 0 HG3 ARG A 46 14.955 -0.162 -14.146 1.00 63.53 H new ATOM 0 HD2 ARG A 46 13.243 0.885 -15.214 1.00 0.15 H new ATOM 0 HD3 ARG A 46 13.073 1.763 -13.706 1.00 0.15 H new ATOM 0 HE ARG A 46 14.996 3.147 -15.282 1.00 71.33 H new ATOM 0 HH11 ARG A 46 11.564 2.323 -15.297 1.00 53.04 H new ATOM 0 HH12 ARG A 46 11.105 3.760 -16.216 1.00 53.04 H new ATOM 0 HH21 ARG A 46 14.398 4.993 -16.460 1.00 30.53 H new ATOM 0 HH22 ARG A 46 12.702 5.266 -16.872 1.00 30.53 H new ATOM 719 N GLN A 47 16.309 -0.506 -9.623 1.00 74.20 N ATOM 720 CA GLN A 47 16.302 -0.430 -8.166 1.00 72.55 C ATOM 721 C GLN A 47 15.496 0.773 -7.689 1.00 13.13 C ATOM 722 O GLN A 47 15.986 1.591 -6.909 1.00 71.25 O ATOM 723 CB GLN A 47 17.732 -0.346 -7.632 1.00 44.43 C ATOM 724 CG GLN A 47 18.703 -1.278 -8.340 1.00 55.30 C ATOM 725 CD GLN A 47 19.002 -2.528 -7.538 1.00 34.25 C ATOM 726 OE1 GLN A 47 20.119 -2.717 -7.055 1.00 31.30 O ATOM 727 NE2 GLN A 47 18.002 -3.389 -7.389 1.00 62.31 N ATOM 0 H GLN A 47 16.311 -1.455 -9.996 1.00 74.20 H new ATOM 0 HA GLN A 47 15.832 -1.335 -7.781 1.00 72.55 H new ATOM 0 HB2 GLN A 47 18.088 0.679 -7.731 1.00 44.43 H new ATOM 0 HB3 GLN A 47 17.728 -0.580 -6.567 1.00 44.43 H new ATOM 0 HG2 GLN A 47 18.288 -1.562 -9.307 1.00 55.30 H new ATOM 0 HG3 GLN A 47 19.634 -0.746 -8.536 1.00 55.30 H new ATOM 0 HE21 GLN A 47 17.093 -3.192 -7.807 1.00 62.31 H new ATOM 0 HE22 GLN A 47 18.143 -4.248 -6.857 1.00 62.31 H new ATOM 736 N MET A 48 14.258 0.874 -8.160 1.00 13.24 N ATOM 737 CA MET A 48 13.383 1.978 -7.779 1.00 21.20 C ATOM 738 C MET A 48 11.928 1.523 -7.722 1.00 52.21 C ATOM 739 O MET A 48 11.541 0.563 -8.387 1.00 22.54 O ATOM 740 CB MET A 48 13.530 3.137 -8.766 1.00 74.13 C ATOM 741 CG MET A 48 12.450 3.164 -9.837 1.00 51.20 C ATOM 742 SD MET A 48 13.042 3.829 -11.404 1.00 45.45 S ATOM 743 CE MET A 48 13.697 5.411 -10.874 1.00 63.51 C ATOM 0 H MET A 48 13.837 0.206 -8.806 1.00 13.24 H new ATOM 0 HA MET A 48 13.678 2.317 -6.786 1.00 21.20 H new ATOM 0 HB2 MET A 48 13.508 4.077 -8.215 1.00 74.13 H new ATOM 0 HB3 MET A 48 14.506 3.072 -9.247 1.00 74.13 H new ATOM 0 HG2 MET A 48 12.075 2.153 -9.995 1.00 51.20 H new ATOM 0 HG3 MET A 48 11.611 3.764 -9.486 1.00 51.20 H new ATOM 0 HE1 MET A 48 13.479 6.166 -11.629 1.00 63.51 H new ATOM 0 HE2 MET A 48 13.235 5.698 -9.930 1.00 63.51 H new ATOM 0 HE3 MET A 48 14.776 5.332 -10.741 1.00 63.51 H new ATOM 753 N VAL A 49 11.126 2.221 -6.924 1.00 14.33 N ATOM 754 CA VAL A 49 9.713 1.889 -6.781 1.00 4.41 C ATOM 755 C VAL A 49 8.871 2.613 -7.826 1.00 12.43 C ATOM 756 O VAL A 49 8.733 3.836 -7.790 1.00 52.43 O ATOM 757 CB VAL A 49 9.191 2.251 -5.378 1.00 32.14 C ATOM 758 CG1 VAL A 49 7.848 1.584 -5.120 1.00 62.23 C ATOM 759 CG2 VAL A 49 10.205 1.855 -4.315 1.00 71.52 C ATOM 0 H VAL A 49 11.430 3.019 -6.367 1.00 14.33 H new ATOM 0 HA VAL A 49 9.624 0.813 -6.928 1.00 4.41 H new ATOM 0 HB VAL A 49 9.049 3.331 -5.329 1.00 32.14 H new ATOM 0 HG11 VAL A 49 7.495 1.851 -4.124 1.00 62.23 H new ATOM 0 HG12 VAL A 49 7.126 1.921 -5.864 1.00 62.23 H new ATOM 0 HG13 VAL A 49 7.960 0.502 -5.187 1.00 62.23 H new ATOM 0 HG21 VAL A 49 9.820 2.118 -3.330 1.00 71.52 H new ATOM 0 HG22 VAL A 49 10.380 0.780 -4.361 1.00 71.52 H new ATOM 0 HG23 VAL A 49 11.142 2.383 -4.491 1.00 71.52 H new ATOM 769 N VAL A 50 8.308 1.848 -8.757 1.00 51.42 N ATOM 770 CA VAL A 50 7.477 2.416 -9.812 1.00 34.14 C ATOM 771 C VAL A 50 6.052 1.877 -9.739 1.00 53.32 C ATOM 772 O VAL A 50 5.834 0.711 -9.409 1.00 13.00 O ATOM 773 CB VAL A 50 8.056 2.115 -11.207 1.00 4.41 C ATOM 774 CG1 VAL A 50 9.407 2.794 -11.382 1.00 13.05 C ATOM 775 CG2 VAL A 50 8.174 0.613 -11.422 1.00 10.33 C ATOM 0 H VAL A 50 8.412 0.834 -8.802 1.00 51.42 H new ATOM 0 HA VAL A 50 7.464 3.495 -9.657 1.00 34.14 H new ATOM 0 HB VAL A 50 7.375 2.514 -11.958 1.00 4.41 H new ATOM 0 HG11 VAL A 50 9.801 2.570 -12.373 1.00 13.05 H new ATOM 0 HG12 VAL A 50 9.289 3.872 -11.273 1.00 13.05 H new ATOM 0 HG13 VAL A 50 10.100 2.427 -10.625 1.00 13.05 H new ATOM 0 HG21 VAL A 50 8.585 0.418 -12.413 1.00 10.33 H new ATOM 0 HG22 VAL A 50 8.834 0.188 -10.666 1.00 10.33 H new ATOM 0 HG23 VAL A 50 7.188 0.155 -11.342 1.00 10.33 H new ATOM 785 N LEU A 51 5.085 2.734 -10.049 1.00 30.20 N ATOM 786 CA LEU A 51 3.680 2.345 -10.019 1.00 73.33 C ATOM 787 C LEU A 51 3.447 1.081 -10.841 1.00 44.24 C ATOM 788 O LEU A 51 4.019 0.916 -11.919 1.00 0.31 O ATOM 789 CB LEU A 51 2.803 3.480 -10.551 1.00 44.12 C ATOM 790 CG LEU A 51 1.331 3.441 -10.143 1.00 34.44 C ATOM 791 CD1 LEU A 51 0.810 4.845 -9.881 1.00 43.31 C ATOM 792 CD2 LEU A 51 0.498 2.752 -11.215 1.00 24.15 C ATOM 0 H LEU A 51 5.249 3.703 -10.324 1.00 30.20 H new ATOM 0 HA LEU A 51 3.409 2.139 -8.984 1.00 73.33 H new ATOM 0 HB2 LEU A 51 3.227 4.427 -10.216 1.00 44.12 H new ATOM 0 HB3 LEU A 51 2.857 3.474 -11.640 1.00 44.12 H new ATOM 0 HG LEU A 51 1.246 2.867 -9.220 1.00 34.44 H new ATOM 0 HD11 LEU A 51 -0.240 4.795 -9.592 1.00 43.31 H new ATOM 0 HD12 LEU A 51 1.387 5.303 -9.077 1.00 43.31 H new ATOM 0 HD13 LEU A 51 0.909 5.445 -10.786 1.00 43.31 H new ATOM 0 HD21 LEU A 51 -0.548 2.733 -10.907 1.00 24.15 H new ATOM 0 HD22 LEU A 51 0.590 3.298 -12.154 1.00 24.15 H new ATOM 0 HD23 LEU A 51 0.854 1.731 -11.352 1.00 24.15 H new ATOM 804 N GLU A 52 2.603 0.192 -10.326 1.00 50.32 N ATOM 805 CA GLU A 52 2.295 -1.056 -11.014 1.00 62.21 C ATOM 806 C GLU A 52 0.880 -1.028 -11.583 1.00 34.00 C ATOM 807 O GLU A 52 0.635 -1.502 -12.693 1.00 5.01 O ATOM 808 CB GLU A 52 2.449 -2.241 -10.060 1.00 22.43 C ATOM 809 CG GLU A 52 2.192 -3.588 -10.715 1.00 23.42 C ATOM 810 CD GLU A 52 2.933 -4.721 -10.031 1.00 45.41 C ATOM 811 OE1 GLU A 52 2.705 -4.936 -8.823 1.00 3.21 O ATOM 812 OE2 GLU A 52 3.742 -5.392 -10.706 1.00 73.32 O ATOM 0 H GLU A 52 2.121 0.313 -9.435 1.00 50.32 H new ATOM 0 HA GLU A 52 2.998 -1.169 -11.839 1.00 62.21 H new ATOM 0 HB2 GLU A 52 3.457 -2.234 -9.646 1.00 22.43 H new ATOM 0 HB3 GLU A 52 1.760 -2.116 -9.224 1.00 22.43 H new ATOM 0 HG2 GLU A 52 1.122 -3.797 -10.700 1.00 23.42 H new ATOM 0 HG3 GLU A 52 2.493 -3.542 -11.762 1.00 23.42 H new ATOM 819 N ASP A 53 -0.050 -0.470 -10.814 1.00 70.34 N ATOM 820 CA ASP A 53 -1.441 -0.379 -11.241 1.00 60.43 C ATOM 821 C ASP A 53 -2.196 0.659 -10.416 1.00 62.41 C ATOM 822 O ASP A 53 -1.696 1.139 -9.400 1.00 14.04 O ATOM 823 CB ASP A 53 -2.125 -1.742 -11.118 1.00 44.42 C ATOM 824 CG ASP A 53 -2.025 -2.557 -12.393 1.00 23.11 C ATOM 825 OD1 ASP A 53 -2.532 -2.092 -13.435 1.00 60.22 O ATOM 826 OD2 ASP A 53 -1.439 -3.659 -12.348 1.00 12.23 O ATOM 0 H ASP A 53 0.135 -0.074 -9.892 1.00 70.34 H new ATOM 0 HA ASP A 53 -1.455 -0.067 -12.285 1.00 60.43 H new ATOM 0 HB2 ASP A 53 -1.673 -2.299 -10.298 1.00 44.42 H new ATOM 0 HB3 ASP A 53 -3.175 -1.597 -10.864 1.00 44.42 H new ATOM 831 N GLU A 54 -3.401 0.999 -10.863 1.00 5.24 N ATOM 832 CA GLU A 54 -4.223 1.982 -10.166 1.00 34.43 C ATOM 833 C GLU A 54 -5.707 1.711 -10.395 1.00 45.13 C ATOM 834 O GLU A 54 -6.218 1.885 -11.503 1.00 42.24 O ATOM 835 CB GLU A 54 -3.873 3.396 -10.633 1.00 74.01 C ATOM 836 CG GLU A 54 -2.937 4.135 -9.692 1.00 34.44 C ATOM 837 CD GLU A 54 -2.725 5.580 -10.096 1.00 44.33 C ATOM 838 OE1 GLU A 54 -2.559 5.839 -11.307 1.00 63.31 O ATOM 839 OE2 GLU A 54 -2.723 6.453 -9.203 1.00 63.12 O ATOM 0 H GLU A 54 -3.829 0.609 -11.703 1.00 5.24 H new ATOM 0 HA GLU A 54 -4.017 1.899 -9.099 1.00 34.43 H new ATOM 0 HB2 GLU A 54 -3.413 3.340 -11.619 1.00 74.01 H new ATOM 0 HB3 GLU A 54 -4.792 3.971 -10.743 1.00 74.01 H new ATOM 0 HG2 GLU A 54 -3.343 4.100 -8.681 1.00 34.44 H new ATOM 0 HG3 GLU A 54 -1.975 3.624 -9.667 1.00 34.44 H new ATOM 846 N LEU A 55 -6.394 1.283 -9.343 1.00 1.13 N ATOM 847 CA LEU A 55 -7.820 0.986 -9.428 1.00 54.21 C ATOM 848 C LEU A 55 -8.635 1.997 -8.627 1.00 32.42 C ATOM 849 O LEU A 55 -8.231 2.413 -7.542 1.00 44.52 O ATOM 850 CB LEU A 55 -8.098 -0.429 -8.919 1.00 44.13 C ATOM 851 CG LEU A 55 -7.132 -1.515 -9.395 1.00 34.11 C ATOM 852 CD1 LEU A 55 -6.929 -2.561 -8.310 1.00 4.53 C ATOM 853 CD2 LEU A 55 -7.647 -2.164 -10.672 1.00 14.13 C ATOM 0 H LEU A 55 -5.987 1.133 -8.420 1.00 1.13 H new ATOM 0 HA LEU A 55 -8.118 1.054 -10.474 1.00 54.21 H new ATOM 0 HB2 LEU A 55 -8.084 -0.411 -7.829 1.00 44.13 H new ATOM 0 HB3 LEU A 55 -9.107 -0.710 -9.221 1.00 44.13 H new ATOM 0 HG LEU A 55 -6.170 -1.050 -9.609 1.00 34.11 H new ATOM 0 HD11 LEU A 55 -6.239 -3.326 -8.666 1.00 4.53 H new ATOM 0 HD12 LEU A 55 -6.516 -2.086 -7.420 1.00 4.53 H new ATOM 0 HD13 LEU A 55 -7.886 -3.022 -8.065 1.00 4.53 H new ATOM 0 HD21 LEU A 55 -6.947 -2.934 -10.996 1.00 14.13 H new ATOM 0 HD22 LEU A 55 -8.621 -2.615 -10.484 1.00 14.13 H new ATOM 0 HD23 LEU A 55 -7.742 -1.408 -11.452 1.00 14.13 H new ATOM 865 N GLN A 56 -9.786 2.383 -9.168 1.00 20.03 N ATOM 866 CA GLN A 56 -10.658 3.343 -8.502 1.00 42.24 C ATOM 867 C GLN A 56 -12.033 2.739 -8.242 1.00 15.21 C ATOM 868 O GLN A 56 -12.403 1.730 -8.841 1.00 31.31 O ATOM 869 CB GLN A 56 -10.796 4.611 -9.348 1.00 35.32 C ATOM 870 CG GLN A 56 -9.489 5.361 -9.537 1.00 3.14 C ATOM 871 CD GLN A 56 -8.603 4.735 -10.596 1.00 71.11 C ATOM 872 OE1 GLN A 56 -8.908 4.789 -11.788 1.00 50.33 O ATOM 873 NE2 GLN A 56 -7.500 4.135 -10.166 1.00 25.11 N ATOM 0 H GLN A 56 -10.136 2.046 -10.065 1.00 20.03 H new ATOM 0 HA GLN A 56 -10.208 3.602 -7.544 1.00 42.24 H new ATOM 0 HB2 GLN A 56 -11.196 4.343 -10.326 1.00 35.32 H new ATOM 0 HB3 GLN A 56 -11.521 5.275 -8.877 1.00 35.32 H new ATOM 0 HG2 GLN A 56 -9.704 6.393 -9.813 1.00 3.14 H new ATOM 0 HG3 GLN A 56 -8.951 5.390 -8.589 1.00 3.14 H new ATOM 0 HE21 GLN A 56 -7.286 4.114 -9.169 1.00 25.11 H new ATOM 0 HE22 GLN A 56 -6.866 3.695 -10.833 1.00 25.11 H new ATOM 882 N ASN A 57 -12.789 3.363 -7.343 1.00 4.43 N ATOM 883 CA ASN A 57 -14.124 2.885 -7.002 1.00 11.51 C ATOM 884 C ASN A 57 -14.130 1.371 -6.820 1.00 0.33 C ATOM 885 O ASN A 57 -14.935 0.666 -7.429 1.00 50.52 O ATOM 886 CB ASN A 57 -15.123 3.285 -8.090 1.00 35.43 C ATOM 887 CG ASN A 57 -14.441 3.796 -9.344 1.00 4.14 C ATOM 888 OD1 ASN A 57 -14.475 3.149 -10.390 1.00 40.03 O ATOM 889 ND2 ASN A 57 -13.814 4.963 -9.242 1.00 74.41 N ATOM 0 H ASN A 57 -12.499 4.201 -6.838 1.00 4.43 H new ATOM 0 HA ASN A 57 -14.419 3.346 -6.059 1.00 11.51 H new ATOM 0 HB2 ASN A 57 -15.744 2.426 -8.342 1.00 35.43 H new ATOM 0 HB3 ASN A 57 -15.789 4.056 -7.702 1.00 35.43 H new ATOM 0 HD21 ASN A 57 -13.335 5.357 -10.052 1.00 74.41 H new ATOM 0 HD22 ASN A 57 -13.812 5.465 -8.354 1.00 74.41 H new ATOM 896 N ILE A 58 -13.228 0.878 -5.978 1.00 52.52 N ATOM 897 CA ILE A 58 -13.131 -0.552 -5.715 1.00 31.42 C ATOM 898 C ILE A 58 -13.190 -0.841 -4.218 1.00 54.31 C ATOM 899 O ILE A 58 -12.606 -0.117 -3.412 1.00 42.12 O ATOM 900 CB ILE A 58 -11.830 -1.143 -6.288 1.00 70.03 C ATOM 901 CG1 ILE A 58 -11.188 -2.096 -5.278 1.00 40.24 C ATOM 902 CG2 ILE A 58 -10.864 -0.030 -6.665 1.00 23.02 C ATOM 903 CD1 ILE A 58 -10.470 -1.387 -4.151 1.00 31.43 C ATOM 0 H ILE A 58 -12.554 1.448 -5.466 1.00 52.52 H new ATOM 0 HA ILE A 58 -13.982 -1.021 -6.208 1.00 31.42 H new ATOM 0 HB ILE A 58 -12.071 -1.708 -7.188 1.00 70.03 H new ATOM 0 HG12 ILE A 58 -11.960 -2.741 -4.858 1.00 40.24 H new ATOM 0 HG13 ILE A 58 -10.481 -2.742 -5.799 1.00 40.24 H new ATOM 0 HG21 ILE A 58 -9.949 -0.464 -7.069 1.00 23.02 H new ATOM 0 HG22 ILE A 58 -11.324 0.612 -7.417 1.00 23.02 H new ATOM 0 HG23 ILE A 58 -10.626 0.561 -5.780 1.00 23.02 H new ATOM 0 HD11 ILE A 58 -10.039 -2.124 -3.473 1.00 31.43 H new ATOM 0 HD12 ILE A 58 -9.676 -0.763 -4.561 1.00 31.43 H new ATOM 0 HD13 ILE A 58 -11.177 -0.762 -3.605 1.00 31.43 H new ATOM 915 N SER A 59 -13.900 -1.904 -3.854 1.00 22.31 N ATOM 916 CA SER A 59 -14.038 -2.288 -2.454 1.00 21.41 C ATOM 917 C SER A 59 -12.810 -3.060 -1.980 1.00 12.25 C ATOM 918 O SER A 59 -11.971 -3.490 -2.770 1.00 72.43 O ATOM 919 CB SER A 59 -15.295 -3.137 -2.258 1.00 72.01 C ATOM 920 OG SER A 59 -16.254 -2.455 -1.469 1.00 4.31 O ATOM 0 H SER A 59 -14.389 -2.515 -4.509 1.00 22.31 H new ATOM 0 HA SER A 59 -14.126 -1.379 -1.860 1.00 21.41 H new ATOM 0 HB2 SER A 59 -15.726 -3.383 -3.228 1.00 72.01 H new ATOM 0 HB3 SER A 59 -15.030 -4.080 -1.779 1.00 72.01 H new ATOM 0 HG SER A 59 -17.048 -3.018 -1.360 1.00 4.31 H new ATOM 926 N PRO A 60 -12.701 -3.239 -0.654 1.00 51.12 N ATOM 927 CA PRO A 60 -11.580 -3.959 -0.042 1.00 43.22 C ATOM 928 C PRO A 60 -11.620 -5.453 -0.340 1.00 64.23 C ATOM 929 O PRO A 60 -10.791 -6.216 0.155 1.00 1.11 O ATOM 930 CB PRO A 60 -11.772 -3.706 1.455 1.00 63.41 C ATOM 931 CG PRO A 60 -13.230 -3.444 1.612 1.00 41.25 C ATOM 932 CD PRO A 60 -13.664 -2.753 0.348 1.00 25.14 C ATOM 0 HA PRO A 60 -10.618 -3.619 -0.425 1.00 43.22 H new ATOM 0 HB2 PRO A 60 -11.459 -4.567 2.045 1.00 63.41 H new ATOM 0 HB3 PRO A 60 -11.179 -2.856 1.792 1.00 63.41 H new ATOM 0 HG2 PRO A 60 -13.780 -4.374 1.758 1.00 41.25 H new ATOM 0 HG3 PRO A 60 -13.423 -2.820 2.484 1.00 41.25 H new ATOM 0 HD2 PRO A 60 -14.688 -3.012 0.080 1.00 25.14 H new ATOM 0 HD3 PRO A 60 -13.626 -1.668 0.449 1.00 25.14 H new ATOM 940 N GLU A 61 -12.588 -5.865 -1.152 1.00 73.32 N ATOM 941 CA GLU A 61 -12.735 -7.270 -1.515 1.00 22.12 C ATOM 942 C GLU A 61 -12.201 -7.528 -2.922 1.00 1.52 C ATOM 943 O GLU A 61 -11.747 -8.628 -3.232 1.00 21.41 O ATOM 944 CB GLU A 61 -14.203 -7.691 -1.430 1.00 50.33 C ATOM 945 CG GLU A 61 -14.542 -8.467 -0.169 1.00 34.12 C ATOM 946 CD GLU A 61 -16.016 -8.396 0.181 1.00 22.43 C ATOM 947 OE1 GLU A 61 -16.828 -9.001 -0.549 1.00 71.11 O ATOM 948 OE2 GLU A 61 -16.357 -7.736 1.185 1.00 54.35 O ATOM 0 H GLU A 61 -13.282 -5.246 -1.571 1.00 73.32 H new ATOM 0 HA GLU A 61 -12.153 -7.863 -0.810 1.00 22.12 H new ATOM 0 HB2 GLU A 61 -14.831 -6.801 -1.479 1.00 50.33 H new ATOM 0 HB3 GLU A 61 -14.448 -8.302 -2.299 1.00 50.33 H new ATOM 0 HG2 GLU A 61 -14.253 -9.510 -0.300 1.00 34.12 H new ATOM 0 HG3 GLU A 61 -13.956 -8.076 0.662 1.00 34.12 H new ATOM 955 N GLU A 62 -12.259 -6.503 -3.767 1.00 31.14 N ATOM 956 CA GLU A 62 -11.782 -6.619 -5.141 1.00 33.32 C ATOM 957 C GLU A 62 -10.267 -6.447 -5.207 1.00 74.25 C ATOM 958 O GLU A 62 -9.580 -7.171 -5.928 1.00 74.33 O ATOM 959 CB GLU A 62 -12.465 -5.578 -6.030 1.00 33.33 C ATOM 960 CG GLU A 62 -13.659 -6.121 -6.797 1.00 35.35 C ATOM 961 CD GLU A 62 -13.254 -7.043 -7.931 1.00 22.31 C ATOM 962 OE1 GLU A 62 -12.146 -7.616 -7.864 1.00 3.24 O ATOM 963 OE2 GLU A 62 -14.046 -7.193 -8.884 1.00 45.11 O ATOM 0 H GLU A 62 -12.631 -5.585 -3.525 1.00 31.14 H new ATOM 0 HA GLU A 62 -12.033 -7.616 -5.504 1.00 33.32 H new ATOM 0 HB2 GLU A 62 -12.791 -4.742 -5.411 1.00 33.33 H new ATOM 0 HB3 GLU A 62 -11.737 -5.184 -6.739 1.00 33.33 H new ATOM 0 HG2 GLU A 62 -14.312 -6.660 -6.111 1.00 35.35 H new ATOM 0 HG3 GLU A 62 -14.237 -5.289 -7.199 1.00 35.35 H new ATOM 970 N LEU A 63 -9.754 -5.484 -4.451 1.00 1.23 N ATOM 971 CA LEU A 63 -8.321 -5.215 -4.423 1.00 62.22 C ATOM 972 C LEU A 63 -7.535 -6.483 -4.105 1.00 5.21 C ATOM 973 O LEU A 63 -6.676 -6.905 -4.880 1.00 41.42 O ATOM 974 CB LEU A 63 -8.004 -4.133 -3.390 1.00 14.44 C ATOM 975 CG LEU A 63 -7.013 -3.055 -3.828 1.00 4.24 C ATOM 976 CD1 LEU A 63 -6.348 -2.416 -2.617 1.00 72.45 C ATOM 977 CD2 LEU A 63 -5.966 -3.642 -4.764 1.00 32.51 C ATOM 0 H LEU A 63 -10.309 -4.876 -3.849 1.00 1.23 H new ATOM 0 HA LEU A 63 -8.024 -4.863 -5.411 1.00 62.22 H new ATOM 0 HB2 LEU A 63 -8.937 -3.646 -3.106 1.00 14.44 H new ATOM 0 HB3 LEU A 63 -7.611 -4.617 -2.496 1.00 14.44 H new ATOM 0 HG LEU A 63 -7.562 -2.282 -4.366 1.00 4.24 H new ATOM 0 HD11 LEU A 63 -5.646 -1.651 -2.949 1.00 72.45 H new ATOM 0 HD12 LEU A 63 -7.108 -1.960 -1.983 1.00 72.45 H new ATOM 0 HD13 LEU A 63 -5.813 -3.179 -2.051 1.00 72.45 H new ATOM 0 HD21 LEU A 63 -5.269 -2.860 -5.066 1.00 32.51 H new ATOM 0 HD22 LEU A 63 -5.422 -4.435 -4.250 1.00 32.51 H new ATOM 0 HD23 LEU A 63 -6.456 -4.052 -5.647 1.00 32.51 H new ATOM 989 N LYS A 64 -7.836 -7.088 -2.961 1.00 44.53 N ATOM 990 CA LYS A 64 -7.161 -8.310 -2.541 1.00 51.11 C ATOM 991 C LYS A 64 -7.069 -9.305 -3.693 1.00 42.54 C ATOM 992 O LYS A 64 -6.173 -10.150 -3.729 1.00 13.13 O ATOM 993 CB LYS A 64 -7.901 -8.946 -1.362 1.00 63.01 C ATOM 994 CG LYS A 64 -8.143 -10.436 -1.528 1.00 51.15 C ATOM 995 CD LYS A 64 -8.421 -11.109 -0.194 1.00 54.50 C ATOM 996 CE LYS A 64 -9.831 -11.678 -0.140 1.00 64.35 C ATOM 997 NZ LYS A 64 -9.829 -13.166 -0.210 1.00 71.43 N ATOM 0 H LYS A 64 -8.544 -6.752 -2.308 1.00 44.53 H new ATOM 0 HA LYS A 64 -6.150 -8.048 -2.229 1.00 51.11 H new ATOM 0 HB2 LYS A 64 -7.327 -8.779 -0.451 1.00 63.01 H new ATOM 0 HB3 LYS A 64 -8.859 -8.443 -1.231 1.00 63.01 H new ATOM 0 HG2 LYS A 64 -8.986 -10.596 -2.200 1.00 51.15 H new ATOM 0 HG3 LYS A 64 -7.272 -10.897 -1.994 1.00 51.15 H new ATOM 0 HD2 LYS A 64 -7.698 -11.909 -0.031 1.00 54.50 H new ATOM 0 HD3 LYS A 64 -8.287 -10.389 0.613 1.00 54.50 H new ATOM 0 HE2 LYS A 64 -10.317 -11.358 0.782 1.00 64.35 H new ATOM 0 HE3 LYS A 64 -10.417 -11.276 -0.966 1.00 64.35 H new ATOM 0 HZ1 LYS A 64 -10.807 -13.517 -0.170 1.00 71.43 H new ATOM 0 HZ2 LYS A 64 -9.388 -13.471 -1.101 1.00 71.43 H new ATOM 0 HZ3 LYS A 64 -9.291 -13.551 0.592 1.00 71.43 H new ATOM 1011 N LEU A 65 -8.000 -9.199 -4.636 1.00 43.31 N ATOM 1012 CA LEU A 65 -8.023 -10.089 -5.792 1.00 30.01 C ATOM 1013 C LEU A 65 -7.105 -9.572 -6.894 1.00 62.34 C ATOM 1014 O LEU A 65 -6.493 -10.354 -7.622 1.00 1.40 O ATOM 1015 CB LEU A 65 -9.450 -10.229 -6.324 1.00 11.40 C ATOM 1016 CG LEU A 65 -10.514 -10.620 -5.298 1.00 5.15 C ATOM 1017 CD1 LEU A 65 -11.903 -10.544 -5.912 1.00 45.10 C ATOM 1018 CD2 LEU A 65 -10.243 -12.017 -4.757 1.00 13.04 C ATOM 0 H LEU A 65 -8.748 -8.506 -4.623 1.00 43.31 H new ATOM 0 HA LEU A 65 -7.663 -11.068 -5.474 1.00 30.01 H new ATOM 0 HB2 LEU A 65 -9.742 -9.282 -6.777 1.00 11.40 H new ATOM 0 HB3 LEU A 65 -9.449 -10.975 -7.118 1.00 11.40 H new ATOM 0 HG LEU A 65 -10.468 -9.914 -4.468 1.00 5.15 H new ATOM 0 HD11 LEU A 65 -12.646 -10.826 -5.166 1.00 45.10 H new ATOM 0 HD12 LEU A 65 -12.096 -9.526 -6.250 1.00 45.10 H new ATOM 0 HD13 LEU A 65 -11.964 -11.226 -6.760 1.00 45.10 H new ATOM 0 HD21 LEU A 65 -11.009 -12.280 -4.028 1.00 13.04 H new ATOM 0 HD22 LEU A 65 -10.261 -12.735 -5.577 1.00 13.04 H new ATOM 0 HD23 LEU A 65 -9.264 -12.038 -4.278 1.00 13.04 H new ATOM 1030 N GLU A 66 -7.013 -8.251 -7.012 1.00 32.03 N ATOM 1031 CA GLU A 66 -6.168 -7.631 -8.026 1.00 15.14 C ATOM 1032 C GLU A 66 -4.692 -7.872 -7.725 1.00 5.33 C ATOM 1033 O GLU A 66 -3.846 -7.803 -8.617 1.00 41.32 O ATOM 1034 CB GLU A 66 -6.446 -6.128 -8.104 1.00 10.14 C ATOM 1035 CG GLU A 66 -7.886 -5.793 -8.449 1.00 15.33 C ATOM 1036 CD GLU A 66 -8.284 -6.276 -9.830 1.00 30.23 C ATOM 1037 OE1 GLU A 66 -7.892 -5.625 -10.822 1.00 13.25 O ATOM 1038 OE2 GLU A 66 -8.985 -7.305 -9.920 1.00 24.42 O ATOM 0 H GLU A 66 -7.513 -7.590 -6.418 1.00 32.03 H new ATOM 0 HA GLU A 66 -6.404 -8.087 -8.988 1.00 15.14 H new ATOM 0 HB2 GLU A 66 -6.195 -5.670 -7.147 1.00 10.14 H new ATOM 0 HB3 GLU A 66 -5.789 -5.684 -8.852 1.00 10.14 H new ATOM 0 HG2 GLU A 66 -8.547 -6.241 -7.707 1.00 15.33 H new ATOM 0 HG3 GLU A 66 -8.028 -4.714 -8.391 1.00 15.33 H new ATOM 1045 N LEU A 67 -4.390 -8.155 -6.463 1.00 54.03 N ATOM 1046 CA LEU A 67 -3.016 -8.407 -6.043 1.00 43.10 C ATOM 1047 C LEU A 67 -2.646 -9.874 -6.239 1.00 12.42 C ATOM 1048 O LEU A 67 -3.497 -10.763 -6.206 1.00 61.52 O ATOM 1049 CB LEU A 67 -2.830 -8.013 -4.577 1.00 5.44 C ATOM 1050 CG LEU A 67 -3.267 -6.597 -4.201 1.00 12.12 C ATOM 1051 CD1 LEU A 67 -3.298 -6.430 -2.689 1.00 63.33 C ATOM 1052 CD2 LEU A 67 -2.343 -5.567 -4.834 1.00 24.20 C ATOM 0 H LEU A 67 -5.078 -8.216 -5.712 1.00 54.03 H new ATOM 0 HA LEU A 67 -2.356 -7.800 -6.662 1.00 43.10 H new ATOM 0 HB2 LEU A 67 -3.385 -8.719 -3.959 1.00 5.44 H new ATOM 0 HB3 LEU A 67 -1.776 -8.126 -4.322 1.00 5.44 H new ATOM 0 HG LEU A 67 -4.275 -6.436 -4.584 1.00 12.12 H new ATOM 0 HD11 LEU A 67 -3.611 -5.416 -2.441 1.00 63.33 H new ATOM 0 HD12 LEU A 67 -4.002 -7.142 -2.259 1.00 63.33 H new ATOM 0 HD13 LEU A 67 -2.303 -6.612 -2.282 1.00 63.33 H new ATOM 0 HD21 LEU A 67 -2.670 -4.565 -4.555 1.00 24.20 H new ATOM 0 HD22 LEU A 67 -1.324 -5.727 -4.482 1.00 24.20 H new ATOM 0 HD23 LEU A 67 -2.373 -5.670 -5.919 1.00 24.20 H new ATOM 1064 N PRO A 68 -1.347 -10.134 -6.445 1.00 4.22 N ATOM 1065 CA PRO A 68 -0.834 -11.492 -6.647 1.00 21.13 C ATOM 1066 C PRO A 68 -0.901 -12.332 -5.376 1.00 30.24 C ATOM 1067 O PRO A 68 -1.608 -11.986 -4.429 1.00 24.03 O ATOM 1068 CB PRO A 68 0.622 -11.265 -7.060 1.00 3.21 C ATOM 1069 CG PRO A 68 0.982 -9.944 -6.469 1.00 34.31 C ATOM 1070 CD PRO A 68 -0.278 -9.123 -6.496 1.00 42.11 C ATOM 0 HA PRO A 68 -1.419 -12.042 -7.384 1.00 21.13 H new ATOM 0 HB2 PRO A 68 1.269 -12.057 -6.683 1.00 3.21 H new ATOM 0 HB3 PRO A 68 0.729 -11.256 -8.145 1.00 3.21 H new ATOM 0 HG2 PRO A 68 1.351 -10.060 -5.450 1.00 34.31 H new ATOM 0 HG3 PRO A 68 1.774 -9.463 -7.042 1.00 34.31 H new ATOM 0 HD2 PRO A 68 -0.330 -8.440 -5.648 1.00 42.11 H new ATOM 0 HD3 PRO A 68 -0.342 -8.516 -7.399 1.00 42.11 H new ATOM 1078 N GLU A 69 -0.163 -13.437 -5.361 1.00 64.23 N ATOM 1079 CA GLU A 69 -0.140 -14.326 -4.205 1.00 62.35 C ATOM 1080 C GLU A 69 1.293 -14.694 -3.829 1.00 53.11 C ATOM 1081 O GLU A 69 1.598 -14.926 -2.660 1.00 61.24 O ATOM 1082 CB GLU A 69 -0.944 -15.595 -4.495 1.00 34.22 C ATOM 1083 CG GLU A 69 -0.352 -16.453 -5.600 1.00 53.22 C ATOM 1084 CD GLU A 69 -1.329 -16.697 -6.735 1.00 60.41 C ATOM 1085 OE1 GLU A 69 -2.456 -17.158 -6.458 1.00 15.53 O ATOM 1086 OE2 GLU A 69 -0.966 -16.429 -7.900 1.00 3.54 O ATOM 0 H GLU A 69 0.427 -13.738 -6.136 1.00 64.23 H new ATOM 0 HA GLU A 69 -0.594 -13.800 -3.365 1.00 62.35 H new ATOM 0 HB2 GLU A 69 -1.012 -16.188 -3.583 1.00 34.22 H new ATOM 0 HB3 GLU A 69 -1.961 -15.315 -4.769 1.00 34.22 H new ATOM 0 HG2 GLU A 69 0.542 -15.968 -5.993 1.00 53.22 H new ATOM 0 HG3 GLU A 69 -0.038 -17.410 -5.183 1.00 53.22 H new ATOM 1093 N ARG A 70 2.166 -14.745 -4.829 1.00 44.54 N ATOM 1094 CA ARG A 70 3.566 -15.085 -4.605 1.00 74.11 C ATOM 1095 C ARG A 70 4.483 -13.972 -5.104 1.00 43.32 C ATOM 1096 O ARG A 70 5.572 -14.235 -5.612 1.00 52.25 O ATOM 1097 CB ARG A 70 3.912 -16.399 -5.308 1.00 13.03 C ATOM 1098 CG ARG A 70 2.869 -17.487 -5.113 1.00 42.35 C ATOM 1099 CD ARG A 70 3.168 -18.332 -3.885 1.00 35.11 C ATOM 1100 NE ARG A 70 2.418 -19.586 -3.887 1.00 42.34 N ATOM 1101 CZ ARG A 70 1.148 -19.683 -3.512 1.00 61.23 C ATOM 1102 NH1 ARG A 70 0.489 -18.607 -3.109 1.00 14.55 N ATOM 1103 NH2 ARG A 70 0.534 -20.859 -3.542 1.00 41.34 N ATOM 0 H ARG A 70 1.929 -14.555 -5.803 1.00 44.54 H new ATOM 0 HA ARG A 70 3.718 -15.203 -3.532 1.00 74.11 H new ATOM 0 HB2 ARG A 70 4.032 -16.210 -6.375 1.00 13.03 H new ATOM 0 HB3 ARG A 70 4.872 -16.758 -4.938 1.00 13.03 H new ATOM 0 HG2 ARG A 70 1.883 -17.033 -5.012 1.00 42.35 H new ATOM 0 HG3 ARG A 70 2.838 -18.125 -5.996 1.00 42.35 H new ATOM 0 HD2 ARG A 70 4.236 -18.548 -3.845 1.00 35.11 H new ATOM 0 HD3 ARG A 70 2.924 -17.765 -2.987 1.00 35.11 H new ATOM 0 HE ARG A 70 2.896 -20.433 -4.193 1.00 42.34 H new ATOM 0 HH11 ARG A 70 0.957 -17.701 -3.086 1.00 14.55 H new ATOM 0 HH12 ARG A 70 -0.487 -18.684 -2.821 1.00 14.55 H new ATOM 0 HH21 ARG A 70 1.038 -21.690 -3.853 1.00 41.34 H new ATOM 0 HH22 ARG A 70 -0.442 -20.932 -3.254 1.00 41.34 H new ATOM 1117 N GLN A 71 4.034 -12.730 -4.954 1.00 74.22 N ATOM 1118 CA GLN A 71 4.813 -11.578 -5.390 1.00 41.31 C ATOM 1119 C GLN A 71 4.559 -10.375 -4.489 1.00 55.41 C ATOM 1120 O GLN A 71 3.439 -9.873 -4.384 1.00 71.11 O ATOM 1121 CB GLN A 71 4.475 -11.226 -6.840 1.00 15.43 C ATOM 1122 CG GLN A 71 4.700 -9.761 -7.178 1.00 64.23 C ATOM 1123 CD GLN A 71 4.225 -9.404 -8.572 1.00 41.33 C ATOM 1124 OE1 GLN A 71 3.574 -8.379 -8.776 1.00 42.52 O ATOM 1125 NE2 GLN A 71 4.548 -10.251 -9.544 1.00 34.25 N ATOM 0 H GLN A 71 3.135 -12.496 -4.534 1.00 74.22 H new ATOM 0 HA GLN A 71 5.869 -11.840 -5.324 1.00 41.31 H new ATOM 0 HB2 GLN A 71 5.081 -11.841 -7.505 1.00 15.43 H new ATOM 0 HB3 GLN A 71 3.433 -11.479 -7.033 1.00 15.43 H new ATOM 0 HG2 GLN A 71 4.178 -9.140 -6.450 1.00 64.23 H new ATOM 0 HG3 GLN A 71 5.762 -9.531 -7.090 1.00 64.23 H new ATOM 0 HE21 GLN A 71 5.089 -11.089 -9.331 1.00 34.25 H new ATOM 0 HE22 GLN A 71 4.255 -10.063 -10.503 1.00 34.25 H new ATOM 1134 N PRO A 72 5.620 -9.900 -3.821 1.00 11.24 N ATOM 1135 CA PRO A 72 5.535 -8.749 -2.917 1.00 3.15 C ATOM 1136 C PRO A 72 5.296 -7.441 -3.662 1.00 50.01 C ATOM 1137 O PRO A 72 5.965 -7.150 -4.654 1.00 43.01 O ATOM 1138 CB PRO A 72 6.906 -8.733 -2.234 1.00 51.24 C ATOM 1139 CG PRO A 72 7.817 -9.409 -3.200 1.00 51.23 C ATOM 1140 CD PRO A 72 6.984 -10.448 -3.897 1.00 52.54 C ATOM 0 HA PRO A 72 4.698 -8.837 -2.224 1.00 3.15 H new ATOM 0 HB2 PRO A 72 7.234 -7.714 -2.027 1.00 51.24 H new ATOM 0 HB3 PRO A 72 6.879 -9.259 -1.280 1.00 51.24 H new ATOM 0 HG2 PRO A 72 8.228 -8.695 -3.914 1.00 51.23 H new ATOM 0 HG3 PRO A 72 8.661 -9.867 -2.685 1.00 51.23 H new ATOM 0 HD2 PRO A 72 7.302 -10.592 -4.930 1.00 52.54 H new ATOM 0 HD3 PRO A 72 7.056 -11.417 -3.404 1.00 52.54 H new ATOM 1148 N ARG A 73 4.339 -6.656 -3.179 1.00 71.22 N ATOM 1149 CA ARG A 73 4.011 -5.380 -3.802 1.00 2.54 C ATOM 1150 C ARG A 73 3.348 -4.440 -2.799 1.00 60.04 C ATOM 1151 O ARG A 73 2.797 -4.880 -1.791 1.00 31.34 O ATOM 1152 CB ARG A 73 3.087 -5.595 -5.003 1.00 23.15 C ATOM 1153 CG ARG A 73 1.678 -6.014 -4.619 1.00 52.42 C ATOM 1154 CD ARG A 73 1.616 -7.489 -4.252 1.00 71.12 C ATOM 1155 NE ARG A 73 0.350 -7.841 -3.615 1.00 41.02 N ATOM 1156 CZ ARG A 73 0.098 -9.036 -3.092 1.00 63.24 C ATOM 1157 NH1 ARG A 73 1.020 -9.987 -3.131 1.00 21.53 N ATOM 1158 NH2 ARG A 73 -1.079 -9.281 -2.528 1.00 43.32 N ATOM 0 H ARG A 73 3.777 -6.881 -2.358 1.00 71.22 H new ATOM 0 HA ARG A 73 4.939 -4.923 -4.145 1.00 2.54 H new ATOM 0 HB2 ARG A 73 3.038 -4.673 -5.583 1.00 23.15 H new ATOM 0 HB3 ARG A 73 3.519 -6.357 -5.652 1.00 23.15 H new ATOM 0 HG2 ARG A 73 1.336 -5.414 -3.776 1.00 52.42 H new ATOM 0 HG3 ARG A 73 0.999 -5.815 -5.449 1.00 52.42 H new ATOM 0 HD2 ARG A 73 1.750 -8.092 -5.150 1.00 71.12 H new ATOM 0 HD3 ARG A 73 2.440 -7.730 -3.580 1.00 71.12 H new ATOM 0 HE ARG A 73 -0.381 -7.131 -3.569 1.00 41.02 H new ATOM 0 HH11 ARG A 73 1.925 -9.802 -3.563 1.00 21.53 H new ATOM 0 HH12 ARG A 73 0.824 -10.904 -2.729 1.00 21.53 H new ATOM 0 HH21 ARG A 73 -1.791 -8.551 -2.496 1.00 43.32 H new ATOM 0 HH22 ARG A 73 -1.271 -10.199 -2.127 1.00 43.32 H new ATOM 1172 N PHE A 74 3.407 -3.143 -3.083 1.00 55.03 N ATOM 1173 CA PHE A 74 2.813 -2.141 -2.205 1.00 43.50 C ATOM 1174 C PHE A 74 1.435 -1.723 -2.710 1.00 64.30 C ATOM 1175 O PHE A 74 1.135 -1.837 -3.899 1.00 5.20 O ATOM 1176 CB PHE A 74 3.725 -0.915 -2.105 1.00 62.42 C ATOM 1177 CG PHE A 74 5.113 -1.238 -1.631 1.00 74.00 C ATOM 1178 CD1 PHE A 74 5.310 -1.956 -0.462 1.00 64.03 C ATOM 1179 CD2 PHE A 74 6.220 -0.825 -2.354 1.00 4.32 C ATOM 1180 CE1 PHE A 74 6.587 -2.254 -0.023 1.00 73.04 C ATOM 1181 CE2 PHE A 74 7.498 -1.120 -1.920 1.00 23.01 C ATOM 1182 CZ PHE A 74 7.682 -1.837 -0.754 1.00 11.43 C ATOM 0 H PHE A 74 3.860 -2.761 -3.914 1.00 55.03 H new ATOM 0 HA PHE A 74 2.699 -2.583 -1.215 1.00 43.50 H new ATOM 0 HB2 PHE A 74 3.786 -0.436 -3.082 1.00 62.42 H new ATOM 0 HB3 PHE A 74 3.276 -0.192 -1.424 1.00 62.42 H new ATOM 0 HD1 PHE A 74 4.457 -2.286 0.112 1.00 64.03 H new ATOM 0 HD2 PHE A 74 6.082 -0.266 -3.268 1.00 4.32 H new ATOM 0 HE1 PHE A 74 6.728 -2.812 0.891 1.00 73.04 H new ATOM 0 HE2 PHE A 74 8.353 -0.790 -2.492 1.00 23.01 H new ATOM 0 HZ PHE A 74 8.680 -2.071 -0.415 1.00 11.43 H new ATOM 1192 N VAL A 75 0.599 -1.239 -1.797 1.00 0.40 N ATOM 1193 CA VAL A 75 -0.748 -0.804 -2.148 1.00 61.14 C ATOM 1194 C VAL A 75 -1.252 0.260 -1.179 1.00 25.24 C ATOM 1195 O VAL A 75 -1.061 0.152 0.032 1.00 31.32 O ATOM 1196 CB VAL A 75 -1.735 -1.985 -2.156 1.00 35.31 C ATOM 1197 CG1 VAL A 75 -3.034 -1.591 -2.843 1.00 23.42 C ATOM 1198 CG2 VAL A 75 -1.111 -3.197 -2.832 1.00 3.14 C ATOM 0 H VAL A 75 0.831 -1.138 -0.809 1.00 0.40 H new ATOM 0 HA VAL A 75 -0.693 -0.381 -3.151 1.00 61.14 H new ATOM 0 HB VAL A 75 -1.964 -2.251 -1.124 1.00 35.31 H new ATOM 0 HG11 VAL A 75 -3.719 -2.439 -2.839 1.00 23.42 H new ATOM 0 HG12 VAL A 75 -3.488 -0.755 -2.311 1.00 23.42 H new ATOM 0 HG13 VAL A 75 -2.827 -1.297 -3.872 1.00 23.42 H new ATOM 0 HG21 VAL A 75 -1.823 -4.022 -2.828 1.00 3.14 H new ATOM 0 HG22 VAL A 75 -0.851 -2.946 -3.860 1.00 3.14 H new ATOM 0 HG23 VAL A 75 -0.211 -3.492 -2.292 1.00 3.14 H new ATOM 1208 N VAL A 76 -1.898 1.287 -1.720 1.00 54.30 N ATOM 1209 CA VAL A 76 -2.432 2.371 -0.902 1.00 72.44 C ATOM 1210 C VAL A 76 -3.947 2.472 -1.047 1.00 4.04 C ATOM 1211 O VAL A 76 -4.451 3.046 -2.013 1.00 35.40 O ATOM 1212 CB VAL A 76 -1.800 3.723 -1.280 1.00 64.41 C ATOM 1213 CG1 VAL A 76 -2.461 4.856 -0.510 1.00 73.43 C ATOM 1214 CG2 VAL A 76 -0.300 3.699 -1.026 1.00 3.13 C ATOM 0 H VAL A 76 -2.065 1.392 -2.721 1.00 54.30 H new ATOM 0 HA VAL A 76 -2.183 2.139 0.134 1.00 72.44 H new ATOM 0 HB VAL A 76 -1.963 3.896 -2.344 1.00 64.41 H new ATOM 0 HG11 VAL A 76 -2.001 5.803 -0.791 1.00 73.43 H new ATOM 0 HG12 VAL A 76 -3.525 4.885 -0.747 1.00 73.43 H new ATOM 0 HG13 VAL A 76 -2.332 4.693 0.560 1.00 73.43 H new ATOM 0 HG21 VAL A 76 0.131 4.662 -1.299 1.00 3.13 H new ATOM 0 HG22 VAL A 76 -0.113 3.504 0.030 1.00 3.13 H new ATOM 0 HG23 VAL A 76 0.158 2.914 -1.627 1.00 3.13 H new ATOM 1224 N TYR A 77 -4.666 1.913 -0.080 1.00 11.42 N ATOM 1225 CA TYR A 77 -6.123 1.939 -0.099 1.00 53.55 C ATOM 1226 C TYR A 77 -6.657 3.158 0.648 1.00 50.43 C ATOM 1227 O TYR A 77 -6.193 3.480 1.742 1.00 14.51 O ATOM 1228 CB TYR A 77 -6.685 0.660 0.521 1.00 14.41 C ATOM 1229 CG TYR A 77 -8.150 0.433 0.220 1.00 74.23 C ATOM 1230 CD1 TYR A 77 -8.632 0.513 -1.082 1.00 23.13 C ATOM 1231 CD2 TYR A 77 -9.052 0.141 1.235 1.00 43.12 C ATOM 1232 CE1 TYR A 77 -9.969 0.307 -1.362 1.00 1.40 C ATOM 1233 CE2 TYR A 77 -10.390 -0.068 0.964 1.00 14.35 C ATOM 1234 CZ TYR A 77 -10.844 0.016 -0.336 1.00 43.31 C ATOM 1235 OH TYR A 77 -12.177 -0.190 -0.610 1.00 43.51 O ATOM 0 H TYR A 77 -4.263 1.436 0.727 1.00 11.42 H new ATOM 0 HA TYR A 77 -6.446 2.003 -1.138 1.00 53.55 H new ATOM 0 HB2 TYR A 77 -6.112 -0.192 0.157 1.00 14.41 H new ATOM 0 HB3 TYR A 77 -6.547 0.699 1.601 1.00 14.41 H new ATOM 0 HD1 TYR A 77 -7.950 0.740 -1.888 1.00 23.13 H new ATOM 0 HD2 TYR A 77 -8.701 0.076 2.254 1.00 43.12 H new ATOM 0 HE1 TYR A 77 -10.327 0.373 -2.379 1.00 1.40 H new ATOM 0 HE2 TYR A 77 -11.077 -0.296 1.765 1.00 14.35 H new ATOM 0 HH TYR A 77 -12.320 -0.163 -1.579 1.00 43.51 H new ATOM 1245 N SER A 78 -7.635 3.830 0.049 1.00 3.14 N ATOM 1246 CA SER A 78 -8.230 5.016 0.655 1.00 35.21 C ATOM 1247 C SER A 78 -9.705 4.783 0.967 1.00 72.23 C ATOM 1248 O SER A 78 -10.566 4.939 0.101 1.00 10.41 O ATOM 1249 CB SER A 78 -8.077 6.222 -0.274 1.00 33.52 C ATOM 1250 OG SER A 78 -8.378 7.429 0.404 1.00 21.31 O ATOM 0 H SER A 78 -8.032 3.574 -0.855 1.00 3.14 H new ATOM 0 HA SER A 78 -7.706 5.219 1.589 1.00 35.21 H new ATOM 0 HB2 SER A 78 -7.058 6.262 -0.659 1.00 33.52 H new ATOM 0 HB3 SER A 78 -8.738 6.109 -1.133 1.00 33.52 H new ATOM 0 HG SER A 78 -9.012 7.953 -0.128 1.00 21.31 H new ATOM 1256 N TYR A 79 -9.990 4.408 2.209 1.00 24.10 N ATOM 1257 CA TYR A 79 -11.358 4.151 2.636 1.00 54.32 C ATOM 1258 C TYR A 79 -12.041 5.441 3.082 1.00 52.35 C ATOM 1259 O TYR A 79 -11.383 6.395 3.498 1.00 32.53 O ATOM 1260 CB TYR A 79 -11.378 3.131 3.775 1.00 42.03 C ATOM 1261 CG TYR A 79 -12.758 2.875 4.336 1.00 70.24 C ATOM 1262 CD1 TYR A 79 -13.606 1.945 3.749 1.00 60.45 C ATOM 1263 CD2 TYR A 79 -13.215 3.565 5.453 1.00 51.34 C ATOM 1264 CE1 TYR A 79 -14.869 1.708 4.258 1.00 53.13 C ATOM 1265 CE2 TYR A 79 -14.475 3.334 5.969 1.00 53.13 C ATOM 1266 CZ TYR A 79 -15.298 2.405 5.367 1.00 31.13 C ATOM 1267 OH TYR A 79 -16.556 2.173 5.878 1.00 65.14 O ATOM 0 H TYR A 79 -9.289 4.275 2.938 1.00 24.10 H new ATOM 0 HA TYR A 79 -11.906 3.745 1.785 1.00 54.32 H new ATOM 0 HB2 TYR A 79 -10.961 2.190 3.416 1.00 42.03 H new ATOM 0 HB3 TYR A 79 -10.729 3.482 4.577 1.00 42.03 H new ATOM 0 HD1 TYR A 79 -13.273 1.397 2.880 1.00 60.45 H new ATOM 0 HD2 TYR A 79 -12.574 4.294 5.925 1.00 51.34 H new ATOM 0 HE1 TYR A 79 -15.516 0.981 3.790 1.00 53.13 H new ATOM 0 HE2 TYR A 79 -14.814 3.877 6.839 1.00 53.13 H new ATOM 0 HH TYR A 79 -16.702 2.745 6.660 1.00 65.14 H new ATOM 1277 N LYS A 80 -13.367 5.463 2.992 1.00 21.03 N ATOM 1278 CA LYS A 80 -14.142 6.632 3.389 1.00 44.44 C ATOM 1279 C LYS A 80 -14.848 6.393 4.719 1.00 43.14 C ATOM 1280 O LYS A 80 -15.829 5.652 4.787 1.00 2.31 O ATOM 1281 CB LYS A 80 -15.169 6.977 2.308 1.00 54.30 C ATOM 1282 CG LYS A 80 -16.115 8.099 2.704 1.00 24.44 C ATOM 1283 CD LYS A 80 -17.270 8.227 1.723 1.00 11.05 C ATOM 1284 CE LYS A 80 -17.898 9.610 1.783 1.00 55.31 C ATOM 1285 NZ LYS A 80 -18.304 10.094 0.434 1.00 43.21 N ATOM 0 H LYS A 80 -13.927 4.683 2.647 1.00 21.03 H new ATOM 0 HA LYS A 80 -13.454 7.469 3.510 1.00 44.44 H new ATOM 0 HB2 LYS A 80 -14.643 7.261 1.396 1.00 54.30 H new ATOM 0 HB3 LYS A 80 -15.752 6.086 2.075 1.00 54.30 H new ATOM 0 HG2 LYS A 80 -16.505 7.911 3.704 1.00 24.44 H new ATOM 0 HG3 LYS A 80 -15.567 9.040 2.747 1.00 24.44 H new ATOM 0 HD2 LYS A 80 -16.914 8.031 0.712 1.00 11.05 H new ATOM 0 HD3 LYS A 80 -18.025 7.473 1.947 1.00 11.05 H new ATOM 0 HE2 LYS A 80 -18.769 9.585 2.437 1.00 55.31 H new ATOM 0 HE3 LYS A 80 -17.189 10.312 2.223 1.00 55.31 H new ATOM 0 HZ1 LYS A 80 -18.728 11.040 0.518 1.00 43.21 H new ATOM 0 HZ2 LYS A 80 -17.469 10.142 -0.183 1.00 43.21 H new ATOM 0 HZ3 LYS A 80 -19.000 9.438 0.025 1.00 43.21 H new ATOM 1299 N TYR A 81 -14.344 7.024 5.773 1.00 50.31 N ATOM 1300 CA TYR A 81 -14.926 6.879 7.102 1.00 71.14 C ATOM 1301 C TYR A 81 -15.845 8.053 7.424 1.00 33.42 C ATOM 1302 O TYR A 81 -15.464 9.214 7.281 1.00 20.21 O ATOM 1303 CB TYR A 81 -13.822 6.776 8.157 1.00 74.24 C ATOM 1304 CG TYR A 81 -14.144 5.813 9.276 1.00 22.13 C ATOM 1305 CD1 TYR A 81 -15.294 5.965 10.042 1.00 23.13 C ATOM 1306 CD2 TYR A 81 -13.298 4.749 9.568 1.00 55.53 C ATOM 1307 CE1 TYR A 81 -15.590 5.087 11.067 1.00 10.22 C ATOM 1308 CE2 TYR A 81 -13.589 3.866 10.590 1.00 45.13 C ATOM 1309 CZ TYR A 81 -14.735 4.040 11.338 1.00 44.15 C ATOM 1310 OH TYR A 81 -15.028 3.163 12.356 1.00 42.02 O ATOM 0 H TYR A 81 -13.533 7.641 5.733 1.00 50.31 H new ATOM 0 HA TYR A 81 -15.517 5.963 7.115 1.00 71.14 H new ATOM 0 HB2 TYR A 81 -12.897 6.462 7.674 1.00 74.24 H new ATOM 0 HB3 TYR A 81 -13.641 7.764 8.580 1.00 74.24 H new ATOM 0 HD1 TYR A 81 -15.967 6.783 9.832 1.00 23.13 H new ATOM 0 HD2 TYR A 81 -12.399 4.610 8.986 1.00 55.53 H new ATOM 0 HE1 TYR A 81 -16.487 5.220 11.653 1.00 10.22 H new ATOM 0 HE2 TYR A 81 -12.922 3.043 10.802 1.00 45.13 H new ATOM 0 HH TYR A 81 -14.325 2.483 12.414 1.00 42.02 H new ATOM 1320 N VAL A 82 -17.061 7.740 7.864 1.00 73.54 N ATOM 1321 CA VAL A 82 -18.037 8.767 8.209 1.00 44.11 C ATOM 1322 C VAL A 82 -18.073 9.005 9.715 1.00 44.31 C ATOM 1323 O VAL A 82 -17.573 8.194 10.494 1.00 11.45 O ATOM 1324 CB VAL A 82 -19.448 8.385 7.727 1.00 35.41 C ATOM 1325 CG1 VAL A 82 -20.419 9.534 7.951 1.00 52.52 C ATOM 1326 CG2 VAL A 82 -19.419 7.979 6.261 1.00 41.04 C ATOM 0 H VAL A 82 -17.393 6.784 7.990 1.00 73.54 H new ATOM 0 HA VAL A 82 -17.726 9.682 7.706 1.00 44.11 H new ATOM 0 HB VAL A 82 -19.793 7.531 8.310 1.00 35.41 H new ATOM 0 HG11 VAL A 82 -21.411 9.245 7.604 1.00 52.52 H new ATOM 0 HG12 VAL A 82 -20.462 9.773 9.014 1.00 52.52 H new ATOM 0 HG13 VAL A 82 -20.081 10.409 7.396 1.00 52.52 H new ATOM 0 HG21 VAL A 82 -20.425 7.712 5.937 1.00 41.04 H new ATOM 0 HG22 VAL A 82 -19.053 8.812 5.660 1.00 41.04 H new ATOM 0 HG23 VAL A 82 -18.758 7.122 6.134 1.00 41.04 H new ATOM 1336 N HIS A 83 -18.669 10.124 10.117 1.00 23.31 N ATOM 1337 CA HIS A 83 -18.772 10.469 11.530 1.00 44.32 C ATOM 1338 C HIS A 83 -20.177 10.192 12.056 1.00 62.14 C ATOM 1339 O HIS A 83 -20.475 9.085 12.504 1.00 1.01 O ATOM 1340 CB HIS A 83 -18.415 11.941 11.744 1.00 24.51 C ATOM 1341 CG HIS A 83 -16.961 12.240 11.547 1.00 1.01 C ATOM 1342 ND1 HIS A 83 -16.126 12.626 12.573 1.00 21.13 N ATOM 1343 CD2 HIS A 83 -16.194 12.206 10.432 1.00 24.44 C ATOM 1344 CE1 HIS A 83 -14.908 12.818 12.099 1.00 70.02 C ATOM 1345 NE2 HIS A 83 -14.922 12.570 10.802 1.00 73.35 N ATOM 0 H HIS A 83 -19.087 10.806 9.484 1.00 23.31 H new ATOM 0 HA HIS A 83 -18.068 9.848 12.083 1.00 44.32 H new ATOM 0 HB2 HIS A 83 -18.999 12.552 11.056 1.00 24.51 H new ATOM 0 HB3 HIS A 83 -18.704 12.233 12.754 1.00 24.51 H new ATOM 0 HD2 HIS A 83 -16.521 11.942 9.437 1.00 24.44 H new ATOM 0 HE1 HIS A 83 -14.047 13.125 12.674 1.00 70.02 H new ATOM 0 HE2 HIS A 83 -14.119 12.638 10.177 1.00 73.35 H new ATOM 1354 N ASP A 84 -21.035 11.205 11.999 1.00 42.13 N ATOM 1355 CA ASP A 84 -22.409 11.070 12.469 1.00 4.04 C ATOM 1356 C ASP A 84 -23.147 12.403 12.379 1.00 22.44 C ATOM 1357 O ASP A 84 -24.282 12.463 11.908 1.00 41.45 O ATOM 1358 CB ASP A 84 -22.429 10.558 13.910 1.00 73.24 C ATOM 1359 CG ASP A 84 -23.203 9.262 14.053 1.00 10.10 C ATOM 1360 OD1 ASP A 84 -23.305 8.519 13.054 1.00 34.11 O ATOM 1361 OD2 ASP A 84 -23.706 8.991 15.163 1.00 23.54 O ATOM 0 H ASP A 84 -20.803 12.128 11.632 1.00 42.13 H new ATOM 0 HA ASP A 84 -22.918 10.349 11.829 1.00 4.04 H new ATOM 0 HB2 ASP A 84 -21.406 10.406 14.253 1.00 73.24 H new ATOM 0 HB3 ASP A 84 -22.873 11.316 14.556 1.00 73.24 H new ATOM 1366 N ASP A 85 -22.495 13.465 12.837 1.00 42.23 N ATOM 1367 CA ASP A 85 -23.089 14.797 12.808 1.00 30.23 C ATOM 1368 C ASP A 85 -23.240 15.294 11.374 1.00 13.51 C ATOM 1369 O ASP A 85 -23.869 16.322 11.125 1.00 14.04 O ATOM 1370 CB ASP A 85 -22.235 15.778 13.613 1.00 25.41 C ATOM 1371 CG ASP A 85 -22.631 15.826 15.075 1.00 35.23 C ATOM 1372 OD1 ASP A 85 -22.625 14.760 15.727 1.00 12.14 O ATOM 1373 OD2 ASP A 85 -22.948 16.929 15.569 1.00 42.15 O ATOM 0 H ASP A 85 -21.556 13.430 13.233 1.00 42.23 H new ATOM 0 HA ASP A 85 -24.080 14.735 13.259 1.00 30.23 H new ATOM 0 HB2 ASP A 85 -21.186 15.492 13.533 1.00 25.41 H new ATOM 0 HB3 ASP A 85 -22.328 16.775 13.182 1.00 25.41 H new ATOM 1378 N GLY A 86 -22.657 14.558 10.433 1.00 60.33 N ATOM 1379 CA GLY A 86 -22.737 14.941 9.035 1.00 33.44 C ATOM 1380 C GLY A 86 -21.372 15.144 8.410 1.00 2.44 C ATOM 1381 O GLY A 86 -21.258 15.708 7.321 1.00 23.43 O ATOM 0 H GLY A 86 -22.131 13.703 10.614 1.00 60.33 H new ATOM 0 HA2 GLY A 86 -23.276 14.172 8.481 1.00 33.44 H new ATOM 0 HA3 GLY A 86 -23.314 15.861 8.946 1.00 33.44 H new ATOM 1385 N ARG A 87 -20.333 14.687 9.101 1.00 1.30 N ATOM 1386 CA ARG A 87 -18.967 14.825 8.608 1.00 74.52 C ATOM 1387 C ARG A 87 -18.396 13.469 8.205 1.00 62.15 C ATOM 1388 O ARG A 87 -18.617 12.464 8.880 1.00 21.13 O ATOM 1389 CB ARG A 87 -18.080 15.468 9.675 1.00 24.12 C ATOM 1390 CG ARG A 87 -18.400 16.931 9.933 1.00 64.30 C ATOM 1391 CD ARG A 87 -18.050 17.797 8.733 1.00 54.42 C ATOM 1392 NE ARG A 87 -19.110 18.753 8.420 1.00 64.43 N ATOM 1393 CZ ARG A 87 -19.226 19.938 9.007 1.00 55.54 C ATOM 1394 NH1 ARG A 87 -18.353 20.313 9.931 1.00 52.22 N ATOM 1395 NH2 ARG A 87 -20.218 20.753 8.668 1.00 73.51 N ATOM 0 H ARG A 87 -20.410 14.218 10.004 1.00 1.30 H new ATOM 0 HA ARG A 87 -18.987 15.467 7.728 1.00 74.52 H new ATOM 0 HB2 ARG A 87 -18.186 14.912 10.607 1.00 24.12 H new ATOM 0 HB3 ARG A 87 -17.037 15.381 9.369 1.00 24.12 H new ATOM 0 HG2 ARG A 87 -19.460 17.038 10.163 1.00 64.30 H new ATOM 0 HG3 ARG A 87 -17.847 17.277 10.807 1.00 64.30 H new ATOM 0 HD2 ARG A 87 -17.123 18.335 8.932 1.00 54.42 H new ATOM 0 HD3 ARG A 87 -17.869 17.160 7.867 1.00 54.42 H new ATOM 0 HE ARG A 87 -19.798 18.496 7.712 1.00 64.43 H new ATOM 0 HH11 ARG A 87 -17.589 19.690 10.193 1.00 52.22 H new ATOM 0 HH12 ARG A 87 -18.445 21.224 10.380 1.00 52.22 H new ATOM 0 HH21 ARG A 87 -20.891 20.469 7.956 1.00 73.51 H new ATOM 0 HH22 ARG A 87 -20.307 21.663 9.119 1.00 73.51 H new ATOM 1409 N VAL A 88 -17.658 13.449 7.098 1.00 73.51 N ATOM 1410 CA VAL A 88 -17.055 12.217 6.605 1.00 43.24 C ATOM 1411 C VAL A 88 -15.642 12.466 6.089 1.00 11.42 C ATOM 1412 O VAL A 88 -15.413 13.371 5.287 1.00 52.32 O ATOM 1413 CB VAL A 88 -17.897 11.590 5.478 1.00 3.22 C ATOM 1414 CG1 VAL A 88 -18.168 12.611 4.384 1.00 50.14 C ATOM 1415 CG2 VAL A 88 -17.201 10.362 4.913 1.00 40.24 C ATOM 0 H VAL A 88 -17.464 14.272 6.527 1.00 73.51 H new ATOM 0 HA VAL A 88 -17.016 11.525 7.447 1.00 43.24 H new ATOM 0 HB VAL A 88 -18.854 11.276 5.894 1.00 3.22 H new ATOM 0 HG11 VAL A 88 -18.764 12.151 3.596 1.00 50.14 H new ATOM 0 HG12 VAL A 88 -18.712 13.457 4.803 1.00 50.14 H new ATOM 0 HG13 VAL A 88 -17.222 12.958 3.968 1.00 50.14 H new ATOM 0 HG21 VAL A 88 -17.810 9.932 4.118 1.00 40.24 H new ATOM 0 HG22 VAL A 88 -16.229 10.647 4.511 1.00 40.24 H new ATOM 0 HG23 VAL A 88 -17.064 9.625 5.704 1.00 40.24 H new ATOM 1425 N SER A 89 -14.696 11.656 6.555 1.00 54.10 N ATOM 1426 CA SER A 89 -13.304 11.791 6.143 1.00 20.03 C ATOM 1427 C SER A 89 -12.772 10.473 5.588 1.00 43.02 C ATOM 1428 O SER A 89 -13.206 9.395 5.994 1.00 62.20 O ATOM 1429 CB SER A 89 -12.443 12.245 7.323 1.00 23.54 C ATOM 1430 OG SER A 89 -12.971 13.416 7.920 1.00 54.45 O ATOM 0 H SER A 89 -14.868 10.900 7.218 1.00 54.10 H new ATOM 0 HA SER A 89 -13.255 12.543 5.356 1.00 20.03 H new ATOM 0 HB2 SER A 89 -12.388 11.448 8.065 1.00 23.54 H new ATOM 0 HB3 SER A 89 -11.425 12.434 6.983 1.00 23.54 H new ATOM 0 HG SER A 89 -12.403 13.684 8.672 1.00 54.45 H new ATOM 1436 N TYR A 90 -11.829 10.569 4.657 1.00 31.01 N ATOM 1437 CA TYR A 90 -11.238 9.385 4.043 1.00 52.22 C ATOM 1438 C TYR A 90 -9.828 9.144 4.572 1.00 33.41 C ATOM 1439 O TYR A 90 -8.845 9.682 4.063 1.00 53.23 O ATOM 1440 CB TYR A 90 -11.205 9.538 2.521 1.00 23.13 C ATOM 1441 CG TYR A 90 -12.247 10.493 1.985 1.00 44.33 C ATOM 1442 CD1 TYR A 90 -13.533 10.056 1.693 1.00 30.11 C ATOM 1443 CD2 TYR A 90 -11.945 11.832 1.770 1.00 31.43 C ATOM 1444 CE1 TYR A 90 -14.489 10.925 1.202 1.00 10.33 C ATOM 1445 CE2 TYR A 90 -12.895 12.708 1.282 1.00 51.24 C ATOM 1446 CZ TYR A 90 -14.164 12.250 0.998 1.00 14.33 C ATOM 1447 OH TYR A 90 -15.114 13.120 0.510 1.00 51.12 O ATOM 0 H TYR A 90 -11.458 11.454 4.311 1.00 31.01 H new ATOM 0 HA TYR A 90 -11.855 8.525 4.302 1.00 52.22 H new ATOM 0 HB2 TYR A 90 -10.217 9.886 2.221 1.00 23.13 H new ATOM 0 HB3 TYR A 90 -11.351 8.560 2.063 1.00 23.13 H new ATOM 0 HD1 TYR A 90 -13.790 9.019 1.852 1.00 30.11 H new ATOM 0 HD2 TYR A 90 -10.951 12.194 1.988 1.00 31.43 H new ATOM 0 HE1 TYR A 90 -15.484 10.569 0.979 1.00 10.33 H new ATOM 0 HE2 TYR A 90 -12.645 13.747 1.124 1.00 51.24 H new ATOM 0 HH TYR A 90 -14.750 14.030 0.500 1.00 51.12 H new ATOM 1457 N PRO A 91 -9.725 8.313 5.620 1.00 41.14 N ATOM 1458 CA PRO A 91 -8.440 7.979 6.242 1.00 73.12 C ATOM 1459 C PRO A 91 -7.569 7.109 5.341 1.00 12.03 C ATOM 1460 O PRO A 91 -7.722 5.887 5.306 1.00 72.53 O ATOM 1461 CB PRO A 91 -8.845 7.208 7.501 1.00 65.45 C ATOM 1462 CG PRO A 91 -10.183 6.637 7.181 1.00 12.14 C ATOM 1463 CD PRO A 91 -10.854 7.636 6.278 1.00 33.42 C ATOM 0 HA PRO A 91 -7.842 8.867 6.444 1.00 73.12 H new ATOM 0 HB2 PRO A 91 -8.125 6.423 7.734 1.00 65.45 H new ATOM 0 HB3 PRO A 91 -8.892 7.865 8.370 1.00 65.45 H new ATOM 0 HG2 PRO A 91 -10.087 5.669 6.689 1.00 12.14 H new ATOM 0 HG3 PRO A 91 -10.766 6.477 8.088 1.00 12.14 H new ATOM 0 HD2 PRO A 91 -11.507 7.148 5.554 1.00 33.42 H new ATOM 0 HD3 PRO A 91 -11.470 8.337 6.842 1.00 33.42 H new ATOM 1471 N LEU A 92 -6.656 7.745 4.615 1.00 33.13 N ATOM 1472 CA LEU A 92 -5.760 7.028 3.714 1.00 14.32 C ATOM 1473 C LEU A 92 -4.720 6.234 4.499 1.00 40.45 C ATOM 1474 O LEU A 92 -4.157 6.726 5.477 1.00 43.32 O ATOM 1475 CB LEU A 92 -5.064 8.009 2.770 1.00 64.00 C ATOM 1476 CG LEU A 92 -5.529 7.983 1.314 1.00 64.25 C ATOM 1477 CD1 LEU A 92 -6.184 9.302 0.938 1.00 30.11 C ATOM 1478 CD2 LEU A 92 -4.359 7.684 0.387 1.00 41.13 C ATOM 0 H LEU A 92 -6.517 8.755 4.633 1.00 33.13 H new ATOM 0 HA LEU A 92 -6.356 6.329 3.127 1.00 14.32 H new ATOM 0 HB2 LEU A 92 -5.205 9.018 3.158 1.00 64.00 H new ATOM 0 HB3 LEU A 92 -3.993 7.806 2.792 1.00 64.00 H new ATOM 0 HG LEU A 92 -6.268 7.190 1.203 1.00 64.25 H new ATOM 0 HD11 LEU A 92 -6.508 9.264 -0.102 1.00 30.11 H new ATOM 0 HD12 LEU A 92 -7.047 9.476 1.581 1.00 30.11 H new ATOM 0 HD13 LEU A 92 -5.467 10.113 1.065 1.00 30.11 H new ATOM 0 HD21 LEU A 92 -4.708 7.669 -0.646 1.00 41.13 H new ATOM 0 HD22 LEU A 92 -3.597 8.455 0.502 1.00 41.13 H new ATOM 0 HD23 LEU A 92 -3.933 6.713 0.640 1.00 41.13 H new ATOM 1490 N CYS A 93 -4.470 5.005 4.062 1.00 34.13 N ATOM 1491 CA CYS A 93 -3.496 4.142 4.723 1.00 11.23 C ATOM 1492 C CYS A 93 -2.646 3.398 3.699 1.00 51.41 C ATOM 1493 O CYS A 93 -3.059 3.206 2.555 1.00 11.53 O ATOM 1494 CB CYS A 93 -4.207 3.143 5.637 1.00 2.11 C ATOM 1495 SG CYS A 93 -5.117 3.906 6.999 1.00 11.51 S ATOM 0 H CYS A 93 -4.927 4.583 3.254 1.00 34.13 H new ATOM 0 HA CYS A 93 -2.839 4.770 5.325 1.00 11.23 H new ATOM 0 HB2 CYS A 93 -4.899 2.549 5.040 1.00 2.11 H new ATOM 0 HB3 CYS A 93 -3.469 2.454 6.048 1.00 2.11 H new ATOM 0 HG CYS A 93 -5.021 3.158 8.058 1.00 11.51 H new ATOM 1501 N PHE A 94 -1.455 2.982 4.116 1.00 44.53 N ATOM 1502 CA PHE A 94 -0.545 2.262 3.234 1.00 62.35 C ATOM 1503 C PHE A 94 -0.587 0.763 3.515 1.00 31.33 C ATOM 1504 O PHE A 94 -0.047 0.293 4.517 1.00 5.04 O ATOM 1505 CB PHE A 94 0.884 2.784 3.404 1.00 31.33 C ATOM 1506 CG PHE A 94 1.883 2.091 2.523 1.00 62.14 C ATOM 1507 CD1 PHE A 94 2.010 2.440 1.188 1.00 11.23 C ATOM 1508 CD2 PHE A 94 2.698 1.090 3.029 1.00 21.14 C ATOM 1509 CE1 PHE A 94 2.928 1.803 0.375 1.00 11.33 C ATOM 1510 CE2 PHE A 94 3.617 0.450 2.222 1.00 22.41 C ATOM 1511 CZ PHE A 94 3.734 0.808 0.893 1.00 11.21 C ATOM 0 H PHE A 94 -1.098 3.131 5.060 1.00 44.53 H new ATOM 0 HA PHE A 94 -0.866 2.430 2.206 1.00 62.35 H new ATOM 0 HB2 PHE A 94 0.900 3.852 3.188 1.00 31.33 H new ATOM 0 HB3 PHE A 94 1.185 2.665 4.445 1.00 31.33 H new ATOM 0 HD1 PHE A 94 1.384 3.219 0.778 1.00 11.23 H new ATOM 0 HD2 PHE A 94 2.613 0.807 4.068 1.00 21.14 H new ATOM 0 HE1 PHE A 94 3.015 2.083 -0.664 1.00 11.33 H new ATOM 0 HE2 PHE A 94 4.244 -0.330 2.629 1.00 22.41 H new ATOM 0 HZ PHE A 94 4.454 0.311 0.260 1.00 11.21 H new ATOM 1521 N ILE A 95 -1.236 0.018 2.626 1.00 72.01 N ATOM 1522 CA ILE A 95 -1.350 -1.427 2.778 1.00 63.51 C ATOM 1523 C ILE A 95 -0.220 -2.147 2.050 1.00 53.13 C ATOM 1524 O ILE A 95 -0.257 -2.308 0.829 1.00 21.33 O ATOM 1525 CB ILE A 95 -2.700 -1.945 2.247 1.00 2.12 C ATOM 1526 CG1 ILE A 95 -3.833 -1.531 3.187 1.00 21.44 C ATOM 1527 CG2 ILE A 95 -2.661 -3.457 2.088 1.00 50.12 C ATOM 1528 CD1 ILE A 95 -5.211 -1.699 2.583 1.00 30.41 C ATOM 0 H ILE A 95 -1.691 0.392 1.793 1.00 72.01 H new ATOM 0 HA ILE A 95 -1.284 -1.638 3.845 1.00 63.51 H new ATOM 0 HB ILE A 95 -2.885 -1.502 1.268 1.00 2.12 H new ATOM 0 HG12 ILE A 95 -3.771 -2.122 4.100 1.00 21.44 H new ATOM 0 HG13 ILE A 95 -3.695 -0.488 3.472 1.00 21.44 H new ATOM 0 HG21 ILE A 95 -3.622 -3.808 1.712 1.00 50.12 H new ATOM 0 HG22 ILE A 95 -1.875 -3.729 1.384 1.00 50.12 H new ATOM 0 HG23 ILE A 95 -2.458 -3.919 3.054 1.00 50.12 H new ATOM 0 HD11 ILE A 95 -5.965 -1.386 3.305 1.00 30.41 H new ATOM 0 HD12 ILE A 95 -5.292 -1.086 1.685 1.00 30.41 H new ATOM 0 HD13 ILE A 95 -5.369 -2.746 2.323 1.00 30.41 H new ATOM 1540 N PHE A 96 0.784 -2.579 2.806 1.00 33.33 N ATOM 1541 CA PHE A 96 1.925 -3.284 2.233 1.00 12.51 C ATOM 1542 C PHE A 96 1.584 -4.748 1.969 1.00 2.42 C ATOM 1543 O PHE A 96 1.666 -5.587 2.866 1.00 4.23 O ATOM 1544 CB PHE A 96 3.132 -3.190 3.168 1.00 15.41 C ATOM 1545 CG PHE A 96 4.307 -4.007 2.715 1.00 71.32 C ATOM 1546 CD1 PHE A 96 4.395 -4.450 1.405 1.00 43.42 C ATOM 1547 CD2 PHE A 96 5.324 -4.333 3.598 1.00 14.15 C ATOM 1548 CE1 PHE A 96 5.476 -5.202 0.984 1.00 62.01 C ATOM 1549 CE2 PHE A 96 6.407 -5.085 3.183 1.00 11.24 C ATOM 1550 CZ PHE A 96 6.483 -5.520 1.875 1.00 72.42 C ATOM 0 H PHE A 96 0.831 -2.453 3.817 1.00 33.33 H new ATOM 0 HA PHE A 96 2.173 -2.810 1.283 1.00 12.51 H new ATOM 0 HB2 PHE A 96 3.436 -2.147 3.252 1.00 15.41 H new ATOM 0 HB3 PHE A 96 2.835 -3.517 4.165 1.00 15.41 H new ATOM 0 HD1 PHE A 96 3.610 -4.205 0.705 1.00 43.42 H new ATOM 0 HD2 PHE A 96 5.270 -3.996 4.622 1.00 14.15 H new ATOM 0 HE1 PHE A 96 5.533 -5.540 -0.040 1.00 62.01 H new ATOM 0 HE2 PHE A 96 7.193 -5.332 3.881 1.00 11.24 H new ATOM 0 HZ PHE A 96 7.328 -6.108 1.549 1.00 72.42 H new ATOM 1560 N SER A 97 1.201 -5.046 0.732 1.00 53.31 N ATOM 1561 CA SER A 97 0.842 -6.407 0.350 1.00 1.11 C ATOM 1562 C SER A 97 2.091 -7.257 0.136 1.00 45.20 C ATOM 1563 O SER A 97 2.768 -7.138 -0.886 1.00 22.25 O ATOM 1564 CB SER A 97 -0.006 -6.396 -0.923 1.00 71.52 C ATOM 1565 OG SER A 97 -1.013 -7.392 -0.873 1.00 50.51 O ATOM 0 H SER A 97 1.131 -4.364 -0.023 1.00 53.31 H new ATOM 0 HA SER A 97 0.260 -6.844 1.161 1.00 1.11 H new ATOM 0 HB2 SER A 97 -0.466 -5.416 -1.049 1.00 71.52 H new ATOM 0 HB3 SER A 97 0.632 -6.563 -1.791 1.00 71.52 H new ATOM 0 HG SER A 97 -0.693 -8.155 -0.347 1.00 50.51 H new ATOM 1571 N SER A 98 2.389 -8.115 1.107 1.00 43.33 N ATOM 1572 CA SER A 98 3.559 -8.983 1.027 1.00 74.25 C ATOM 1573 C SER A 98 3.205 -10.410 1.437 1.00 12.40 C ATOM 1574 O SER A 98 3.005 -10.713 2.613 1.00 3.03 O ATOM 1575 CB SER A 98 4.680 -8.447 1.919 1.00 40.51 C ATOM 1576 OG SER A 98 4.566 -8.949 3.239 1.00 13.14 O ATOM 0 H SER A 98 1.837 -8.228 1.957 1.00 43.33 H new ATOM 0 HA SER A 98 3.902 -8.995 -0.007 1.00 74.25 H new ATOM 0 HB2 SER A 98 5.647 -8.729 1.502 1.00 40.51 H new ATOM 0 HB3 SER A 98 4.645 -7.358 1.937 1.00 40.51 H new ATOM 0 HG SER A 98 3.651 -9.266 3.390 1.00 13.14 H new ATOM 1582 N PRO A 99 3.126 -11.307 0.445 1.00 52.25 N ATOM 1583 CA PRO A 99 2.797 -12.717 0.676 1.00 74.24 C ATOM 1584 C PRO A 99 3.916 -13.463 1.393 1.00 21.12 C ATOM 1585 O PRO A 99 4.842 -12.851 1.926 1.00 0.42 O ATOM 1586 CB PRO A 99 2.604 -13.273 -0.737 1.00 53.42 C ATOM 1587 CG PRO A 99 3.416 -12.380 -1.610 1.00 63.10 C ATOM 1588 CD PRO A 99 3.352 -11.016 -0.982 1.00 14.52 C ATOM 0 HA PRO A 99 1.923 -12.831 1.317 1.00 74.24 H new ATOM 0 HB2 PRO A 99 2.942 -14.307 -0.805 1.00 53.42 H new ATOM 0 HB3 PRO A 99 1.553 -13.261 -1.027 1.00 53.42 H new ATOM 0 HG2 PRO A 99 4.446 -12.731 -1.677 1.00 63.10 H new ATOM 0 HG3 PRO A 99 3.019 -12.361 -2.625 1.00 63.10 H new ATOM 0 HD2 PRO A 99 4.276 -10.459 -1.137 1.00 14.52 H new ATOM 0 HD3 PRO A 99 2.544 -10.417 -1.403 1.00 14.52 H new ATOM 1596 N VAL A 100 3.827 -14.790 1.403 1.00 14.31 N ATOM 1597 CA VAL A 100 4.833 -15.620 2.053 1.00 1.22 C ATOM 1598 C VAL A 100 5.446 -16.611 1.071 1.00 3.10 C ATOM 1599 O VAL A 100 6.570 -17.075 1.261 1.00 51.13 O ATOM 1600 CB VAL A 100 4.237 -16.395 3.244 1.00 45.41 C ATOM 1601 CG1 VAL A 100 3.255 -17.449 2.757 1.00 13.53 C ATOM 1602 CG2 VAL A 100 5.344 -17.027 4.074 1.00 32.30 C ATOM 0 H VAL A 100 3.067 -15.313 0.967 1.00 14.31 H new ATOM 0 HA VAL A 100 5.610 -14.948 2.418 1.00 1.22 H new ATOM 0 HB VAL A 100 3.694 -15.694 3.878 1.00 45.41 H new ATOM 0 HG11 VAL A 100 2.844 -17.986 3.612 1.00 13.53 H new ATOM 0 HG12 VAL A 100 2.446 -16.967 2.209 1.00 13.53 H new ATOM 0 HG13 VAL A 100 3.770 -18.151 2.101 1.00 13.53 H new ATOM 0 HG21 VAL A 100 4.906 -17.571 4.911 1.00 32.30 H new ATOM 0 HG22 VAL A 100 5.916 -17.717 3.453 1.00 32.30 H new ATOM 0 HG23 VAL A 100 6.005 -16.247 4.453 1.00 32.30 H new ATOM 1612 N GLY A 101 4.700 -16.932 0.018 1.00 34.22 N ATOM 1613 CA GLY A 101 5.187 -17.867 -0.979 1.00 53.24 C ATOM 1614 C GLY A 101 6.226 -17.249 -1.893 1.00 63.14 C ATOM 1615 O GLY A 101 6.970 -17.961 -2.569 1.00 32.30 O ATOM 0 H GLY A 101 3.767 -16.561 -0.162 1.00 34.22 H new ATOM 0 HA2 GLY A 101 5.617 -18.735 -0.479 1.00 53.24 H new ATOM 0 HA3 GLY A 101 4.349 -18.226 -1.577 1.00 53.24 H new ATOM 1619 N CYS A 102 6.277 -15.922 -1.917 1.00 24.10 N ATOM 1620 CA CYS A 102 7.232 -15.209 -2.758 1.00 1.24 C ATOM 1621 C CYS A 102 8.664 -15.618 -2.424 1.00 15.03 C ATOM 1622 O CYS A 102 8.892 -16.477 -1.572 1.00 0.43 O ATOM 1623 CB CYS A 102 7.068 -13.698 -2.583 1.00 74.24 C ATOM 1624 SG CYS A 102 6.954 -13.161 -0.861 1.00 21.42 S ATOM 0 H CYS A 102 5.669 -15.318 -1.364 1.00 24.10 H new ATOM 0 HA CYS A 102 7.031 -15.472 -3.796 1.00 1.24 H new ATOM 0 HB2 CYS A 102 7.913 -13.195 -3.054 1.00 74.24 H new ATOM 0 HB3 CYS A 102 6.171 -13.377 -3.112 1.00 74.24 H new ATOM 0 HG CYS A 102 6.609 -11.908 -0.819 1.00 21.42 H new ATOM 1630 N LYS A 103 9.624 -14.999 -3.102 1.00 1.12 N ATOM 1631 CA LYS A 103 11.033 -15.298 -2.878 1.00 43.20 C ATOM 1632 C LYS A 103 11.683 -14.232 -2.000 1.00 71.44 C ATOM 1633 O LYS A 103 11.288 -13.066 -2.003 1.00 32.40 O ATOM 1634 CB LYS A 103 11.773 -15.394 -4.214 1.00 21.12 C ATOM 1635 CG LYS A 103 10.946 -16.019 -5.324 1.00 42.32 C ATOM 1636 CD LYS A 103 10.812 -15.083 -6.514 1.00 73.32 C ATOM 1637 CE LYS A 103 12.169 -14.745 -7.112 1.00 31.11 C ATOM 1638 NZ LYS A 103 12.485 -15.600 -8.290 1.00 34.12 N ATOM 0 H LYS A 103 9.452 -14.287 -3.812 1.00 1.12 H new ATOM 0 HA LYS A 103 11.098 -16.257 -2.363 1.00 43.20 H new ATOM 0 HB2 LYS A 103 12.082 -14.395 -4.521 1.00 21.12 H new ATOM 0 HB3 LYS A 103 12.682 -15.980 -4.075 1.00 21.12 H new ATOM 0 HG2 LYS A 103 11.410 -16.952 -5.644 1.00 42.32 H new ATOM 0 HG3 LYS A 103 9.956 -16.270 -4.944 1.00 42.32 H new ATOM 0 HD2 LYS A 103 10.183 -15.547 -7.274 1.00 73.32 H new ATOM 0 HD3 LYS A 103 10.312 -14.166 -6.203 1.00 73.32 H new ATOM 0 HE2 LYS A 103 12.184 -13.697 -7.410 1.00 31.11 H new ATOM 0 HE3 LYS A 103 12.942 -14.872 -6.354 1.00 31.11 H new ATOM 0 HZ1 LYS A 103 13.418 -15.339 -8.669 1.00 34.12 H new ATOM 0 HZ2 LYS A 103 12.496 -16.599 -8.001 1.00 34.12 H new ATOM 0 HZ3 LYS A 103 11.762 -15.460 -9.024 1.00 34.12 H new ATOM 1652 N PRO A 104 12.705 -14.640 -1.233 1.00 41.13 N ATOM 1653 CA PRO A 104 13.432 -13.735 -0.338 1.00 32.23 C ATOM 1654 C PRO A 104 14.280 -12.723 -1.101 1.00 32.32 C ATOM 1655 O PRO A 104 14.802 -11.773 -0.518 1.00 55.34 O ATOM 1656 CB PRO A 104 14.325 -14.678 0.471 1.00 33.23 C ATOM 1657 CG PRO A 104 14.508 -15.870 -0.403 1.00 64.32 C ATOM 1658 CD PRO A 104 13.229 -16.015 -1.180 1.00 42.30 C ATOM 0 HA PRO A 104 12.756 -13.137 0.273 1.00 32.23 H new ATOM 0 HB2 PRO A 104 15.281 -14.211 0.709 1.00 33.23 H new ATOM 0 HB3 PRO A 104 13.859 -14.949 1.418 1.00 33.23 H new ATOM 0 HG2 PRO A 104 15.358 -15.736 -1.072 1.00 64.32 H new ATOM 0 HG3 PRO A 104 14.707 -16.762 0.191 1.00 64.32 H new ATOM 0 HD2 PRO A 104 13.408 -16.416 -2.178 1.00 42.30 H new ATOM 0 HD3 PRO A 104 12.533 -16.692 -0.685 1.00 42.30 H new ATOM 1666 N GLU A 105 14.413 -12.935 -2.407 1.00 4.53 N ATOM 1667 CA GLU A 105 15.199 -12.040 -3.248 1.00 43.25 C ATOM 1668 C GLU A 105 14.421 -10.765 -3.562 1.00 40.52 C ATOM 1669 O GLU A 105 14.999 -9.682 -3.660 1.00 33.13 O ATOM 1670 CB GLU A 105 15.595 -12.743 -4.549 1.00 54.32 C ATOM 1671 CG GLU A 105 16.804 -13.651 -4.407 1.00 12.42 C ATOM 1672 CD GLU A 105 18.002 -13.154 -5.192 1.00 0.44 C ATOM 1673 OE1 GLU A 105 18.091 -13.461 -6.398 1.00 51.52 O ATOM 1674 OE2 GLU A 105 18.852 -12.457 -4.597 1.00 11.22 O ATOM 0 H GLU A 105 13.987 -13.717 -2.904 1.00 4.53 H new ATOM 0 HA GLU A 105 16.102 -11.768 -2.701 1.00 43.25 H new ATOM 0 HB2 GLU A 105 14.750 -13.331 -4.906 1.00 54.32 H new ATOM 0 HB3 GLU A 105 15.804 -11.991 -5.310 1.00 54.32 H new ATOM 0 HG2 GLU A 105 17.072 -13.731 -3.354 1.00 12.42 H new ATOM 0 HG3 GLU A 105 16.543 -14.653 -4.746 1.00 12.42 H new ATOM 1681 N GLN A 106 13.109 -10.903 -3.719 1.00 62.23 N ATOM 1682 CA GLN A 106 12.252 -9.763 -4.022 1.00 52.24 C ATOM 1683 C GLN A 106 11.708 -9.136 -2.744 1.00 12.22 C ATOM 1684 O GLN A 106 11.860 -7.936 -2.517 1.00 23.11 O ATOM 1685 CB GLN A 106 11.095 -10.194 -4.926 1.00 45.23 C ATOM 1686 CG GLN A 106 11.475 -11.274 -5.927 1.00 20.02 C ATOM 1687 CD GLN A 106 12.263 -10.730 -7.102 1.00 40.20 C ATOM 1688 OE1 GLN A 106 13.326 -11.249 -7.445 1.00 50.10 O ATOM 1689 NE2 GLN A 106 11.746 -9.678 -7.727 1.00 24.14 N ATOM 0 H GLN A 106 12.616 -11.793 -3.641 1.00 62.23 H new ATOM 0 HA GLN A 106 12.853 -9.017 -4.543 1.00 52.24 H new ATOM 0 HB2 GLN A 106 10.276 -10.557 -4.305 1.00 45.23 H new ATOM 0 HB3 GLN A 106 10.723 -9.324 -5.467 1.00 45.23 H new ATOM 0 HG2 GLN A 106 12.064 -12.040 -5.423 1.00 20.02 H new ATOM 0 HG3 GLN A 106 10.570 -11.758 -6.294 1.00 20.02 H new ATOM 0 HE21 GLN A 106 10.862 -9.280 -7.409 1.00 24.14 H new ATOM 0 HE22 GLN A 106 12.233 -9.269 -8.525 1.00 24.14 H new ATOM 1698 N GLN A 107 11.070 -9.955 -1.913 1.00 44.13 N ATOM 1699 CA GLN A 107 10.502 -9.478 -0.658 1.00 20.32 C ATOM 1700 C GLN A 107 11.429 -8.468 0.011 1.00 23.31 C ATOM 1701 O GLN A 107 10.975 -7.477 0.581 1.00 21.34 O ATOM 1702 CB GLN A 107 10.242 -10.653 0.287 1.00 23.21 C ATOM 1703 CG GLN A 107 8.781 -10.807 0.677 1.00 13.43 C ATOM 1704 CD GLN A 107 8.464 -10.164 2.013 1.00 12.51 C ATOM 1705 OE1 GLN A 107 8.126 -10.848 2.980 1.00 14.50 O ATOM 1706 NE2 GLN A 107 8.570 -8.842 2.075 1.00 43.53 N ATOM 0 H GLN A 107 10.934 -10.951 -2.086 1.00 44.13 H new ATOM 0 HA GLN A 107 9.557 -8.983 -0.881 1.00 20.32 H new ATOM 0 HB2 GLN A 107 10.582 -11.573 -0.189 1.00 23.21 H new ATOM 0 HB3 GLN A 107 10.839 -10.522 1.190 1.00 23.21 H new ATOM 0 HG2 GLN A 107 8.154 -10.361 -0.095 1.00 13.43 H new ATOM 0 HG3 GLN A 107 8.530 -11.867 0.719 1.00 13.43 H new ATOM 0 HE21 GLN A 107 8.853 -8.314 1.250 1.00 43.53 H new ATOM 0 HE22 GLN A 107 8.368 -8.355 2.948 1.00 43.53 H new ATOM 1715 N MET A 108 12.731 -8.728 -0.063 1.00 15.20 N ATOM 1716 CA MET A 108 13.722 -7.841 0.535 1.00 52.42 C ATOM 1717 C MET A 108 13.698 -6.469 -0.134 1.00 72.15 C ATOM 1718 O MET A 108 13.826 -5.442 0.531 1.00 70.05 O ATOM 1719 CB MET A 108 15.120 -8.452 0.422 1.00 12.11 C ATOM 1720 CG MET A 108 15.501 -9.320 1.610 1.00 70.31 C ATOM 1721 SD MET A 108 17.270 -9.285 1.956 1.00 51.22 S ATOM 1722 CE MET A 108 17.942 -9.492 0.309 1.00 51.40 C ATOM 0 H MET A 108 13.124 -9.545 -0.531 1.00 15.20 H new ATOM 0 HA MET A 108 13.472 -7.717 1.589 1.00 52.42 H new ATOM 0 HB2 MET A 108 15.174 -9.051 -0.487 1.00 12.11 H new ATOM 0 HB3 MET A 108 15.851 -7.650 0.319 1.00 12.11 H new ATOM 0 HG2 MET A 108 14.956 -8.983 2.491 1.00 70.31 H new ATOM 0 HG3 MET A 108 15.192 -10.348 1.418 1.00 70.31 H new ATOM 0 HE1 MET A 108 18.953 -9.893 0.376 1.00 51.40 H new ATOM 0 HE2 MET A 108 17.315 -10.182 -0.256 1.00 51.40 H new ATOM 0 HE3 MET A 108 17.967 -8.527 -0.198 1.00 51.40 H new ATOM 1732 N MET A 109 13.533 -6.462 -1.453 1.00 34.03 N ATOM 1733 CA MET A 109 13.492 -5.217 -2.211 1.00 15.34 C ATOM 1734 C MET A 109 12.405 -4.290 -1.674 1.00 63.43 C ATOM 1735 O MET A 109 12.594 -3.076 -1.600 1.00 4.41 O ATOM 1736 CB MET A 109 13.246 -5.505 -3.693 1.00 42.32 C ATOM 1737 CG MET A 109 14.421 -6.178 -4.384 1.00 72.22 C ATOM 1738 SD MET A 109 13.961 -6.939 -5.953 1.00 3.51 S ATOM 1739 CE MET A 109 13.222 -5.544 -6.800 1.00 62.22 C ATOM 0 H MET A 109 13.426 -7.304 -2.019 1.00 34.03 H new ATOM 0 HA MET A 109 14.456 -4.721 -2.100 1.00 15.34 H new ATOM 0 HB2 MET A 109 12.365 -6.140 -3.790 1.00 42.32 H new ATOM 0 HB3 MET A 109 13.022 -4.569 -4.204 1.00 42.32 H new ATOM 0 HG2 MET A 109 15.206 -5.442 -4.558 1.00 72.22 H new ATOM 0 HG3 MET A 109 14.838 -6.939 -3.724 1.00 72.22 H new ATOM 0 HE1 MET A 109 12.934 -5.841 -7.808 1.00 62.22 H new ATOM 0 HE2 MET A 109 12.339 -5.213 -6.254 1.00 62.22 H new ATOM 0 HE3 MET A 109 13.942 -4.728 -6.854 1.00 62.22 H new ATOM 1749 N TYR A 110 11.270 -4.870 -1.302 1.00 71.33 N ATOM 1750 CA TYR A 110 10.153 -4.095 -0.775 1.00 52.34 C ATOM 1751 C TYR A 110 10.318 -3.851 0.722 1.00 41.42 C ATOM 1752 O TYR A 110 10.048 -2.756 1.216 1.00 25.34 O ATOM 1753 CB TYR A 110 8.832 -4.818 -1.043 1.00 51.10 C ATOM 1754 CG TYR A 110 8.622 -5.177 -2.496 1.00 24.02 C ATOM 1755 CD1 TYR A 110 9.289 -6.252 -3.070 1.00 61.20 C ATOM 1756 CD2 TYR A 110 7.755 -4.441 -3.295 1.00 64.22 C ATOM 1757 CE1 TYR A 110 9.100 -6.583 -4.398 1.00 1.32 C ATOM 1758 CE2 TYR A 110 7.560 -4.766 -4.625 1.00 22.35 C ATOM 1759 CZ TYR A 110 8.235 -5.838 -5.171 1.00 54.32 C ATOM 1760 OH TYR A 110 8.043 -6.165 -6.494 1.00 5.22 O ATOM 0 H TYR A 110 11.099 -5.874 -1.355 1.00 71.33 H new ATOM 0 HA TYR A 110 10.141 -3.131 -1.283 1.00 52.34 H new ATOM 0 HB2 TYR A 110 8.798 -5.728 -0.444 1.00 51.10 H new ATOM 0 HB3 TYR A 110 8.008 -4.186 -0.711 1.00 51.10 H new ATOM 0 HD1 TYR A 110 9.967 -6.839 -2.468 1.00 61.20 H new ATOM 0 HD2 TYR A 110 7.225 -3.601 -2.870 1.00 64.22 H new ATOM 0 HE1 TYR A 110 9.627 -7.421 -4.829 1.00 1.32 H new ATOM 0 HE2 TYR A 110 6.883 -4.184 -5.233 1.00 22.35 H new ATOM 0 HH TYR A 110 7.227 -6.700 -6.584 1.00 5.22 H new ATOM 1770 N ALA A 111 10.763 -4.878 1.437 1.00 52.22 N ATOM 1771 CA ALA A 111 10.967 -4.776 2.876 1.00 10.34 C ATOM 1772 C ALA A 111 11.996 -3.701 3.210 1.00 24.35 C ATOM 1773 O ALA A 111 11.959 -3.104 4.285 1.00 74.30 O ATOM 1774 CB ALA A 111 11.400 -6.119 3.445 1.00 0.14 C ATOM 0 H ALA A 111 10.989 -5.791 1.043 1.00 52.22 H new ATOM 0 HA ALA A 111 10.020 -4.489 3.332 1.00 10.34 H new ATOM 0 HB1 ALA A 111 11.549 -6.027 4.521 1.00 0.14 H new ATOM 0 HB2 ALA A 111 10.629 -6.864 3.247 1.00 0.14 H new ATOM 0 HB3 ALA A 111 12.333 -6.429 2.975 1.00 0.14 H new ATOM 1780 N GLY A 112 12.916 -3.460 2.281 1.00 33.43 N ATOM 1781 CA GLY A 112 13.943 -2.459 2.497 1.00 61.14 C ATOM 1782 C GLY A 112 13.597 -1.128 1.861 1.00 42.45 C ATOM 1783 O GLY A 112 14.092 -0.082 2.281 1.00 1.15 O ATOM 0 H GLY A 112 12.968 -3.940 1.383 1.00 33.43 H new ATOM 0 HA2 GLY A 112 14.090 -2.319 3.568 1.00 61.14 H new ATOM 0 HA3 GLY A 112 14.888 -2.818 2.089 1.00 61.14 H new ATOM 1787 N SER A 113 12.746 -1.164 0.841 1.00 62.35 N ATOM 1788 CA SER A 113 12.338 0.048 0.140 1.00 72.21 C ATOM 1789 C SER A 113 10.964 0.512 0.613 1.00 10.11 C ATOM 1790 O SER A 113 10.495 1.588 0.237 1.00 20.54 O ATOM 1791 CB SER A 113 12.316 -0.193 -1.370 1.00 43.45 C ATOM 1792 OG SER A 113 13.522 -0.795 -1.809 1.00 35.11 O ATOM 0 H SER A 113 12.325 -2.021 0.481 1.00 62.35 H new ATOM 0 HA SER A 113 13.064 0.830 0.365 1.00 72.21 H new ATOM 0 HB2 SER A 113 11.472 -0.833 -1.627 1.00 43.45 H new ATOM 0 HB3 SER A 113 12.168 0.753 -1.890 1.00 43.45 H new ATOM 0 HG SER A 113 13.514 -1.748 -1.580 1.00 35.11 H new ATOM 1798 N LYS A 114 10.322 -0.306 1.439 1.00 60.43 N ATOM 1799 CA LYS A 114 9.001 0.018 1.966 1.00 41.31 C ATOM 1800 C LYS A 114 9.010 1.380 2.653 1.00 33.33 C ATOM 1801 O LYS A 114 8.367 2.322 2.192 1.00 62.32 O ATOM 1802 CB LYS A 114 8.543 -1.060 2.950 1.00 24.12 C ATOM 1803 CG LYS A 114 7.269 -0.702 3.694 1.00 73.23 C ATOM 1804 CD LYS A 114 6.839 -1.818 4.633 1.00 41.01 C ATOM 1805 CE LYS A 114 7.238 -1.520 6.070 1.00 71.33 C ATOM 1806 NZ LYS A 114 6.783 -2.587 7.004 1.00 32.10 N ATOM 0 H LYS A 114 10.695 -1.200 1.759 1.00 60.43 H new ATOM 0 HA LYS A 114 8.302 0.057 1.130 1.00 41.31 H new ATOM 0 HB2 LYS A 114 8.387 -1.993 2.408 1.00 24.12 H new ATOM 0 HB3 LYS A 114 9.338 -1.241 3.674 1.00 24.12 H new ATOM 0 HG2 LYS A 114 7.424 0.214 4.264 1.00 73.23 H new ATOM 0 HG3 LYS A 114 6.472 -0.501 2.978 1.00 73.23 H new ATOM 0 HD2 LYS A 114 5.759 -1.949 4.574 1.00 41.01 H new ATOM 0 HD3 LYS A 114 7.292 -2.757 4.316 1.00 41.01 H new ATOM 0 HE2 LYS A 114 8.322 -1.420 6.133 1.00 71.33 H new ATOM 0 HE3 LYS A 114 6.811 -0.564 6.375 1.00 71.33 H new ATOM 0 HZ1 LYS A 114 7.074 -2.347 7.973 1.00 32.10 H new ATOM 0 HZ2 LYS A 114 5.747 -2.665 6.963 1.00 32.10 H new ATOM 0 HZ3 LYS A 114 7.210 -3.494 6.729 1.00 32.10 H new ATOM 1820 N ASN A 115 9.744 1.475 3.758 1.00 15.10 N ATOM 1821 CA ASN A 115 9.835 2.722 4.509 1.00 60.24 C ATOM 1822 C ASN A 115 10.121 3.897 3.578 1.00 14.42 C ATOM 1823 O ASN A 115 9.678 5.019 3.825 1.00 73.44 O ATOM 1824 CB ASN A 115 10.931 2.622 5.572 1.00 54.13 C ATOM 1825 CG ASN A 115 10.399 2.127 6.903 1.00 24.34 C ATOM 1826 OD1 ASN A 115 9.771 2.876 7.652 1.00 43.13 O ATOM 1827 ND2 ASN A 115 10.650 0.858 7.205 1.00 31.22 N ATOM 0 H ASN A 115 10.283 0.704 4.152 1.00 15.10 H new ATOM 0 HA ASN A 115 8.877 2.893 4.999 1.00 60.24 H new ATOM 0 HB2 ASN A 115 11.713 1.948 5.222 1.00 54.13 H new ATOM 0 HB3 ASN A 115 11.392 3.600 5.709 1.00 54.13 H new ATOM 0 HD21 ASN A 115 10.318 0.469 8.087 1.00 31.22 H new ATOM 0 HD22 ASN A 115 11.174 0.273 6.554 1.00 31.22 H new ATOM 1834 N ARG A 116 10.863 3.631 2.507 1.00 33.15 N ATOM 1835 CA ARG A 116 11.207 4.666 1.541 1.00 65.45 C ATOM 1836 C ARG A 116 9.982 5.087 0.735 1.00 13.10 C ATOM 1837 O ARG A 116 9.674 6.275 0.627 1.00 24.42 O ATOM 1838 CB ARG A 116 12.304 4.167 0.598 1.00 40.01 C ATOM 1839 CG ARG A 116 12.510 5.053 -0.620 1.00 34.52 C ATOM 1840 CD ARG A 116 13.279 6.316 -0.268 1.00 30.43 C ATOM 1841 NE ARG A 116 14.644 6.287 -0.784 1.00 64.23 N ATOM 1842 CZ ARG A 116 15.581 7.160 -0.433 1.00 0.23 C ATOM 1843 NH1 ARG A 116 15.301 8.127 0.431 1.00 62.50 N ATOM 1844 NH2 ARG A 116 16.802 7.069 -0.946 1.00 32.31 N ATOM 0 H ARG A 116 11.237 2.708 2.287 1.00 33.15 H new ATOM 0 HA ARG A 116 11.574 5.533 2.090 1.00 65.45 H new ATOM 0 HB2 ARG A 116 13.242 4.098 1.149 1.00 40.01 H new ATOM 0 HB3 ARG A 116 12.055 3.159 0.266 1.00 40.01 H new ATOM 0 HG2 ARG A 116 13.051 4.499 -1.387 1.00 34.52 H new ATOM 0 HG3 ARG A 116 11.542 5.321 -1.044 1.00 34.52 H new ATOM 0 HD2 ARG A 116 12.757 7.183 -0.673 1.00 30.43 H new ATOM 0 HD3 ARG A 116 13.303 6.436 0.815 1.00 30.43 H new ATOM 0 HE ARG A 116 14.892 5.556 -1.451 1.00 64.23 H new ATOM 0 HH11 ARG A 116 14.364 8.201 0.827 1.00 62.50 H new ATOM 0 HH12 ARG A 116 16.023 8.796 0.699 1.00 62.50 H new ATOM 0 HH21 ARG A 116 17.022 6.328 -1.611 1.00 32.31 H new ATOM 0 HH22 ARG A 116 17.520 7.741 -0.675 1.00 32.31 H new ATOM 1858 N LEU A 117 9.287 4.106 0.170 1.00 52.21 N ATOM 1859 CA LEU A 117 8.095 4.375 -0.627 1.00 70.45 C ATOM 1860 C LEU A 117 7.004 5.018 0.224 1.00 52.44 C ATOM 1861 O LEU A 117 6.385 6.002 -0.182 1.00 41.14 O ATOM 1862 CB LEU A 117 7.572 3.079 -1.252 1.00 43.22 C ATOM 1863 CG LEU A 117 6.397 3.228 -2.220 1.00 23.32 C ATOM 1864 CD1 LEU A 117 5.126 3.584 -1.465 1.00 13.11 C ATOM 1865 CD2 LEU A 117 6.705 4.277 -3.277 1.00 5.45 C ATOM 0 H LEU A 117 9.528 3.118 0.249 1.00 52.21 H new ATOM 0 HA LEU A 117 8.368 5.070 -1.421 1.00 70.45 H new ATOM 0 HB2 LEU A 117 8.394 2.597 -1.781 1.00 43.22 H new ATOM 0 HB3 LEU A 117 7.272 2.407 -0.448 1.00 43.22 H new ATOM 0 HG LEU A 117 6.241 2.273 -2.722 1.00 23.32 H new ATOM 0 HD11 LEU A 117 4.301 3.686 -2.170 1.00 13.11 H new ATOM 0 HD12 LEU A 117 4.896 2.796 -0.748 1.00 13.11 H new ATOM 0 HD13 LEU A 117 5.269 4.526 -0.935 1.00 13.11 H new ATOM 0 HD21 LEU A 117 5.858 4.369 -3.956 1.00 5.45 H new ATOM 0 HD22 LEU A 117 6.889 5.237 -2.794 1.00 5.45 H new ATOM 0 HD23 LEU A 117 7.590 3.978 -3.839 1.00 5.45 H new ATOM 1877 N VAL A 118 6.775 4.457 1.406 1.00 51.10 N ATOM 1878 CA VAL A 118 5.763 4.978 2.316 1.00 12.12 C ATOM 1879 C VAL A 118 6.088 6.405 2.742 1.00 60.13 C ATOM 1880 O VAL A 118 5.250 7.301 2.636 1.00 22.32 O ATOM 1881 CB VAL A 118 5.630 4.097 3.572 1.00 11.21 C ATOM 1882 CG1 VAL A 118 4.756 4.780 4.614 1.00 73.43 C ATOM 1883 CG2 VAL A 118 5.070 2.730 3.207 1.00 4.25 C ATOM 0 H VAL A 118 7.277 3.641 1.756 1.00 51.10 H new ATOM 0 HA VAL A 118 4.817 4.970 1.774 1.00 12.12 H new ATOM 0 HB VAL A 118 6.622 3.955 4.002 1.00 11.21 H new ATOM 0 HG11 VAL A 118 4.674 4.142 5.494 1.00 73.43 H new ATOM 0 HG12 VAL A 118 5.204 5.733 4.897 1.00 73.43 H new ATOM 0 HG13 VAL A 118 3.764 4.955 4.198 1.00 73.43 H new ATOM 0 HG21 VAL A 118 4.983 2.121 4.106 1.00 4.25 H new ATOM 0 HG22 VAL A 118 4.086 2.849 2.753 1.00 4.25 H new ATOM 0 HG23 VAL A 118 5.739 2.240 2.500 1.00 4.25 H new ATOM 1893 N GLN A 119 7.310 6.610 3.223 1.00 52.03 N ATOM 1894 CA GLN A 119 7.746 7.929 3.666 1.00 42.34 C ATOM 1895 C GLN A 119 7.482 8.978 2.590 1.00 63.04 C ATOM 1896 O GLN A 119 7.103 10.111 2.891 1.00 24.30 O ATOM 1897 CB GLN A 119 9.234 7.905 4.018 1.00 1.51 C ATOM 1898 CG GLN A 119 9.511 7.517 5.461 1.00 12.21 C ATOM 1899 CD GLN A 119 10.732 8.212 6.029 1.00 42.00 C ATOM 1900 OE1 GLN A 119 11.071 9.325 5.626 1.00 13.22 O ATOM 1901 NE2 GLN A 119 11.402 7.558 6.971 1.00 33.15 N ATOM 0 H GLN A 119 8.016 5.879 3.316 1.00 52.03 H new ATOM 0 HA GLN A 119 7.174 8.195 4.555 1.00 42.34 H new ATOM 0 HB2 GLN A 119 9.744 7.204 3.358 1.00 1.51 H new ATOM 0 HB3 GLN A 119 9.660 8.890 3.827 1.00 1.51 H new ATOM 0 HG2 GLN A 119 8.642 7.761 6.072 1.00 12.21 H new ATOM 0 HG3 GLN A 119 9.651 6.438 5.522 1.00 12.21 H new ATOM 0 HE21 GLN A 119 11.086 6.637 7.276 1.00 33.15 H new ATOM 0 HE22 GLN A 119 12.233 7.977 7.390 1.00 33.15 H new ATOM 1910 N THR A 120 7.685 8.594 1.333 1.00 72.31 N ATOM 1911 CA THR A 120 7.471 9.501 0.213 1.00 41.31 C ATOM 1912 C THR A 120 6.015 9.944 0.134 1.00 34.20 C ATOM 1913 O THR A 120 5.724 11.119 -0.094 1.00 24.41 O ATOM 1914 CB THR A 120 7.870 8.848 -1.124 1.00 23.42 C ATOM 1915 OG1 THR A 120 9.120 8.164 -0.981 1.00 0.33 O ATOM 1916 CG2 THR A 120 7.980 9.891 -2.224 1.00 43.35 C ATOM 0 H THR A 120 7.997 7.661 1.066 1.00 72.31 H new ATOM 0 HA THR A 120 8.104 10.371 0.387 1.00 41.31 H new ATOM 0 HB THR A 120 7.095 8.133 -1.400 1.00 23.42 H new ATOM 0 HG1 THR A 120 8.968 7.289 -0.567 1.00 0.33 H new ATOM 0 HG21 THR A 120 8.263 9.406 -3.158 1.00 43.35 H new ATOM 0 HG22 THR A 120 7.019 10.389 -2.350 1.00 43.35 H new ATOM 0 HG23 THR A 120 8.737 10.627 -1.953 1.00 43.35 H new ATOM 1924 N ALA A 121 5.102 8.997 0.324 1.00 31.02 N ATOM 1925 CA ALA A 121 3.675 9.290 0.277 1.00 3.34 C ATOM 1926 C ALA A 121 3.227 10.037 1.530 1.00 64.10 C ATOM 1927 O ALA A 121 2.189 10.696 1.531 1.00 71.20 O ATOM 1928 CB ALA A 121 2.877 8.006 0.113 1.00 51.33 C ATOM 0 H ALA A 121 5.326 8.020 0.512 1.00 31.02 H new ATOM 0 HA ALA A 121 3.489 9.932 -0.584 1.00 3.34 H new ATOM 0 HB1 ALA A 121 1.813 8.241 0.080 1.00 51.33 H new ATOM 0 HB2 ALA A 121 3.169 7.512 -0.814 1.00 51.33 H new ATOM 0 HB3 ALA A 121 3.076 7.344 0.956 1.00 51.33 H new ATOM 1934 N GLU A 122 4.019 9.929 2.593 1.00 35.41 N ATOM 1935 CA GLU A 122 3.701 10.594 3.852 1.00 72.44 C ATOM 1936 C GLU A 122 2.520 9.916 4.541 1.00 53.23 C ATOM 1937 O GLU A 122 1.728 10.567 5.224 1.00 50.14 O ATOM 1938 CB GLU A 122 3.384 12.070 3.608 1.00 22.05 C ATOM 1939 CG GLU A 122 3.993 13.002 4.643 1.00 20.00 C ATOM 1940 CD GLU A 122 3.287 14.342 4.710 1.00 73.12 C ATOM 1941 OE1 GLU A 122 3.684 15.258 3.961 1.00 12.50 O ATOM 1942 OE2 GLU A 122 2.337 14.474 5.510 1.00 73.43 O ATOM 0 H GLU A 122 4.884 9.388 2.607 1.00 35.41 H new ATOM 0 HA GLU A 122 4.572 10.520 4.504 1.00 72.44 H new ATOM 0 HB2 GLU A 122 3.746 12.352 2.619 1.00 22.05 H new ATOM 0 HB3 GLU A 122 2.302 12.205 3.602 1.00 22.05 H new ATOM 0 HG2 GLU A 122 3.954 12.526 5.623 1.00 20.00 H new ATOM 0 HG3 GLU A 122 5.045 13.162 4.408 1.00 20.00 H new ATOM 1949 N LEU A 123 2.407 8.605 4.357 1.00 64.22 N ATOM 1950 CA LEU A 123 1.323 7.838 4.961 1.00 23.52 C ATOM 1951 C LEU A 123 1.691 7.395 6.373 1.00 11.23 C ATOM 1952 O LEU A 123 2.218 6.301 6.576 1.00 64.13 O ATOM 1953 CB LEU A 123 0.995 6.617 4.100 1.00 23.12 C ATOM 1954 CG LEU A 123 0.621 6.902 2.645 1.00 13.03 C ATOM 1955 CD1 LEU A 123 1.079 5.766 1.744 1.00 54.52 C ATOM 1956 CD2 LEU A 123 -0.880 7.117 2.514 1.00 52.34 C ATOM 0 H LEU A 123 3.053 8.051 3.794 1.00 64.22 H new ATOM 0 HA LEU A 123 0.444 8.480 5.019 1.00 23.52 H new ATOM 0 HB2 LEU A 123 1.857 5.949 4.109 1.00 23.12 H new ATOM 0 HB3 LEU A 123 0.170 6.079 4.567 1.00 23.12 H new ATOM 0 HG LEU A 123 1.128 7.814 2.331 1.00 13.03 H new ATOM 0 HD11 LEU A 123 0.804 5.986 0.712 1.00 54.52 H new ATOM 0 HD12 LEU A 123 2.161 5.658 1.816 1.00 54.52 H new ATOM 0 HD13 LEU A 123 0.600 4.838 2.057 1.00 54.52 H new ATOM 0 HD21 LEU A 123 -1.129 7.319 1.472 1.00 52.34 H new ATOM 0 HD22 LEU A 123 -1.406 6.222 2.846 1.00 52.34 H new ATOM 0 HD23 LEU A 123 -1.181 7.965 3.130 1.00 52.34 H new ATOM 1968 N THR A 124 1.406 8.251 7.349 1.00 20.12 N ATOM 1969 CA THR A 124 1.705 7.948 8.743 1.00 12.34 C ATOM 1970 C THR A 124 1.128 6.596 9.148 1.00 15.23 C ATOM 1971 O THR A 124 1.689 5.898 9.992 1.00 33.23 O ATOM 1972 CB THR A 124 1.150 9.033 9.686 1.00 43.42 C ATOM 1973 OG1 THR A 124 1.985 10.195 9.639 1.00 3.20 O ATOM 1974 CG2 THR A 124 1.068 8.518 11.115 1.00 12.51 C ATOM 0 H THR A 124 0.968 9.160 7.200 1.00 20.12 H new ATOM 0 HA THR A 124 2.791 7.919 8.834 1.00 12.34 H new ATOM 0 HB THR A 124 0.145 9.294 9.353 1.00 43.42 H new ATOM 0 HG1 THR A 124 1.625 10.881 10.239 1.00 3.20 H new ATOM 0 HG21 THR A 124 0.674 9.301 11.762 1.00 12.51 H new ATOM 0 HG22 THR A 124 0.409 7.651 11.152 1.00 12.51 H new ATOM 0 HG23 THR A 124 2.063 8.232 11.456 1.00 12.51 H new ATOM 1982 N LYS A 125 0.003 6.233 8.542 1.00 62.14 N ATOM 1983 CA LYS A 125 -0.650 4.964 8.837 1.00 73.35 C ATOM 1984 C LYS A 125 -0.267 3.902 7.810 1.00 24.22 C ATOM 1985 O LYS A 125 -0.862 3.818 6.737 1.00 72.30 O ATOM 1986 CB LYS A 125 -2.170 5.141 8.858 1.00 72.13 C ATOM 1987 CG LYS A 125 -2.687 5.810 10.119 1.00 21.24 C ATOM 1988 CD LYS A 125 -4.198 5.698 10.231 1.00 21.04 C ATOM 1989 CE LYS A 125 -4.853 7.066 10.337 1.00 3.41 C ATOM 1990 NZ LYS A 125 -5.061 7.687 8.999 1.00 63.23 N ATOM 0 H LYS A 125 -0.476 6.801 7.843 1.00 62.14 H new ATOM 0 HA LYS A 125 -0.314 4.633 9.820 1.00 73.35 H new ATOM 0 HB2 LYS A 125 -2.470 5.733 7.993 1.00 72.13 H new ATOM 0 HB3 LYS A 125 -2.643 4.164 8.755 1.00 72.13 H new ATOM 0 HG2 LYS A 125 -2.222 5.352 10.992 1.00 21.24 H new ATOM 0 HG3 LYS A 125 -2.398 6.861 10.119 1.00 21.24 H new ATOM 0 HD2 LYS A 125 -4.590 5.172 9.360 1.00 21.04 H new ATOM 0 HD3 LYS A 125 -4.456 5.102 11.106 1.00 21.04 H new ATOM 0 HE2 LYS A 125 -5.812 6.971 10.846 1.00 3.41 H new ATOM 0 HE3 LYS A 125 -4.231 7.720 10.948 1.00 3.41 H new ATOM 0 HZ1 LYS A 125 -5.510 8.618 9.114 1.00 63.23 H new ATOM 0 HZ2 LYS A 125 -4.143 7.801 8.523 1.00 63.23 H new ATOM 0 HZ3 LYS A 125 -5.675 7.076 8.424 1.00 63.23 H new ATOM 2004 N VAL A 126 0.732 3.092 8.149 1.00 43.25 N ATOM 2005 CA VAL A 126 1.194 2.035 7.258 1.00 62.12 C ATOM 2006 C VAL A 126 1.018 0.662 7.897 1.00 72.42 C ATOM 2007 O VAL A 126 1.558 0.391 8.969 1.00 32.25 O ATOM 2008 CB VAL A 126 2.674 2.227 6.880 1.00 63.54 C ATOM 2009 CG1 VAL A 126 3.464 2.758 8.065 1.00 43.52 C ATOM 2010 CG2 VAL A 126 3.269 0.919 6.375 1.00 12.54 C ATOM 0 H VAL A 126 1.236 3.148 9.034 1.00 43.25 H new ATOM 0 HA VAL A 126 0.586 2.093 6.355 1.00 62.12 H new ATOM 0 HB VAL A 126 2.733 2.961 6.077 1.00 63.54 H new ATOM 0 HG11 VAL A 126 4.508 2.887 7.778 1.00 43.52 H new ATOM 0 HG12 VAL A 126 3.052 3.718 8.376 1.00 43.52 H new ATOM 0 HG13 VAL A 126 3.400 2.050 8.892 1.00 43.52 H new ATOM 0 HG21 VAL A 126 4.316 1.073 6.112 1.00 12.54 H new ATOM 0 HG22 VAL A 126 3.198 0.162 7.156 1.00 12.54 H new ATOM 0 HG23 VAL A 126 2.719 0.585 5.495 1.00 12.54 H new ATOM 2020 N PHE A 127 0.259 -0.202 7.230 1.00 13.15 N ATOM 2021 CA PHE A 127 0.010 -1.547 7.733 1.00 25.52 C ATOM 2022 C PHE A 127 0.658 -2.594 6.831 1.00 4.13 C ATOM 2023 O PHE A 127 0.984 -2.316 5.677 1.00 70.31 O ATOM 2024 CB PHE A 127 -1.494 -1.807 7.836 1.00 63.22 C ATOM 2025 CG PHE A 127 -2.258 -0.671 8.453 1.00 41.40 C ATOM 2026 CD1 PHE A 127 -1.820 -0.081 9.628 1.00 42.35 C ATOM 2027 CD2 PHE A 127 -3.412 -0.191 7.857 1.00 73.41 C ATOM 2028 CE1 PHE A 127 -2.521 0.964 10.198 1.00 41.32 C ATOM 2029 CE2 PHE A 127 -4.118 0.855 8.421 1.00 34.13 C ATOM 2030 CZ PHE A 127 -3.671 1.434 9.593 1.00 61.41 C ATOM 0 H PHE A 127 -0.194 0.006 6.340 1.00 13.15 H new ATOM 0 HA PHE A 127 0.453 -1.624 8.726 1.00 25.52 H new ATOM 0 HB2 PHE A 127 -1.890 -2.002 6.839 1.00 63.22 H new ATOM 0 HB3 PHE A 127 -1.659 -2.708 8.426 1.00 63.22 H new ATOM 0 HD1 PHE A 127 -0.920 -0.442 10.104 1.00 42.35 H new ATOM 0 HD2 PHE A 127 -3.765 -0.639 6.940 1.00 73.41 H new ATOM 0 HE1 PHE A 127 -2.171 1.413 11.116 1.00 41.32 H new ATOM 0 HE2 PHE A 127 -5.017 1.219 7.946 1.00 34.13 H new ATOM 0 HZ PHE A 127 -4.219 2.252 10.036 1.00 61.41 H new ATOM 2040 N GLU A 128 0.842 -3.797 7.366 1.00 72.32 N ATOM 2041 CA GLU A 128 1.452 -4.884 6.610 1.00 54.14 C ATOM 2042 C GLU A 128 0.595 -6.145 6.680 1.00 10.44 C ATOM 2043 O GLU A 128 0.298 -6.645 7.766 1.00 53.21 O ATOM 2044 CB GLU A 128 2.857 -5.178 7.140 1.00 33.52 C ATOM 2045 CG GLU A 128 3.611 -6.214 6.322 1.00 3.33 C ATOM 2046 CD GLU A 128 4.232 -7.297 7.182 1.00 44.01 C ATOM 2047 OE1 GLU A 128 3.475 -8.110 7.752 1.00 75.12 O ATOM 2048 OE2 GLU A 128 5.477 -7.331 7.284 1.00 33.43 O ATOM 0 H GLU A 128 0.577 -4.043 8.320 1.00 72.32 H new ATOM 0 HA GLU A 128 1.523 -4.572 5.568 1.00 54.14 H new ATOM 0 HB2 GLU A 128 3.431 -4.252 7.156 1.00 33.52 H new ATOM 0 HB3 GLU A 128 2.782 -5.525 8.171 1.00 33.52 H new ATOM 0 HG2 GLU A 128 2.930 -6.671 5.605 1.00 3.33 H new ATOM 0 HG3 GLU A 128 4.393 -5.718 5.747 1.00 3.33 H new ATOM 2055 N ILE A 129 0.200 -6.651 5.517 1.00 24.23 N ATOM 2056 CA ILE A 129 -0.622 -7.852 5.447 1.00 62.13 C ATOM 2057 C ILE A 129 0.224 -9.078 5.119 1.00 34.44 C ATOM 2058 O ILE A 129 1.028 -9.059 4.189 1.00 25.22 O ATOM 2059 CB ILE A 129 -1.734 -7.712 4.391 1.00 22.25 C ATOM 2060 CG1 ILE A 129 -1.154 -7.204 3.071 1.00 71.54 C ATOM 2061 CG2 ILE A 129 -2.824 -6.777 4.892 1.00 55.24 C ATOM 2062 CD1 ILE A 129 -2.054 -7.450 1.880 1.00 43.43 C ATOM 0 H ILE A 129 0.436 -6.248 4.610 1.00 24.23 H new ATOM 0 HA ILE A 129 -1.079 -7.980 6.428 1.00 62.13 H new ATOM 0 HB ILE A 129 -2.175 -8.693 4.217 1.00 22.25 H new ATOM 0 HG12 ILE A 129 -0.962 -6.134 3.156 1.00 71.54 H new ATOM 0 HG13 ILE A 129 -0.193 -7.688 2.896 1.00 71.54 H new ATOM 0 HG21 ILE A 129 -3.603 -6.688 4.135 1.00 55.24 H new ATOM 0 HG22 ILE A 129 -3.254 -7.178 5.810 1.00 55.24 H new ATOM 0 HG23 ILE A 129 -2.397 -5.794 5.091 1.00 55.24 H new ATOM 0 HD11 ILE A 129 -1.578 -7.064 0.979 1.00 43.43 H new ATOM 0 HD12 ILE A 129 -2.226 -8.521 1.769 1.00 43.43 H new ATOM 0 HD13 ILE A 129 -3.007 -6.943 2.033 1.00 43.43 H new ATOM 2074 N ARG A 130 0.032 -10.145 5.890 1.00 63.05 N ATOM 2075 CA ARG A 130 0.776 -11.381 5.681 1.00 32.20 C ATOM 2076 C ARG A 130 0.259 -12.126 4.453 1.00 32.42 C ATOM 2077 O ARG A 130 0.922 -13.025 3.934 1.00 75.13 O ATOM 2078 CB ARG A 130 0.673 -12.278 6.915 1.00 33.24 C ATOM 2079 CG ARG A 130 1.246 -13.670 6.706 1.00 11.02 C ATOM 2080 CD ARG A 130 2.753 -13.628 6.509 1.00 63.52 C ATOM 2081 NE ARG A 130 3.476 -13.817 7.764 1.00 73.52 N ATOM 2082 CZ ARG A 130 3.615 -14.995 8.362 1.00 62.25 C ATOM 2083 NH1 ARG A 130 3.086 -16.084 7.820 1.00 33.05 N ATOM 2084 NH2 ARG A 130 4.287 -15.087 9.503 1.00 50.33 N ATOM 0 H ARG A 130 -0.632 -10.177 6.664 1.00 63.05 H new ATOM 0 HA ARG A 130 1.822 -11.122 5.514 1.00 32.20 H new ATOM 0 HB2 ARG A 130 1.194 -11.801 7.745 1.00 33.24 H new ATOM 0 HB3 ARG A 130 -0.374 -12.365 7.204 1.00 33.24 H new ATOM 0 HG2 ARG A 130 1.008 -14.296 7.566 1.00 11.02 H new ATOM 0 HG3 ARG A 130 0.777 -14.131 5.837 1.00 11.02 H new ATOM 0 HD2 ARG A 130 3.047 -14.403 5.801 1.00 63.52 H new ATOM 0 HD3 ARG A 130 3.034 -12.671 6.069 1.00 63.52 H new ATOM 0 HE ARG A 130 3.897 -13.000 8.205 1.00 73.52 H new ATOM 0 HH11 ARG A 130 2.571 -16.018 6.942 1.00 33.05 H new ATOM 0 HH12 ARG A 130 3.194 -16.987 8.281 1.00 33.05 H new ATOM 0 HH21 ARG A 130 4.697 -14.252 9.922 1.00 50.33 H new ATOM 0 HH22 ARG A 130 4.393 -15.992 9.961 1.00 50.33 H new ATOM 2098 N THR A 131 -0.929 -11.747 3.993 1.00 34.42 N ATOM 2099 CA THR A 131 -1.536 -12.379 2.829 1.00 73.23 C ATOM 2100 C THR A 131 -2.789 -11.631 2.387 1.00 25.22 C ATOM 2101 O THR A 131 -3.564 -11.152 3.216 1.00 42.21 O ATOM 2102 CB THR A 131 -1.903 -13.847 3.115 1.00 71.54 C ATOM 2103 OG1 THR A 131 -2.714 -14.366 2.054 1.00 45.34 O ATOM 2104 CG2 THR A 131 -2.646 -13.973 4.436 1.00 72.33 C ATOM 0 H THR A 131 -1.490 -11.004 4.410 1.00 34.42 H new ATOM 0 HA THR A 131 -0.796 -12.346 2.030 1.00 73.23 H new ATOM 0 HB THR A 131 -0.979 -14.422 3.180 1.00 71.54 H new ATOM 0 HG1 THR A 131 -2.941 -15.300 2.243 1.00 45.34 H new ATOM 0 HG21 THR A 131 -2.894 -15.019 4.616 1.00 72.33 H new ATOM 0 HG22 THR A 131 -2.015 -13.606 5.245 1.00 72.33 H new ATOM 0 HG23 THR A 131 -3.563 -13.384 4.396 1.00 72.33 H new ATOM 2112 N THR A 132 -2.984 -11.536 1.076 1.00 43.43 N ATOM 2113 CA THR A 132 -4.142 -10.846 0.524 1.00 52.44 C ATOM 2114 C THR A 132 -5.366 -11.027 1.414 1.00 53.30 C ATOM 2115 O THR A 132 -6.025 -10.055 1.786 1.00 2.13 O ATOM 2116 CB THR A 132 -4.474 -11.350 -0.894 1.00 44.43 C ATOM 2117 OG1 THR A 132 -4.503 -12.781 -0.911 1.00 41.41 O ATOM 2118 CG2 THR A 132 -3.450 -10.846 -1.900 1.00 41.24 C ATOM 0 H THR A 132 -2.354 -11.929 0.376 1.00 43.43 H new ATOM 0 HA THR A 132 -3.885 -9.788 0.475 1.00 52.44 H new ATOM 0 HB THR A 132 -5.455 -10.964 -1.173 1.00 44.43 H new ATOM 0 HG1 THR A 132 -4.716 -13.093 -1.815 1.00 41.41 H new ATOM 0 HG21 THR A 132 -3.705 -11.214 -2.894 1.00 41.24 H new ATOM 0 HG22 THR A 132 -3.451 -9.756 -1.906 1.00 41.24 H new ATOM 0 HG23 THR A 132 -2.459 -11.206 -1.622 1.00 41.24 H new ATOM 2126 N ASP A 133 -5.666 -12.276 1.752 1.00 43.42 N ATOM 2127 CA ASP A 133 -6.810 -12.584 2.601 1.00 71.43 C ATOM 2128 C ASP A 133 -7.003 -11.509 3.667 1.00 63.15 C ATOM 2129 O ASP A 133 -8.113 -11.020 3.875 1.00 71.40 O ATOM 2130 CB ASP A 133 -6.627 -13.951 3.265 1.00 41.12 C ATOM 2131 CG ASP A 133 -7.678 -14.952 2.829 1.00 2.24 C ATOM 2132 OD1 ASP A 133 -7.612 -15.417 1.673 1.00 53.45 O ATOM 2133 OD2 ASP A 133 -8.566 -15.272 3.646 1.00 14.12 O ATOM 0 H ASP A 133 -5.133 -13.092 1.451 1.00 43.42 H new ATOM 0 HA ASP A 133 -7.700 -12.610 1.972 1.00 71.43 H new ATOM 0 HB2 ASP A 133 -5.638 -14.339 3.024 1.00 41.12 H new ATOM 0 HB3 ASP A 133 -6.668 -13.834 4.348 1.00 41.12 H new ATOM 2138 N ASP A 134 -5.915 -11.147 4.337 1.00 70.12 N ATOM 2139 CA ASP A 134 -5.963 -10.129 5.380 1.00 64.12 C ATOM 2140 C ASP A 134 -6.767 -8.918 4.921 1.00 52.42 C ATOM 2141 O ASP A 134 -7.654 -8.443 5.631 1.00 12.30 O ATOM 2142 CB ASP A 134 -4.547 -9.699 5.769 1.00 22.41 C ATOM 2143 CG ASP A 134 -4.302 -9.799 7.262 1.00 31.04 C ATOM 2144 OD1 ASP A 134 -4.690 -8.862 7.992 1.00 73.24 O ATOM 2145 OD2 ASP A 134 -3.722 -10.814 7.701 1.00 2.32 O ATOM 0 H ASP A 134 -4.989 -11.543 4.177 1.00 70.12 H new ATOM 0 HA ASP A 134 -6.456 -10.560 6.251 1.00 64.12 H new ATOM 0 HB2 ASP A 134 -3.824 -10.322 5.242 1.00 22.41 H new ATOM 0 HB3 ASP A 134 -4.380 -8.672 5.444 1.00 22.41 H new ATOM 2150 N LEU A 135 -6.452 -8.421 3.730 1.00 54.23 N ATOM 2151 CA LEU A 135 -7.146 -7.263 3.175 1.00 63.14 C ATOM 2152 C LEU A 135 -8.653 -7.494 3.146 1.00 42.32 C ATOM 2153 O LEU A 135 -9.202 -7.962 2.148 1.00 51.22 O ATOM 2154 CB LEU A 135 -6.636 -6.967 1.763 1.00 21.22 C ATOM 2155 CG LEU A 135 -7.406 -5.903 0.981 1.00 73.42 C ATOM 2156 CD1 LEU A 135 -7.891 -4.803 1.911 1.00 1.13 C ATOM 2157 CD2 LEU A 135 -6.541 -5.325 -0.128 1.00 64.23 C ATOM 0 H LEU A 135 -5.720 -8.801 3.130 1.00 54.23 H new ATOM 0 HA LEU A 135 -6.941 -6.405 3.816 1.00 63.14 H new ATOM 0 HB2 LEU A 135 -5.594 -6.655 1.833 1.00 21.22 H new ATOM 0 HB3 LEU A 135 -6.654 -7.894 1.190 1.00 21.22 H new ATOM 0 HG LEU A 135 -8.277 -6.374 0.525 1.00 73.42 H new ATOM 0 HD11 LEU A 135 -8.437 -4.055 1.336 1.00 1.13 H new ATOM 0 HD12 LEU A 135 -8.549 -5.230 2.668 1.00 1.13 H new ATOM 0 HD13 LEU A 135 -7.035 -4.334 2.397 1.00 1.13 H new ATOM 0 HD21 LEU A 135 -7.106 -4.569 -0.674 1.00 64.23 H new ATOM 0 HD22 LEU A 135 -5.650 -4.870 0.305 1.00 64.23 H new ATOM 0 HD23 LEU A 135 -6.246 -6.121 -0.811 1.00 64.23 H new ATOM 2169 N THR A 136 -9.319 -7.159 4.247 1.00 31.14 N ATOM 2170 CA THR A 136 -10.762 -7.327 4.348 1.00 61.25 C ATOM 2171 C THR A 136 -11.432 -6.049 4.835 1.00 13.23 C ATOM 2172 O THR A 136 -10.883 -5.329 5.669 1.00 52.21 O ATOM 2173 CB THR A 136 -11.128 -8.481 5.301 1.00 2.35 C ATOM 2174 OG1 THR A 136 -10.106 -8.638 6.294 1.00 55.25 O ATOM 2175 CG2 THR A 136 -11.302 -9.783 4.535 1.00 1.40 C ATOM 0 H THR A 136 -8.881 -6.769 5.082 1.00 31.14 H new ATOM 0 HA THR A 136 -11.123 -7.564 3.347 1.00 61.25 H new ATOM 0 HB THR A 136 -12.073 -8.236 5.786 1.00 2.35 H new ATOM 0 HG1 THR A 136 -9.271 -8.917 5.863 1.00 55.25 H new ATOM 0 HG21 THR A 136 -11.560 -10.582 5.230 1.00 1.40 H new ATOM 0 HG22 THR A 136 -12.099 -9.669 3.801 1.00 1.40 H new ATOM 0 HG23 THR A 136 -10.372 -10.032 4.025 1.00 1.40 H new ATOM 2183 N GLU A 137 -12.622 -5.772 4.310 1.00 24.42 N ATOM 2184 CA GLU A 137 -13.367 -4.579 4.693 1.00 5.33 C ATOM 2185 C GLU A 137 -13.234 -4.310 6.189 1.00 30.54 C ATOM 2186 O GLU A 137 -12.971 -3.183 6.610 1.00 31.11 O ATOM 2187 CB GLU A 137 -14.842 -4.729 4.320 1.00 73.11 C ATOM 2188 CG GLU A 137 -15.652 -3.457 4.510 1.00 33.53 C ATOM 2189 CD GLU A 137 -17.136 -3.728 4.665 1.00 51.34 C ATOM 2190 OE1 GLU A 137 -17.763 -4.173 3.681 1.00 54.35 O ATOM 2191 OE2 GLU A 137 -17.670 -3.495 5.769 1.00 52.51 O ATOM 0 H GLU A 137 -13.090 -6.358 3.619 1.00 24.42 H new ATOM 0 HA GLU A 137 -12.947 -3.732 4.151 1.00 5.33 H new ATOM 0 HB2 GLU A 137 -14.914 -5.043 3.279 1.00 73.11 H new ATOM 0 HB3 GLU A 137 -15.282 -5.523 4.924 1.00 73.11 H new ATOM 0 HG2 GLU A 137 -15.289 -2.928 5.391 1.00 33.53 H new ATOM 0 HG3 GLU A 137 -15.494 -2.799 3.656 1.00 33.53 H new ATOM 2198 N THR A 138 -13.417 -5.356 6.990 1.00 31.23 N ATOM 2199 CA THR A 138 -13.320 -5.235 8.439 1.00 5.23 C ATOM 2200 C THR A 138 -11.881 -4.984 8.875 1.00 40.42 C ATOM 2201 O THR A 138 -11.575 -3.951 9.473 1.00 45.04 O ATOM 2202 CB THR A 138 -13.844 -6.500 9.145 1.00 65.33 C ATOM 2203 OG1 THR A 138 -15.104 -6.886 8.586 1.00 21.34 O ATOM 2204 CG2 THR A 138 -13.997 -6.262 10.640 1.00 53.31 C ATOM 0 H THR A 138 -13.633 -6.296 6.659 1.00 31.23 H new ATOM 0 HA THR A 138 -13.938 -4.384 8.727 1.00 5.23 H new ATOM 0 HB THR A 138 -13.120 -7.300 8.994 1.00 65.33 H new ATOM 0 HG1 THR A 138 -15.430 -7.692 9.039 1.00 21.34 H new ATOM 0 HG21 THR A 138 -14.368 -7.169 11.117 1.00 53.31 H new ATOM 0 HG22 THR A 138 -13.030 -5.997 11.067 1.00 53.31 H new ATOM 0 HG23 THR A 138 -14.703 -5.449 10.809 1.00 53.31 H new ATOM 2212 N TRP A 139 -11.002 -5.932 8.571 1.00 5.51 N ATOM 2213 CA TRP A 139 -9.594 -5.811 8.931 1.00 5.02 C ATOM 2214 C TRP A 139 -9.082 -4.398 8.667 1.00 72.24 C ATOM 2215 O TRP A 139 -8.102 -3.959 9.271 1.00 54.44 O ATOM 2216 CB TRP A 139 -8.757 -6.824 8.148 1.00 62.11 C ATOM 2217 CG TRP A 139 -7.288 -6.529 8.176 1.00 0.40 C ATOM 2218 CD1 TRP A 139 -6.371 -7.015 9.064 1.00 62.14 C ATOM 2219 CD2 TRP A 139 -6.567 -5.679 7.277 1.00 53.22 C ATOM 2220 NE1 TRP A 139 -5.123 -6.519 8.770 1.00 13.44 N ATOM 2221 CE2 TRP A 139 -5.217 -5.697 7.677 1.00 33.23 C ATOM 2222 CE3 TRP A 139 -6.930 -4.907 6.170 1.00 21.15 C ATOM 2223 CZ2 TRP A 139 -4.233 -4.972 7.011 1.00 33.03 C ATOM 2224 CZ3 TRP A 139 -5.952 -4.187 5.510 1.00 13.14 C ATOM 2225 CH2 TRP A 139 -4.617 -4.224 5.932 1.00 1.13 C ATOM 0 H TRP A 139 -11.239 -6.792 8.077 1.00 5.51 H new ATOM 0 HA TRP A 139 -9.499 -6.018 9.997 1.00 5.02 H new ATOM 0 HB2 TRP A 139 -8.928 -7.820 8.557 1.00 62.11 H new ATOM 0 HB3 TRP A 139 -9.097 -6.842 7.113 1.00 62.11 H new ATOM 0 HD1 TRP A 139 -6.594 -7.690 9.877 1.00 62.14 H new ATOM 0 HE1 TRP A 139 -4.266 -6.729 9.282 1.00 13.44 H new ATOM 0 HE3 TRP A 139 -7.957 -4.874 5.836 1.00 21.15 H new ATOM 0 HZ2 TRP A 139 -3.203 -4.999 7.335 1.00 33.03 H new ATOM 0 HZ3 TRP A 139 -6.222 -3.586 4.654 1.00 13.14 H new ATOM 0 HH2 TRP A 139 -3.876 -3.651 5.395 1.00 1.13 H new ATOM 2236 N LEU A 140 -9.752 -3.692 7.763 1.00 60.14 N ATOM 2237 CA LEU A 140 -9.365 -2.328 7.419 1.00 74.33 C ATOM 2238 C LEU A 140 -10.007 -1.323 8.371 1.00 73.35 C ATOM 2239 O LEU A 140 -9.320 -0.667 9.153 1.00 11.44 O ATOM 2240 CB LEU A 140 -9.768 -2.011 5.978 1.00 52.11 C ATOM 2241 CG LEU A 140 -9.829 -0.528 5.608 1.00 21.12 C ATOM 2242 CD1 LEU A 140 -8.508 0.155 5.925 1.00 62.41 C ATOM 2243 CD2 LEU A 140 -10.179 -0.359 4.137 1.00 21.52 C ATOM 0 H LEU A 140 -10.565 -4.041 7.255 1.00 60.14 H new ATOM 0 HA LEU A 140 -8.282 -2.249 7.513 1.00 74.33 H new ATOM 0 HB2 LEU A 140 -9.063 -2.503 5.308 1.00 52.11 H new ATOM 0 HB3 LEU A 140 -10.747 -2.452 5.790 1.00 52.11 H new ATOM 0 HG LEU A 140 -10.611 -0.056 6.203 1.00 21.12 H new ATOM 0 HD11 LEU A 140 -8.570 1.209 5.655 1.00 62.41 H new ATOM 0 HD12 LEU A 140 -8.298 0.065 6.991 1.00 62.41 H new ATOM 0 HD13 LEU A 140 -7.708 -0.319 5.356 1.00 62.41 H new ATOM 0 HD21 LEU A 140 -10.218 0.702 3.892 1.00 21.52 H new ATOM 0 HD22 LEU A 140 -9.420 -0.845 3.524 1.00 21.52 H new ATOM 0 HD23 LEU A 140 -11.150 -0.813 3.940 1.00 21.52 H new ATOM 2255 N LYS A 141 -11.329 -1.211 8.301 1.00 42.05 N ATOM 2256 CA LYS A 141 -12.065 -0.290 9.157 1.00 0.42 C ATOM 2257 C LYS A 141 -11.659 -0.463 10.618 1.00 50.30 C ATOM 2258 O LYS A 141 -11.903 0.414 11.446 1.00 51.00 O ATOM 2259 CB LYS A 141 -13.572 -0.514 9.006 1.00 3.44 C ATOM 2260 CG LYS A 141 -14.223 0.405 7.987 1.00 13.24 C ATOM 2261 CD LYS A 141 -15.377 -0.282 7.275 1.00 64.35 C ATOM 2262 CE LYS A 141 -16.721 0.206 7.791 1.00 14.23 C ATOM 2263 NZ LYS A 141 -17.314 -0.741 8.776 1.00 22.24 N ATOM 0 H LYS A 141 -11.913 -1.748 7.659 1.00 42.05 H new ATOM 0 HA LYS A 141 -11.822 0.727 8.848 1.00 0.42 H new ATOM 0 HB2 LYS A 141 -13.750 -1.549 8.715 1.00 3.44 H new ATOM 0 HB3 LYS A 141 -14.052 -0.368 9.974 1.00 3.44 H new ATOM 0 HG2 LYS A 141 -14.585 1.304 8.485 1.00 13.24 H new ATOM 0 HG3 LYS A 141 -13.480 0.723 7.255 1.00 13.24 H new ATOM 0 HD2 LYS A 141 -15.308 -0.095 6.203 1.00 64.35 H new ATOM 0 HD3 LYS A 141 -15.302 -1.360 7.415 1.00 64.35 H new ATOM 0 HE2 LYS A 141 -16.598 1.184 8.256 1.00 14.23 H new ATOM 0 HE3 LYS A 141 -17.406 0.335 6.953 1.00 14.23 H new ATOM 0 HZ1 LYS A 141 -18.230 -0.373 9.104 1.00 22.24 H new ATOM 0 HZ2 LYS A 141 -17.455 -1.668 8.325 1.00 22.24 H new ATOM 0 HZ3 LYS A 141 -16.672 -0.845 9.587 1.00 22.24 H new ATOM 2277 N GLU A 142 -11.038 -1.597 10.924 1.00 70.44 N ATOM 2278 CA GLU A 142 -10.598 -1.883 12.284 1.00 4.24 C ATOM 2279 C GLU A 142 -9.439 -0.975 12.683 1.00 5.41 C ATOM 2280 O GLU A 142 -9.504 -0.272 13.692 1.00 45.10 O ATOM 2281 CB GLU A 142 -10.177 -3.349 12.411 1.00 14.12 C ATOM 2282 CG GLU A 142 -11.334 -4.290 12.707 1.00 51.21 C ATOM 2283 CD GLU A 142 -10.891 -5.552 13.422 1.00 5.31 C ATOM 2284 OE1 GLU A 142 -10.325 -5.438 14.530 1.00 50.13 O ATOM 2285 OE2 GLU A 142 -11.108 -6.652 12.874 1.00 13.01 O ATOM 0 H GLU A 142 -10.828 -2.332 10.249 1.00 70.44 H new ATOM 0 HA GLU A 142 -11.435 -1.693 12.956 1.00 4.24 H new ATOM 0 HB2 GLU A 142 -9.693 -3.661 11.485 1.00 14.12 H new ATOM 0 HB3 GLU A 142 -9.435 -3.438 13.204 1.00 14.12 H new ATOM 0 HG2 GLU A 142 -12.073 -3.771 13.318 1.00 51.21 H new ATOM 0 HG3 GLU A 142 -11.826 -4.560 11.773 1.00 51.21 H new ATOM 2292 N LYS A 143 -8.376 -0.994 11.884 1.00 15.23 N ATOM 2293 CA LYS A 143 -7.202 -0.173 12.151 1.00 22.25 C ATOM 2294 C LYS A 143 -7.569 1.307 12.185 1.00 51.41 C ATOM 2295 O LYS A 143 -7.037 2.072 12.992 1.00 74.40 O ATOM 2296 CB LYS A 143 -6.129 -0.420 11.089 1.00 53.44 C ATOM 2297 CG LYS A 143 -5.775 -1.885 10.911 1.00 21.02 C ATOM 2298 CD LYS A 143 -4.345 -2.169 11.341 1.00 33.25 C ATOM 2299 CE LYS A 143 -3.738 -3.308 10.537 1.00 25.13 C ATOM 2300 NZ LYS A 143 -2.278 -3.453 10.796 1.00 31.14 N ATOM 0 H LYS A 143 -8.305 -1.570 11.045 1.00 15.23 H new ATOM 0 HA LYS A 143 -6.808 -0.453 13.128 1.00 22.25 H new ATOM 0 HB2 LYS A 143 -6.475 -0.020 10.136 1.00 53.44 H new ATOM 0 HB3 LYS A 143 -5.229 0.132 11.359 1.00 53.44 H new ATOM 0 HG2 LYS A 143 -6.460 -2.499 11.495 1.00 21.02 H new ATOM 0 HG3 LYS A 143 -5.905 -2.167 9.866 1.00 21.02 H new ATOM 0 HD2 LYS A 143 -3.741 -1.271 11.215 1.00 33.25 H new ATOM 0 HD3 LYS A 143 -4.326 -2.420 12.402 1.00 33.25 H new ATOM 0 HE2 LYS A 143 -4.246 -4.240 10.787 1.00 25.13 H new ATOM 0 HE3 LYS A 143 -3.903 -3.130 9.474 1.00 25.13 H new ATOM 0 HZ1 LYS A 143 -1.891 -4.206 10.192 1.00 31.14 H new ATOM 0 HZ2 LYS A 143 -1.797 -2.556 10.582 1.00 31.14 H new ATOM 0 HZ3 LYS A 143 -2.125 -3.698 11.795 1.00 31.14 H new ATOM 2314 N LEU A 144 -8.482 1.706 11.306 1.00 70.13 N ATOM 2315 CA LEU A 144 -8.921 3.094 11.235 1.00 12.42 C ATOM 2316 C LEU A 144 -9.786 3.454 12.440 1.00 45.02 C ATOM 2317 O LEU A 144 -9.599 4.500 13.061 1.00 21.15 O ATOM 2318 CB LEU A 144 -9.702 3.339 9.943 1.00 73.03 C ATOM 2319 CG LEU A 144 -9.124 2.700 8.679 1.00 33.24 C ATOM 2320 CD1 LEU A 144 -10.084 2.865 7.512 1.00 61.23 C ATOM 2321 CD2 LEU A 144 -7.769 3.307 8.347 1.00 22.15 C ATOM 0 H LEU A 144 -8.933 1.087 10.632 1.00 70.13 H new ATOM 0 HA LEU A 144 -8.035 3.729 11.243 1.00 12.42 H new ATOM 0 HB2 LEU A 144 -10.718 2.970 10.081 1.00 73.03 H new ATOM 0 HB3 LEU A 144 -9.772 4.415 9.783 1.00 73.03 H new ATOM 0 HG LEU A 144 -8.987 1.634 8.863 1.00 33.24 H new ATOM 0 HD11 LEU A 144 -9.657 2.405 6.621 1.00 61.23 H new ATOM 0 HD12 LEU A 144 -11.032 2.383 7.750 1.00 61.23 H new ATOM 0 HD13 LEU A 144 -10.253 3.926 7.327 1.00 61.23 H new ATOM 0 HD21 LEU A 144 -7.373 2.841 7.445 1.00 22.15 H new ATOM 0 HD22 LEU A 144 -7.881 4.379 8.182 1.00 22.15 H new ATOM 0 HD23 LEU A 144 -7.081 3.137 9.175 1.00 22.15 H new ATOM 2333 N ALA A 145 -10.731 2.578 12.766 1.00 31.01 N ATOM 2334 CA ALA A 145 -11.621 2.801 13.899 1.00 71.24 C ATOM 2335 C ALA A 145 -10.888 3.486 15.047 1.00 63.54 C ATOM 2336 O ALA A 145 -11.120 4.661 15.332 1.00 70.22 O ATOM 2337 CB ALA A 145 -12.222 1.483 14.365 1.00 42.24 C ATOM 0 H ALA A 145 -10.900 1.708 12.262 1.00 31.01 H new ATOM 0 HA ALA A 145 -12.426 3.460 13.573 1.00 71.24 H new ATOM 0 HB1 ALA A 145 -12.884 1.664 15.211 1.00 42.24 H new ATOM 0 HB2 ALA A 145 -12.789 1.033 13.550 1.00 42.24 H new ATOM 0 HB3 ALA A 145 -11.423 0.806 14.668 1.00 42.24 H new ATOM 2343 N SER A 146 -10.002 2.744 15.703 1.00 3.34 N ATOM 2344 CA SER A 146 -9.237 3.279 16.824 1.00 10.12 C ATOM 2345 C SER A 146 -8.115 2.324 17.221 1.00 1.54 C ATOM 2346 O SER A 146 -7.807 2.167 18.402 1.00 54.41 O ATOM 2347 CB SER A 146 -10.156 3.531 18.021 1.00 64.12 C ATOM 2348 OG SER A 146 -9.799 4.726 18.695 1.00 71.20 O ATOM 0 H SER A 146 -9.796 1.771 15.478 1.00 3.34 H new ATOM 0 HA SER A 146 -8.792 4.224 16.511 1.00 10.12 H new ATOM 0 HB2 SER A 146 -11.190 3.596 17.682 1.00 64.12 H new ATOM 0 HB3 SER A 146 -10.099 2.689 18.711 1.00 64.12 H new ATOM 0 HG SER A 146 -10.402 4.866 19.455 1.00 71.20 H new ATOM 2354 N GLY A 147 -7.507 1.688 16.224 1.00 25.13 N ATOM 2355 CA GLY A 147 -6.426 0.757 16.489 1.00 72.01 C ATOM 2356 C GLY A 147 -5.354 1.350 17.381 1.00 14.11 C ATOM 2357 O GLY A 147 -5.264 2.565 17.556 1.00 54.53 O ATOM 0 H GLY A 147 -7.744 1.801 15.238 1.00 25.13 H new ATOM 0 HA2 GLY A 147 -6.830 -0.139 16.959 1.00 72.01 H new ATOM 0 HA3 GLY A 147 -5.978 0.447 15.545 1.00 72.01 H new ATOM 2361 N PRO A 148 -4.518 0.481 17.967 1.00 63.14 N ATOM 2362 CA PRO A 148 -3.432 0.903 18.857 1.00 75.12 C ATOM 2363 C PRO A 148 -2.316 1.624 18.109 1.00 41.11 C ATOM 2364 O PRO A 148 -1.550 1.004 17.370 1.00 12.30 O ATOM 2365 CB PRO A 148 -2.920 -0.415 19.441 1.00 30.20 C ATOM 2366 CG PRO A 148 -3.278 -1.444 18.426 1.00 64.44 C ATOM 2367 CD PRO A 148 -4.566 -0.982 17.803 1.00 22.14 C ATOM 0 HA PRO A 148 -3.774 1.614 19.609 1.00 75.12 H new ATOM 0 HB2 PRO A 148 -1.843 -0.382 19.608 1.00 30.20 H new ATOM 0 HB3 PRO A 148 -3.386 -0.629 20.403 1.00 30.20 H new ATOM 0 HG2 PRO A 148 -2.494 -1.540 17.675 1.00 64.44 H new ATOM 0 HG3 PRO A 148 -3.398 -2.423 18.889 1.00 64.44 H new ATOM 0 HD2 PRO A 148 -4.629 -1.267 16.753 1.00 22.14 H new ATOM 0 HD3 PRO A 148 -5.432 -1.414 18.303 1.00 22.14 H new ATOM 2375 N SER A 149 -2.229 2.936 18.305 1.00 33.12 N ATOM 2376 CA SER A 149 -1.208 3.742 17.647 1.00 72.13 C ATOM 2377 C SER A 149 -0.528 4.676 18.642 1.00 22.30 C ATOM 2378 O SER A 149 -1.191 5.363 19.418 1.00 24.11 O ATOM 2379 CB SER A 149 -1.826 4.554 16.507 1.00 0.34 C ATOM 2380 OG SER A 149 -2.733 5.523 17.005 1.00 74.23 O ATOM 0 H SER A 149 -2.854 3.463 18.915 1.00 33.12 H new ATOM 0 HA SER A 149 -0.456 3.068 17.237 1.00 72.13 H new ATOM 0 HB2 SER A 149 -1.038 5.047 15.939 1.00 0.34 H new ATOM 0 HB3 SER A 149 -2.344 3.886 15.819 1.00 0.34 H new ATOM 0 HG SER A 149 -3.113 6.030 16.257 1.00 74.23 H new ATOM 2386 N SER A 150 0.801 4.695 18.612 1.00 43.32 N ATOM 2387 CA SER A 150 1.574 5.542 19.514 1.00 52.41 C ATOM 2388 C SER A 150 2.477 6.489 18.729 1.00 2.11 C ATOM 2389 O SER A 150 3.488 6.076 18.166 1.00 65.24 O ATOM 2390 CB SER A 150 2.415 4.683 20.459 1.00 22.44 C ATOM 2391 OG SER A 150 3.381 3.934 19.743 1.00 62.02 O ATOM 0 H SER A 150 1.365 4.134 17.973 1.00 43.32 H new ATOM 0 HA SER A 150 0.875 6.138 20.102 1.00 52.41 H new ATOM 0 HB2 SER A 150 2.913 5.321 21.189 1.00 22.44 H new ATOM 0 HB3 SER A 150 1.766 4.007 21.016 1.00 22.44 H new ATOM 0 HG SER A 150 3.585 4.386 18.898 1.00 62.02 H new ATOM 2397 N GLY A 151 2.102 7.764 18.698 1.00 40.34 N ATOM 2398 CA GLY A 151 2.888 8.752 17.981 1.00 31.30 C ATOM 2399 C GLY A 151 4.376 8.588 18.214 1.00 3.20 C ATOM 2400 O GLY A 151 5.165 8.599 17.268 1.00 35.11 O ATOM 0 H GLY A 151 1.268 8.131 19.157 1.00 40.34 H new ATOM 0 HA2 GLY A 151 2.679 8.673 16.914 1.00 31.30 H new ATOM 0 HA3 GLY A 151 2.582 9.751 18.293 1.00 31.30 H new TER 2404 GLY A 151