USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1324 hydrogens (29 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 145 SER OG : rot 177:sc= 1.15! USER MOD Set 1.2: A 148 THR OG1 : rot 27:sc= -0.019 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.662 K(o=1.1,f=-6.2!) USER MOD Set 2.2: A 137 TYR OH : rot -39:sc= 0.416 USER MOD Set 3.1: A 86 ASN : amide:sc= 0.179 K(o=-0.78,f=-1.6) USER MOD Set 3.2: A 89 SER OG : rot -60:sc= -0.96 USER MOD Set 4.1: A 87 THR OG1 : rot -33:sc= 1.19 USER MOD Set 4.2: A 124 THR OG1 : rot -62:sc= 1.83 USER MOD Set 5.1: A 25 GLN : amide:sc= -0.924 K(o=-3.6,f=-5.6!) USER MOD Set 5.2: A 27 HIS : no HD1:sc= -2.71 X(o=-3.6,f=-3.4) USER MOD Set 6.1: A 1 MET CE :methyl -163:sc= -2.32! (180deg=-2) USER MOD Set 6.2: A 43 GLN : amide:sc= -0.521 K(o=-2.8,f=-6.6!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 177:sc= 0.00142 (180deg=-0.0112) USER MOD Single : A 20 THR OG1 : rot 97:sc= 1.15 USER MOD Single : A 22 GLN : amide:sc= -1.16 K(o=-1.2,f=-4.2) USER MOD Single : A 26 ASN : amide:sc= -1.38 X(o=-1.4,f=-1.5) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -52:sc= 0.0483 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= -0.059 USER MOD Single : A 42 LYS NZ :NH3+ 158:sc= 0.304 (180deg=0.132) USER MOD Single : A 50 THR OG1 : rot 180:sc= -1.14 USER MOD Single : A 51 CYS SG : rot 8:sc= -1.05 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.408 X(o=-0.41,f=-0.1) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0617 USER MOD Single : A 67 MET CE :methyl -109:sc= -7.65! (180deg=-12.3!) USER MOD Single : A 70 GLN : amide:sc= -3.59! C(o=-3.6!,f=-4.9!) USER MOD Single : A 71 TYR OH : rot 30:sc= -0.45 USER MOD Single : A 72 MET CE :methyl -127:sc= -0.292 (180deg=-1.02) USER MOD Single : A 74 THR OG1 : rot -1:sc= -0.959! USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -3.4 K(o=-3.4,f=-7!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.28 X(o=-0.28,f=0) USER MOD Single : A 96 TYR OH : rot 130:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.411 K(o=0.41,f=-0.16) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -155:sc= -5.36! (180deg=-10!) USER MOD Single : A 116 ASN : amide:sc= -5.23! C(o=-5.2!,f=-17!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot -34:sc= 0.00162 USER MOD Single : A 127 SER OG : rot 180:sc= 0.0221 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc=-0.00611 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 147:sc= 0.177 USER MOD Single : A 158 THR OG1 : rot 83:sc= -0.292 USER MOD Single : A 165 GLN : amide:sc= 0.362 X(o=0.36,f=0) USER MOD Single : A 166 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 201 GNP O2' : rot 180:sc= 0 USER MOD Single : A 201 GNP O3' : rot 136:sc= 0.104 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.613 -2.410 22.662 1.00 0.00 N ATOM 2 CA MET A 1 -1.914 -2.375 21.351 1.00 52.33 C ATOM 3 C MET A 1 -2.234 -3.615 20.523 1.00 64.14 C ATOM 4 O MET A 1 -2.264 -4.730 21.043 1.00 70.24 O ATOM 5 CB MET A 1 -0.408 -2.284 21.604 1.00 30.31 C ATOM 6 CG MET A 1 0.370 -1.692 20.439 1.00 5.21 C ATOM 7 SD MET A 1 0.666 0.076 20.630 1.00 14.01 S ATOM 8 CE MET A 1 1.713 0.089 22.083 1.00 50.23 C ATOM 0 H1 MET A 1 -2.377 -1.554 23.204 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.641 -2.449 22.507 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.311 -3.251 23.194 1.00 0.00 H new ATOM 0 HA MET A 1 -2.254 -1.506 20.787 1.00 52.33 H new ATOM 0 HB2 MET A 1 -0.233 -1.677 22.493 1.00 30.31 H new ATOM 0 HB3 MET A 1 -0.023 -3.281 21.818 1.00 30.31 H new ATOM 0 HG2 MET A 1 1.325 -2.208 20.345 1.00 5.21 H new ATOM 0 HG3 MET A 1 -0.179 -1.867 19.514 1.00 5.21 H new ATOM 0 HE1 MET A 1 1.736 1.093 22.506 1.00 50.23 H new ATOM 0 HE2 MET A 1 1.317 -0.607 22.823 1.00 50.23 H new ATOM 0 HE3 MET A 1 2.724 -0.211 21.806 1.00 50.23 H new ATOM 18 N THR A 2 -2.472 -3.413 19.230 1.00 53.14 N ATOM 19 CA THR A 2 -2.788 -4.517 18.331 1.00 44.22 C ATOM 20 C THR A 2 -1.845 -4.525 17.130 1.00 51.12 C ATOM 21 O THR A 2 -1.448 -3.470 16.633 1.00 10.31 O ATOM 22 CB THR A 2 -4.251 -4.426 17.874 1.00 23.41 C ATOM 23 OG1 THR A 2 -4.808 -5.719 17.722 1.00 2.12 O ATOM 24 CG2 THR A 2 -4.446 -3.689 16.563 1.00 72.13 C ATOM 0 H THR A 2 -2.452 -2.497 18.783 1.00 53.14 H new ATOM 0 HA THR A 2 -2.651 -5.454 18.871 1.00 44.22 H new ATOM 0 HB THR A 2 -4.753 -3.860 18.659 1.00 23.41 H new ATOM 0 HG1 THR A 2 -5.741 -5.641 17.432 1.00 2.12 H new ATOM 0 HG21 THR A 2 -5.506 -3.669 16.311 1.00 72.13 H new ATOM 0 HG22 THR A 2 -4.077 -2.668 16.661 1.00 72.13 H new ATOM 0 HG23 THR A 2 -3.895 -4.200 15.773 1.00 72.13 H new ATOM 32 N GLU A 3 -1.491 -5.719 16.668 1.00 5.22 N ATOM 33 CA GLU A 3 -0.595 -5.861 15.526 1.00 24.31 C ATOM 34 C GLU A 3 -1.363 -5.728 14.214 1.00 71.11 C ATOM 35 O GLU A 3 -2.156 -6.599 13.856 1.00 13.25 O ATOM 36 CB GLU A 3 0.126 -7.211 15.580 1.00 43.41 C ATOM 37 CG GLU A 3 1.609 -7.094 15.893 1.00 43.43 C ATOM 38 CD GLU A 3 2.293 -8.444 15.987 1.00 2.14 C ATOM 39 OE1 GLU A 3 1.735 -9.430 15.462 1.00 14.54 O ATOM 40 OE2 GLU A 3 3.386 -8.514 16.587 1.00 2.35 O ATOM 0 H GLU A 3 -1.810 -6.602 17.066 1.00 5.22 H new ATOM 0 HA GLU A 3 0.146 -5.063 15.573 1.00 24.31 H new ATOM 0 HB2 GLU A 3 -0.348 -7.837 16.335 1.00 43.41 H new ATOM 0 HB3 GLU A 3 0.004 -7.718 14.623 1.00 43.41 H new ATOM 0 HG2 GLU A 3 2.094 -6.498 15.120 1.00 43.43 H new ATOM 0 HG3 GLU A 3 1.737 -6.560 16.834 1.00 43.43 H new ATOM 47 N TYR A 4 -1.122 -4.631 13.502 1.00 70.35 N ATOM 48 CA TYR A 4 -1.791 -4.383 12.230 1.00 41.53 C ATOM 49 C TYR A 4 -0.867 -4.698 11.058 1.00 34.12 C ATOM 50 O TYR A 4 0.081 -3.961 10.786 1.00 50.05 O ATOM 51 CB TYR A 4 -2.254 -2.927 12.149 1.00 43.00 C ATOM 52 CG TYR A 4 -3.571 -2.667 12.844 1.00 73.43 C ATOM 53 CD1 TYR A 4 -4.731 -3.320 12.444 1.00 22.55 C ATOM 54 CD2 TYR A 4 -3.656 -1.767 13.899 1.00 72.03 C ATOM 55 CE1 TYR A 4 -5.937 -3.083 13.075 1.00 14.34 C ATOM 56 CE2 TYR A 4 -4.858 -1.526 14.536 1.00 11.12 C ATOM 57 CZ TYR A 4 -5.995 -2.186 14.120 1.00 70.34 C ATOM 58 OH TYR A 4 -7.195 -1.947 14.752 1.00 2.34 O ATOM 0 H TYR A 4 -0.469 -3.900 13.784 1.00 70.35 H new ATOM 0 HA TYR A 4 -2.660 -5.039 12.172 1.00 41.53 H new ATOM 0 HB2 TYR A 4 -1.489 -2.287 12.589 1.00 43.00 H new ATOM 0 HB3 TYR A 4 -2.344 -2.642 11.101 1.00 43.00 H new ATOM 0 HD1 TYR A 4 -4.689 -4.024 11.626 1.00 22.55 H new ATOM 0 HD2 TYR A 4 -2.768 -1.247 14.227 1.00 72.03 H new ATOM 0 HE1 TYR A 4 -6.830 -3.598 12.751 1.00 14.34 H new ATOM 0 HE2 TYR A 4 -4.907 -0.824 15.356 1.00 11.12 H new ATOM 0 HH TYR A 4 -7.063 -1.290 15.467 1.00 2.34 H new ATOM 68 N LYS A 5 -1.150 -5.796 10.366 1.00 33.33 N ATOM 69 CA LYS A 5 -0.345 -6.206 9.222 1.00 33.11 C ATOM 70 C LYS A 5 -0.874 -5.581 7.935 1.00 0.12 C ATOM 71 O LYS A 5 -1.796 -6.108 7.312 1.00 70.44 O ATOM 72 CB LYS A 5 -0.339 -7.730 9.096 1.00 3.30 C ATOM 73 CG LYS A 5 0.706 -8.411 9.965 1.00 22.21 C ATOM 74 CD LYS A 5 1.968 -8.729 9.177 1.00 43.04 C ATOM 75 CE LYS A 5 2.308 -10.209 9.244 1.00 2.04 C ATOM 76 NZ LYS A 5 2.818 -10.602 10.587 1.00 63.11 N ATOM 0 H LYS A 5 -1.931 -6.418 10.577 1.00 33.33 H new ATOM 0 HA LYS A 5 0.675 -5.858 9.383 1.00 33.11 H new ATOM 0 HB2 LYS A 5 -1.325 -8.112 9.362 1.00 3.30 H new ATOM 0 HB3 LYS A 5 -0.164 -7.999 8.054 1.00 3.30 H new ATOM 0 HG2 LYS A 5 0.955 -7.766 10.808 1.00 22.21 H new ATOM 0 HG3 LYS A 5 0.293 -9.331 10.378 1.00 22.21 H new ATOM 0 HD2 LYS A 5 1.833 -8.432 8.137 1.00 43.04 H new ATOM 0 HD3 LYS A 5 2.800 -8.145 9.570 1.00 43.04 H new ATOM 0 HE2 LYS A 5 1.421 -10.796 9.007 1.00 2.04 H new ATOM 0 HE3 LYS A 5 3.057 -10.444 8.488 1.00 2.04 H new ATOM 0 HZ1 LYS A 5 3.038 -11.618 10.591 1.00 63.11 H new ATOM 0 HZ2 LYS A 5 3.679 -10.060 10.804 1.00 63.11 H new ATOM 0 HZ3 LYS A 5 2.093 -10.402 11.306 1.00 63.11 H new ATOM 90 N LEU A 6 -0.288 -4.455 7.544 1.00 30.04 N ATOM 91 CA LEU A 6 -0.703 -3.758 6.332 1.00 54.25 C ATOM 92 C LEU A 6 0.084 -4.249 5.121 1.00 71.31 C ATOM 93 O LEU A 6 1.281 -3.988 4.999 1.00 14.21 O ATOM 94 CB LEU A 6 -0.517 -2.249 6.498 1.00 35.23 C ATOM 95 CG LEU A 6 -1.192 -1.645 7.730 1.00 72.30 C ATOM 96 CD1 LEU A 6 -0.935 -0.147 7.802 1.00 74.12 C ATOM 97 CD2 LEU A 6 -2.686 -1.931 7.712 1.00 63.53 C ATOM 0 H LEU A 6 0.476 -4.005 8.049 1.00 30.04 H new ATOM 0 HA LEU A 6 -1.759 -3.972 6.165 1.00 54.25 H new ATOM 0 HB2 LEU A 6 0.550 -2.033 6.545 1.00 35.23 H new ATOM 0 HB3 LEU A 6 -0.904 -1.751 5.609 1.00 35.23 H new ATOM 0 HG LEU A 6 -0.763 -2.108 8.619 1.00 72.30 H new ATOM 0 HD11 LEU A 6 -1.424 0.264 8.685 1.00 74.12 H new ATOM 0 HD12 LEU A 6 0.138 0.036 7.863 1.00 74.12 H new ATOM 0 HD13 LEU A 6 -1.335 0.334 6.909 1.00 74.12 H new ATOM 0 HD21 LEU A 6 -3.151 -1.494 8.596 1.00 63.53 H new ATOM 0 HD22 LEU A 6 -3.129 -1.496 6.816 1.00 63.53 H new ATOM 0 HD23 LEU A 6 -2.850 -3.009 7.711 1.00 63.53 H new ATOM 109 N VAL A 7 -0.597 -4.961 4.229 1.00 55.14 N ATOM 110 CA VAL A 7 0.034 -5.488 3.027 1.00 13.53 C ATOM 111 C VAL A 7 0.139 -4.415 1.948 1.00 2.24 C ATOM 112 O VAL A 7 -0.851 -4.070 1.303 1.00 53.35 O ATOM 113 CB VAL A 7 -0.750 -6.690 2.470 1.00 45.23 C ATOM 114 CG1 VAL A 7 -0.010 -7.317 1.301 1.00 21.22 C ATOM 115 CG2 VAL A 7 -1.001 -7.717 3.564 1.00 33.13 C ATOM 0 H VAL A 7 -1.588 -5.186 4.317 1.00 55.14 H new ATOM 0 HA VAL A 7 1.036 -5.814 3.307 1.00 13.53 H new ATOM 0 HB VAL A 7 -1.715 -6.334 2.109 1.00 45.23 H new ATOM 0 HG11 VAL A 7 -0.581 -8.165 0.922 1.00 21.22 H new ATOM 0 HG12 VAL A 7 0.112 -6.578 0.509 1.00 21.22 H new ATOM 0 HG13 VAL A 7 0.971 -7.659 1.632 1.00 21.22 H new ATOM 0 HG21 VAL A 7 -1.556 -8.559 3.152 1.00 33.13 H new ATOM 0 HG22 VAL A 7 -0.048 -8.069 3.958 1.00 33.13 H new ATOM 0 HG23 VAL A 7 -1.579 -7.259 4.367 1.00 33.13 H new ATOM 125 N VAL A 8 1.345 -3.891 1.757 1.00 74.34 N ATOM 126 CA VAL A 8 1.583 -2.859 0.759 1.00 45.02 C ATOM 127 C VAL A 8 1.784 -3.469 -0.625 1.00 34.34 C ATOM 128 O VAL A 8 2.706 -4.256 -0.838 1.00 24.31 O ATOM 129 CB VAL A 8 2.819 -2.015 1.118 1.00 30.24 C ATOM 130 CG1 VAL A 8 2.952 -0.835 0.171 1.00 33.42 C ATOM 131 CG2 VAL A 8 2.743 -1.544 2.562 1.00 41.43 C ATOM 0 H VAL A 8 2.174 -4.166 2.283 1.00 74.34 H new ATOM 0 HA VAL A 8 0.701 -2.218 0.745 1.00 45.02 H new ATOM 0 HB VAL A 8 3.706 -2.639 1.010 1.00 30.24 H new ATOM 0 HG11 VAL A 8 3.831 -0.250 0.440 1.00 33.42 H new ATOM 0 HG12 VAL A 8 3.057 -1.199 -0.851 1.00 33.42 H new ATOM 0 HG13 VAL A 8 2.063 -0.208 0.243 1.00 33.42 H new ATOM 0 HG21 VAL A 8 3.625 -0.949 2.798 1.00 41.43 H new ATOM 0 HG22 VAL A 8 1.848 -0.937 2.700 1.00 41.43 H new ATOM 0 HG23 VAL A 8 2.701 -2.408 3.225 1.00 41.43 H new ATOM 141 N VAL A 9 0.917 -3.100 -1.563 1.00 10.52 N ATOM 142 CA VAL A 9 1.005 -3.611 -2.925 1.00 23.40 C ATOM 143 C VAL A 9 0.938 -2.475 -3.942 1.00 41.13 C ATOM 144 O VAL A 9 0.314 -1.444 -3.694 1.00 22.01 O ATOM 145 CB VAL A 9 -0.119 -4.624 -3.221 1.00 71.43 C ATOM 146 CG1 VAL A 9 -0.051 -5.795 -2.253 1.00 25.22 C ATOM 147 CG2 VAL A 9 -1.482 -3.951 -3.158 1.00 64.33 C ATOM 0 H VAL A 9 0.147 -2.450 -1.404 1.00 10.52 H new ATOM 0 HA VAL A 9 1.967 -4.116 -3.013 1.00 23.40 H new ATOM 0 HB VAL A 9 0.023 -5.007 -4.232 1.00 71.43 H new ATOM 0 HG11 VAL A 9 -0.852 -6.499 -2.477 1.00 25.22 H new ATOM 0 HG12 VAL A 9 0.912 -6.296 -2.355 1.00 25.22 H new ATOM 0 HG13 VAL A 9 -0.164 -5.430 -1.232 1.00 25.22 H new ATOM 0 HG21 VAL A 9 -2.260 -4.684 -3.370 1.00 64.33 H new ATOM 0 HG22 VAL A 9 -1.637 -3.535 -2.162 1.00 64.33 H new ATOM 0 HG23 VAL A 9 -1.527 -3.151 -3.896 1.00 64.33 H new ATOM 157 N GLY A 10 1.586 -2.672 -5.086 1.00 34.41 N ATOM 158 CA GLY A 10 1.587 -1.654 -6.120 1.00 21.24 C ATOM 159 C GLY A 10 1.900 -2.219 -7.492 1.00 23.43 C ATOM 160 O GLY A 10 1.014 -2.335 -8.339 1.00 5.44 O ATOM 0 H GLY A 10 2.109 -3.517 -5.315 1.00 34.41 H new ATOM 0 HA2 GLY A 10 0.613 -1.166 -6.145 1.00 21.24 H new ATOM 0 HA3 GLY A 10 2.321 -0.888 -5.870 1.00 21.24 H new ATOM 164 N ALA A 11 3.164 -2.569 -7.713 1.00 61.35 N ATOM 165 CA ALA A 11 3.593 -3.123 -8.992 1.00 1.13 C ATOM 166 C ALA A 11 5.082 -3.450 -8.976 1.00 71.24 C ATOM 167 O ALA A 11 5.511 -4.466 -9.522 1.00 73.32 O ATOM 168 CB ALA A 11 3.278 -2.154 -10.122 1.00 72.11 C ATOM 0 H ALA A 11 3.909 -2.478 -7.022 1.00 61.35 H new ATOM 0 HA ALA A 11 3.044 -4.050 -9.159 1.00 1.13 H new ATOM 0 HB1 ALA A 11 3.604 -2.582 -11.070 1.00 72.11 H new ATOM 0 HB2 ALA A 11 2.204 -1.972 -10.157 1.00 72.11 H new ATOM 0 HB3 ALA A 11 3.800 -1.213 -9.950 1.00 72.11 H new ATOM 174 N GLY A 12 5.866 -2.581 -8.346 1.00 3.43 N ATOM 175 CA GLY A 12 7.300 -2.794 -8.271 1.00 73.10 C ATOM 176 C GLY A 12 8.085 -1.508 -8.430 1.00 52.33 C ATOM 177 O GLY A 12 9.184 -1.373 -7.893 1.00 64.53 O ATOM 0 H GLY A 12 5.534 -1.733 -7.886 1.00 3.43 H new ATOM 0 HA2 GLY A 12 7.547 -3.251 -7.313 1.00 73.10 H new ATOM 0 HA3 GLY A 12 7.601 -3.498 -9.047 1.00 73.10 H new ATOM 181 N GLY A 13 7.518 -0.559 -9.168 1.00 10.43 N ATOM 182 CA GLY A 13 8.184 0.712 -9.382 1.00 42.15 C ATOM 183 C GLY A 13 7.239 1.889 -9.257 1.00 22.21 C ATOM 184 O GLY A 13 7.407 2.905 -9.932 1.00 41.51 O ATOM 0 H GLY A 13 6.609 -0.648 -9.622 1.00 10.43 H new ATOM 0 HA2 GLY A 13 8.993 0.821 -8.660 1.00 42.15 H new ATOM 0 HA3 GLY A 13 8.638 0.718 -10.373 1.00 42.15 H new ATOM 188 N VAL A 14 6.242 1.752 -8.390 1.00 11.21 N ATOM 189 CA VAL A 14 5.263 2.810 -8.174 1.00 21.22 C ATOM 190 C VAL A 14 5.695 3.736 -7.041 1.00 43.13 C ATOM 191 O VAL A 14 5.312 4.905 -7.001 1.00 51.20 O ATOM 192 CB VAL A 14 3.874 2.231 -7.846 1.00 43.01 C ATOM 193 CG1 VAL A 14 3.342 1.421 -9.018 1.00 20.51 C ATOM 194 CG2 VAL A 14 3.933 1.381 -6.584 1.00 31.35 C ATOM 0 H VAL A 14 6.091 0.917 -7.824 1.00 11.21 H new ATOM 0 HA VAL A 14 5.202 3.379 -9.102 1.00 21.22 H new ATOM 0 HB VAL A 14 3.189 3.060 -7.666 1.00 43.01 H new ATOM 0 HG11 VAL A 14 2.360 1.020 -8.767 1.00 20.51 H new ATOM 0 HG12 VAL A 14 3.259 2.062 -9.896 1.00 20.51 H new ATOM 0 HG13 VAL A 14 4.025 0.599 -9.232 1.00 20.51 H new ATOM 0 HG21 VAL A 14 2.942 0.981 -6.368 1.00 31.35 H new ATOM 0 HG22 VAL A 14 4.633 0.558 -6.732 1.00 31.35 H new ATOM 0 HG23 VAL A 14 4.266 1.995 -5.747 1.00 31.35 H new ATOM 204 N GLY A 15 6.495 3.205 -6.122 1.00 14.00 N ATOM 205 CA GLY A 15 6.966 3.996 -5.000 1.00 24.44 C ATOM 206 C GLY A 15 6.416 3.511 -3.672 1.00 63.24 C ATOM 207 O GLY A 15 6.405 4.254 -2.690 1.00 32.53 O ATOM 0 H GLY A 15 6.826 2.240 -6.134 1.00 14.00 H new ATOM 0 HA2 GLY A 15 8.055 3.966 -4.971 1.00 24.44 H new ATOM 0 HA3 GLY A 15 6.680 5.037 -5.149 1.00 24.44 H new ATOM 211 N LYS A 16 5.960 2.262 -3.639 1.00 75.25 N ATOM 212 CA LYS A 16 5.410 1.683 -2.420 1.00 65.32 C ATOM 213 C LYS A 16 6.458 1.661 -1.312 1.00 22.21 C ATOM 214 O LYS A 16 6.170 2.002 -0.165 1.00 44.12 O ATOM 215 CB LYS A 16 4.904 0.264 -2.686 1.00 72.34 C ATOM 216 CG LYS A 16 5.969 -0.666 -3.243 1.00 2.54 C ATOM 217 CD LYS A 16 5.368 -1.980 -3.718 1.00 32.14 C ATOM 218 CE LYS A 16 6.386 -2.815 -4.479 1.00 4.32 C ATOM 219 NZ LYS A 16 7.534 -3.213 -3.619 1.00 23.12 N ATOM 0 H LYS A 16 5.961 1.633 -4.442 1.00 75.25 H new ATOM 0 HA LYS A 16 4.574 2.303 -2.097 1.00 65.32 H new ATOM 0 HB2 LYS A 16 4.517 -0.155 -1.757 1.00 72.34 H new ATOM 0 HB3 LYS A 16 4.070 0.310 -3.387 1.00 72.34 H new ATOM 0 HG2 LYS A 16 6.482 -0.178 -4.072 1.00 2.54 H new ATOM 0 HG3 LYS A 16 6.718 -0.863 -2.476 1.00 2.54 H new ATOM 0 HD2 LYS A 16 5.001 -2.544 -2.861 1.00 32.14 H new ATOM 0 HD3 LYS A 16 4.509 -1.778 -4.358 1.00 32.14 H new ATOM 0 HE2 LYS A 16 5.901 -3.708 -4.873 1.00 4.32 H new ATOM 0 HE3 LYS A 16 6.753 -2.248 -5.335 1.00 4.32 H new ATOM 0 HZ1 LYS A 16 8.179 -3.823 -4.161 1.00 23.12 H new ATOM 0 HZ2 LYS A 16 8.044 -2.363 -3.305 1.00 23.12 H new ATOM 0 HZ3 LYS A 16 7.183 -3.732 -2.789 1.00 23.12 H new ATOM 233 N SER A 17 7.676 1.261 -1.664 1.00 32.12 N ATOM 234 CA SER A 17 8.767 1.197 -0.699 1.00 24.05 C ATOM 235 C SER A 17 9.097 2.584 -0.160 1.00 74.22 C ATOM 236 O SER A 17 9.313 2.761 1.039 1.00 72.11 O ATOM 237 CB SER A 17 10.009 0.576 -1.341 1.00 15.33 C ATOM 238 OG SER A 17 10.288 1.169 -2.598 1.00 12.21 O ATOM 0 H SER A 17 7.932 0.977 -2.610 1.00 32.12 H new ATOM 0 HA SER A 17 8.447 0.570 0.133 1.00 24.05 H new ATOM 0 HB2 SER A 17 10.865 0.702 -0.679 1.00 15.33 H new ATOM 0 HB3 SER A 17 9.859 -0.496 -1.467 1.00 15.33 H new ATOM 244 N ALA A 18 9.135 3.566 -1.054 1.00 44.14 N ATOM 245 CA ALA A 18 9.439 4.939 -0.671 1.00 14.30 C ATOM 246 C ALA A 18 8.359 5.507 0.244 1.00 42.22 C ATOM 247 O ALA A 18 8.658 6.167 1.239 1.00 42.31 O ATOM 248 CB ALA A 18 9.597 5.810 -1.908 1.00 70.23 C ATOM 0 H ALA A 18 8.959 3.436 -2.050 1.00 44.14 H new ATOM 0 HA ALA A 18 10.380 4.936 -0.120 1.00 14.30 H new ATOM 0 HB1 ALA A 18 9.824 6.833 -1.606 1.00 70.23 H new ATOM 0 HB2 ALA A 18 10.410 5.424 -2.523 1.00 70.23 H new ATOM 0 HB3 ALA A 18 8.671 5.798 -2.482 1.00 70.23 H new ATOM 254 N LEU A 19 7.102 5.244 -0.100 1.00 42.05 N ATOM 255 CA LEU A 19 5.976 5.729 0.690 1.00 73.34 C ATOM 256 C LEU A 19 5.918 5.028 2.045 1.00 21.31 C ATOM 257 O LEU A 19 5.441 5.596 3.027 1.00 41.33 O ATOM 258 CB LEU A 19 4.664 5.511 -0.066 1.00 12.24 C ATOM 259 CG LEU A 19 4.246 6.661 -0.983 1.00 55.51 C ATOM 260 CD1 LEU A 19 3.097 6.234 -1.883 1.00 43.24 C ATOM 261 CD2 LEU A 19 3.858 7.882 -0.163 1.00 34.31 C ATOM 0 H LEU A 19 6.838 4.698 -0.920 1.00 42.05 H new ATOM 0 HA LEU A 19 6.117 6.796 0.859 1.00 73.34 H new ATOM 0 HB2 LEU A 19 4.753 4.604 -0.664 1.00 12.24 H new ATOM 0 HB3 LEU A 19 3.869 5.338 0.659 1.00 12.24 H new ATOM 0 HG LEU A 19 5.095 6.926 -1.613 1.00 55.51 H new ATOM 0 HD11 LEU A 19 2.813 7.065 -2.529 1.00 43.24 H new ATOM 0 HD12 LEU A 19 3.410 5.389 -2.496 1.00 43.24 H new ATOM 0 HD13 LEU A 19 2.244 5.942 -1.270 1.00 43.24 H new ATOM 0 HD21 LEU A 19 3.563 8.691 -0.832 1.00 34.31 H new ATOM 0 HD22 LEU A 19 3.024 7.630 0.492 1.00 34.31 H new ATOM 0 HD23 LEU A 19 4.709 8.201 0.439 1.00 34.31 H new ATOM 273 N THR A 20 6.404 3.792 2.089 1.00 25.42 N ATOM 274 CA THR A 20 6.404 3.014 3.323 1.00 53.32 C ATOM 275 C THR A 20 7.357 3.619 4.350 1.00 63.34 C ATOM 276 O THR A 20 6.955 3.945 5.467 1.00 13.25 O ATOM 277 CB THR A 20 6.798 1.564 3.036 1.00 72.03 C ATOM 278 OG1 THR A 20 5.918 0.983 2.090 1.00 31.32 O ATOM 279 CG2 THR A 20 6.791 0.686 4.269 1.00 23.13 C ATOM 0 H THR A 20 6.803 3.307 1.285 1.00 25.42 H new ATOM 0 HA THR A 20 5.395 3.035 3.735 1.00 53.32 H new ATOM 0 HB THR A 20 7.816 1.613 2.650 1.00 72.03 H new ATOM 0 HG1 THR A 20 6.317 1.037 1.196 1.00 31.32 H new ATOM 0 HG21 THR A 20 7.080 -0.329 3.995 1.00 23.13 H new ATOM 0 HG22 THR A 20 7.498 1.079 5.000 1.00 23.13 H new ATOM 0 HG23 THR A 20 5.791 0.674 4.702 1.00 23.13 H new ATOM 287 N ILE A 21 8.622 3.764 3.966 1.00 44.32 N ATOM 288 CA ILE A 21 9.634 4.327 4.854 1.00 1.15 C ATOM 289 C ILE A 21 9.203 5.689 5.392 1.00 20.43 C ATOM 290 O ILE A 21 9.578 6.075 6.499 1.00 42.04 O ATOM 291 CB ILE A 21 10.993 4.468 4.137 1.00 41.21 C ATOM 292 CG1 ILE A 21 11.467 3.109 3.624 1.00 11.25 C ATOM 293 CG2 ILE A 21 12.034 5.070 5.068 1.00 1.31 C ATOM 294 CD1 ILE A 21 11.545 2.047 4.699 1.00 2.42 C ATOM 0 H ILE A 21 8.971 3.499 3.045 1.00 44.32 H new ATOM 0 HA ILE A 21 9.744 3.635 5.689 1.00 1.15 H new ATOM 0 HB ILE A 21 10.862 5.138 3.288 1.00 41.21 H new ATOM 0 HG12 ILE A 21 10.790 2.770 2.840 1.00 11.25 H new ATOM 0 HG13 ILE A 21 12.450 3.225 3.168 1.00 11.25 H new ATOM 0 HG21 ILE A 21 12.984 5.160 4.542 1.00 1.31 H new ATOM 0 HG22 ILE A 21 11.704 6.057 5.393 1.00 1.31 H new ATOM 0 HG23 ILE A 21 12.161 4.425 5.938 1.00 1.31 H new ATOM 0 HD11 ILE A 21 11.889 1.110 4.261 1.00 2.42 H new ATOM 0 HD12 ILE A 21 12.244 2.363 5.473 1.00 2.42 H new ATOM 0 HD13 ILE A 21 10.558 1.901 5.139 1.00 2.42 H new ATOM 306 N GLN A 22 8.411 6.412 4.606 1.00 22.24 N ATOM 307 CA GLN A 22 7.930 7.728 5.013 1.00 54.55 C ATOM 308 C GLN A 22 7.159 7.635 6.326 1.00 64.44 C ATOM 309 O GLN A 22 7.429 8.374 7.272 1.00 32.53 O ATOM 310 CB GLN A 22 7.039 8.329 3.924 1.00 63.44 C ATOM 311 CG GLN A 22 7.817 9.011 2.810 1.00 42.11 C ATOM 312 CD GLN A 22 8.660 10.168 3.311 1.00 14.24 C ATOM 313 OE1 GLN A 22 8.424 10.697 4.397 1.00 40.25 O ATOM 314 NE2 GLN A 22 9.649 10.566 2.520 1.00 31.44 N ATOM 0 H GLN A 22 8.089 6.110 3.686 1.00 22.24 H new ATOM 0 HA GLN A 22 8.793 8.377 5.161 1.00 54.55 H new ATOM 0 HB2 GLN A 22 6.422 7.540 3.495 1.00 63.44 H new ATOM 0 HB3 GLN A 22 6.362 9.052 4.378 1.00 63.44 H new ATOM 0 HG2 GLN A 22 8.463 8.280 2.323 1.00 42.11 H new ATOM 0 HG3 GLN A 22 7.120 9.374 2.055 1.00 42.11 H new ATOM 0 HE21 GLN A 22 9.808 10.098 1.628 1.00 31.44 H new ATOM 0 HE22 GLN A 22 10.250 11.340 2.804 1.00 31.44 H new ATOM 323 N LEU A 23 6.204 6.715 6.376 1.00 62.31 N ATOM 324 CA LEU A 23 5.397 6.515 7.573 1.00 63.22 C ATOM 325 C LEU A 23 6.239 5.960 8.719 1.00 50.23 C ATOM 326 O LEU A 23 5.832 6.009 9.880 1.00 71.44 O ATOM 327 CB LEU A 23 4.241 5.566 7.273 1.00 51.24 C ATOM 328 CG LEU A 23 3.105 5.602 8.295 1.00 33.51 C ATOM 329 CD1 LEU A 23 1.846 6.190 7.679 1.00 71.35 C ATOM 330 CD2 LEU A 23 2.836 4.209 8.836 1.00 34.21 C ATOM 0 H LEU A 23 5.969 6.095 5.601 1.00 62.31 H new ATOM 0 HA LEU A 23 5.000 7.483 7.878 1.00 63.22 H new ATOM 0 HB2 LEU A 23 3.836 5.808 6.290 1.00 51.24 H new ATOM 0 HB3 LEU A 23 4.629 4.549 7.216 1.00 51.24 H new ATOM 0 HG LEU A 23 3.408 6.242 9.124 1.00 33.51 H new ATOM 0 HD11 LEU A 23 1.050 6.206 8.424 1.00 71.35 H new ATOM 0 HD12 LEU A 23 2.047 7.206 7.340 1.00 71.35 H new ATOM 0 HD13 LEU A 23 1.537 5.580 6.831 1.00 71.35 H new ATOM 0 HD21 LEU A 23 2.025 4.251 9.563 1.00 34.21 H new ATOM 0 HD22 LEU A 23 2.555 3.548 8.016 1.00 34.21 H new ATOM 0 HD23 LEU A 23 3.735 3.826 9.318 1.00 34.21 H new ATOM 342 N ILE A 24 7.411 5.423 8.388 1.00 53.43 N ATOM 343 CA ILE A 24 8.300 4.852 9.390 1.00 73.24 C ATOM 344 C ILE A 24 9.283 5.886 9.930 1.00 33.24 C ATOM 345 O ILE A 24 9.195 6.290 11.090 1.00 25.21 O ATOM 346 CB ILE A 24 9.088 3.658 8.818 1.00 42.11 C ATOM 347 CG1 ILE A 24 8.126 2.635 8.224 1.00 32.34 C ATOM 348 CG2 ILE A 24 9.937 3.014 9.902 1.00 20.33 C ATOM 349 CD1 ILE A 24 7.192 2.043 9.251 1.00 11.13 C ATOM 0 H ILE A 24 7.765 5.373 7.433 1.00 53.43 H new ATOM 0 HA ILE A 24 7.667 4.510 10.209 1.00 73.24 H new ATOM 0 HB ILE A 24 9.749 4.020 8.031 1.00 42.11 H new ATOM 0 HG12 ILE A 24 7.539 3.109 7.437 1.00 32.34 H new ATOM 0 HG13 ILE A 24 8.698 1.834 7.756 1.00 32.34 H new ATOM 0 HG21 ILE A 24 10.487 2.172 9.481 1.00 20.33 H new ATOM 0 HG22 ILE A 24 10.641 3.747 10.296 1.00 20.33 H new ATOM 0 HG23 ILE A 24 9.293 2.660 10.707 1.00 20.33 H new ATOM 0 HD11 ILE A 24 6.531 1.322 8.769 1.00 11.13 H new ATOM 0 HD12 ILE A 24 7.773 1.542 10.025 1.00 11.13 H new ATOM 0 HD13 ILE A 24 6.596 2.837 9.701 1.00 11.13 H new ATOM 361 N GLN A 25 10.228 6.298 9.092 1.00 64.45 N ATOM 362 CA GLN A 25 11.234 7.270 9.501 1.00 33.34 C ATOM 363 C GLN A 25 10.968 8.648 8.894 1.00 61.32 C ATOM 364 O GLN A 25 11.548 9.644 9.326 1.00 30.42 O ATOM 365 CB GLN A 25 12.629 6.782 9.103 1.00 54.54 C ATOM 366 CG GLN A 25 12.836 5.294 9.327 1.00 42.44 C ATOM 367 CD GLN A 25 14.201 4.822 8.876 1.00 42.00 C ATOM 368 OE1 GLN A 25 14.780 5.363 7.935 1.00 64.01 O ATOM 369 NE2 GLN A 25 14.722 3.806 9.549 1.00 14.33 N ATOM 0 H GLN A 25 10.318 5.975 8.129 1.00 64.45 H new ATOM 0 HA GLN A 25 11.179 7.368 10.585 1.00 33.34 H new ATOM 0 HB2 GLN A 25 12.799 7.010 8.051 1.00 54.54 H new ATOM 0 HB3 GLN A 25 13.375 7.335 9.674 1.00 54.54 H new ATOM 0 HG2 GLN A 25 12.709 5.069 10.386 1.00 42.44 H new ATOM 0 HG3 GLN A 25 12.068 4.739 8.789 1.00 42.44 H new ATOM 0 HE21 GLN A 25 14.205 3.388 10.323 1.00 14.33 H new ATOM 0 HE22 GLN A 25 15.640 3.442 9.293 1.00 14.33 H new ATOM 378 N ASN A 26 10.092 8.702 7.894 1.00 23.21 N ATOM 379 CA ASN A 26 9.759 9.964 7.238 1.00 21.43 C ATOM 380 C ASN A 26 10.951 10.497 6.451 1.00 35.35 C ATOM 381 O ASN A 26 11.167 11.707 6.377 1.00 41.43 O ATOM 382 CB ASN A 26 9.307 11.005 8.267 1.00 15.11 C ATOM 383 CG ASN A 26 8.445 10.407 9.364 1.00 1.23 C ATOM 384 OD1 ASN A 26 8.946 10.013 10.417 1.00 11.11 O ATOM 385 ND2 ASN A 26 7.142 10.337 9.121 1.00 13.32 N ATOM 0 H ASN A 26 9.601 7.889 7.521 1.00 23.21 H new ATOM 0 HA ASN A 26 8.939 9.775 6.545 1.00 21.43 H new ATOM 0 HB2 ASN A 26 10.184 11.473 8.714 1.00 15.11 H new ATOM 0 HB3 ASN A 26 8.749 11.792 7.760 1.00 15.11 H new ATOM 0 HD21 ASN A 26 6.513 9.945 9.821 1.00 13.32 H new ATOM 0 HD22 ASN A 26 6.770 10.676 8.234 1.00 13.32 H new ATOM 392 N HIS A 27 11.722 9.588 5.865 1.00 23.24 N ATOM 393 CA HIS A 27 12.892 9.968 5.084 1.00 22.11 C ATOM 394 C HIS A 27 12.913 9.233 3.746 1.00 12.15 C ATOM 395 O HIS A 27 12.302 8.175 3.599 1.00 53.02 O ATOM 396 CB HIS A 27 14.176 9.684 5.879 1.00 63.51 C ATOM 397 CG HIS A 27 14.859 8.398 5.513 1.00 32.05 C ATOM 398 ND1 HIS A 27 14.281 7.159 5.698 1.00 72.55 N ATOM 399 CD2 HIS A 27 16.075 8.166 4.963 1.00 60.20 C ATOM 400 CE1 HIS A 27 15.113 6.221 5.278 1.00 62.14 C ATOM 401 NE2 HIS A 27 16.207 6.806 4.828 1.00 5.53 N ATOM 0 H HIS A 27 11.557 8.583 5.916 1.00 23.24 H new ATOM 0 HA HIS A 27 12.838 11.037 4.880 1.00 22.11 H new ATOM 0 HB2 HIS A 27 14.873 10.508 5.727 1.00 63.51 H new ATOM 0 HB3 HIS A 27 13.934 9.663 6.942 1.00 63.51 H new ATOM 0 HD2 HIS A 27 16.804 8.912 4.683 1.00 60.20 H new ATOM 0 HE1 HIS A 27 14.929 5.157 5.300 1.00 62.14 H new ATOM 0 HE2 HIS A 27 17.020 6.325 4.442 1.00 5.53 H new ATOM 410 N PHE A 28 13.627 9.796 2.777 1.00 62.40 N ATOM 411 CA PHE A 28 13.733 9.187 1.458 1.00 1.23 C ATOM 412 C PHE A 28 14.709 8.016 1.488 1.00 24.53 C ATOM 413 O PHE A 28 15.815 8.133 2.015 1.00 54.33 O ATOM 414 CB PHE A 28 14.186 10.222 0.428 1.00 44.14 C ATOM 415 CG PHE A 28 14.104 9.733 -0.990 1.00 33.12 C ATOM 416 CD1 PHE A 28 12.894 9.325 -1.527 1.00 15.44 C ATOM 417 CD2 PHE A 28 15.238 9.682 -1.785 1.00 4.51 C ATOM 418 CE1 PHE A 28 12.816 8.874 -2.831 1.00 51.24 C ATOM 419 CE2 PHE A 28 15.166 9.233 -3.090 1.00 71.43 C ATOM 420 CZ PHE A 28 13.953 8.828 -3.614 1.00 45.33 C ATOM 0 H PHE A 28 14.140 10.672 2.881 1.00 62.40 H new ATOM 0 HA PHE A 28 12.749 8.815 1.172 1.00 1.23 H new ATOM 0 HB2 PHE A 28 13.573 11.117 0.531 1.00 44.14 H new ATOM 0 HB3 PHE A 28 15.214 10.513 0.645 1.00 44.14 H new ATOM 0 HD1 PHE A 28 12.002 9.360 -0.920 1.00 15.44 H new ATOM 0 HD2 PHE A 28 16.189 9.997 -1.380 1.00 4.51 H new ATOM 0 HE1 PHE A 28 11.867 8.558 -3.238 1.00 51.24 H new ATOM 0 HE2 PHE A 28 16.057 9.199 -3.700 1.00 71.43 H new ATOM 0 HZ PHE A 28 13.894 8.476 -4.633 1.00 45.33 H new ATOM 430 N VAL A 29 14.293 6.886 0.927 1.00 31.34 N ATOM 431 CA VAL A 29 15.132 5.693 0.898 1.00 12.02 C ATOM 432 C VAL A 29 16.510 5.998 0.319 1.00 52.32 C ATOM 433 O VAL A 29 16.668 6.171 -0.890 1.00 75.40 O ATOM 434 CB VAL A 29 14.462 4.555 0.096 1.00 20.30 C ATOM 435 CG1 VAL A 29 15.480 3.512 -0.348 1.00 45.43 C ATOM 436 CG2 VAL A 29 13.369 3.909 0.931 1.00 61.43 C ATOM 0 H VAL A 29 13.380 6.771 0.486 1.00 31.34 H new ATOM 0 HA VAL A 29 15.256 5.363 1.929 1.00 12.02 H new ATOM 0 HB VAL A 29 14.020 4.986 -0.802 1.00 20.30 H new ATOM 0 HG11 VAL A 29 14.975 2.726 -0.909 1.00 45.43 H new ATOM 0 HG12 VAL A 29 16.232 3.984 -0.981 1.00 45.43 H new ATOM 0 HG13 VAL A 29 15.963 3.079 0.528 1.00 45.43 H new ATOM 0 HG21 VAL A 29 12.901 3.107 0.360 1.00 61.43 H new ATOM 0 HG22 VAL A 29 13.802 3.499 1.843 1.00 61.43 H new ATOM 0 HG23 VAL A 29 12.619 4.656 1.190 1.00 61.43 H new ATOM 446 N ASP A 30 17.502 6.058 1.198 1.00 12.13 N ATOM 447 CA ASP A 30 18.875 6.339 0.794 1.00 74.14 C ATOM 448 C ASP A 30 19.785 5.151 1.095 1.00 72.20 C ATOM 449 O ASP A 30 20.697 4.845 0.326 1.00 70.45 O ATOM 450 CB ASP A 30 19.392 7.588 1.510 1.00 33.20 C ATOM 451 CG ASP A 30 20.790 7.973 1.065 1.00 63.51 C ATOM 452 OD1 ASP A 30 20.997 8.153 -0.153 1.00 75.11 O ATOM 453 OD2 ASP A 30 21.677 8.096 1.936 1.00 52.12 O ATOM 0 H ASP A 30 17.381 5.915 2.201 1.00 12.13 H new ATOM 0 HA ASP A 30 18.883 6.515 -0.282 1.00 74.14 H new ATOM 0 HB2 ASP A 30 18.712 8.419 1.322 1.00 33.20 H new ATOM 0 HB3 ASP A 30 19.391 7.413 2.586 1.00 33.20 H new ATOM 458 N GLU A 31 19.532 4.485 2.218 1.00 14.11 N ATOM 459 CA GLU A 31 20.329 3.332 2.621 1.00 21.22 C ATOM 460 C GLU A 31 19.476 2.333 3.401 1.00 10.52 C ATOM 461 O GLU A 31 18.906 2.666 4.439 1.00 12.34 O ATOM 462 CB GLU A 31 21.524 3.787 3.467 1.00 4.24 C ATOM 463 CG GLU A 31 22.216 2.662 4.224 1.00 11.34 C ATOM 464 CD GLU A 31 22.541 1.472 3.341 1.00 41.11 C ATOM 465 OE1 GLU A 31 22.530 1.631 2.102 1.00 63.42 O ATOM 466 OE2 GLU A 31 22.808 0.382 3.889 1.00 73.55 O ATOM 0 H GLU A 31 18.781 4.725 2.865 1.00 14.11 H new ATOM 0 HA GLU A 31 20.701 2.837 1.724 1.00 21.22 H new ATOM 0 HB2 GLU A 31 22.251 4.273 2.817 1.00 4.24 H new ATOM 0 HB3 GLU A 31 21.184 4.536 4.182 1.00 4.24 H new ATOM 0 HG2 GLU A 31 23.136 3.041 4.668 1.00 11.34 H new ATOM 0 HG3 GLU A 31 21.577 2.336 5.045 1.00 11.34 H new ATOM 473 N TYR A 32 19.397 1.107 2.892 1.00 31.11 N ATOM 474 CA TYR A 32 18.617 0.060 3.541 1.00 53.44 C ATOM 475 C TYR A 32 19.276 -1.303 3.356 1.00 0.31 C ATOM 476 O TYR A 32 20.251 -1.436 2.617 1.00 24.10 O ATOM 477 CB TYR A 32 17.193 0.031 2.982 1.00 22.42 C ATOM 478 CG TYR A 32 17.133 -0.101 1.477 1.00 34.30 C ATOM 479 CD1 TYR A 32 17.244 1.015 0.658 1.00 73.42 C ATOM 480 CD2 TYR A 32 16.965 -1.342 0.876 1.00 14.12 C ATOM 481 CE1 TYR A 32 17.188 0.898 -0.718 1.00 22.42 C ATOM 482 CE2 TYR A 32 16.909 -1.467 -0.499 1.00 25.54 C ATOM 483 CZ TYR A 32 17.021 -0.344 -1.291 1.00 74.12 C ATOM 484 OH TYR A 32 16.965 -0.464 -2.661 1.00 31.01 O ATOM 0 H TYR A 32 19.863 0.815 2.033 1.00 31.11 H new ATOM 0 HA TYR A 32 18.575 0.283 4.607 1.00 53.44 H new ATOM 0 HB2 TYR A 32 16.652 -0.801 3.433 1.00 22.42 H new ATOM 0 HB3 TYR A 32 16.677 0.944 3.279 1.00 22.42 H new ATOM 0 HD1 TYR A 32 17.376 1.990 1.103 1.00 73.42 H new ATOM 0 HD2 TYR A 32 16.877 -2.224 1.494 1.00 14.12 H new ATOM 0 HE1 TYR A 32 17.275 1.776 -1.341 1.00 22.42 H new ATOM 0 HE2 TYR A 32 16.778 -2.439 -0.951 1.00 25.54 H new ATOM 0 HH TYR A 32 16.845 -1.406 -2.902 1.00 31.01 H new ATOM 494 N ASP A 33 18.737 -2.312 4.031 1.00 61.20 N ATOM 495 CA ASP A 33 19.273 -3.666 3.942 1.00 72.12 C ATOM 496 C ASP A 33 18.362 -4.556 3.098 1.00 53.45 C ATOM 497 O ASP A 33 17.397 -5.127 3.605 1.00 45.10 O ATOM 498 CB ASP A 33 19.433 -4.268 5.338 1.00 50.13 C ATOM 499 CG ASP A 33 20.039 -3.291 6.327 1.00 33.24 C ATOM 500 OD1 ASP A 33 21.261 -3.045 6.247 1.00 44.23 O ATOM 501 OD2 ASP A 33 19.291 -2.771 7.182 1.00 5.13 O ATOM 0 H ASP A 33 17.929 -2.218 4.646 1.00 61.20 H new ATOM 0 HA ASP A 33 20.250 -3.611 3.462 1.00 72.12 H new ATOM 0 HB2 ASP A 33 18.459 -4.593 5.704 1.00 50.13 H new ATOM 0 HB3 ASP A 33 20.063 -5.156 5.277 1.00 50.13 H new ATOM 506 N PRO A 34 18.659 -4.685 1.794 1.00 3.45 N ATOM 507 CA PRO A 34 17.861 -5.507 0.882 1.00 33.30 C ATOM 508 C PRO A 34 18.103 -6.999 1.086 1.00 73.32 C ATOM 509 O PRO A 34 18.704 -7.410 2.079 1.00 60.21 O ATOM 510 CB PRO A 34 18.344 -5.068 -0.500 1.00 53.24 C ATOM 511 CG PRO A 34 19.743 -4.604 -0.284 1.00 23.30 C ATOM 512 CD PRO A 34 19.792 -4.035 1.109 1.00 35.41 C ATOM 0 HA PRO A 34 16.791 -5.371 1.037 1.00 33.30 H new ATOM 0 HB2 PRO A 34 18.306 -5.892 -1.213 1.00 53.24 H new ATOM 0 HB3 PRO A 34 17.720 -4.270 -0.902 1.00 53.24 H new ATOM 0 HG2 PRO A 34 20.447 -5.429 -0.391 1.00 23.30 H new ATOM 0 HG3 PRO A 34 20.020 -3.851 -1.021 1.00 23.30 H new ATOM 0 HD2 PRO A 34 20.739 -4.260 1.600 1.00 35.41 H new ATOM 0 HD3 PRO A 34 19.686 -2.950 1.102 1.00 35.41 H new ATOM 520 N SER A 35 17.629 -7.806 0.142 1.00 64.15 N ATOM 521 CA SER A 35 17.792 -9.255 0.219 1.00 21.44 C ATOM 522 C SER A 35 17.043 -9.826 1.420 1.00 23.01 C ATOM 523 O SER A 35 17.371 -10.907 1.910 1.00 72.42 O ATOM 524 CB SER A 35 19.275 -9.621 0.307 1.00 31.22 C ATOM 525 OG SER A 35 19.500 -10.949 -0.132 1.00 12.45 O ATOM 0 H SER A 35 17.129 -7.482 -0.686 1.00 64.15 H new ATOM 0 HA SER A 35 17.372 -9.689 -0.688 1.00 21.44 H new ATOM 0 HB2 SER A 35 19.860 -8.930 -0.300 1.00 31.22 H new ATOM 0 HB3 SER A 35 19.619 -9.511 1.335 1.00 31.22 H new ATOM 0 HG SER A 35 18.897 -11.557 0.344 1.00 12.45 H new ATOM 531 N ILE A 36 16.035 -9.096 1.889 1.00 30.35 N ATOM 532 CA ILE A 36 15.240 -9.531 3.031 1.00 12.13 C ATOM 533 C ILE A 36 13.865 -8.872 3.021 1.00 35.52 C ATOM 534 O ILE A 36 13.540 -8.107 2.113 1.00 24.51 O ATOM 535 CB ILE A 36 15.942 -9.206 4.364 1.00 63.23 C ATOM 536 CG1 ILE A 36 16.203 -7.703 4.476 1.00 63.54 C ATOM 537 CG2 ILE A 36 17.243 -9.985 4.482 1.00 43.45 C ATOM 538 CD1 ILE A 36 15.068 -6.939 5.122 1.00 63.54 C ATOM 0 H ILE A 36 15.750 -8.200 1.495 1.00 30.35 H new ATOM 0 HA ILE A 36 15.126 -10.612 2.945 1.00 12.13 H new ATOM 0 HB ILE A 36 15.288 -9.504 5.183 1.00 63.23 H new ATOM 0 HG12 ILE A 36 17.113 -7.543 5.054 1.00 63.54 H new ATOM 0 HG13 ILE A 36 16.382 -7.298 3.480 1.00 63.54 H new ATOM 0 HG21 ILE A 36 17.727 -9.744 5.429 1.00 43.45 H new ATOM 0 HG22 ILE A 36 17.032 -11.054 4.444 1.00 43.45 H new ATOM 0 HG23 ILE A 36 17.904 -9.716 3.658 1.00 43.45 H new ATOM 0 HD11 ILE A 36 15.322 -5.880 5.168 1.00 63.54 H new ATOM 0 HD12 ILE A 36 14.160 -7.069 4.533 1.00 63.54 H new ATOM 0 HD13 ILE A 36 14.903 -7.317 6.131 1.00 63.54 H new ATOM 550 N GLU A 37 13.061 -9.171 4.036 1.00 13.34 N ATOM 551 CA GLU A 37 11.722 -8.604 4.141 1.00 73.11 C ATOM 552 C GLU A 37 11.783 -7.143 4.573 1.00 10.11 C ATOM 553 O GLU A 37 12.091 -6.838 5.725 1.00 52.55 O ATOM 554 CB GLU A 37 10.879 -9.411 5.131 1.00 3.34 C ATOM 555 CG GLU A 37 9.803 -10.254 4.466 1.00 3.50 C ATOM 556 CD GLU A 37 8.557 -9.456 4.137 1.00 21.44 C ATOM 557 OE1 GLU A 37 8.311 -8.434 4.811 1.00 21.41 O ATOM 558 OE2 GLU A 37 7.827 -9.853 3.204 1.00 5.02 O ATOM 0 H GLU A 37 13.313 -9.802 4.797 1.00 13.34 H new ATOM 0 HA GLU A 37 11.255 -8.652 3.157 1.00 73.11 H new ATOM 0 HB2 GLU A 37 11.535 -10.063 5.708 1.00 3.34 H new ATOM 0 HB3 GLU A 37 10.409 -8.727 5.837 1.00 3.34 H new ATOM 0 HG2 GLU A 37 10.203 -10.690 3.551 1.00 3.50 H new ATOM 0 HG3 GLU A 37 9.537 -11.081 5.124 1.00 3.50 H new ATOM 565 N ASP A 38 11.488 -6.243 3.641 1.00 24.21 N ATOM 566 CA ASP A 38 11.509 -4.813 3.925 1.00 14.44 C ATOM 567 C ASP A 38 10.247 -4.389 4.671 1.00 33.41 C ATOM 568 O ASP A 38 9.442 -3.610 4.160 1.00 3.34 O ATOM 569 CB ASP A 38 11.643 -4.016 2.625 1.00 62.43 C ATOM 570 CG ASP A 38 12.995 -4.206 1.966 1.00 62.31 C ATOM 571 OD1 ASP A 38 13.938 -4.642 2.659 1.00 51.25 O ATOM 572 OD2 ASP A 38 13.111 -3.920 0.755 1.00 4.23 O ATOM 0 H ASP A 38 11.232 -6.479 2.682 1.00 24.21 H new ATOM 0 HA ASP A 38 12.370 -4.605 4.559 1.00 14.44 H new ATOM 0 HB2 ASP A 38 10.858 -4.321 1.933 1.00 62.43 H new ATOM 0 HB3 ASP A 38 11.489 -2.957 2.834 1.00 62.43 H new ATOM 577 N SER A 39 10.081 -4.909 5.882 1.00 24.22 N ATOM 578 CA SER A 39 8.917 -4.587 6.700 1.00 52.02 C ATOM 579 C SER A 39 9.311 -3.727 7.896 1.00 32.42 C ATOM 580 O SER A 39 10.386 -3.899 8.471 1.00 13.24 O ATOM 581 CB SER A 39 8.237 -5.870 7.181 1.00 4.13 C ATOM 582 OG SER A 39 9.123 -6.657 7.958 1.00 12.21 O ATOM 0 H SER A 39 10.738 -5.555 6.319 1.00 24.22 H new ATOM 0 HA SER A 39 8.218 -4.021 6.085 1.00 52.02 H new ATOM 0 HB2 SER A 39 7.356 -5.619 7.771 1.00 4.13 H new ATOM 0 HB3 SER A 39 7.892 -6.446 6.322 1.00 4.13 H new ATOM 0 HG SER A 39 8.664 -7.470 8.255 1.00 12.21 H new ATOM 588 N TYR A 40 8.432 -2.801 8.266 1.00 40.11 N ATOM 589 CA TYR A 40 8.684 -1.912 9.394 1.00 15.21 C ATOM 590 C TYR A 40 7.418 -1.716 10.223 1.00 42.11 C ATOM 591 O TYR A 40 6.367 -1.360 9.691 1.00 51.30 O ATOM 592 CB TYR A 40 9.194 -0.557 8.900 1.00 65.32 C ATOM 593 CG TYR A 40 10.240 -0.655 7.812 1.00 21.11 C ATOM 594 CD1 TYR A 40 9.873 -0.703 6.474 1.00 72.01 C ATOM 595 CD2 TYR A 40 11.593 -0.699 8.124 1.00 23.00 C ATOM 596 CE1 TYR A 40 10.824 -0.792 5.475 1.00 54.54 C ATOM 597 CE2 TYR A 40 12.551 -0.787 7.131 1.00 44.32 C ATOM 598 CZ TYR A 40 12.161 -0.834 5.809 1.00 14.44 C ATOM 599 OH TYR A 40 13.112 -0.922 4.818 1.00 41.13 O ATOM 0 H TYR A 40 7.538 -2.647 7.800 1.00 40.11 H new ATOM 0 HA TYR A 40 9.445 -2.372 10.024 1.00 15.21 H new ATOM 0 HB2 TYR A 40 8.350 0.024 8.528 1.00 65.32 H new ATOM 0 HB3 TYR A 40 9.612 -0.008 9.744 1.00 65.32 H new ATOM 0 HD1 TYR A 40 8.826 -0.670 6.209 1.00 72.01 H new ATOM 0 HD2 TYR A 40 11.901 -0.664 9.158 1.00 23.00 H new ATOM 0 HE1 TYR A 40 10.522 -0.828 4.439 1.00 54.54 H new ATOM 0 HE2 TYR A 40 13.599 -0.819 7.389 1.00 44.32 H new ATOM 0 HH TYR A 40 14.005 -0.940 5.222 1.00 41.13 H new ATOM 609 N ARG A 41 7.525 -1.948 11.527 1.00 22.13 N ATOM 610 CA ARG A 41 6.386 -1.794 12.425 1.00 51.44 C ATOM 611 C ARG A 41 6.558 -0.568 13.317 1.00 25.02 C ATOM 612 O ARG A 41 7.584 -0.409 13.979 1.00 74.31 O ATOM 613 CB ARG A 41 6.208 -3.048 13.283 1.00 55.22 C ATOM 614 CG ARG A 41 7.336 -3.275 14.277 1.00 22.44 C ATOM 615 CD ARG A 41 7.160 -4.586 15.026 1.00 71.21 C ATOM 616 NE ARG A 41 8.256 -4.835 15.959 1.00 34.55 N ATOM 617 CZ ARG A 41 8.361 -5.935 16.702 1.00 3.21 C ATOM 618 NH1 ARG A 41 7.440 -6.887 16.623 1.00 71.14 N ATOM 619 NH2 ARG A 41 9.389 -6.083 17.526 1.00 31.50 N ATOM 0 H ARG A 41 8.387 -2.243 11.985 1.00 22.13 H new ATOM 0 HA ARG A 41 5.493 -1.654 11.816 1.00 51.44 H new ATOM 0 HB2 ARG A 41 5.266 -2.975 13.827 1.00 55.22 H new ATOM 0 HB3 ARG A 41 6.132 -3.917 12.629 1.00 55.22 H new ATOM 0 HG2 ARG A 41 8.291 -3.280 13.751 1.00 22.44 H new ATOM 0 HG3 ARG A 41 7.368 -2.449 14.988 1.00 22.44 H new ATOM 0 HD2 ARG A 41 6.217 -4.568 15.572 1.00 71.21 H new ATOM 0 HD3 ARG A 41 7.099 -5.407 14.311 1.00 71.21 H new ATOM 0 HE ARG A 41 8.983 -4.125 16.046 1.00 34.55 H new ATOM 0 HH11 ARG A 41 6.647 -6.778 15.991 1.00 71.14 H new ATOM 0 HH12 ARG A 41 7.525 -7.728 17.194 1.00 71.14 H new ATOM 0 HH21 ARG A 41 10.100 -5.354 17.591 1.00 31.50 H new ATOM 0 HH22 ARG A 41 9.469 -6.926 18.095 1.00 31.50 H new ATOM 633 N LYS A 42 5.549 0.296 13.328 1.00 60.32 N ATOM 634 CA LYS A 42 5.590 1.509 14.137 1.00 1.53 C ATOM 635 C LYS A 42 4.345 1.624 15.012 1.00 55.44 C ATOM 636 O LYS A 42 3.254 1.216 14.615 1.00 21.35 O ATOM 637 CB LYS A 42 5.712 2.741 13.239 1.00 54.00 C ATOM 638 CG LYS A 42 6.714 3.766 13.745 1.00 12.35 C ATOM 639 CD LYS A 42 6.952 4.867 12.721 1.00 34.41 C ATOM 640 CE LYS A 42 6.378 6.197 13.183 1.00 4.43 C ATOM 641 NZ LYS A 42 7.446 7.197 13.458 1.00 22.33 N ATOM 0 H LYS A 42 4.693 0.179 12.786 1.00 60.32 H new ATOM 0 HA LYS A 42 6.463 1.453 14.787 1.00 1.53 H new ATOM 0 HB2 LYS A 42 6.004 2.423 12.238 1.00 54.00 H new ATOM 0 HB3 LYS A 42 4.734 3.214 13.151 1.00 54.00 H new ATOM 0 HG2 LYS A 42 6.350 4.204 14.674 1.00 12.35 H new ATOM 0 HG3 LYS A 42 7.658 3.271 13.975 1.00 12.35 H new ATOM 0 HD2 LYS A 42 8.022 4.974 12.544 1.00 34.41 H new ATOM 0 HD3 LYS A 42 6.498 4.585 11.771 1.00 34.41 H new ATOM 0 HE2 LYS A 42 5.704 6.586 12.420 1.00 4.43 H new ATOM 0 HE3 LYS A 42 5.784 6.043 14.084 1.00 4.43 H new ATOM 0 HZ1 LYS A 42 7.046 8.156 13.404 1.00 22.33 H new ATOM 0 HZ2 LYS A 42 7.834 7.037 14.409 1.00 22.33 H new ATOM 0 HZ3 LYS A 42 8.204 7.098 12.753 1.00 22.33 H new ATOM 655 N GLN A 43 4.518 2.185 16.204 1.00 20.44 N ATOM 656 CA GLN A 43 3.411 2.359 17.136 1.00 5.34 C ATOM 657 C GLN A 43 2.763 3.728 16.955 1.00 25.33 C ATOM 658 O GLN A 43 3.451 4.747 16.894 1.00 45.05 O ATOM 659 CB GLN A 43 3.901 2.203 18.577 1.00 3.04 C ATOM 660 CG GLN A 43 2.790 2.292 19.610 1.00 21.10 C ATOM 661 CD GLN A 43 2.752 3.636 20.310 1.00 1.00 C ATOM 662 OE1 GLN A 43 2.568 4.675 19.675 1.00 60.55 O ATOM 663 NE2 GLN A 43 2.926 3.622 21.626 1.00 61.22 N ATOM 0 H GLN A 43 5.415 2.527 16.547 1.00 20.44 H new ATOM 0 HA GLN A 43 2.667 1.591 16.927 1.00 5.34 H new ATOM 0 HB2 GLN A 43 4.404 1.242 18.679 1.00 3.04 H new ATOM 0 HB3 GLN A 43 4.642 2.974 18.785 1.00 3.04 H new ATOM 0 HG2 GLN A 43 1.831 2.113 19.124 1.00 21.10 H new ATOM 0 HG3 GLN A 43 2.924 1.504 20.351 1.00 21.10 H new ATOM 0 HE21 GLN A 43 3.075 2.737 22.111 1.00 61.22 H new ATOM 0 HE22 GLN A 43 2.910 4.496 22.152 1.00 61.22 H new ATOM 672 N VAL A 44 1.437 3.747 16.868 1.00 40.53 N ATOM 673 CA VAL A 44 0.704 4.994 16.694 1.00 3.30 C ATOM 674 C VAL A 44 -0.640 4.950 17.415 1.00 22.33 C ATOM 675 O VAL A 44 -0.995 3.943 18.027 1.00 33.22 O ATOM 676 CB VAL A 44 0.468 5.305 15.201 1.00 3.15 C ATOM 677 CG1 VAL A 44 1.791 5.362 14.454 1.00 1.04 C ATOM 678 CG2 VAL A 44 -0.459 4.274 14.573 1.00 23.23 C ATOM 0 H VAL A 44 0.850 2.914 16.915 1.00 40.53 H new ATOM 0 HA VAL A 44 1.317 5.784 17.128 1.00 3.30 H new ATOM 0 HB VAL A 44 -0.012 6.281 15.127 1.00 3.15 H new ATOM 0 HG11 VAL A 44 1.606 5.582 13.403 1.00 1.04 H new ATOM 0 HG12 VAL A 44 2.418 6.143 14.884 1.00 1.04 H new ATOM 0 HG13 VAL A 44 2.299 4.401 14.540 1.00 1.04 H new ATOM 0 HG21 VAL A 44 -0.611 4.514 13.521 1.00 23.23 H new ATOM 0 HG22 VAL A 44 -0.013 3.283 14.659 1.00 23.23 H new ATOM 0 HG23 VAL A 44 -1.419 4.285 15.089 1.00 23.23 H new ATOM 688 N VAL A 45 -1.383 6.048 17.335 1.00 31.33 N ATOM 689 CA VAL A 45 -2.689 6.135 17.976 1.00 25.12 C ATOM 690 C VAL A 45 -3.761 6.560 16.979 1.00 3.34 C ATOM 691 O VAL A 45 -3.888 7.741 16.655 1.00 11.32 O ATOM 692 CB VAL A 45 -2.675 7.130 19.151 1.00 23.44 C ATOM 693 CG1 VAL A 45 -3.974 7.045 19.938 1.00 4.33 C ATOM 694 CG2 VAL A 45 -1.478 6.875 20.054 1.00 63.52 C ATOM 0 H VAL A 45 -1.103 6.890 16.832 1.00 31.33 H new ATOM 0 HA VAL A 45 -2.921 5.140 18.356 1.00 25.12 H new ATOM 0 HB VAL A 45 -2.587 8.139 18.747 1.00 23.44 H new ATOM 0 HG11 VAL A 45 -3.946 7.755 20.764 1.00 4.33 H new ATOM 0 HG12 VAL A 45 -4.812 7.283 19.283 1.00 4.33 H new ATOM 0 HG13 VAL A 45 -4.096 6.036 20.331 1.00 4.33 H new ATOM 0 HG21 VAL A 45 -1.486 7.588 20.878 1.00 63.52 H new ATOM 0 HG22 VAL A 45 -1.531 5.861 20.451 1.00 63.52 H new ATOM 0 HG23 VAL A 45 -0.558 6.993 19.481 1.00 63.52 H new ATOM 704 N ILE A 46 -4.530 5.591 16.495 1.00 42.11 N ATOM 705 CA ILE A 46 -5.592 5.865 15.535 1.00 65.03 C ATOM 706 C ILE A 46 -6.957 5.513 16.115 1.00 24.24 C ATOM 707 O ILE A 46 -7.121 4.474 16.756 1.00 12.14 O ATOM 708 CB ILE A 46 -5.384 5.081 14.225 1.00 0.05 C ATOM 709 CG1 ILE A 46 -3.957 5.278 13.708 1.00 3.50 C ATOM 710 CG2 ILE A 46 -6.398 5.518 13.177 1.00 45.24 C ATOM 711 CD1 ILE A 46 -3.674 4.541 12.417 1.00 1.13 C ATOM 0 H ILE A 46 -4.437 4.608 16.752 1.00 42.11 H new ATOM 0 HA ILE A 46 -5.555 6.932 15.318 1.00 65.03 H new ATOM 0 HB ILE A 46 -5.535 4.020 14.427 1.00 0.05 H new ATOM 0 HG12 ILE A 46 -3.778 6.342 13.556 1.00 3.50 H new ATOM 0 HG13 ILE A 46 -3.254 4.942 14.470 1.00 3.50 H new ATOM 0 HG21 ILE A 46 -6.237 4.955 12.258 1.00 45.24 H new ATOM 0 HG22 ILE A 46 -7.406 5.330 13.546 1.00 45.24 H new ATOM 0 HG23 ILE A 46 -6.278 6.582 12.976 1.00 45.24 H new ATOM 0 HD11 ILE A 46 -2.645 4.726 12.110 1.00 1.13 H new ATOM 0 HD12 ILE A 46 -3.820 3.472 12.569 1.00 1.13 H new ATOM 0 HD13 ILE A 46 -4.353 4.893 11.641 1.00 1.13 H new ATOM 723 N ASP A 47 -7.933 6.386 15.889 1.00 61.23 N ATOM 724 CA ASP A 47 -9.286 6.168 16.391 1.00 2.43 C ATOM 725 C ASP A 47 -9.304 6.145 17.917 1.00 12.03 C ATOM 726 O ASP A 47 -10.154 5.497 18.527 1.00 21.21 O ATOM 727 CB ASP A 47 -9.854 4.858 15.839 1.00 55.24 C ATOM 728 CG ASP A 47 -11.201 5.048 15.170 1.00 11.11 C ATOM 729 OD1 ASP A 47 -12.160 5.438 15.868 1.00 43.01 O ATOM 730 OD2 ASP A 47 -11.296 4.806 13.948 1.00 62.14 O ATOM 0 H ASP A 47 -7.813 7.251 15.362 1.00 61.23 H new ATOM 0 HA ASP A 47 -9.910 6.995 16.052 1.00 2.43 H new ATOM 0 HB2 ASP A 47 -9.151 4.435 15.121 1.00 55.24 H new ATOM 0 HB3 ASP A 47 -9.953 4.138 16.651 1.00 55.24 H new ATOM 735 N GLY A 48 -8.360 6.856 18.527 1.00 21.34 N ATOM 736 CA GLY A 48 -8.287 6.902 19.976 1.00 41.25 C ATOM 737 C GLY A 48 -7.898 5.568 20.581 1.00 42.50 C ATOM 738 O GLY A 48 -8.327 5.232 21.686 1.00 12.32 O ATOM 0 H GLY A 48 -7.645 7.400 18.044 1.00 21.34 H new ATOM 0 HA2 GLY A 48 -7.562 7.658 20.276 1.00 41.25 H new ATOM 0 HA3 GLY A 48 -9.253 7.210 20.375 1.00 41.25 H new ATOM 742 N GLU A 49 -7.085 4.806 19.858 1.00 73.54 N ATOM 743 CA GLU A 49 -6.638 3.501 20.331 1.00 72.21 C ATOM 744 C GLU A 49 -5.216 3.208 19.864 1.00 74.53 C ATOM 745 O GLU A 49 -4.985 2.919 18.689 1.00 70.22 O ATOM 746 CB GLU A 49 -7.586 2.404 19.839 1.00 62.31 C ATOM 747 CG GLU A 49 -7.182 1.006 20.280 1.00 63.02 C ATOM 748 CD GLU A 49 -8.336 0.225 20.877 1.00 22.52 C ATOM 749 OE1 GLU A 49 -9.277 -0.111 20.127 1.00 30.15 O ATOM 750 OE2 GLU A 49 -8.299 -0.051 22.095 1.00 41.24 O ATOM 0 H GLU A 49 -6.722 5.069 18.942 1.00 73.54 H new ATOM 0 HA GLU A 49 -6.646 3.517 21.421 1.00 72.21 H new ATOM 0 HB2 GLU A 49 -8.591 2.614 20.203 1.00 62.31 H new ATOM 0 HB3 GLU A 49 -7.629 2.434 18.750 1.00 62.31 H new ATOM 0 HG2 GLU A 49 -6.783 0.461 19.425 1.00 63.02 H new ATOM 0 HG3 GLU A 49 -6.379 1.079 21.014 1.00 63.02 H new ATOM 757 N THR A 50 -4.267 3.283 20.790 1.00 43.32 N ATOM 758 CA THR A 50 -2.868 3.024 20.473 1.00 11.14 C ATOM 759 C THR A 50 -2.682 1.593 19.980 1.00 21.22 C ATOM 760 O THR A 50 -3.076 0.639 20.651 1.00 5.21 O ATOM 761 CB THR A 50 -1.991 3.272 21.702 1.00 44.23 C ATOM 762 OG1 THR A 50 -2.137 4.604 22.161 1.00 10.20 O ATOM 763 CG2 THR A 50 -0.518 3.034 21.447 1.00 55.04 C ATOM 0 H THR A 50 -4.441 3.521 21.766 1.00 43.32 H new ATOM 0 HA THR A 50 -2.566 3.706 19.678 1.00 11.14 H new ATOM 0 HB THR A 50 -2.333 2.556 22.449 1.00 44.23 H new ATOM 0 HG1 THR A 50 -1.570 4.743 22.948 1.00 10.20 H new ATOM 0 HG21 THR A 50 0.045 3.228 22.360 1.00 55.04 H new ATOM 0 HG22 THR A 50 -0.365 2.000 21.139 1.00 55.04 H new ATOM 0 HG23 THR A 50 -0.173 3.703 20.658 1.00 55.04 H new ATOM 771 N CYS A 51 -2.081 1.450 18.803 1.00 42.22 N ATOM 772 CA CYS A 51 -1.846 0.133 18.222 1.00 43.00 C ATOM 773 C CYS A 51 -0.580 0.126 17.375 1.00 4.41 C ATOM 774 O CYS A 51 -0.066 1.178 16.996 1.00 43.32 O ATOM 775 CB CYS A 51 -3.041 -0.291 17.367 1.00 32.35 C ATOM 776 SG CYS A 51 -4.539 -0.648 18.315 1.00 43.14 S ATOM 0 H CYS A 51 -1.748 2.228 18.234 1.00 42.22 H new ATOM 0 HA CYS A 51 -1.719 -0.576 19.040 1.00 43.00 H new ATOM 0 HB2 CYS A 51 -3.259 0.499 16.649 1.00 32.35 H new ATOM 0 HB3 CYS A 51 -2.767 -1.177 16.793 1.00 32.35 H new ATOM 0 HG CYS A 51 -4.357 -0.312 19.558 1.00 43.14 H new ATOM 782 N LEU A 52 -0.087 -1.071 17.079 1.00 14.00 N ATOM 783 CA LEU A 52 1.116 -1.224 16.273 1.00 2.20 C ATOM 784 C LEU A 52 0.768 -1.244 14.788 1.00 51.20 C ATOM 785 O LEU A 52 -0.305 -1.706 14.399 1.00 5.32 O ATOM 786 CB LEU A 52 1.850 -2.511 16.662 1.00 75.55 C ATOM 787 CG LEU A 52 3.266 -2.312 17.204 1.00 1.13 C ATOM 788 CD1 LEU A 52 4.204 -1.865 16.093 1.00 23.41 C ATOM 789 CD2 LEU A 52 3.263 -1.302 18.341 1.00 50.41 C ATOM 0 H LEU A 52 -0.503 -1.950 17.386 1.00 14.00 H new ATOM 0 HA LEU A 52 1.770 -0.373 16.462 1.00 2.20 H new ATOM 0 HB2 LEU A 52 1.260 -3.034 17.414 1.00 75.55 H new ATOM 0 HB3 LEU A 52 1.900 -3.161 15.788 1.00 75.55 H new ATOM 0 HG LEU A 52 3.625 -3.265 17.592 1.00 1.13 H new ATOM 0 HD11 LEU A 52 5.207 -1.728 16.497 1.00 23.41 H new ATOM 0 HD12 LEU A 52 4.228 -2.623 15.310 1.00 23.41 H new ATOM 0 HD13 LEU A 52 3.850 -0.923 15.675 1.00 23.41 H new ATOM 0 HD21 LEU A 52 4.279 -1.172 18.715 1.00 50.41 H new ATOM 0 HD22 LEU A 52 2.885 -0.346 17.978 1.00 50.41 H new ATOM 0 HD23 LEU A 52 2.623 -1.663 19.146 1.00 50.41 H new ATOM 801 N LEU A 53 1.676 -0.736 13.962 1.00 60.42 N ATOM 802 CA LEU A 53 1.457 -0.694 12.521 1.00 31.22 C ATOM 803 C LEU A 53 2.558 -1.442 11.776 1.00 33.04 C ATOM 804 O LEU A 53 3.501 -0.834 11.270 1.00 51.12 O ATOM 805 CB LEU A 53 1.392 0.756 12.038 1.00 50.31 C ATOM 806 CG LEU A 53 0.168 1.541 12.511 1.00 61.54 C ATOM 807 CD1 LEU A 53 0.183 2.948 11.934 1.00 44.15 C ATOM 808 CD2 LEU A 53 -1.112 0.817 12.122 1.00 75.11 C ATOM 0 H LEU A 53 2.569 -0.348 14.265 1.00 60.42 H new ATOM 0 HA LEU A 53 0.507 -1.185 12.310 1.00 31.22 H new ATOM 0 HB2 LEU A 53 2.290 1.275 12.373 1.00 50.31 H new ATOM 0 HB3 LEU A 53 1.409 0.761 10.948 1.00 50.31 H new ATOM 0 HG LEU A 53 0.204 1.615 13.598 1.00 61.54 H new ATOM 0 HD11 LEU A 53 -0.695 3.493 12.281 1.00 44.15 H new ATOM 0 HD12 LEU A 53 1.084 3.466 12.262 1.00 44.15 H new ATOM 0 HD13 LEU A 53 0.171 2.895 10.845 1.00 44.15 H new ATOM 0 HD21 LEU A 53 -1.973 1.390 12.467 1.00 75.11 H new ATOM 0 HD22 LEU A 53 -1.156 0.713 11.038 1.00 75.11 H new ATOM 0 HD23 LEU A 53 -1.126 -0.171 12.582 1.00 75.11 H new ATOM 820 N ASP A 54 2.429 -2.763 11.710 1.00 72.14 N ATOM 821 CA ASP A 54 3.411 -3.594 11.023 1.00 54.24 C ATOM 822 C ASP A 54 3.245 -3.491 9.510 1.00 54.43 C ATOM 823 O ASP A 54 2.389 -4.154 8.924 1.00 60.13 O ATOM 824 CB ASP A 54 3.275 -5.052 11.465 1.00 53.04 C ATOM 825 CG ASP A 54 4.026 -5.341 12.749 1.00 43.21 C ATOM 826 OD1 ASP A 54 3.731 -4.684 13.770 1.00 43.41 O ATOM 827 OD2 ASP A 54 4.909 -6.224 12.735 1.00 23.21 O ATOM 0 H ASP A 54 1.654 -3.281 12.124 1.00 72.14 H new ATOM 0 HA ASP A 54 4.405 -3.234 11.287 1.00 54.24 H new ATOM 0 HB2 ASP A 54 2.220 -5.290 11.603 1.00 53.04 H new ATOM 0 HB3 ASP A 54 3.648 -5.704 10.675 1.00 53.04 H new ATOM 832 N ILE A 55 4.065 -2.654 8.885 1.00 75.45 N ATOM 833 CA ILE A 55 4.007 -2.461 7.440 1.00 71.11 C ATOM 834 C ILE A 55 4.907 -3.458 6.714 1.00 51.14 C ATOM 835 O ILE A 55 6.131 -3.389 6.816 1.00 63.23 O ATOM 836 CB ILE A 55 4.425 -1.029 7.046 1.00 1.40 C ATOM 837 CG1 ILE A 55 3.815 -0.007 8.009 1.00 35.32 C ATOM 838 CG2 ILE A 55 4.004 -0.727 5.616 1.00 74.43 C ATOM 839 CD1 ILE A 55 2.306 -0.075 8.085 1.00 63.31 C ATOM 0 H ILE A 55 4.778 -2.098 9.356 1.00 75.45 H new ATOM 0 HA ILE A 55 2.972 -2.625 7.141 1.00 71.11 H new ATOM 0 HB ILE A 55 5.511 -0.958 7.110 1.00 1.40 H new ATOM 0 HG12 ILE A 55 4.228 -0.166 9.005 1.00 35.32 H new ATOM 0 HG13 ILE A 55 4.110 0.995 7.698 1.00 35.32 H new ATOM 0 HG21 ILE A 55 4.306 0.287 5.354 1.00 74.43 H new ATOM 0 HG22 ILE A 55 4.482 -1.435 4.939 1.00 74.43 H new ATOM 0 HG23 ILE A 55 2.921 -0.817 5.529 1.00 74.43 H new ATOM 0 HD11 ILE A 55 1.943 0.677 8.786 1.00 63.31 H new ATOM 0 HD12 ILE A 55 1.883 0.114 7.098 1.00 63.31 H new ATOM 0 HD13 ILE A 55 2.003 -1.065 8.426 1.00 63.31 H new ATOM 851 N LEU A 56 4.293 -4.382 5.979 1.00 52.04 N ATOM 852 CA LEU A 56 5.041 -5.386 5.237 1.00 61.10 C ATOM 853 C LEU A 56 5.199 -4.966 3.778 1.00 72.21 C ATOM 854 O LEU A 56 4.214 -4.795 3.059 1.00 12.54 O ATOM 855 CB LEU A 56 4.332 -6.741 5.330 1.00 64.04 C ATOM 856 CG LEU A 56 4.752 -7.774 4.281 1.00 4.32 C ATOM 857 CD1 LEU A 56 5.158 -9.079 4.945 1.00 32.12 C ATOM 858 CD2 LEU A 56 3.624 -8.008 3.291 1.00 43.34 C ATOM 0 H LEU A 56 3.280 -4.454 5.883 1.00 52.04 H new ATOM 0 HA LEU A 56 6.035 -5.478 5.675 1.00 61.10 H new ATOM 0 HB2 LEU A 56 4.512 -7.159 6.320 1.00 64.04 H new ATOM 0 HB3 LEU A 56 3.258 -6.577 5.244 1.00 64.04 H new ATOM 0 HG LEU A 56 5.614 -7.385 3.740 1.00 4.32 H new ATOM 0 HD11 LEU A 56 5.453 -9.799 4.182 1.00 32.12 H new ATOM 0 HD12 LEU A 56 5.997 -8.899 5.618 1.00 32.12 H new ATOM 0 HD13 LEU A 56 4.316 -9.476 5.512 1.00 32.12 H new ATOM 0 HD21 LEU A 56 3.936 -8.745 2.551 1.00 43.34 H new ATOM 0 HD22 LEU A 56 2.745 -8.376 3.821 1.00 43.34 H new ATOM 0 HD23 LEU A 56 3.380 -7.071 2.790 1.00 43.34 H new ATOM 870 N ASP A 57 6.445 -4.802 3.348 1.00 43.13 N ATOM 871 CA ASP A 57 6.737 -4.404 1.977 1.00 55.42 C ATOM 872 C ASP A 57 7.357 -5.561 1.202 1.00 34.13 C ATOM 873 O ASP A 57 8.560 -5.806 1.289 1.00 71.10 O ATOM 874 CB ASP A 57 7.679 -3.198 1.961 1.00 74.12 C ATOM 875 CG ASP A 57 7.552 -2.381 0.689 1.00 63.40 C ATOM 876 OD1 ASP A 57 6.707 -1.461 0.657 1.00 1.24 O ATOM 877 OD2 ASP A 57 8.297 -2.661 -0.273 1.00 40.24 O ATOM 0 H ASP A 57 7.271 -4.939 3.931 1.00 43.13 H new ATOM 0 HA ASP A 57 5.800 -4.126 1.496 1.00 55.42 H new ATOM 0 HB2 ASP A 57 7.466 -2.562 2.820 1.00 74.12 H new ATOM 0 HB3 ASP A 57 8.708 -3.543 2.067 1.00 74.12 H new ATOM 882 N THR A 58 6.526 -6.272 0.449 1.00 60.12 N ATOM 883 CA THR A 58 6.991 -7.408 -0.338 1.00 24.53 C ATOM 884 C THR A 58 7.750 -6.940 -1.574 1.00 72.40 C ATOM 885 O THR A 58 7.964 -5.743 -1.767 1.00 72.33 O ATOM 886 CB THR A 58 5.809 -8.285 -0.755 1.00 12.21 C ATOM 887 OG1 THR A 58 5.104 -7.697 -1.834 1.00 1.33 O ATOM 888 CG2 THR A 58 4.819 -8.526 0.364 1.00 30.12 C ATOM 0 H THR A 58 5.527 -6.082 0.367 1.00 60.12 H new ATOM 0 HA THR A 58 7.669 -7.994 0.283 1.00 24.53 H new ATOM 0 HB THR A 58 6.246 -9.241 -1.044 1.00 12.21 H new ATOM 0 HG1 THR A 58 4.353 -8.274 -2.087 1.00 1.33 H new ATOM 0 HG21 THR A 58 4.006 -9.155 0.001 1.00 30.12 H new ATOM 0 HG22 THR A 58 5.321 -9.025 1.193 1.00 30.12 H new ATOM 0 HG23 THR A 58 4.416 -7.572 0.705 1.00 30.12 H new ATOM 896 N ALA A 59 8.153 -7.892 -2.409 1.00 1.34 N ATOM 897 CA ALA A 59 8.888 -7.578 -3.628 1.00 32.22 C ATOM 898 C ALA A 59 7.951 -7.511 -4.829 1.00 14.54 C ATOM 899 O ALA A 59 7.277 -8.487 -5.157 1.00 53.51 O ATOM 900 CB ALA A 59 9.981 -8.608 -3.866 1.00 11.54 C ATOM 0 H ALA A 59 7.983 -8.887 -2.264 1.00 1.34 H new ATOM 0 HA ALA A 59 9.350 -6.598 -3.503 1.00 32.22 H new ATOM 0 HB1 ALA A 59 10.521 -8.361 -4.780 1.00 11.54 H new ATOM 0 HB2 ALA A 59 10.673 -8.606 -3.024 1.00 11.54 H new ATOM 0 HB3 ALA A 59 9.534 -9.597 -3.966 1.00 11.54 H new ATOM 906 N GLY A 60 7.914 -6.353 -5.480 1.00 20.41 N ATOM 907 CA GLY A 60 7.056 -6.181 -6.637 1.00 54.21 C ATOM 908 C GLY A 60 7.489 -7.032 -7.815 1.00 25.35 C ATOM 909 O GLY A 60 6.680 -7.356 -8.685 1.00 64.24 O ATOM 0 H GLY A 60 8.463 -5.531 -5.227 1.00 20.41 H new ATOM 0 HA2 GLY A 60 6.031 -6.436 -6.366 1.00 54.21 H new ATOM 0 HA3 GLY A 60 7.056 -5.132 -6.932 1.00 54.21 H new ATOM 913 N GLN A 61 8.768 -7.394 -7.846 1.00 2.31 N ATOM 914 CA GLN A 61 9.306 -8.211 -8.927 1.00 21.31 C ATOM 915 C GLN A 61 9.840 -9.538 -8.396 1.00 75.22 C ATOM 916 O GLN A 61 9.633 -9.880 -7.232 1.00 23.33 O ATOM 917 CB GLN A 61 10.415 -7.456 -9.657 1.00 71.31 C ATOM 918 CG GLN A 61 11.625 -7.177 -8.786 1.00 21.23 C ATOM 919 CD GLN A 61 12.894 -7.813 -9.322 1.00 10.23 C ATOM 920 OE1 GLN A 61 13.678 -8.392 -8.571 1.00 31.35 O ATOM 921 NE2 GLN A 61 13.101 -7.708 -10.630 1.00 34.50 N ATOM 0 H GLN A 61 9.451 -7.134 -7.134 1.00 2.31 H new ATOM 0 HA GLN A 61 8.497 -8.423 -9.626 1.00 21.31 H new ATOM 0 HB2 GLN A 61 10.727 -8.035 -10.526 1.00 71.31 H new ATOM 0 HB3 GLN A 61 10.018 -6.511 -10.029 1.00 71.31 H new ATOM 0 HG2 GLN A 61 11.769 -6.100 -8.707 1.00 21.23 H new ATOM 0 HG3 GLN A 61 11.435 -7.548 -7.779 1.00 21.23 H new ATOM 0 HE21 GLN A 61 12.424 -7.219 -11.216 1.00 34.50 H new ATOM 0 HE22 GLN A 61 13.937 -8.117 -11.048 1.00 34.50 H new ATOM 930 N GLU A 62 10.530 -10.281 -9.257 1.00 12.41 N ATOM 931 CA GLU A 62 11.097 -11.571 -8.877 1.00 13.23 C ATOM 932 C GLU A 62 9.996 -12.578 -8.557 1.00 53.34 C ATOM 933 O GLU A 62 8.910 -12.206 -8.111 1.00 4.53 O ATOM 934 CB GLU A 62 12.028 -11.410 -7.671 1.00 41.14 C ATOM 935 CG GLU A 62 13.499 -11.577 -8.013 1.00 1.01 C ATOM 936 CD GLU A 62 13.908 -13.031 -8.135 1.00 22.31 C ATOM 937 OE1 GLU A 62 13.072 -13.848 -8.574 1.00 63.43 O ATOM 938 OE2 GLU A 62 15.065 -13.354 -7.790 1.00 70.04 O ATOM 0 H GLU A 62 10.710 -10.011 -10.224 1.00 12.41 H new ATOM 0 HA GLU A 62 11.673 -11.948 -9.722 1.00 13.23 H new ATOM 0 HB2 GLU A 62 11.875 -10.424 -7.233 1.00 41.14 H new ATOM 0 HB3 GLU A 62 11.755 -12.142 -6.911 1.00 41.14 H new ATOM 0 HG2 GLU A 62 13.710 -11.064 -8.951 1.00 1.01 H new ATOM 0 HG3 GLU A 62 14.104 -11.097 -7.244 1.00 1.01 H new ATOM 945 N GLU A 63 10.285 -13.854 -8.789 1.00 35.12 N ATOM 946 CA GLU A 63 9.322 -14.917 -8.526 1.00 61.40 C ATOM 947 C GLU A 63 9.235 -15.211 -7.032 1.00 43.14 C ATOM 948 O GLU A 63 10.250 -15.445 -6.376 1.00 51.05 O ATOM 949 CB GLU A 63 9.712 -16.186 -9.285 1.00 51.44 C ATOM 950 CG GLU A 63 9.353 -16.146 -10.761 1.00 10.43 C ATOM 951 CD GLU A 63 8.902 -17.495 -11.288 1.00 33.15 C ATOM 952 OE1 GLU A 63 9.674 -18.469 -11.163 1.00 34.11 O ATOM 953 OE2 GLU A 63 7.778 -17.577 -11.824 1.00 35.35 O ATOM 0 H GLU A 63 11.179 -14.177 -9.159 1.00 35.12 H new ATOM 0 HA GLU A 63 8.344 -14.582 -8.871 1.00 61.40 H new ATOM 0 HB2 GLU A 63 10.786 -16.344 -9.185 1.00 51.44 H new ATOM 0 HB3 GLU A 63 9.220 -17.042 -8.823 1.00 51.44 H new ATOM 0 HG2 GLU A 63 8.560 -15.415 -10.919 1.00 10.43 H new ATOM 0 HG3 GLU A 63 10.217 -15.807 -11.332 1.00 10.43 H new ATOM 960 N TYR A 64 8.018 -15.196 -6.499 1.00 43.11 N ATOM 961 CA TYR A 64 7.804 -15.459 -5.081 1.00 64.31 C ATOM 962 C TYR A 64 6.314 -15.474 -4.749 1.00 35.35 C ATOM 963 O TYR A 64 5.901 -15.016 -3.683 1.00 3.12 O ATOM 964 CB TYR A 64 8.523 -14.404 -4.235 1.00 10.01 C ATOM 965 CG TYR A 64 9.803 -14.902 -3.599 1.00 74.34 C ATOM 966 CD1 TYR A 64 9.873 -16.168 -3.031 1.00 71.21 C ATOM 967 CD2 TYR A 64 10.939 -14.105 -3.565 1.00 34.13 C ATOM 968 CE1 TYR A 64 11.039 -16.625 -2.447 1.00 72.03 C ATOM 969 CE2 TYR A 64 12.109 -14.554 -2.984 1.00 44.15 C ATOM 970 CZ TYR A 64 12.154 -15.814 -2.426 1.00 12.31 C ATOM 971 OH TYR A 64 13.317 -16.265 -1.845 1.00 24.20 O ATOM 0 H TYR A 64 7.166 -15.005 -7.027 1.00 43.11 H new ATOM 0 HA TYR A 64 8.215 -16.441 -4.849 1.00 64.31 H new ATOM 0 HB2 TYR A 64 8.751 -13.542 -4.862 1.00 10.01 H new ATOM 0 HB3 TYR A 64 7.849 -14.059 -3.451 1.00 10.01 H new ATOM 0 HD1 TYR A 64 9.001 -16.806 -3.046 1.00 71.21 H new ATOM 0 HD2 TYR A 64 10.908 -13.117 -4.000 1.00 34.13 H new ATOM 0 HE1 TYR A 64 11.077 -17.612 -2.010 1.00 72.03 H new ATOM 0 HE2 TYR A 64 12.984 -13.921 -2.967 1.00 44.15 H new ATOM 0 HH TYR A 64 14.007 -15.573 -1.915 1.00 24.20 H new ATOM 981 N SER A 65 5.511 -16.007 -5.666 1.00 73.23 N ATOM 982 CA SER A 65 4.068 -16.082 -5.463 1.00 34.32 C ATOM 983 C SER A 65 3.742 -16.809 -4.163 1.00 30.24 C ATOM 984 O SER A 65 2.786 -16.462 -3.468 1.00 43.42 O ATOM 985 CB SER A 65 3.399 -16.793 -6.641 1.00 10.42 C ATOM 986 OG SER A 65 4.303 -17.671 -7.288 1.00 42.11 O ATOM 0 H SER A 65 5.834 -16.392 -6.554 1.00 73.23 H new ATOM 0 HA SER A 65 3.682 -15.065 -5.398 1.00 34.32 H new ATOM 0 HB2 SER A 65 2.534 -17.353 -6.287 1.00 10.42 H new ATOM 0 HB3 SER A 65 3.031 -16.055 -7.354 1.00 10.42 H new ATOM 0 HG SER A 65 3.850 -18.114 -8.036 1.00 42.11 H new ATOM 992 N ALA A 66 4.547 -17.814 -3.836 1.00 34.11 N ATOM 993 CA ALA A 66 4.350 -18.583 -2.615 1.00 44.23 C ATOM 994 C ALA A 66 4.381 -17.673 -1.393 1.00 34.43 C ATOM 995 O ALA A 66 3.748 -17.957 -0.377 1.00 34.31 O ATOM 996 CB ALA A 66 5.411 -19.667 -2.495 1.00 15.35 C ATOM 0 H ALA A 66 5.342 -18.114 -4.400 1.00 34.11 H new ATOM 0 HA ALA A 66 3.370 -19.057 -2.664 1.00 44.23 H new ATOM 0 HB1 ALA A 66 5.251 -20.233 -1.578 1.00 15.35 H new ATOM 0 HB2 ALA A 66 5.344 -20.338 -3.352 1.00 15.35 H new ATOM 0 HB3 ALA A 66 6.399 -19.208 -2.470 1.00 15.35 H new ATOM 1002 N MET A 67 5.115 -16.571 -1.505 1.00 33.33 N ATOM 1003 CA MET A 67 5.223 -15.613 -0.412 1.00 74.35 C ATOM 1004 C MET A 67 3.977 -14.738 -0.348 1.00 52.32 C ATOM 1005 O MET A 67 3.496 -14.397 0.733 1.00 15.21 O ATOM 1006 CB MET A 67 6.464 -14.728 -0.586 1.00 54.14 C ATOM 1007 CG MET A 67 7.711 -15.479 -1.029 1.00 1.12 C ATOM 1008 SD MET A 67 8.699 -16.067 0.359 1.00 11.33 S ATOM 1009 CE MET A 67 7.764 -17.511 0.857 1.00 73.13 C ATOM 0 H MET A 67 5.643 -16.320 -2.341 1.00 33.33 H new ATOM 0 HA MET A 67 5.317 -16.172 0.519 1.00 74.35 H new ATOM 0 HB2 MET A 67 6.242 -13.951 -1.318 1.00 54.14 H new ATOM 0 HB3 MET A 67 6.673 -14.225 0.358 1.00 54.14 H new ATOM 0 HG2 MET A 67 7.418 -16.328 -1.647 1.00 1.12 H new ATOM 0 HG3 MET A 67 8.321 -14.826 -1.653 1.00 1.12 H new ATOM 0 HE1 MET A 67 7.270 -17.314 1.808 1.00 73.13 H new ATOM 0 HE2 MET A 67 7.014 -17.738 0.099 1.00 73.13 H new ATOM 0 HE3 MET A 67 8.438 -18.361 0.967 1.00 73.13 H new ATOM 1019 N ARG A 68 3.466 -14.375 -1.518 1.00 34.43 N ATOM 1020 CA ARG A 68 2.280 -13.533 -1.614 1.00 14.30 C ATOM 1021 C ARG A 68 1.083 -14.171 -0.912 1.00 4.22 C ATOM 1022 O ARG A 68 0.516 -13.595 0.017 1.00 5.41 O ATOM 1023 CB ARG A 68 1.944 -13.273 -3.086 1.00 41.21 C ATOM 1024 CG ARG A 68 1.494 -11.849 -3.370 1.00 51.22 C ATOM 1025 CD ARG A 68 1.974 -11.375 -4.733 1.00 22.43 C ATOM 1026 NE ARG A 68 0.893 -11.344 -5.716 1.00 33.34 N ATOM 1027 CZ ARG A 68 1.064 -11.023 -6.996 1.00 14.35 C ATOM 1028 NH1 ARG A 68 2.270 -10.708 -7.453 1.00 54.51 N ATOM 1029 NH2 ARG A 68 0.028 -11.018 -7.823 1.00 33.33 N ATOM 0 H ARG A 68 3.857 -14.652 -2.418 1.00 34.43 H new ATOM 0 HA ARG A 68 2.497 -12.588 -1.116 1.00 14.30 H new ATOM 0 HB2 ARG A 68 2.821 -13.495 -3.694 1.00 41.21 H new ATOM 0 HB3 ARG A 68 1.158 -13.961 -3.397 1.00 41.21 H new ATOM 0 HG2 ARG A 68 0.406 -11.794 -3.327 1.00 51.22 H new ATOM 0 HG3 ARG A 68 1.877 -11.184 -2.596 1.00 51.22 H new ATOM 0 HD2 ARG A 68 2.406 -10.379 -4.638 1.00 22.43 H new ATOM 0 HD3 ARG A 68 2.767 -12.034 -5.087 1.00 22.43 H new ATOM 0 HE ARG A 68 -0.048 -11.582 -5.402 1.00 33.34 H new ATOM 0 HH11 ARG A 68 3.071 -10.711 -6.822 1.00 54.51 H new ATOM 0 HH12 ARG A 68 2.395 -10.463 -8.435 1.00 54.51 H new ATOM 0 HH21 ARG A 68 -0.901 -11.260 -7.478 1.00 33.33 H new ATOM 0 HH22 ARG A 68 0.160 -10.772 -8.804 1.00 33.33 H new ATOM 1043 N ASP A 69 0.698 -15.360 -1.368 1.00 2.54 N ATOM 1044 CA ASP A 69 -0.438 -16.077 -0.792 1.00 64.33 C ATOM 1045 C ASP A 69 -0.346 -16.147 0.731 1.00 50.24 C ATOM 1046 O ASP A 69 -1.363 -16.246 1.418 1.00 22.31 O ATOM 1047 CB ASP A 69 -0.520 -17.491 -1.371 1.00 2.11 C ATOM 1048 CG ASP A 69 -0.947 -17.497 -2.826 1.00 13.23 C ATOM 1049 OD1 ASP A 69 -0.843 -16.437 -3.480 1.00 13.22 O ATOM 1050 OD2 ASP A 69 -1.386 -18.560 -3.311 1.00 11.34 O ATOM 0 H ASP A 69 1.157 -15.849 -2.137 1.00 2.54 H new ATOM 0 HA ASP A 69 -1.341 -15.525 -1.051 1.00 64.33 H new ATOM 0 HB2 ASP A 69 0.452 -17.975 -1.279 1.00 2.11 H new ATOM 0 HB3 ASP A 69 -1.226 -18.080 -0.786 1.00 2.11 H new ATOM 1055 N GLN A 70 0.875 -16.101 1.252 1.00 75.02 N ATOM 1056 CA GLN A 70 1.093 -16.165 2.693 1.00 65.11 C ATOM 1057 C GLN A 70 0.887 -14.801 3.345 1.00 40.53 C ATOM 1058 O GLN A 70 0.354 -14.705 4.450 1.00 43.13 O ATOM 1059 CB GLN A 70 2.505 -16.674 2.991 1.00 22.33 C ATOM 1060 CG GLN A 70 2.807 -16.803 4.476 1.00 11.01 C ATOM 1061 CD GLN A 70 2.544 -18.201 5.001 1.00 43.12 C ATOM 1062 OE1 GLN A 70 1.933 -19.026 4.322 1.00 74.24 O ATOM 1063 NE2 GLN A 70 3.004 -18.474 6.216 1.00 23.00 N ATOM 0 H GLN A 70 1.728 -16.020 0.699 1.00 75.02 H new ATOM 0 HA GLN A 70 0.363 -16.858 3.111 1.00 65.11 H new ATOM 0 HB2 GLN A 70 2.639 -17.646 2.516 1.00 22.33 H new ATOM 0 HB3 GLN A 70 3.229 -15.996 2.539 1.00 22.33 H new ATOM 0 HG2 GLN A 70 3.850 -16.541 4.656 1.00 11.01 H new ATOM 0 HG3 GLN A 70 2.198 -16.089 5.031 1.00 11.01 H new ATOM 0 HE21 GLN A 70 3.505 -17.760 6.744 1.00 23.00 H new ATOM 0 HE22 GLN A 70 2.856 -19.398 6.622 1.00 23.00 H new ATOM 1072 N TYR A 71 1.324 -13.750 2.661 1.00 4.22 N ATOM 1073 CA TYR A 71 1.201 -12.393 3.179 1.00 14.31 C ATOM 1074 C TYR A 71 -0.254 -11.944 3.232 1.00 13.44 C ATOM 1075 O TYR A 71 -0.662 -11.237 4.154 1.00 3.44 O ATOM 1076 CB TYR A 71 2.033 -11.442 2.329 1.00 74.33 C ATOM 1077 CG TYR A 71 3.480 -11.857 2.287 1.00 53.33 C ATOM 1078 CD1 TYR A 71 4.108 -12.336 3.431 1.00 11.44 C ATOM 1079 CD2 TYR A 71 4.209 -11.799 1.113 1.00 64.15 C ATOM 1080 CE1 TYR A 71 5.421 -12.741 3.405 1.00 34.14 C ATOM 1081 CE2 TYR A 71 5.525 -12.206 1.076 1.00 53.31 C ATOM 1082 CZ TYR A 71 6.129 -12.677 2.225 1.00 24.30 C ATOM 1083 OH TYR A 71 7.443 -13.083 2.192 1.00 54.31 O ATOM 0 H TYR A 71 1.768 -13.812 1.745 1.00 4.22 H new ATOM 0 HA TYR A 71 1.578 -12.379 4.202 1.00 14.31 H new ATOM 0 HB2 TYR A 71 1.632 -11.414 1.316 1.00 74.33 H new ATOM 0 HB3 TYR A 71 1.955 -10.432 2.731 1.00 74.33 H new ATOM 0 HD1 TYR A 71 3.554 -12.391 4.357 1.00 11.44 H new ATOM 0 HD2 TYR A 71 3.740 -11.430 0.213 1.00 64.15 H new ATOM 0 HE1 TYR A 71 5.895 -13.107 4.304 1.00 34.14 H new ATOM 0 HE2 TYR A 71 6.082 -12.157 0.152 1.00 53.31 H new ATOM 0 HH TYR A 71 7.585 -13.786 2.860 1.00 54.31 H new ATOM 1093 N MET A 72 -1.038 -12.366 2.246 1.00 3.10 N ATOM 1094 CA MET A 72 -2.450 -12.011 2.196 1.00 22.03 C ATOM 1095 C MET A 72 -3.198 -12.659 3.353 1.00 51.42 C ATOM 1096 O MET A 72 -4.098 -12.060 3.941 1.00 64.44 O ATOM 1097 CB MET A 72 -3.068 -12.452 0.867 1.00 0.41 C ATOM 1098 CG MET A 72 -2.230 -12.096 -0.348 1.00 40.15 C ATOM 1099 SD MET A 72 -3.236 -11.706 -1.793 1.00 24.23 S ATOM 1100 CE MET A 72 -2.277 -10.385 -2.529 1.00 33.25 C ATOM 0 H MET A 72 -0.721 -12.952 1.474 1.00 3.10 H new ATOM 0 HA MET A 72 -2.534 -10.927 2.280 1.00 22.03 H new ATOM 0 HB2 MET A 72 -3.220 -13.531 0.888 1.00 0.41 H new ATOM 0 HB3 MET A 72 -4.052 -11.994 0.765 1.00 0.41 H new ATOM 0 HG2 MET A 72 -1.596 -11.242 -0.110 1.00 40.15 H new ATOM 0 HG3 MET A 72 -1.568 -12.929 -0.585 1.00 40.15 H new ATOM 0 HE1 MET A 72 -2.917 -9.518 -2.693 1.00 33.25 H new ATOM 0 HE2 MET A 72 -1.461 -10.112 -1.860 1.00 33.25 H new ATOM 0 HE3 MET A 72 -1.868 -10.720 -3.482 1.00 33.25 H new ATOM 1110 N ARG A 73 -2.815 -13.891 3.671 1.00 33.50 N ATOM 1111 CA ARG A 73 -3.440 -14.635 4.756 1.00 35.11 C ATOM 1112 C ARG A 73 -2.909 -14.190 6.119 1.00 11.44 C ATOM 1113 O ARG A 73 -3.500 -14.498 7.154 1.00 34.02 O ATOM 1114 CB ARG A 73 -3.206 -16.130 4.564 1.00 72.31 C ATOM 1115 CG ARG A 73 -3.951 -16.696 3.369 1.00 50.10 C ATOM 1116 CD ARG A 73 -3.903 -18.210 3.350 1.00 14.43 C ATOM 1117 NE ARG A 73 -4.276 -18.789 4.639 1.00 71.51 N ATOM 1118 CZ ARG A 73 -3.997 -20.040 4.998 1.00 14.40 C ATOM 1119 NH1 ARG A 73 -3.340 -20.844 4.170 1.00 35.41 N ATOM 1120 NH2 ARG A 73 -4.374 -20.489 6.187 1.00 43.22 N ATOM 0 H ARG A 73 -2.071 -14.396 3.190 1.00 33.50 H new ATOM 0 HA ARG A 73 -4.510 -14.430 4.732 1.00 35.11 H new ATOM 0 HB2 ARG A 73 -2.139 -16.312 4.440 1.00 72.31 H new ATOM 0 HB3 ARG A 73 -3.517 -16.660 5.464 1.00 72.31 H new ATOM 0 HG2 ARG A 73 -4.989 -16.364 3.396 1.00 50.10 H new ATOM 0 HG3 ARG A 73 -3.515 -16.306 2.449 1.00 50.10 H new ATOM 0 HD2 ARG A 73 -4.575 -18.584 2.577 1.00 14.43 H new ATOM 0 HD3 ARG A 73 -2.898 -18.537 3.084 1.00 14.43 H new ATOM 0 HE ARG A 73 -4.780 -18.200 5.302 1.00 71.51 H new ATOM 0 HH11 ARG A 73 -3.047 -20.504 3.254 1.00 35.41 H new ATOM 0 HH12 ARG A 73 -3.129 -21.802 4.450 1.00 35.41 H new ATOM 0 HH21 ARG A 73 -4.878 -19.876 6.827 1.00 43.22 H new ATOM 0 HH22 ARG A 73 -4.160 -21.448 6.461 1.00 43.22 H new ATOM 1134 N THR A 74 -1.794 -13.462 6.115 1.00 2.05 N ATOM 1135 CA THR A 74 -1.195 -12.975 7.353 1.00 20.44 C ATOM 1136 C THR A 74 -1.546 -11.507 7.585 1.00 21.43 C ATOM 1137 O THR A 74 -1.474 -11.012 8.710 1.00 43.53 O ATOM 1138 CB THR A 74 0.328 -13.138 7.315 1.00 12.10 C ATOM 1139 OG1 THR A 74 0.884 -12.407 6.238 1.00 72.30 O ATOM 1140 CG2 THR A 74 0.782 -14.576 7.173 1.00 62.43 C ATOM 0 H THR A 74 -1.289 -13.197 5.269 1.00 2.05 H new ATOM 0 HA THR A 74 -1.597 -13.568 8.174 1.00 20.44 H new ATOM 0 HB THR A 74 0.677 -12.760 8.276 1.00 12.10 H new ATOM 0 HG1 THR A 74 0.166 -11.968 5.735 1.00 72.30 H new ATOM 0 HG21 THR A 74 1.871 -14.613 7.153 1.00 62.43 H new ATOM 0 HG22 THR A 74 0.414 -15.159 8.017 1.00 62.43 H new ATOM 0 HG23 THR A 74 0.388 -14.992 6.246 1.00 62.43 H new ATOM 1148 N GLY A 75 -1.916 -10.812 6.511 1.00 31.10 N ATOM 1149 CA GLY A 75 -2.260 -9.408 6.617 1.00 12.30 C ATOM 1150 C GLY A 75 -3.736 -9.173 6.873 1.00 61.52 C ATOM 1151 O GLY A 75 -4.583 -9.955 6.440 1.00 11.23 O ATOM 0 H GLY A 75 -1.983 -11.199 5.570 1.00 31.10 H new ATOM 0 HA2 GLY A 75 -1.682 -8.959 7.424 1.00 12.30 H new ATOM 0 HA3 GLY A 75 -1.972 -8.899 5.697 1.00 12.30 H new ATOM 1155 N GLU A 76 -4.041 -8.084 7.573 1.00 60.02 N ATOM 1156 CA GLU A 76 -5.422 -7.730 7.883 1.00 53.41 C ATOM 1157 C GLU A 76 -5.997 -6.802 6.814 1.00 73.23 C ATOM 1158 O GLU A 76 -7.214 -6.653 6.697 1.00 75.11 O ATOM 1159 CB GLU A 76 -5.500 -7.058 9.256 1.00 10.12 C ATOM 1160 CG GLU A 76 -4.785 -7.830 10.353 1.00 11.33 C ATOM 1161 CD GLU A 76 -5.712 -8.234 11.483 1.00 4.51 C ATOM 1162 OE1 GLU A 76 -6.765 -8.843 11.199 1.00 61.34 O ATOM 1163 OE2 GLU A 76 -5.386 -7.941 12.653 1.00 10.02 O ATOM 0 H GLU A 76 -3.348 -7.430 7.937 1.00 60.02 H new ATOM 0 HA GLU A 76 -6.013 -8.645 7.900 1.00 53.41 H new ATOM 0 HB2 GLU A 76 -5.070 -6.059 9.187 1.00 10.12 H new ATOM 0 HB3 GLU A 76 -6.547 -6.936 9.533 1.00 10.12 H new ATOM 0 HG2 GLU A 76 -4.329 -8.723 9.925 1.00 11.33 H new ATOM 0 HG3 GLU A 76 -3.976 -7.219 10.753 1.00 11.33 H new ATOM 1170 N GLY A 77 -5.113 -6.183 6.035 1.00 23.23 N ATOM 1171 CA GLY A 77 -5.545 -5.280 4.985 1.00 72.21 C ATOM 1172 C GLY A 77 -4.501 -5.127 3.897 1.00 41.30 C ATOM 1173 O GLY A 77 -3.342 -5.496 4.086 1.00 74.14 O ATOM 0 H GLY A 77 -4.102 -6.292 6.114 1.00 23.23 H new ATOM 0 HA2 GLY A 77 -6.472 -5.651 4.547 1.00 72.21 H new ATOM 0 HA3 GLY A 77 -5.765 -4.303 5.416 1.00 72.21 H new ATOM 1177 N PHE A 78 -4.908 -4.586 2.753 1.00 33.44 N ATOM 1178 CA PHE A 78 -3.992 -4.392 1.635 1.00 63.45 C ATOM 1179 C PHE A 78 -4.042 -2.956 1.125 1.00 24.14 C ATOM 1180 O PHE A 78 -5.104 -2.334 1.091 1.00 35.43 O ATOM 1181 CB PHE A 78 -4.330 -5.363 0.502 1.00 72.35 C ATOM 1182 CG PHE A 78 -4.377 -6.798 0.944 1.00 63.31 C ATOM 1183 CD1 PHE A 78 -5.430 -7.264 1.715 1.00 24.21 C ATOM 1184 CD2 PHE A 78 -3.365 -7.678 0.595 1.00 70.12 C ATOM 1185 CE1 PHE A 78 -5.474 -8.581 2.128 1.00 23.42 C ATOM 1186 CE2 PHE A 78 -3.403 -8.997 1.006 1.00 43.50 C ATOM 1187 CZ PHE A 78 -4.459 -9.449 1.774 1.00 31.42 C ATOM 0 H PHE A 78 -5.863 -4.275 2.576 1.00 33.44 H new ATOM 0 HA PHE A 78 -2.981 -4.592 1.989 1.00 63.45 H new ATOM 0 HB2 PHE A 78 -5.295 -5.090 0.074 1.00 72.35 H new ATOM 0 HB3 PHE A 78 -3.589 -5.258 -0.290 1.00 72.35 H new ATOM 0 HD1 PHE A 78 -6.225 -6.590 1.996 1.00 24.21 H new ATOM 0 HD2 PHE A 78 -2.537 -7.329 -0.005 1.00 70.12 H new ATOM 0 HE1 PHE A 78 -6.301 -8.932 2.727 1.00 23.42 H new ATOM 0 HE2 PHE A 78 -2.609 -9.673 0.727 1.00 43.50 H new ATOM 0 HZ PHE A 78 -4.491 -10.479 2.097 1.00 31.42 H new ATOM 1197 N LEU A 79 -2.884 -2.436 0.730 1.00 53.04 N ATOM 1198 CA LEU A 79 -2.789 -1.072 0.222 1.00 20.02 C ATOM 1199 C LEU A 79 -2.375 -1.068 -1.246 1.00 4.21 C ATOM 1200 O LEU A 79 -1.282 -1.516 -1.593 1.00 62.41 O ATOM 1201 CB LEU A 79 -1.785 -0.268 1.049 1.00 2.24 C ATOM 1202 CG LEU A 79 -2.167 1.196 1.291 1.00 2.11 C ATOM 1203 CD1 LEU A 79 -2.526 1.423 2.753 1.00 72.43 C ATOM 1204 CD2 LEU A 79 -1.035 2.121 0.869 1.00 51.24 C ATOM 0 H LEU A 79 -1.997 -2.940 0.752 1.00 53.04 H new ATOM 0 HA LEU A 79 -3.772 -0.609 0.306 1.00 20.02 H new ATOM 0 HB2 LEU A 79 -1.657 -0.758 2.014 1.00 2.24 H new ATOM 0 HB3 LEU A 79 -0.818 -0.297 0.547 1.00 2.24 H new ATOM 0 HG LEU A 79 -3.043 1.425 0.684 1.00 2.11 H new ATOM 0 HD11 LEU A 79 -2.794 2.469 2.904 1.00 72.43 H new ATOM 0 HD12 LEU A 79 -3.371 0.789 3.023 1.00 72.43 H new ATOM 0 HD13 LEU A 79 -1.670 1.174 3.381 1.00 72.43 H new ATOM 0 HD21 LEU A 79 -1.325 3.156 1.048 1.00 51.24 H new ATOM 0 HD22 LEU A 79 -0.141 1.889 1.448 1.00 51.24 H new ATOM 0 HD23 LEU A 79 -0.827 1.981 -0.192 1.00 51.24 H new ATOM 1216 N CYS A 80 -3.253 -0.559 -2.104 1.00 61.21 N ATOM 1217 CA CYS A 80 -2.975 -0.499 -3.535 1.00 41.12 C ATOM 1218 C CYS A 80 -2.418 0.865 -3.925 1.00 23.20 C ATOM 1219 O CYS A 80 -3.155 1.847 -4.013 1.00 5.20 O ATOM 1220 CB CYS A 80 -4.242 -0.792 -4.340 1.00 64.42 C ATOM 1221 SG CYS A 80 -4.834 -2.495 -4.191 1.00 41.44 S ATOM 0 H CYS A 80 -4.162 -0.183 -1.834 1.00 61.21 H new ATOM 0 HA CYS A 80 -2.226 -1.258 -3.763 1.00 41.12 H new ATOM 0 HB2 CYS A 80 -5.031 -0.114 -4.014 1.00 64.42 H new ATOM 0 HB3 CYS A 80 -4.050 -0.576 -5.391 1.00 64.42 H new ATOM 0 HG CYS A 80 -5.910 -2.644 -4.905 1.00 41.44 H new ATOM 1227 N VAL A 81 -1.111 0.918 -4.160 1.00 2.45 N ATOM 1228 CA VAL A 81 -0.453 2.160 -4.544 1.00 21.42 C ATOM 1229 C VAL A 81 0.083 2.074 -5.970 1.00 0.24 C ATOM 1230 O VAL A 81 0.725 1.093 -6.344 1.00 14.44 O ATOM 1231 CB VAL A 81 0.705 2.502 -3.585 1.00 21.25 C ATOM 1232 CG1 VAL A 81 1.738 1.386 -3.569 1.00 3.12 C ATOM 1233 CG2 VAL A 81 1.348 3.828 -3.966 1.00 53.45 C ATOM 0 H VAL A 81 -0.487 0.114 -4.091 1.00 2.45 H new ATOM 0 HA VAL A 81 -1.202 2.950 -4.488 1.00 21.42 H new ATOM 0 HB VAL A 81 0.296 2.601 -2.580 1.00 21.25 H new ATOM 0 HG11 VAL A 81 2.546 1.648 -2.886 1.00 3.12 H new ATOM 0 HG12 VAL A 81 1.268 0.460 -3.237 1.00 3.12 H new ATOM 0 HG13 VAL A 81 2.141 1.249 -4.572 1.00 3.12 H new ATOM 0 HG21 VAL A 81 2.162 4.049 -3.276 1.00 53.45 H new ATOM 0 HG22 VAL A 81 1.740 3.764 -4.981 1.00 53.45 H new ATOM 0 HG23 VAL A 81 0.603 4.622 -3.914 1.00 53.45 H new ATOM 1243 N PHE A 82 -0.186 3.106 -6.760 1.00 13.41 N ATOM 1244 CA PHE A 82 0.269 3.148 -8.144 1.00 63.13 C ATOM 1245 C PHE A 82 0.632 4.573 -8.552 1.00 43.42 C ATOM 1246 O PHE A 82 0.091 5.539 -8.015 1.00 61.31 O ATOM 1247 CB PHE A 82 -0.809 2.588 -9.078 1.00 71.24 C ATOM 1248 CG PHE A 82 -1.974 3.516 -9.287 1.00 23.02 C ATOM 1249 CD1 PHE A 82 -3.052 3.505 -8.416 1.00 75.21 C ATOM 1250 CD2 PHE A 82 -1.988 4.399 -10.355 1.00 44.15 C ATOM 1251 CE1 PHE A 82 -4.122 4.358 -8.607 1.00 42.54 C ATOM 1252 CE2 PHE A 82 -3.056 5.254 -10.550 1.00 2.03 C ATOM 1253 CZ PHE A 82 -4.124 5.233 -9.676 1.00 42.43 C ATOM 0 H PHE A 82 -0.717 3.925 -6.466 1.00 13.41 H new ATOM 0 HA PHE A 82 1.162 2.529 -8.227 1.00 63.13 H new ATOM 0 HB2 PHE A 82 -0.358 2.363 -10.044 1.00 71.24 H new ATOM 0 HB3 PHE A 82 -1.176 1.646 -8.671 1.00 71.24 H new ATOM 0 HD1 PHE A 82 -3.056 2.822 -7.579 1.00 75.21 H new ATOM 0 HD2 PHE A 82 -1.155 4.419 -11.042 1.00 44.15 H new ATOM 0 HE1 PHE A 82 -4.956 4.341 -7.921 1.00 42.54 H new ATOM 0 HE2 PHE A 82 -3.055 5.938 -11.386 1.00 2.03 H new ATOM 0 HZ PHE A 82 -4.960 5.900 -9.828 1.00 42.43 H new ATOM 1263 N ALA A 83 1.548 4.695 -9.506 1.00 45.35 N ATOM 1264 CA ALA A 83 1.978 6.002 -9.984 1.00 72.11 C ATOM 1265 C ALA A 83 1.095 6.483 -11.129 1.00 4.13 C ATOM 1266 O ALA A 83 0.952 5.802 -12.144 1.00 12.45 O ATOM 1267 CB ALA A 83 3.434 5.951 -10.422 1.00 71.01 C ATOM 0 H ALA A 83 2.006 3.906 -9.962 1.00 45.35 H new ATOM 0 HA ALA A 83 1.883 6.712 -9.163 1.00 72.11 H new ATOM 0 HB1 ALA A 83 3.742 6.935 -10.777 1.00 71.01 H new ATOM 0 HB2 ALA A 83 4.058 5.658 -9.578 1.00 71.01 H new ATOM 0 HB3 ALA A 83 3.547 5.224 -11.226 1.00 71.01 H new ATOM 1273 N ILE A 84 0.506 7.663 -10.961 1.00 21.34 N ATOM 1274 CA ILE A 84 -0.361 8.238 -11.981 1.00 55.42 C ATOM 1275 C ILE A 84 0.381 8.394 -13.302 1.00 64.35 C ATOM 1276 O ILE A 84 -0.214 8.319 -14.377 1.00 51.43 O ATOM 1277 CB ILE A 84 -0.902 9.611 -11.545 1.00 51.25 C ATOM 1278 CG1 ILE A 84 0.244 10.514 -11.090 1.00 31.23 C ATOM 1279 CG2 ILE A 84 -1.921 9.445 -10.432 1.00 2.54 C ATOM 1280 CD1 ILE A 84 -0.037 11.989 -11.273 1.00 14.23 C ATOM 0 H ILE A 84 0.614 8.240 -10.127 1.00 21.34 H new ATOM 0 HA ILE A 84 -1.197 7.551 -12.114 1.00 55.42 H new ATOM 0 HB ILE A 84 -1.393 10.080 -12.398 1.00 51.25 H new ATOM 0 HG12 ILE A 84 0.452 10.320 -10.038 1.00 31.23 H new ATOM 0 HG13 ILE A 84 1.144 10.253 -11.646 1.00 31.23 H new ATOM 0 HG21 ILE A 84 -2.296 10.424 -10.133 1.00 2.54 H new ATOM 0 HG22 ILE A 84 -2.750 8.832 -10.786 1.00 2.54 H new ATOM 0 HG23 ILE A 84 -1.450 8.960 -9.577 1.00 2.54 H new ATOM 0 HD11 ILE A 84 0.820 12.568 -10.929 1.00 14.23 H new ATOM 0 HD12 ILE A 84 -0.215 12.197 -12.328 1.00 14.23 H new ATOM 0 HD13 ILE A 84 -0.918 12.266 -10.694 1.00 14.23 H new ATOM 1292 N ASN A 85 1.687 8.611 -13.210 1.00 23.43 N ATOM 1293 CA ASN A 85 2.523 8.779 -14.394 1.00 64.20 C ATOM 1294 C ASN A 85 2.699 7.454 -15.135 1.00 52.21 C ATOM 1295 O ASN A 85 3.106 7.434 -16.296 1.00 2.44 O ATOM 1296 CB ASN A 85 3.895 9.341 -14.012 1.00 73.40 C ATOM 1297 CG ASN A 85 3.827 10.338 -12.871 1.00 34.32 C ATOM 1298 OD1 ASN A 85 4.335 10.085 -11.779 1.00 15.34 O ATOM 1299 ND2 ASN A 85 3.198 11.479 -13.120 1.00 35.05 N ATOM 0 H ASN A 85 2.192 8.675 -12.326 1.00 23.43 H new ATOM 0 HA ASN A 85 2.020 9.485 -15.055 1.00 64.20 H new ATOM 0 HB2 ASN A 85 4.553 8.519 -13.731 1.00 73.40 H new ATOM 0 HB3 ASN A 85 4.340 9.823 -14.883 1.00 73.40 H new ATOM 0 HD21 ASN A 85 3.121 12.188 -12.391 1.00 35.05 H new ATOM 0 HD22 ASN A 85 2.791 11.647 -14.040 1.00 35.05 H new ATOM 1306 N ASN A 86 2.398 6.349 -14.458 1.00 72.42 N ATOM 1307 CA ASN A 86 2.530 5.027 -15.058 1.00 61.00 C ATOM 1308 C ASN A 86 1.164 4.376 -15.253 1.00 1.34 C ATOM 1309 O ASN A 86 0.549 3.901 -14.298 1.00 71.53 O ATOM 1310 CB ASN A 86 3.414 4.135 -14.184 1.00 74.43 C ATOM 1311 CG ASN A 86 4.335 3.254 -15.005 1.00 12.33 C ATOM 1312 OD1 ASN A 86 4.978 3.716 -15.947 1.00 62.21 O ATOM 1313 ND2 ASN A 86 4.404 1.976 -14.650 1.00 23.52 N ATOM 0 H ASN A 86 2.062 6.344 -13.495 1.00 72.42 H new ATOM 0 HA ASN A 86 2.997 5.145 -16.036 1.00 61.00 H new ATOM 0 HB2 ASN A 86 4.010 4.759 -13.518 1.00 74.43 H new ATOM 0 HB3 ASN A 86 2.783 3.509 -13.553 1.00 74.43 H new ATOM 0 HD21 ASN A 86 5.008 1.335 -15.165 1.00 23.52 H new ATOM 0 HD22 ASN A 86 3.853 1.635 -13.862 1.00 23.52 H new ATOM 1320 N THR A 87 0.696 4.357 -16.496 1.00 31.12 N ATOM 1321 CA THR A 87 -0.596 3.762 -16.818 1.00 20.50 C ATOM 1322 C THR A 87 -0.581 2.257 -16.567 1.00 50.31 C ATOM 1323 O THR A 87 -1.624 1.649 -16.325 1.00 45.51 O ATOM 1324 CB THR A 87 -0.961 4.044 -18.276 1.00 33.52 C ATOM 1325 OG1 THR A 87 -0.679 5.391 -18.612 1.00 41.33 O ATOM 1326 CG2 THR A 87 -2.420 3.789 -18.587 1.00 62.55 C ATOM 0 H THR A 87 1.192 4.747 -17.297 1.00 31.12 H new ATOM 0 HA THR A 87 -1.347 4.212 -16.169 1.00 20.50 H new ATOM 0 HB THR A 87 -0.355 3.355 -18.864 1.00 33.52 H new ATOM 0 HG1 THR A 87 -0.820 5.960 -17.827 1.00 41.33 H new ATOM 0 HG21 THR A 87 -2.612 4.008 -19.637 1.00 62.55 H new ATOM 0 HG22 THR A 87 -2.658 2.745 -18.385 1.00 62.55 H new ATOM 0 HG23 THR A 87 -3.043 4.430 -17.963 1.00 62.55 H new ATOM 1334 N LYS A 88 0.606 1.661 -16.624 1.00 32.53 N ATOM 1335 CA LYS A 88 0.756 0.232 -16.402 1.00 12.52 C ATOM 1336 C LYS A 88 0.457 -0.122 -14.947 1.00 3.44 C ATOM 1337 O LYS A 88 -0.204 -1.121 -14.664 1.00 14.31 O ATOM 1338 CB LYS A 88 2.175 -0.205 -16.781 1.00 44.43 C ATOM 1339 CG LYS A 88 2.559 -1.575 -16.250 1.00 5.00 C ATOM 1340 CD LYS A 88 3.257 -2.413 -17.310 1.00 5.41 C ATOM 1341 CE LYS A 88 4.586 -1.799 -17.718 1.00 52.34 C ATOM 1342 NZ LYS A 88 5.291 -2.627 -18.736 1.00 53.12 N ATOM 0 H LYS A 88 1.479 2.150 -16.823 1.00 32.53 H new ATOM 0 HA LYS A 88 0.042 -0.299 -17.032 1.00 12.52 H new ATOM 0 HB2 LYS A 88 2.266 -0.209 -17.867 1.00 44.43 H new ATOM 0 HB3 LYS A 88 2.884 0.532 -16.404 1.00 44.43 H new ATOM 0 HG2 LYS A 88 3.215 -1.460 -15.387 1.00 5.00 H new ATOM 0 HG3 LYS A 88 1.666 -2.095 -15.905 1.00 5.00 H new ATOM 0 HD2 LYS A 88 3.422 -3.421 -16.928 1.00 5.41 H new ATOM 0 HD3 LYS A 88 2.613 -2.505 -18.185 1.00 5.41 H new ATOM 0 HE2 LYS A 88 4.417 -0.799 -18.117 1.00 52.34 H new ATOM 0 HE3 LYS A 88 5.220 -1.688 -16.838 1.00 52.34 H new ATOM 0 HZ1 LYS A 88 6.193 -2.174 -18.988 1.00 53.12 H new ATOM 0 HZ2 LYS A 88 5.476 -3.573 -18.346 1.00 53.12 H new ATOM 0 HZ3 LYS A 88 4.697 -2.712 -19.586 1.00 53.12 H new ATOM 1356 N SER A 89 0.946 0.706 -14.029 1.00 21.21 N ATOM 1357 CA SER A 89 0.729 0.481 -12.604 1.00 30.32 C ATOM 1358 C SER A 89 -0.761 0.451 -12.281 1.00 72.41 C ATOM 1359 O SER A 89 -1.210 -0.329 -11.442 1.00 34.43 O ATOM 1360 CB SER A 89 1.421 1.571 -11.783 1.00 45.44 C ATOM 1361 OG SER A 89 2.822 1.556 -11.994 1.00 41.33 O ATOM 0 H SER A 89 1.495 1.538 -14.246 1.00 21.21 H new ATOM 0 HA SER A 89 1.159 -0.486 -12.343 1.00 30.32 H new ATOM 0 HB2 SER A 89 1.019 2.547 -12.056 1.00 45.44 H new ATOM 0 HB3 SER A 89 1.208 1.424 -10.724 1.00 45.44 H new ATOM 0 HG SER A 89 3.184 0.686 -11.725 1.00 41.33 H new ATOM 1367 N PHE A 90 -1.523 1.305 -12.956 1.00 24.15 N ATOM 1368 CA PHE A 90 -2.964 1.377 -12.746 1.00 63.23 C ATOM 1369 C PHE A 90 -3.628 0.044 -13.085 1.00 11.00 C ATOM 1370 O PHE A 90 -4.673 -0.298 -12.533 1.00 31.42 O ATOM 1371 CB PHE A 90 -3.568 2.499 -13.596 1.00 73.32 C ATOM 1372 CG PHE A 90 -5.069 2.563 -13.538 1.00 45.44 C ATOM 1373 CD1 PHE A 90 -5.710 3.122 -12.444 1.00 13.32 C ATOM 1374 CD2 PHE A 90 -5.836 2.066 -14.579 1.00 41.44 C ATOM 1375 CE1 PHE A 90 -7.090 3.182 -12.389 1.00 40.05 C ATOM 1376 CE2 PHE A 90 -7.216 2.123 -14.530 1.00 12.52 C ATOM 1377 CZ PHE A 90 -7.844 2.682 -13.434 1.00 12.35 C ATOM 0 H PHE A 90 -1.166 1.958 -13.654 1.00 24.15 H new ATOM 0 HA PHE A 90 -3.146 1.594 -11.693 1.00 63.23 H new ATOM 0 HB2 PHE A 90 -3.160 3.454 -13.264 1.00 73.32 H new ATOM 0 HB3 PHE A 90 -3.259 2.363 -14.633 1.00 73.32 H new ATOM 0 HD1 PHE A 90 -5.125 3.515 -11.626 1.00 13.32 H new ATOM 0 HD2 PHE A 90 -5.350 1.629 -15.439 1.00 41.44 H new ATOM 0 HE1 PHE A 90 -7.578 3.619 -11.531 1.00 40.05 H new ATOM 0 HE2 PHE A 90 -7.803 1.731 -15.348 1.00 12.52 H new ATOM 0 HZ PHE A 90 -8.922 2.728 -13.394 1.00 12.35 H new ATOM 1387 N GLU A 91 -3.014 -0.704 -13.997 1.00 52.15 N ATOM 1388 CA GLU A 91 -3.546 -1.997 -14.409 1.00 34.12 C ATOM 1389 C GLU A 91 -3.243 -3.069 -13.366 1.00 21.32 C ATOM 1390 O GLU A 91 -4.064 -3.951 -13.113 1.00 73.41 O ATOM 1391 CB GLU A 91 -2.962 -2.405 -15.762 1.00 73.51 C ATOM 1392 CG GLU A 91 -3.032 -1.306 -16.810 1.00 10.42 C ATOM 1393 CD GLU A 91 -3.316 -1.842 -18.200 1.00 73.41 C ATOM 1394 OE1 GLU A 91 -2.348 -2.159 -18.923 1.00 55.23 O ATOM 1395 OE2 GLU A 91 -4.506 -1.945 -18.565 1.00 55.23 O ATOM 0 H GLU A 91 -2.148 -0.436 -14.464 1.00 52.15 H new ATOM 0 HA GLU A 91 -4.628 -1.903 -14.502 1.00 34.12 H new ATOM 0 HB2 GLU A 91 -1.922 -2.700 -15.625 1.00 73.51 H new ATOM 0 HB3 GLU A 91 -3.496 -3.281 -16.130 1.00 73.51 H new ATOM 0 HG2 GLU A 91 -3.810 -0.594 -16.533 1.00 10.42 H new ATOM 0 HG3 GLU A 91 -2.089 -0.759 -16.821 1.00 10.42 H new ATOM 1402 N ASP A 92 -2.061 -2.988 -12.763 1.00 50.22 N ATOM 1403 CA ASP A 92 -1.652 -3.952 -11.747 1.00 44.13 C ATOM 1404 C ASP A 92 -2.559 -3.869 -10.524 1.00 22.03 C ATOM 1405 O ASP A 92 -2.840 -4.878 -9.877 1.00 54.03 O ATOM 1406 CB ASP A 92 -0.199 -3.709 -11.338 1.00 62.31 C ATOM 1407 CG ASP A 92 0.720 -3.549 -12.533 1.00 34.13 C ATOM 1408 OD1 ASP A 92 0.343 -3.997 -13.636 1.00 12.22 O ATOM 1409 OD2 ASP A 92 1.817 -2.975 -12.367 1.00 4.11 O ATOM 0 H ASP A 92 -1.369 -2.265 -12.960 1.00 50.22 H new ATOM 0 HA ASP A 92 -1.738 -4.951 -12.174 1.00 44.13 H new ATOM 0 HB2 ASP A 92 -0.144 -2.814 -10.719 1.00 62.31 H new ATOM 0 HB3 ASP A 92 0.147 -4.542 -10.726 1.00 62.31 H new ATOM 1414 N ILE A 93 -3.018 -2.662 -10.213 1.00 70.31 N ATOM 1415 CA ILE A 93 -3.897 -2.452 -9.069 1.00 24.04 C ATOM 1416 C ILE A 93 -5.181 -3.267 -9.214 1.00 10.13 C ATOM 1417 O ILE A 93 -5.807 -3.638 -8.221 1.00 40.30 O ATOM 1418 CB ILE A 93 -4.254 -0.956 -8.905 1.00 42.42 C ATOM 1419 CG1 ILE A 93 -3.021 -0.149 -8.515 1.00 32.40 C ATOM 1420 CG2 ILE A 93 -5.338 -0.764 -7.862 1.00 45.20 C ATOM 1421 CD1 ILE A 93 -2.311 -0.678 -7.287 1.00 24.13 C ATOM 0 H ILE A 93 -2.796 -1.815 -10.736 1.00 70.31 H new ATOM 0 HA ILE A 93 -3.359 -2.785 -8.181 1.00 24.04 H new ATOM 0 HB ILE A 93 -4.626 -0.599 -9.865 1.00 42.42 H new ATOM 0 HG12 ILE A 93 -2.323 -0.141 -9.352 1.00 32.40 H new ATOM 0 HG13 ILE A 93 -3.316 0.885 -8.336 1.00 32.40 H new ATOM 0 HG21 ILE A 93 -5.569 0.297 -7.768 1.00 45.20 H new ATOM 0 HG22 ILE A 93 -6.235 -1.305 -8.165 1.00 45.20 H new ATOM 0 HG23 ILE A 93 -4.991 -1.146 -6.902 1.00 45.20 H new ATOM 0 HD11 ILE A 93 -1.444 -0.054 -7.071 1.00 24.13 H new ATOM 0 HD12 ILE A 93 -2.993 -0.660 -6.437 1.00 24.13 H new ATOM 0 HD13 ILE A 93 -1.984 -1.702 -7.468 1.00 24.13 H new ATOM 1433 N HIS A 94 -5.568 -3.538 -10.456 1.00 64.00 N ATOM 1434 CA HIS A 94 -6.778 -4.304 -10.730 1.00 43.31 C ATOM 1435 C HIS A 94 -6.554 -5.795 -10.483 1.00 61.01 C ATOM 1436 O HIS A 94 -7.285 -6.421 -9.715 1.00 45.05 O ATOM 1437 CB HIS A 94 -7.231 -4.076 -12.175 1.00 42.22 C ATOM 1438 CG HIS A 94 -8.434 -4.880 -12.562 1.00 4.45 C ATOM 1439 ND1 HIS A 94 -9.725 -4.489 -12.276 1.00 72.41 N ATOM 1440 CD2 HIS A 94 -8.537 -6.062 -13.215 1.00 23.13 C ATOM 1441 CE1 HIS A 94 -10.570 -5.396 -12.735 1.00 43.14 C ATOM 1442 NE2 HIS A 94 -9.874 -6.359 -13.310 1.00 60.23 N ATOM 0 H HIS A 94 -5.061 -3.238 -11.289 1.00 64.00 H new ATOM 0 HA HIS A 94 -7.557 -3.959 -10.050 1.00 43.31 H new ATOM 0 HB2 HIS A 94 -7.452 -3.018 -12.315 1.00 42.22 H new ATOM 0 HB3 HIS A 94 -6.409 -4.322 -12.847 1.00 42.22 H new ATOM 0 HD1 HIS A 94 -9.987 -3.633 -11.787 1.00 72.41 H new ATOM 0 HD2 HIS A 94 -7.720 -6.660 -13.591 1.00 23.13 H new ATOM 0 HE1 HIS A 94 -11.646 -5.356 -12.653 1.00 43.14 H new ATOM 1451 N GLN A 95 -5.545 -6.359 -11.140 1.00 12.42 N ATOM 1452 CA GLN A 95 -5.237 -7.777 -10.990 1.00 54.40 C ATOM 1453 C GLN A 95 -4.781 -8.093 -9.569 1.00 5.12 C ATOM 1454 O GLN A 95 -4.997 -9.198 -9.071 1.00 50.45 O ATOM 1455 CB GLN A 95 -4.160 -8.200 -11.993 1.00 44.41 C ATOM 1456 CG GLN A 95 -2.937 -7.297 -11.994 1.00 63.02 C ATOM 1457 CD GLN A 95 -1.692 -7.999 -11.487 1.00 12.35 C ATOM 1458 OE1 GLN A 95 -1.032 -8.728 -12.228 1.00 21.43 O ATOM 1459 NE2 GLN A 95 -1.366 -7.784 -10.218 1.00 33.21 N ATOM 0 H GLN A 95 -4.929 -5.858 -11.779 1.00 12.42 H new ATOM 0 HA GLN A 95 -6.149 -8.340 -11.190 1.00 54.40 H new ATOM 0 HB2 GLN A 95 -3.847 -9.220 -11.768 1.00 44.41 H new ATOM 0 HB3 GLN A 95 -4.592 -8.212 -12.993 1.00 44.41 H new ATOM 0 HG2 GLN A 95 -2.758 -6.935 -13.006 1.00 63.02 H new ATOM 0 HG3 GLN A 95 -3.135 -6.423 -11.373 1.00 63.02 H new ATOM 0 HE21 GLN A 95 -1.942 -7.172 -9.640 1.00 33.21 H new ATOM 0 HE22 GLN A 95 -0.539 -8.231 -9.821 1.00 33.21 H new ATOM 1468 N TYR A 96 -4.154 -7.118 -8.919 1.00 43.11 N ATOM 1469 CA TYR A 96 -3.674 -7.299 -7.554 1.00 21.34 C ATOM 1470 C TYR A 96 -4.840 -7.547 -6.602 1.00 33.15 C ATOM 1471 O TYR A 96 -4.777 -8.425 -5.742 1.00 61.32 O ATOM 1472 CB TYR A 96 -2.880 -6.073 -7.101 1.00 3.21 C ATOM 1473 CG TYR A 96 -1.396 -6.183 -7.368 1.00 42.12 C ATOM 1474 CD1 TYR A 96 -0.672 -7.284 -6.928 1.00 73.34 C ATOM 1475 CD2 TYR A 96 -0.719 -5.187 -8.061 1.00 35.51 C ATOM 1476 CE1 TYR A 96 0.685 -7.389 -7.171 1.00 52.35 C ATOM 1477 CE2 TYR A 96 0.637 -5.285 -8.308 1.00 70.51 C ATOM 1478 CZ TYR A 96 1.334 -6.388 -7.861 1.00 63.00 C ATOM 1479 OH TYR A 96 2.684 -6.490 -8.106 1.00 31.43 O ATOM 0 H TYR A 96 -3.967 -6.197 -9.314 1.00 43.11 H new ATOM 0 HA TYR A 96 -3.019 -8.170 -7.536 1.00 21.34 H new ATOM 0 HB2 TYR A 96 -3.268 -5.190 -7.609 1.00 3.21 H new ATOM 0 HB3 TYR A 96 -3.039 -5.921 -6.033 1.00 3.21 H new ATOM 0 HD1 TYR A 96 -1.177 -8.071 -6.387 1.00 73.34 H new ATOM 0 HD2 TYR A 96 -1.262 -4.322 -8.412 1.00 35.51 H new ATOM 0 HE1 TYR A 96 1.234 -8.251 -6.822 1.00 52.35 H new ATOM 0 HE2 TYR A 96 1.148 -4.502 -8.848 1.00 70.51 H new ATOM 0 HH TYR A 96 2.857 -6.325 -9.056 1.00 31.43 H new ATOM 1489 N ARG A 97 -5.903 -6.768 -6.766 1.00 40.55 N ATOM 1490 CA ARG A 97 -7.087 -6.896 -5.932 1.00 3.22 C ATOM 1491 C ARG A 97 -7.715 -8.278 -6.080 1.00 4.32 C ATOM 1492 O ARG A 97 -8.196 -8.859 -5.107 1.00 74.24 O ATOM 1493 CB ARG A 97 -8.095 -5.822 -6.314 1.00 32.34 C ATOM 1494 CG ARG A 97 -9.328 -5.805 -5.436 1.00 24.55 C ATOM 1495 CD ARG A 97 -10.276 -4.704 -5.862 1.00 53.11 C ATOM 1496 NE ARG A 97 -9.744 -3.376 -5.560 1.00 61.25 N ATOM 1497 CZ ARG A 97 -8.962 -2.682 -6.386 1.00 53.33 C ATOM 1498 NH1 ARG A 97 -8.623 -3.177 -7.570 1.00 11.25 N ATOM 1499 NH2 ARG A 97 -8.517 -1.486 -6.025 1.00 44.04 N ATOM 0 H ARG A 97 -5.967 -6.037 -7.475 1.00 40.55 H new ATOM 0 HA ARG A 97 -6.793 -6.769 -4.890 1.00 3.22 H new ATOM 0 HB2 ARG A 97 -7.610 -4.847 -6.264 1.00 32.34 H new ATOM 0 HB3 ARG A 97 -8.399 -5.974 -7.350 1.00 32.34 H new ATOM 0 HG2 ARG A 97 -9.834 -6.769 -5.493 1.00 24.55 H new ATOM 0 HG3 ARG A 97 -9.037 -5.659 -4.396 1.00 24.55 H new ATOM 0 HD2 ARG A 97 -10.466 -4.783 -6.932 1.00 53.11 H new ATOM 0 HD3 ARG A 97 -11.233 -4.834 -5.357 1.00 53.11 H new ATOM 0 HE ARG A 97 -9.986 -2.955 -4.663 1.00 61.25 H new ATOM 0 HH11 ARG A 97 -8.962 -4.096 -7.854 1.00 11.25 H new ATOM 0 HH12 ARG A 97 -8.024 -2.638 -8.195 1.00 11.25 H new ATOM 0 HH21 ARG A 97 -8.773 -1.099 -5.117 1.00 44.04 H new ATOM 0 HH22 ARG A 97 -7.918 -0.953 -6.656 1.00 44.04 H new ATOM 1513 N GLU A 98 -7.708 -8.797 -7.304 1.00 12.00 N ATOM 1514 CA GLU A 98 -8.279 -10.111 -7.583 1.00 12.14 C ATOM 1515 C GLU A 98 -7.676 -11.176 -6.670 1.00 2.21 C ATOM 1516 O GLU A 98 -8.325 -12.171 -6.349 1.00 3.44 O ATOM 1517 CB GLU A 98 -8.051 -10.488 -9.048 1.00 30.21 C ATOM 1518 CG GLU A 98 -8.957 -9.742 -10.015 1.00 63.23 C ATOM 1519 CD GLU A 98 -10.065 -10.616 -10.569 1.00 10.14 C ATOM 1520 OE1 GLU A 98 -10.897 -11.097 -9.772 1.00 65.11 O ATOM 1521 OE2 GLU A 98 -10.100 -10.820 -11.801 1.00 3.14 O ATOM 0 H GLU A 98 -7.313 -8.328 -8.119 1.00 12.00 H new ATOM 0 HA GLU A 98 -9.351 -10.061 -7.390 1.00 12.14 H new ATOM 0 HB2 GLU A 98 -7.012 -10.288 -9.309 1.00 30.21 H new ATOM 0 HB3 GLU A 98 -8.209 -11.560 -9.168 1.00 30.21 H new ATOM 0 HG2 GLU A 98 -9.396 -8.884 -9.507 1.00 63.23 H new ATOM 0 HG3 GLU A 98 -8.360 -9.353 -10.840 1.00 63.23 H new ATOM 1528 N GLN A 99 -6.432 -10.958 -6.255 1.00 44.14 N ATOM 1529 CA GLN A 99 -5.745 -11.899 -5.377 1.00 61.33 C ATOM 1530 C GLN A 99 -6.258 -11.776 -3.946 1.00 44.42 C ATOM 1531 O GLN A 99 -6.494 -12.779 -3.272 1.00 72.31 O ATOM 1532 CB GLN A 99 -4.234 -11.656 -5.417 1.00 23.21 C ATOM 1533 CG GLN A 99 -3.468 -12.717 -6.190 1.00 42.24 C ATOM 1534 CD GLN A 99 -3.023 -13.870 -5.311 1.00 54.13 C ATOM 1535 OE1 GLN A 99 -3.832 -14.483 -4.614 1.00 64.42 O ATOM 1536 NE2 GLN A 99 -1.730 -14.171 -5.341 1.00 3.20 N ATOM 0 H GLN A 99 -5.880 -10.140 -6.512 1.00 44.14 H new ATOM 0 HA GLN A 99 -5.950 -12.909 -5.731 1.00 61.33 H new ATOM 0 HB2 GLN A 99 -4.043 -10.682 -5.867 1.00 23.21 H new ATOM 0 HB3 GLN A 99 -3.854 -11.616 -4.396 1.00 23.21 H new ATOM 0 HG2 GLN A 99 -4.096 -13.099 -6.995 1.00 42.24 H new ATOM 0 HG3 GLN A 99 -2.594 -12.262 -6.656 1.00 42.24 H new ATOM 0 HE21 GLN A 99 -1.095 -13.636 -5.934 1.00 3.20 H new ATOM 0 HE22 GLN A 99 -1.371 -14.937 -4.771 1.00 3.20 H new ATOM 1545 N ILE A 100 -6.432 -10.540 -3.489 1.00 31.41 N ATOM 1546 CA ILE A 100 -6.920 -10.285 -2.139 1.00 72.34 C ATOM 1547 C ILE A 100 -8.297 -10.908 -1.929 1.00 31.54 C ATOM 1548 O ILE A 100 -8.523 -11.623 -0.953 1.00 61.34 O ATOM 1549 CB ILE A 100 -6.997 -8.772 -1.847 1.00 1.33 C ATOM 1550 CG1 ILE A 100 -5.623 -8.126 -2.036 1.00 23.42 C ATOM 1551 CG2 ILE A 100 -7.517 -8.521 -0.437 1.00 25.45 C ATOM 1552 CD1 ILE A 100 -5.672 -6.618 -2.142 1.00 24.22 C ATOM 0 H ILE A 100 -6.242 -9.699 -4.034 1.00 31.41 H new ATOM 0 HA ILE A 100 -6.210 -10.742 -1.450 1.00 72.34 H new ATOM 0 HB ILE A 100 -7.695 -8.319 -2.552 1.00 1.33 H new ATOM 0 HG12 ILE A 100 -4.983 -8.402 -1.198 1.00 23.42 H new ATOM 0 HG13 ILE A 100 -5.162 -8.530 -2.937 1.00 23.42 H new ATOM 0 HG21 ILE A 100 -7.563 -7.448 -0.252 1.00 25.45 H new ATOM 0 HG22 ILE A 100 -8.514 -8.950 -0.335 1.00 25.45 H new ATOM 0 HG23 ILE A 100 -6.846 -8.985 0.286 1.00 25.45 H new ATOM 0 HD11 ILE A 100 -4.662 -6.230 -2.275 1.00 24.22 H new ATOM 0 HD12 ILE A 100 -6.285 -6.333 -2.997 1.00 24.22 H new ATOM 0 HD13 ILE A 100 -6.104 -6.203 -1.231 1.00 24.22 H new ATOM 1564 N LYS A 101 -9.212 -10.631 -2.851 1.00 62.33 N ATOM 1565 CA LYS A 101 -10.568 -11.163 -2.767 1.00 44.03 C ATOM 1566 C LYS A 101 -10.555 -12.688 -2.712 1.00 73.01 C ATOM 1567 O LYS A 101 -11.326 -13.297 -1.971 1.00 42.21 O ATOM 1568 CB LYS A 101 -11.399 -10.686 -3.960 1.00 74.30 C ATOM 1569 CG LYS A 101 -11.367 -9.178 -4.157 1.00 20.42 C ATOM 1570 CD LYS A 101 -12.421 -8.722 -5.152 1.00 12.41 C ATOM 1571 CE LYS A 101 -12.112 -9.214 -6.557 1.00 34.21 C ATOM 1572 NZ LYS A 101 -12.302 -8.144 -7.575 1.00 32.33 N ATOM 0 H LYS A 101 -9.040 -10.041 -3.665 1.00 62.33 H new ATOM 0 HA LYS A 101 -11.021 -10.792 -1.848 1.00 44.03 H new ATOM 0 HB2 LYS A 101 -11.033 -11.171 -4.865 1.00 74.30 H new ATOM 0 HB3 LYS A 101 -12.432 -11.005 -3.824 1.00 74.30 H new ATOM 0 HG2 LYS A 101 -11.530 -8.682 -3.200 1.00 20.42 H new ATOM 0 HG3 LYS A 101 -10.380 -8.877 -4.508 1.00 20.42 H new ATOM 0 HD2 LYS A 101 -13.399 -9.092 -4.843 1.00 12.41 H new ATOM 0 HD3 LYS A 101 -12.477 -7.633 -5.151 1.00 12.41 H new ATOM 0 HE2 LYS A 101 -11.084 -9.575 -6.597 1.00 34.21 H new ATOM 0 HE3 LYS A 101 -12.757 -10.060 -6.795 1.00 34.21 H new ATOM 0 HZ1 LYS A 101 -12.081 -8.520 -8.519 1.00 32.33 H new ATOM 0 HZ2 LYS A 101 -13.289 -7.817 -7.555 1.00 32.33 H new ATOM 0 HZ3 LYS A 101 -11.669 -7.347 -7.363 1.00 32.33 H new ATOM 1586 N ARG A 102 -9.678 -13.299 -3.501 1.00 64.03 N ATOM 1587 CA ARG A 102 -9.568 -14.750 -3.541 1.00 22.10 C ATOM 1588 C ARG A 102 -9.099 -15.306 -2.200 1.00 1.00 C ATOM 1589 O ARG A 102 -9.789 -16.115 -1.579 1.00 44.12 O ATOM 1590 CB ARG A 102 -8.603 -15.173 -4.648 1.00 33.42 C ATOM 1591 CG ARG A 102 -9.110 -16.344 -5.467 1.00 60.55 C ATOM 1592 CD ARG A 102 -8.270 -16.561 -6.715 1.00 34.11 C ATOM 1593 NE ARG A 102 -8.054 -17.980 -6.990 1.00 21.23 N ATOM 1594 CZ ARG A 102 -8.974 -18.780 -7.524 1.00 31.34 C ATOM 1595 NH1 ARG A 102 -10.171 -18.306 -7.845 1.00 0.23 N ATOM 1596 NH2 ARG A 102 -8.695 -20.059 -7.739 1.00 2.12 N ATOM 0 H ARG A 102 -9.033 -12.810 -4.122 1.00 64.03 H new ATOM 0 HA ARG A 102 -10.557 -15.157 -3.750 1.00 22.10 H new ATOM 0 HB2 ARG A 102 -8.425 -14.325 -5.310 1.00 33.42 H new ATOM 0 HB3 ARG A 102 -7.644 -15.437 -4.203 1.00 33.42 H new ATOM 0 HG2 ARG A 102 -9.097 -17.248 -4.857 1.00 60.55 H new ATOM 0 HG3 ARG A 102 -10.147 -16.167 -5.752 1.00 60.55 H new ATOM 0 HD2 ARG A 102 -8.763 -16.097 -7.569 1.00 34.11 H new ATOM 0 HD3 ARG A 102 -7.307 -16.064 -6.595 1.00 34.11 H new ATOM 0 HE ARG A 102 -7.145 -18.381 -6.759 1.00 21.23 H new ATOM 0 HH11 ARG A 102 -10.391 -17.323 -7.683 1.00 0.23 H new ATOM 0 HH12 ARG A 102 -10.872 -18.924 -8.254 1.00 0.23 H new ATOM 0 HH21 ARG A 102 -7.776 -20.429 -7.495 1.00 2.12 H new ATOM 0 HH22 ARG A 102 -9.399 -20.673 -8.148 1.00 2.12 H new ATOM 1610 N VAL A 103 -7.923 -14.870 -1.759 1.00 64.10 N ATOM 1611 CA VAL A 103 -7.367 -15.328 -0.493 1.00 51.04 C ATOM 1612 C VAL A 103 -8.311 -15.018 0.664 1.00 72.14 C ATOM 1613 O VAL A 103 -8.653 -15.898 1.453 1.00 73.23 O ATOM 1614 CB VAL A 103 -5.997 -14.678 -0.215 1.00 72.15 C ATOM 1615 CG1 VAL A 103 -5.395 -15.220 1.072 1.00 73.44 C ATOM 1616 CG2 VAL A 103 -5.051 -14.901 -1.387 1.00 52.31 C ATOM 0 H VAL A 103 -7.338 -14.201 -2.260 1.00 64.10 H new ATOM 0 HA VAL A 103 -7.238 -16.407 -0.573 1.00 51.04 H new ATOM 0 HB VAL A 103 -6.146 -13.605 -0.095 1.00 72.15 H new ATOM 0 HG11 VAL A 103 -4.429 -14.748 1.249 1.00 73.44 H new ATOM 0 HG12 VAL A 103 -6.063 -15.003 1.906 1.00 73.44 H new ATOM 0 HG13 VAL A 103 -5.261 -16.298 0.985 1.00 73.44 H new ATOM 0 HG21 VAL A 103 -4.089 -14.435 -1.172 1.00 52.31 H new ATOM 0 HG22 VAL A 103 -4.909 -15.971 -1.542 1.00 52.31 H new ATOM 0 HG23 VAL A 103 -5.476 -14.457 -2.287 1.00 52.31 H new ATOM 1626 N LYS A 104 -8.728 -13.760 0.758 1.00 30.32 N ATOM 1627 CA LYS A 104 -9.633 -13.331 1.817 1.00 23.31 C ATOM 1628 C LYS A 104 -11.001 -13.991 1.670 1.00 34.24 C ATOM 1629 O LYS A 104 -11.755 -14.099 2.638 1.00 71.00 O ATOM 1630 CB LYS A 104 -9.785 -11.809 1.799 1.00 31.11 C ATOM 1631 CG LYS A 104 -8.461 -11.066 1.853 1.00 4.13 C ATOM 1632 CD LYS A 104 -7.844 -11.128 3.241 1.00 52.42 C ATOM 1633 CE LYS A 104 -8.356 -10.007 4.133 1.00 0.25 C ATOM 1634 NZ LYS A 104 -9.052 -10.533 5.340 1.00 4.02 N ATOM 0 H LYS A 104 -8.453 -13.019 0.113 1.00 30.32 H new ATOM 0 HA LYS A 104 -9.204 -13.638 2.771 1.00 23.31 H new ATOM 0 HB2 LYS A 104 -10.320 -11.516 0.896 1.00 31.11 H new ATOM 0 HB3 LYS A 104 -10.399 -11.503 2.646 1.00 31.11 H new ATOM 0 HG2 LYS A 104 -7.771 -11.497 1.127 1.00 4.13 H new ATOM 0 HG3 LYS A 104 -8.615 -10.025 1.568 1.00 4.13 H new ATOM 0 HD2 LYS A 104 -8.072 -12.091 3.698 1.00 52.42 H new ATOM 0 HD3 LYS A 104 -6.759 -11.063 3.161 1.00 52.42 H new ATOM 0 HE2 LYS A 104 -7.521 -9.378 4.441 1.00 0.25 H new ATOM 0 HE3 LYS A 104 -9.040 -9.375 3.566 1.00 0.25 H new ATOM 0 HZ1 LYS A 104 -9.386 -9.738 5.922 1.00 4.02 H new ATOM 0 HZ2 LYS A 104 -9.864 -11.113 5.047 1.00 4.02 H new ATOM 0 HZ3 LYS A 104 -8.393 -11.115 5.895 1.00 4.02 H new ATOM 1648 N ASP A 105 -11.319 -14.431 0.455 1.00 24.20 N ATOM 1649 CA ASP A 105 -12.597 -15.078 0.186 1.00 22.31 C ATOM 1650 C ASP A 105 -13.751 -14.104 0.400 1.00 22.10 C ATOM 1651 O ASP A 105 -14.737 -14.425 1.064 1.00 11.23 O ATOM 1652 CB ASP A 105 -12.771 -16.307 1.081 1.00 45.03 C ATOM 1653 CG ASP A 105 -13.923 -17.187 0.637 1.00 45.31 C ATOM 1654 OD1 ASP A 105 -14.323 -17.092 -0.542 1.00 51.55 O ATOM 1655 OD2 ASP A 105 -14.424 -17.973 1.468 1.00 30.12 O ATOM 0 H ASP A 105 -10.708 -14.350 -0.358 1.00 24.20 H new ATOM 0 HA ASP A 105 -12.604 -15.398 -0.856 1.00 22.31 H new ATOM 0 HB2 ASP A 105 -11.850 -16.890 1.077 1.00 45.03 H new ATOM 0 HB3 ASP A 105 -12.939 -15.984 2.108 1.00 45.03 H new ATOM 1660 N SER A 106 -13.618 -12.910 -0.167 1.00 52.42 N ATOM 1661 CA SER A 106 -14.644 -11.884 -0.041 1.00 1.45 C ATOM 1662 C SER A 106 -14.328 -10.691 -0.938 1.00 12.35 C ATOM 1663 O SER A 106 -13.184 -10.242 -1.011 1.00 2.45 O ATOM 1664 CB SER A 106 -14.761 -11.429 1.414 1.00 23.24 C ATOM 1665 OG SER A 106 -16.110 -11.168 1.761 1.00 32.14 O ATOM 0 H SER A 106 -12.808 -12.629 -0.719 1.00 52.42 H new ATOM 0 HA SER A 106 -15.596 -12.311 -0.357 1.00 1.45 H new ATOM 0 HB2 SER A 106 -14.355 -12.197 2.072 1.00 23.24 H new ATOM 0 HB3 SER A 106 -14.163 -10.531 1.566 1.00 23.24 H new ATOM 0 HG SER A 106 -16.157 -10.880 2.697 1.00 32.14 H new ATOM 1671 N ASP A 107 -15.349 -10.183 -1.620 1.00 61.33 N ATOM 1672 CA ASP A 107 -15.179 -9.044 -2.515 1.00 53.21 C ATOM 1673 C ASP A 107 -14.921 -7.762 -1.728 1.00 32.30 C ATOM 1674 O ASP A 107 -14.133 -6.914 -2.147 1.00 24.14 O ATOM 1675 CB ASP A 107 -16.418 -8.873 -3.396 1.00 3.44 C ATOM 1676 CG ASP A 107 -17.668 -8.584 -2.588 1.00 65.12 C ATOM 1677 OD1 ASP A 107 -18.042 -9.431 -1.750 1.00 61.02 O ATOM 1678 OD2 ASP A 107 -18.272 -7.510 -2.794 1.00 0.23 O ATOM 0 H ASP A 107 -16.303 -10.542 -1.570 1.00 61.33 H new ATOM 0 HA ASP A 107 -14.313 -9.239 -3.148 1.00 53.21 H new ATOM 0 HB2 ASP A 107 -16.249 -8.060 -4.102 1.00 3.44 H new ATOM 0 HB3 ASP A 107 -16.570 -9.778 -3.984 1.00 3.44 H new ATOM 1683 N ASP A 108 -15.593 -7.625 -0.590 1.00 10.35 N ATOM 1684 CA ASP A 108 -15.438 -6.444 0.251 1.00 43.14 C ATOM 1685 C ASP A 108 -14.378 -6.667 1.324 1.00 21.34 C ATOM 1686 O ASP A 108 -14.679 -7.143 2.419 1.00 33.42 O ATOM 1687 CB ASP A 108 -16.772 -6.081 0.906 1.00 20.12 C ATOM 1688 CG ASP A 108 -17.874 -5.854 -0.110 1.00 21.30 C ATOM 1689 OD1 ASP A 108 -17.760 -4.898 -0.905 1.00 14.03 O ATOM 1690 OD2 ASP A 108 -18.850 -6.633 -0.110 1.00 75.30 O ATOM 0 H ASP A 108 -16.250 -8.317 -0.229 1.00 10.35 H new ATOM 0 HA ASP A 108 -15.114 -5.620 -0.385 1.00 43.14 H new ATOM 0 HB2 ASP A 108 -17.068 -6.879 1.586 1.00 20.12 H new ATOM 0 HB3 ASP A 108 -16.645 -5.181 1.507 1.00 20.12 H new ATOM 1695 N VAL A 109 -13.136 -6.315 1.006 1.00 55.14 N ATOM 1696 CA VAL A 109 -12.033 -6.471 1.946 1.00 63.51 C ATOM 1697 C VAL A 109 -11.456 -5.113 2.338 1.00 61.53 C ATOM 1698 O VAL A 109 -11.543 -4.149 1.577 1.00 74.32 O ATOM 1699 CB VAL A 109 -10.909 -7.352 1.364 1.00 40.51 C ATOM 1700 CG1 VAL A 109 -11.443 -8.730 1.002 1.00 52.22 C ATOM 1701 CG2 VAL A 109 -10.272 -6.685 0.153 1.00 50.30 C ATOM 0 H VAL A 109 -12.869 -5.920 0.104 1.00 55.14 H new ATOM 0 HA VAL A 109 -12.438 -6.963 2.831 1.00 63.51 H new ATOM 0 HB VAL A 109 -10.140 -7.473 2.127 1.00 40.51 H new ATOM 0 HG11 VAL A 109 -10.635 -9.337 0.593 1.00 52.22 H new ATOM 0 HG12 VAL A 109 -11.843 -9.211 1.895 1.00 52.22 H new ATOM 0 HG13 VAL A 109 -12.234 -8.630 0.259 1.00 52.22 H new ATOM 0 HG21 VAL A 109 -9.482 -7.324 -0.241 1.00 50.30 H new ATOM 0 HG22 VAL A 109 -11.029 -6.528 -0.616 1.00 50.30 H new ATOM 0 HG23 VAL A 109 -9.849 -5.725 0.447 1.00 50.30 H new ATOM 1711 N PRO A 110 -10.856 -5.017 3.537 1.00 75.40 N ATOM 1712 CA PRO A 110 -10.265 -3.767 4.024 1.00 42.01 C ATOM 1713 C PRO A 110 -8.994 -3.396 3.268 1.00 12.40 C ATOM 1714 O PRO A 110 -7.943 -4.005 3.465 1.00 70.14 O ATOM 1715 CB PRO A 110 -9.948 -4.072 5.489 1.00 55.14 C ATOM 1716 CG PRO A 110 -9.769 -5.549 5.538 1.00 22.24 C ATOM 1717 CD PRO A 110 -10.708 -6.116 4.508 1.00 23.55 C ATOM 0 HA PRO A 110 -10.935 -2.918 3.888 1.00 42.01 H new ATOM 0 HB2 PRO A 110 -9.047 -3.553 5.815 1.00 55.14 H new ATOM 0 HB3 PRO A 110 -10.757 -3.749 6.145 1.00 55.14 H new ATOM 0 HG2 PRO A 110 -8.737 -5.824 5.319 1.00 22.24 H new ATOM 0 HG3 PRO A 110 -9.998 -5.937 6.530 1.00 22.24 H new ATOM 0 HD2 PRO A 110 -10.299 -7.012 4.041 1.00 23.55 H new ATOM 0 HD3 PRO A 110 -11.666 -6.395 4.948 1.00 23.55 H new ATOM 1725 N MET A 111 -9.098 -2.393 2.403 1.00 44.43 N ATOM 1726 CA MET A 111 -7.955 -1.942 1.617 1.00 55.13 C ATOM 1727 C MET A 111 -8.114 -0.480 1.214 1.00 3.22 C ATOM 1728 O MET A 111 -9.175 0.115 1.402 1.00 14.52 O ATOM 1729 CB MET A 111 -7.792 -2.812 0.370 1.00 4.02 C ATOM 1730 CG MET A 111 -9.027 -2.843 -0.516 1.00 51.22 C ATOM 1731 SD MET A 111 -8.656 -3.352 -2.205 1.00 12.33 S ATOM 1732 CE MET A 111 -8.574 -5.130 -2.008 1.00 43.23 C ATOM 0 H MET A 111 -9.961 -1.877 2.228 1.00 44.43 H new ATOM 0 HA MET A 111 -7.062 -2.034 2.235 1.00 55.13 H new ATOM 0 HB2 MET A 111 -6.947 -2.444 -0.212 1.00 4.02 H new ATOM 0 HB3 MET A 111 -7.549 -3.830 0.676 1.00 4.02 H new ATOM 0 HG2 MET A 111 -9.760 -3.526 -0.087 1.00 51.22 H new ATOM 0 HG3 MET A 111 -9.484 -1.854 -0.531 1.00 51.22 H new ATOM 0 HE1 MET A 111 -7.945 -5.554 -2.791 1.00 43.23 H new ATOM 0 HE2 MET A 111 -8.150 -5.369 -1.033 1.00 43.23 H new ATOM 0 HE3 MET A 111 -9.577 -5.551 -2.080 1.00 43.23 H new ATOM 1742 N VAL A 112 -7.051 0.094 0.660 1.00 42.55 N ATOM 1743 CA VAL A 112 -7.069 1.486 0.231 1.00 0.14 C ATOM 1744 C VAL A 112 -6.323 1.665 -1.087 1.00 13.44 C ATOM 1745 O VAL A 112 -5.374 0.937 -1.378 1.00 21.32 O ATOM 1746 CB VAL A 112 -6.441 2.406 1.297 1.00 22.51 C ATOM 1747 CG1 VAL A 112 -6.534 3.864 0.873 1.00 25.34 C ATOM 1748 CG2 VAL A 112 -7.111 2.192 2.646 1.00 0.34 C ATOM 0 H VAL A 112 -6.165 -0.385 0.498 1.00 42.55 H new ATOM 0 HA VAL A 112 -8.114 1.764 0.091 1.00 0.14 H new ATOM 0 HB VAL A 112 -5.386 2.149 1.394 1.00 22.51 H new ATOM 0 HG11 VAL A 112 -6.085 4.495 1.640 1.00 25.34 H new ATOM 0 HG12 VAL A 112 -6.003 4.004 -0.069 1.00 25.34 H new ATOM 0 HG13 VAL A 112 -7.581 4.139 0.744 1.00 25.34 H new ATOM 0 HG21 VAL A 112 -6.656 2.849 3.387 1.00 0.34 H new ATOM 0 HG22 VAL A 112 -8.174 2.419 2.564 1.00 0.34 H new ATOM 0 HG23 VAL A 112 -6.984 1.154 2.955 1.00 0.34 H new ATOM 1758 N LEU A 113 -6.758 2.640 -1.880 1.00 24.23 N ATOM 1759 CA LEU A 113 -6.130 2.916 -3.167 1.00 64.13 C ATOM 1760 C LEU A 113 -5.445 4.278 -3.155 1.00 74.05 C ATOM 1761 O LEU A 113 -6.101 5.316 -3.248 1.00 55.43 O ATOM 1762 CB LEU A 113 -7.173 2.863 -4.289 1.00 4.21 C ATOM 1763 CG LEU A 113 -6.634 3.101 -5.706 1.00 30.24 C ATOM 1764 CD1 LEU A 113 -5.220 2.556 -5.853 1.00 64.44 C ATOM 1765 CD2 LEU A 113 -7.557 2.465 -6.735 1.00 73.55 C ATOM 0 H LEU A 113 -7.542 3.251 -1.654 1.00 24.23 H new ATOM 0 HA LEU A 113 -5.374 2.152 -3.348 1.00 64.13 H new ATOM 0 HB2 LEU A 113 -7.659 1.888 -4.263 1.00 4.21 H new ATOM 0 HB3 LEU A 113 -7.942 3.608 -4.082 1.00 4.21 H new ATOM 0 HG LEU A 113 -6.600 4.177 -5.880 1.00 30.24 H new ATOM 0 HD11 LEU A 113 -4.863 2.738 -6.867 1.00 64.44 H new ATOM 0 HD12 LEU A 113 -4.562 3.055 -5.142 1.00 64.44 H new ATOM 0 HD13 LEU A 113 -5.221 1.484 -5.656 1.00 64.44 H new ATOM 0 HD21 LEU A 113 -7.163 2.641 -7.736 1.00 73.55 H new ATOM 0 HD22 LEU A 113 -7.620 1.392 -6.554 1.00 73.55 H new ATOM 0 HD23 LEU A 113 -8.551 2.905 -6.654 1.00 73.55 H new ATOM 1777 N VAL A 114 -4.121 4.267 -3.037 1.00 15.14 N ATOM 1778 CA VAL A 114 -3.345 5.500 -3.009 1.00 34.14 C ATOM 1779 C VAL A 114 -2.679 5.764 -4.356 1.00 11.44 C ATOM 1780 O VAL A 114 -2.275 4.834 -5.053 1.00 63.12 O ATOM 1781 CB VAL A 114 -2.262 5.456 -1.916 1.00 21.33 C ATOM 1782 CG1 VAL A 114 -1.609 6.819 -1.755 1.00 64.14 C ATOM 1783 CG2 VAL A 114 -2.852 4.979 -0.596 1.00 71.34 C ATOM 0 H VAL A 114 -3.563 3.416 -2.959 1.00 15.14 H new ATOM 0 HA VAL A 114 -4.044 6.307 -2.788 1.00 34.14 H new ATOM 0 HB VAL A 114 -1.494 4.745 -2.221 1.00 21.33 H new ATOM 0 HG11 VAL A 114 -0.846 6.768 -0.978 1.00 64.14 H new ATOM 0 HG12 VAL A 114 -1.148 7.115 -2.697 1.00 64.14 H new ATOM 0 HG13 VAL A 114 -2.364 7.553 -1.474 1.00 64.14 H new ATOM 0 HG21 VAL A 114 -2.071 4.955 0.164 1.00 71.34 H new ATOM 0 HG22 VAL A 114 -3.642 5.662 -0.283 1.00 71.34 H new ATOM 0 HG23 VAL A 114 -3.266 3.979 -0.723 1.00 71.34 H new ATOM 1793 N GLY A 115 -2.567 7.040 -4.714 1.00 54.34 N ATOM 1794 CA GLY A 115 -1.947 7.405 -5.975 1.00 24.01 C ATOM 1795 C GLY A 115 -0.628 8.128 -5.783 1.00 53.31 C ATOM 1796 O GLY A 115 -0.593 9.355 -5.684 1.00 50.23 O ATOM 0 H GLY A 115 -2.894 7.827 -4.154 1.00 54.34 H new ATOM 0 HA2 GLY A 115 -1.782 6.506 -6.569 1.00 24.01 H new ATOM 0 HA3 GLY A 115 -2.628 8.041 -6.541 1.00 24.01 H new ATOM 1800 N ASN A 116 0.459 7.366 -5.728 1.00 74.40 N ATOM 1801 CA ASN A 116 1.788 7.939 -5.544 1.00 71.42 C ATOM 1802 C ASN A 116 2.198 8.770 -6.755 1.00 42.33 C ATOM 1803 O ASN A 116 1.546 8.730 -7.799 1.00 31.01 O ATOM 1804 CB ASN A 116 2.814 6.831 -5.300 1.00 71.30 C ATOM 1805 CG ASN A 116 4.045 7.333 -4.571 1.00 43.12 C ATOM 1806 OD1 ASN A 116 4.230 8.538 -4.397 1.00 30.14 O ATOM 1807 ND2 ASN A 116 4.896 6.409 -4.141 1.00 2.41 N ATOM 0 H ASN A 116 0.446 6.349 -5.808 1.00 74.40 H new ATOM 0 HA ASN A 116 1.755 8.594 -4.673 1.00 71.42 H new ATOM 0 HB2 ASN A 116 2.352 6.033 -4.719 1.00 71.30 H new ATOM 0 HB3 ASN A 116 3.112 6.399 -6.255 1.00 71.30 H new ATOM 0 HD21 ASN A 116 5.743 6.687 -3.645 1.00 2.41 H new ATOM 0 HD22 ASN A 116 4.703 5.421 -4.307 1.00 2.41 H new ATOM 1814 N LYS A 117 3.284 9.523 -6.609 1.00 42.21 N ATOM 1815 CA LYS A 117 3.786 10.365 -7.689 1.00 64.40 C ATOM 1816 C LYS A 117 2.758 11.424 -8.077 1.00 3.30 C ATOM 1817 O LYS A 117 2.199 11.390 -9.174 1.00 44.13 O ATOM 1818 CB LYS A 117 4.144 9.511 -8.907 1.00 44.41 C ATOM 1819 CG LYS A 117 4.917 8.249 -8.560 1.00 61.54 C ATOM 1820 CD LYS A 117 5.864 7.850 -9.680 1.00 11.41 C ATOM 1821 CE LYS A 117 7.169 8.626 -9.608 1.00 12.33 C ATOM 1822 NZ LYS A 117 7.820 8.743 -10.942 1.00 53.21 N ATOM 0 H LYS A 117 3.834 9.567 -5.751 1.00 42.21 H new ATOM 0 HA LYS A 117 4.684 10.871 -7.334 1.00 64.40 H new ATOM 0 HB2 LYS A 117 3.227 9.234 -9.428 1.00 44.41 H new ATOM 0 HB3 LYS A 117 4.735 10.110 -9.599 1.00 44.41 H new ATOM 0 HG2 LYS A 117 5.484 8.409 -7.643 1.00 61.54 H new ATOM 0 HG3 LYS A 117 4.218 7.435 -8.365 1.00 61.54 H new ATOM 0 HD2 LYS A 117 6.071 6.782 -9.620 1.00 11.41 H new ATOM 0 HD3 LYS A 117 5.386 8.028 -10.643 1.00 11.41 H new ATOM 0 HE2 LYS A 117 6.977 9.622 -9.209 1.00 12.33 H new ATOM 0 HE3 LYS A 117 7.848 8.130 -8.915 1.00 12.33 H new ATOM 0 HZ1 LYS A 117 8.707 9.279 -10.850 1.00 53.21 H new ATOM 0 HZ2 LYS A 117 8.026 7.793 -11.312 1.00 53.21 H new ATOM 0 HZ3 LYS A 117 7.182 9.239 -11.597 1.00 53.21 H new ATOM 1836 N CYS A 118 2.514 12.363 -7.170 1.00 13.12 N ATOM 1837 CA CYS A 118 1.553 13.433 -7.415 1.00 44.14 C ATOM 1838 C CYS A 118 2.259 14.753 -7.722 1.00 3.15 C ATOM 1839 O CYS A 118 1.640 15.695 -8.217 1.00 1.13 O ATOM 1840 CB CYS A 118 0.633 13.604 -6.205 1.00 15.31 C ATOM 1841 SG CYS A 118 -0.859 14.569 -6.544 1.00 41.42 S ATOM 0 H CYS A 118 2.968 12.405 -6.258 1.00 13.12 H new ATOM 0 HA CYS A 118 0.957 13.155 -8.285 1.00 44.14 H new ATOM 0 HB2 CYS A 118 0.341 12.619 -5.842 1.00 15.31 H new ATOM 0 HB3 CYS A 118 1.191 14.087 -5.403 1.00 15.31 H new ATOM 0 HG CYS A 118 -0.587 15.498 -7.411 1.00 41.42 H new ATOM 1847 N ASP A 119 3.555 14.820 -7.425 1.00 42.22 N ATOM 1848 CA ASP A 119 4.333 16.029 -7.672 1.00 15.13 C ATOM 1849 C ASP A 119 4.856 16.064 -9.105 1.00 52.41 C ATOM 1850 O ASP A 119 5.130 17.134 -9.648 1.00 54.21 O ATOM 1851 CB ASP A 119 5.501 16.119 -6.688 1.00 55.43 C ATOM 1852 CG ASP A 119 6.361 14.870 -6.697 1.00 2.20 C ATOM 1853 OD1 ASP A 119 5.851 13.795 -6.316 1.00 31.51 O ATOM 1854 OD2 ASP A 119 7.544 14.968 -7.084 1.00 34.32 O ATOM 0 H ASP A 119 4.086 14.052 -7.014 1.00 42.22 H new ATOM 0 HA ASP A 119 3.676 16.886 -7.527 1.00 15.13 H new ATOM 0 HB2 ASP A 119 6.117 16.983 -6.937 1.00 55.43 H new ATOM 0 HB3 ASP A 119 5.114 16.283 -5.682 1.00 55.43 H new ATOM 1859 N LEU A 120 4.994 14.889 -9.714 1.00 35.41 N ATOM 1860 CA LEU A 120 5.486 14.787 -11.085 1.00 13.14 C ATOM 1861 C LEU A 120 4.747 15.753 -12.009 1.00 34.21 C ATOM 1862 O LEU A 120 3.701 16.293 -11.648 1.00 63.11 O ATOM 1863 CB LEU A 120 5.331 13.354 -11.595 1.00 21.24 C ATOM 1864 CG LEU A 120 6.498 12.419 -11.271 1.00 75.30 C ATOM 1865 CD1 LEU A 120 7.723 12.789 -12.092 1.00 61.25 C ATOM 1866 CD2 LEU A 120 6.817 12.461 -9.784 1.00 12.13 C ATOM 0 H LEU A 120 4.772 13.993 -9.279 1.00 35.41 H new ATOM 0 HA LEU A 120 6.542 15.056 -11.085 1.00 13.14 H new ATOM 0 HB2 LEU A 120 4.419 12.931 -11.173 1.00 21.24 H new ATOM 0 HB3 LEU A 120 5.198 13.382 -12.676 1.00 21.24 H new ATOM 0 HG LEU A 120 6.207 11.401 -11.531 1.00 75.30 H new ATOM 0 HD11 LEU A 120 8.542 12.113 -11.848 1.00 61.25 H new ATOM 0 HD12 LEU A 120 7.488 12.706 -13.153 1.00 61.25 H new ATOM 0 HD13 LEU A 120 8.018 13.813 -11.864 1.00 61.25 H new ATOM 0 HD21 LEU A 120 7.649 11.790 -9.571 1.00 12.13 H new ATOM 0 HD22 LEU A 120 7.088 13.477 -9.499 1.00 12.13 H new ATOM 0 HD23 LEU A 120 5.942 12.146 -9.215 1.00 12.13 H new ATOM 1878 N ALA A 121 5.299 15.970 -13.199 1.00 13.10 N ATOM 1879 CA ALA A 121 4.692 16.874 -14.169 1.00 14.31 C ATOM 1880 C ALA A 121 4.286 16.137 -15.442 1.00 3.44 C ATOM 1881 O ALA A 121 4.216 16.731 -16.518 1.00 4.55 O ATOM 1882 CB ALA A 121 5.651 18.009 -14.499 1.00 32.32 C ATOM 0 H ALA A 121 6.165 15.532 -13.514 1.00 13.10 H new ATOM 0 HA ALA A 121 3.788 17.288 -13.722 1.00 14.31 H new ATOM 0 HB1 ALA A 121 5.187 18.678 -15.224 1.00 32.32 H new ATOM 0 HB2 ALA A 121 5.884 18.564 -13.590 1.00 32.32 H new ATOM 0 HB3 ALA A 121 6.569 17.599 -14.919 1.00 32.32 H new ATOM 1888 N ALA A 122 4.021 14.841 -15.315 1.00 70.24 N ATOM 1889 CA ALA A 122 3.625 14.027 -16.457 1.00 20.12 C ATOM 1890 C ALA A 122 2.652 12.930 -16.035 1.00 5.32 C ATOM 1891 O ALA A 122 2.972 11.743 -16.105 1.00 44.33 O ATOM 1892 CB ALA A 122 4.853 13.421 -17.114 1.00 64.43 C ATOM 0 H ALA A 122 4.073 14.332 -14.432 1.00 70.24 H new ATOM 0 HA ALA A 122 3.117 14.669 -17.177 1.00 20.12 H new ATOM 0 HB1 ALA A 122 4.548 12.814 -17.966 1.00 64.43 H new ATOM 0 HB2 ALA A 122 5.514 14.218 -17.454 1.00 64.43 H new ATOM 0 HB3 ALA A 122 5.380 12.795 -16.393 1.00 64.43 H new ATOM 1898 N ARG A 123 1.466 13.333 -15.591 1.00 44.10 N ATOM 1899 CA ARG A 123 0.454 12.381 -15.151 1.00 33.40 C ATOM 1900 C ARG A 123 -0.273 11.761 -16.336 1.00 20.55 C ATOM 1901 O ARG A 123 -0.828 12.466 -17.178 1.00 52.52 O ATOM 1902 CB ARG A 123 -0.552 13.071 -14.231 1.00 4.55 C ATOM 1903 CG ARG A 123 -1.341 14.170 -14.922 1.00 74.25 C ATOM 1904 CD ARG A 123 -2.214 14.932 -13.940 1.00 41.34 C ATOM 1905 NE ARG A 123 -1.459 15.389 -12.776 1.00 32.31 N ATOM 1906 CZ ARG A 123 -0.631 16.432 -12.792 1.00 10.33 C ATOM 1907 NH1 ARG A 123 -0.454 17.130 -13.907 1.00 15.41 N ATOM 1908 NH2 ARG A 123 0.019 16.779 -11.689 1.00 61.03 N ATOM 0 H ARG A 123 1.183 14.311 -15.527 1.00 44.10 H new ATOM 0 HA ARG A 123 0.959 11.584 -14.605 1.00 33.40 H new ATOM 0 HB2 ARG A 123 -1.245 12.327 -13.839 1.00 4.55 H new ATOM 0 HB3 ARG A 123 -0.023 13.495 -13.378 1.00 4.55 H new ATOM 0 HG2 ARG A 123 -0.653 14.860 -15.411 1.00 74.25 H new ATOM 0 HG3 ARG A 123 -1.965 13.735 -15.703 1.00 74.25 H new ATOM 0 HD2 ARG A 123 -2.660 15.790 -14.442 1.00 41.34 H new ATOM 0 HD3 ARG A 123 -3.034 14.293 -13.612 1.00 41.34 H new ATOM 0 HE ARG A 123 -1.573 14.879 -11.900 1.00 32.31 H new ATOM 0 HH11 ARG A 123 -0.953 16.868 -14.757 1.00 15.41 H new ATOM 0 HH12 ARG A 123 0.181 17.928 -13.914 1.00 15.41 H new ATOM 0 HH21 ARG A 123 -0.115 16.247 -10.829 1.00 61.03 H new ATOM 0 HH22 ARG A 123 0.653 17.578 -11.701 1.00 61.03 H new ATOM 1922 N THR A 124 -0.269 10.434 -16.391 1.00 65.22 N ATOM 1923 CA THR A 124 -0.933 9.711 -17.467 1.00 53.34 C ATOM 1924 C THR A 124 -2.343 9.305 -17.053 1.00 75.35 C ATOM 1925 O THR A 124 -3.285 9.403 -17.839 1.00 75.43 O ATOM 1926 CB THR A 124 -0.121 8.474 -17.852 1.00 21.32 C ATOM 1927 OG1 THR A 124 -0.326 7.429 -16.917 1.00 1.12 O ATOM 1928 CG2 THR A 124 1.367 8.738 -17.928 1.00 74.43 C ATOM 0 H THR A 124 0.188 9.837 -15.701 1.00 65.22 H new ATOM 0 HA THR A 124 -1.004 10.371 -18.332 1.00 53.34 H new ATOM 0 HB THR A 124 -0.475 8.191 -18.843 1.00 21.32 H new ATOM 0 HG1 THR A 124 -0.015 7.716 -16.033 1.00 1.12 H new ATOM 0 HG21 THR A 124 1.886 7.820 -18.206 1.00 74.43 H new ATOM 0 HG22 THR A 124 1.563 9.506 -18.676 1.00 74.43 H new ATOM 0 HG23 THR A 124 1.726 9.078 -16.957 1.00 74.43 H new ATOM 1936 N VAL A 125 -2.479 8.855 -15.809 1.00 61.31 N ATOM 1937 CA VAL A 125 -3.767 8.438 -15.280 1.00 40.22 C ATOM 1938 C VAL A 125 -4.309 9.476 -14.302 1.00 61.21 C ATOM 1939 O VAL A 125 -3.982 9.455 -13.115 1.00 65.13 O ATOM 1940 CB VAL A 125 -3.656 7.076 -14.570 1.00 51.40 C ATOM 1941 CG1 VAL A 125 -4.993 6.669 -13.977 1.00 12.34 C ATOM 1942 CG2 VAL A 125 -3.147 6.012 -15.531 1.00 73.43 C ATOM 0 H VAL A 125 -1.707 8.771 -15.148 1.00 61.31 H new ATOM 0 HA VAL A 125 -4.454 8.344 -16.121 1.00 40.22 H new ATOM 0 HB VAL A 125 -2.939 7.172 -13.755 1.00 51.40 H new ATOM 0 HG11 VAL A 125 -4.892 5.704 -13.480 1.00 12.34 H new ATOM 0 HG12 VAL A 125 -5.313 7.418 -13.253 1.00 12.34 H new ATOM 0 HG13 VAL A 125 -5.735 6.592 -14.772 1.00 12.34 H new ATOM 0 HG21 VAL A 125 -3.075 5.057 -15.011 1.00 73.43 H new ATOM 0 HG22 VAL A 125 -3.838 5.918 -16.369 1.00 73.43 H new ATOM 0 HG23 VAL A 125 -2.163 6.298 -15.902 1.00 73.43 H new ATOM 1952 N GLU A 126 -5.137 10.385 -14.808 1.00 62.41 N ATOM 1953 CA GLU A 126 -5.722 11.434 -13.979 1.00 70.43 C ATOM 1954 C GLU A 126 -6.450 10.840 -12.777 1.00 5.14 C ATOM 1955 O GLU A 126 -6.845 9.674 -12.791 1.00 24.52 O ATOM 1956 CB GLU A 126 -6.688 12.286 -14.805 1.00 10.24 C ATOM 1957 CG GLU A 126 -7.666 11.468 -15.633 1.00 24.51 C ATOM 1958 CD GLU A 126 -8.794 12.307 -16.204 1.00 43.23 C ATOM 1959 OE1 GLU A 126 -8.747 13.547 -16.056 1.00 74.52 O ATOM 1960 OE2 GLU A 126 -9.724 11.724 -16.799 1.00 72.23 O ATOM 0 H GLU A 126 -5.418 10.416 -15.788 1.00 62.41 H new ATOM 0 HA GLU A 126 -4.912 12.065 -13.613 1.00 70.43 H new ATOM 0 HB2 GLU A 126 -7.249 12.938 -14.135 1.00 10.24 H new ATOM 0 HB3 GLU A 126 -6.113 12.931 -15.470 1.00 10.24 H new ATOM 0 HG2 GLU A 126 -7.129 10.985 -16.449 1.00 24.51 H new ATOM 0 HG3 GLU A 126 -8.086 10.675 -15.014 1.00 24.51 H new ATOM 1967 N SER A 127 -6.623 11.651 -11.738 1.00 20.22 N ATOM 1968 CA SER A 127 -7.304 11.208 -10.525 1.00 43.40 C ATOM 1969 C SER A 127 -8.707 10.697 -10.842 1.00 25.44 C ATOM 1970 O SER A 127 -9.229 9.821 -10.154 1.00 62.33 O ATOM 1971 CB SER A 127 -7.382 12.352 -9.513 1.00 53.25 C ATOM 1972 OG SER A 127 -7.645 13.586 -10.158 1.00 42.11 O ATOM 0 H SER A 127 -6.301 12.619 -11.711 1.00 20.22 H new ATOM 0 HA SER A 127 -6.728 10.389 -10.094 1.00 43.40 H new ATOM 0 HB2 SER A 127 -8.166 12.145 -8.784 1.00 53.25 H new ATOM 0 HB3 SER A 127 -6.444 12.419 -8.962 1.00 53.25 H new ATOM 0 HG SER A 127 -7.692 14.301 -9.490 1.00 42.11 H new ATOM 1978 N ARG A 128 -9.310 11.252 -11.889 1.00 74.22 N ATOM 1979 CA ARG A 128 -10.652 10.854 -12.299 1.00 72.01 C ATOM 1980 C ARG A 128 -10.697 9.367 -12.642 1.00 52.31 C ATOM 1981 O ARG A 128 -11.631 8.661 -12.264 1.00 31.12 O ATOM 1982 CB ARG A 128 -11.103 11.684 -13.503 1.00 34.25 C ATOM 1983 CG ARG A 128 -12.458 11.271 -14.058 1.00 62.24 C ATOM 1984 CD ARG A 128 -13.396 12.461 -14.190 1.00 44.40 C ATOM 1985 NE ARG A 128 -14.422 12.239 -15.206 1.00 3.31 N ATOM 1986 CZ ARG A 128 -15.505 13.001 -15.345 1.00 14.41 C ATOM 1987 NH1 ARG A 128 -15.707 14.033 -14.535 1.00 11.03 N ATOM 1988 NH2 ARG A 128 -16.389 12.729 -16.295 1.00 41.43 N ATOM 0 H ARG A 128 -8.890 11.979 -12.469 1.00 74.22 H new ATOM 0 HA ARG A 128 -11.332 11.035 -11.466 1.00 72.01 H new ATOM 0 HB2 ARG A 128 -11.143 12.734 -13.214 1.00 34.25 H new ATOM 0 HB3 ARG A 128 -10.356 11.599 -14.292 1.00 34.25 H new ATOM 0 HG2 ARG A 128 -12.325 10.802 -15.033 1.00 62.24 H new ATOM 0 HG3 ARG A 128 -12.907 10.524 -13.404 1.00 62.24 H new ATOM 0 HD2 ARG A 128 -13.873 12.655 -13.229 1.00 44.40 H new ATOM 0 HD3 ARG A 128 -12.820 13.350 -14.445 1.00 44.40 H new ATOM 0 HE ARG A 128 -14.302 11.454 -15.846 1.00 3.31 H new ATOM 0 HH11 ARG A 128 -15.031 14.246 -13.802 1.00 11.03 H new ATOM 0 HH12 ARG A 128 -16.538 14.613 -14.646 1.00 11.03 H new ATOM 0 HH21 ARG A 128 -16.239 11.936 -16.919 1.00 41.43 H new ATOM 0 HH22 ARG A 128 -17.219 13.313 -16.402 1.00 41.43 H new ATOM 2002 N GLN A 129 -9.682 8.902 -13.361 1.00 53.14 N ATOM 2003 CA GLN A 129 -9.605 7.501 -13.759 1.00 32.40 C ATOM 2004 C GLN A 129 -9.440 6.595 -12.542 1.00 43.41 C ATOM 2005 O GLN A 129 -9.952 5.476 -12.516 1.00 13.24 O ATOM 2006 CB GLN A 129 -8.442 7.291 -14.730 1.00 1.32 C ATOM 2007 CG GLN A 129 -8.420 8.294 -15.873 1.00 2.40 C ATOM 2008 CD GLN A 129 -8.373 7.628 -17.235 1.00 53.11 C ATOM 2009 OE1 GLN A 129 -9.398 7.472 -17.899 1.00 70.22 O ATOM 2010 NE2 GLN A 129 -7.178 7.231 -17.659 1.00 12.32 N ATOM 0 H GLN A 129 -8.901 9.475 -13.680 1.00 53.14 H new ATOM 0 HA GLN A 129 -10.538 7.238 -14.257 1.00 32.40 H new ATOM 0 HB2 GLN A 129 -7.503 7.357 -14.180 1.00 1.32 H new ATOM 0 HB3 GLN A 129 -8.500 6.283 -15.142 1.00 1.32 H new ATOM 0 HG2 GLN A 129 -9.305 8.927 -15.813 1.00 2.40 H new ATOM 0 HG3 GLN A 129 -7.554 8.946 -15.762 1.00 2.40 H new ATOM 0 HE21 GLN A 129 -6.354 7.380 -17.076 1.00 12.32 H new ATOM 0 HE22 GLN A 129 -7.084 6.777 -18.568 1.00 12.32 H new ATOM 2019 N ALA A 130 -8.724 7.086 -11.536 1.00 71.21 N ATOM 2020 CA ALA A 130 -8.495 6.319 -10.317 1.00 12.44 C ATOM 2021 C ALA A 130 -9.707 6.380 -9.395 1.00 1.22 C ATOM 2022 O ALA A 130 -10.042 5.402 -8.727 1.00 4.51 O ATOM 2023 CB ALA A 130 -7.256 6.828 -9.597 1.00 65.15 C ATOM 0 H ALA A 130 -8.293 8.010 -11.541 1.00 71.21 H new ATOM 0 HA ALA A 130 -8.336 5.278 -10.597 1.00 12.44 H new ATOM 0 HB1 ALA A 130 -7.098 6.246 -8.689 1.00 65.15 H new ATOM 0 HB2 ALA A 130 -6.389 6.726 -10.249 1.00 65.15 H new ATOM 0 HB3 ALA A 130 -7.392 7.877 -9.336 1.00 65.15 H new ATOM 2029 N GLN A 131 -10.361 7.537 -9.362 1.00 42.45 N ATOM 2030 CA GLN A 131 -11.536 7.726 -8.520 1.00 74.21 C ATOM 2031 C GLN A 131 -12.691 6.849 -8.994 1.00 20.23 C ATOM 2032 O GLN A 131 -13.367 6.208 -8.190 1.00 11.43 O ATOM 2033 CB GLN A 131 -11.958 9.198 -8.523 1.00 14.23 C ATOM 2034 CG GLN A 131 -11.546 9.948 -7.267 1.00 52.30 C ATOM 2035 CD GLN A 131 -12.719 10.244 -6.353 1.00 5.32 C ATOM 2036 OE1 GLN A 131 -13.221 11.366 -6.312 1.00 44.45 O ATOM 2037 NE2 GLN A 131 -13.160 9.233 -5.614 1.00 52.24 N ATOM 0 H GLN A 131 -10.097 8.357 -9.908 1.00 42.45 H new ATOM 0 HA GLN A 131 -11.277 7.433 -7.503 1.00 74.21 H new ATOM 0 HB2 GLN A 131 -11.521 9.691 -9.391 1.00 14.23 H new ATOM 0 HB3 GLN A 131 -13.041 9.257 -8.634 1.00 14.23 H new ATOM 0 HG2 GLN A 131 -10.806 9.360 -6.724 1.00 52.30 H new ATOM 0 HG3 GLN A 131 -11.065 10.884 -7.549 1.00 52.30 H new ATOM 0 HE21 GLN A 131 -12.712 8.319 -5.681 1.00 52.24 H new ATOM 0 HE22 GLN A 131 -13.947 9.370 -4.979 1.00 52.24 H new ATOM 2046 N ASP A 132 -12.909 6.824 -10.305 1.00 41.33 N ATOM 2047 CA ASP A 132 -13.980 6.023 -10.885 1.00 52.13 C ATOM 2048 C ASP A 132 -13.764 4.540 -10.600 1.00 74.32 C ATOM 2049 O ASP A 132 -14.719 3.771 -10.503 1.00 63.32 O ATOM 2050 CB ASP A 132 -14.061 6.257 -12.395 1.00 12.30 C ATOM 2051 CG ASP A 132 -15.486 6.220 -12.911 1.00 51.14 C ATOM 2052 OD1 ASP A 132 -16.321 6.999 -12.404 1.00 74.43 O ATOM 2053 OD2 ASP A 132 -15.768 5.413 -13.821 1.00 61.43 O ATOM 0 H ASP A 132 -12.359 7.349 -10.985 1.00 41.33 H new ATOM 0 HA ASP A 132 -14.920 6.331 -10.426 1.00 52.13 H new ATOM 0 HB2 ASP A 132 -13.616 7.223 -12.634 1.00 12.30 H new ATOM 0 HB3 ASP A 132 -13.472 5.498 -12.909 1.00 12.30 H new ATOM 2058 N LEU A 133 -12.501 4.147 -10.465 1.00 23.53 N ATOM 2059 CA LEU A 133 -12.158 2.757 -10.189 1.00 3.35 C ATOM 2060 C LEU A 133 -12.327 2.439 -8.707 1.00 44.20 C ATOM 2061 O LEU A 133 -12.972 1.456 -8.343 1.00 64.05 O ATOM 2062 CB LEU A 133 -10.719 2.470 -10.624 1.00 34.03 C ATOM 2063 CG LEU A 133 -10.201 1.073 -10.277 1.00 74.02 C ATOM 2064 CD1 LEU A 133 -10.726 0.048 -11.270 1.00 30.34 C ATOM 2065 CD2 LEU A 133 -8.681 1.061 -10.248 1.00 42.35 C ATOM 0 H LEU A 133 -11.699 4.772 -10.542 1.00 23.53 H new ATOM 0 HA LEU A 133 -12.836 2.121 -10.758 1.00 3.35 H new ATOM 0 HB2 LEU A 133 -10.648 2.609 -11.703 1.00 34.03 H new ATOM 0 HB3 LEU A 133 -10.063 3.208 -10.163 1.00 34.03 H new ATOM 0 HG LEU A 133 -10.565 0.806 -9.285 1.00 74.02 H new ATOM 0 HD11 LEU A 133 -10.347 -0.940 -11.008 1.00 30.34 H new ATOM 0 HD12 LEU A 133 -11.816 0.038 -11.241 1.00 30.34 H new ATOM 0 HD13 LEU A 133 -10.392 0.310 -12.274 1.00 30.34 H new ATOM 0 HD21 LEU A 133 -8.330 0.060 -10.000 1.00 42.35 H new ATOM 0 HD22 LEU A 133 -8.296 1.348 -11.227 1.00 42.35 H new ATOM 0 HD23 LEU A 133 -8.326 1.767 -9.497 1.00 42.35 H new ATOM 2077 N ALA A 134 -11.743 3.277 -7.856 1.00 53.21 N ATOM 2078 CA ALA A 134 -11.829 3.081 -6.414 1.00 43.05 C ATOM 2079 C ALA A 134 -13.269 3.198 -5.929 1.00 15.33 C ATOM 2080 O ALA A 134 -13.733 2.383 -5.131 1.00 35.10 O ATOM 2081 CB ALA A 134 -10.944 4.084 -5.689 1.00 22.21 C ATOM 0 H ALA A 134 -11.206 4.097 -8.140 1.00 53.21 H new ATOM 0 HA ALA A 134 -11.477 2.074 -6.189 1.00 43.05 H new ATOM 0 HB1 ALA A 134 -11.019 3.925 -4.613 1.00 22.21 H new ATOM 0 HB2 ALA A 134 -9.909 3.951 -6.004 1.00 22.21 H new ATOM 0 HB3 ALA A 134 -11.269 5.096 -5.929 1.00 22.21 H new ATOM 2087 N ARG A 135 -13.973 4.214 -6.417 1.00 55.34 N ATOM 2088 CA ARG A 135 -15.361 4.434 -6.034 1.00 2.12 C ATOM 2089 C ARG A 135 -16.221 3.234 -6.422 1.00 50.13 C ATOM 2090 O ARG A 135 -17.203 2.917 -5.751 1.00 61.22 O ATOM 2091 CB ARG A 135 -15.893 5.709 -6.695 1.00 21.04 C ATOM 2092 CG ARG A 135 -17.400 5.878 -6.586 1.00 41.14 C ATOM 2093 CD ARG A 135 -18.110 5.274 -7.785 1.00 25.34 C ATOM 2094 NE ARG A 135 -19.433 4.760 -7.438 1.00 54.21 N ATOM 2095 CZ ARG A 135 -20.401 4.545 -8.326 1.00 65.12 C ATOM 2096 NH1 ARG A 135 -20.202 4.800 -9.613 1.00 2.15 N ATOM 2097 NH2 ARG A 135 -21.574 4.073 -7.925 1.00 50.41 N ATOM 0 H ARG A 135 -13.604 4.897 -7.078 1.00 55.34 H new ATOM 0 HA ARG A 135 -15.409 4.553 -4.952 1.00 2.12 H new ATOM 0 HB2 ARG A 135 -15.407 6.572 -6.240 1.00 21.04 H new ATOM 0 HB3 ARG A 135 -15.613 5.704 -7.748 1.00 21.04 H new ATOM 0 HG2 ARG A 135 -17.756 5.403 -5.672 1.00 41.14 H new ATOM 0 HG3 ARG A 135 -17.645 6.937 -6.511 1.00 41.14 H new ATOM 0 HD2 ARG A 135 -18.208 6.028 -8.566 1.00 25.34 H new ATOM 0 HD3 ARG A 135 -17.504 4.467 -8.196 1.00 25.34 H new ATOM 0 HE ARG A 135 -19.626 4.554 -6.458 1.00 54.21 H new ATOM 0 HH11 ARG A 135 -19.302 5.163 -9.928 1.00 2.15 H new ATOM 0 HH12 ARG A 135 -20.949 4.633 -10.287 1.00 2.15 H new ATOM 0 HH21 ARG A 135 -21.733 3.875 -6.937 1.00 50.41 H new ATOM 0 HH22 ARG A 135 -22.317 3.908 -8.605 1.00 50.41 H new ATOM 2111 N SER A 136 -15.840 2.566 -7.507 1.00 61.12 N ATOM 2112 CA SER A 136 -16.570 1.397 -7.980 1.00 31.34 C ATOM 2113 C SER A 136 -16.284 0.191 -7.093 1.00 54.42 C ATOM 2114 O SER A 136 -17.114 -0.709 -6.963 1.00 53.14 O ATOM 2115 CB SER A 136 -16.191 1.083 -9.428 1.00 30.40 C ATOM 2116 OG SER A 136 -17.108 0.172 -10.009 1.00 73.52 O ATOM 0 H SER A 136 -15.030 2.815 -8.074 1.00 61.12 H new ATOM 0 HA SER A 136 -17.636 1.618 -7.934 1.00 31.34 H new ATOM 0 HB2 SER A 136 -16.171 2.004 -10.010 1.00 30.40 H new ATOM 0 HB3 SER A 136 -15.186 0.663 -9.461 1.00 30.40 H new ATOM 0 HG SER A 136 -16.845 -0.011 -10.935 1.00 73.52 H new ATOM 2122 N TYR A 137 -15.103 0.180 -6.482 1.00 61.43 N ATOM 2123 CA TYR A 137 -14.704 -0.913 -5.604 1.00 12.14 C ATOM 2124 C TYR A 137 -15.240 -0.708 -4.190 1.00 4.12 C ATOM 2125 O TYR A 137 -15.282 -1.644 -3.392 1.00 61.44 O ATOM 2126 CB TYR A 137 -13.184 -1.037 -5.573 1.00 33.31 C ATOM 2127 CG TYR A 137 -12.624 -1.647 -6.833 1.00 2.04 C ATOM 2128 CD1 TYR A 137 -13.189 -2.793 -7.373 1.00 22.14 C ATOM 2129 CD2 TYR A 137 -11.542 -1.075 -7.487 1.00 54.12 C ATOM 2130 CE1 TYR A 137 -12.691 -3.357 -8.529 1.00 25.01 C ATOM 2131 CE2 TYR A 137 -11.038 -1.631 -8.646 1.00 61.40 C ATOM 2132 CZ TYR A 137 -11.615 -2.772 -9.164 1.00 52.22 C ATOM 2133 OH TYR A 137 -11.116 -3.329 -10.318 1.00 4.14 O ATOM 0 H TYR A 137 -14.405 0.917 -6.580 1.00 61.43 H new ATOM 0 HA TYR A 137 -15.131 -1.835 -6.000 1.00 12.14 H new ATOM 0 HB2 TYR A 137 -12.746 -0.050 -5.426 1.00 33.31 H new ATOM 0 HB3 TYR A 137 -12.891 -1.646 -4.718 1.00 33.31 H new ATOM 0 HD1 TYR A 137 -14.033 -3.252 -6.880 1.00 22.14 H new ATOM 0 HD2 TYR A 137 -11.088 -0.182 -7.084 1.00 54.12 H new ATOM 0 HE1 TYR A 137 -13.141 -4.251 -8.935 1.00 25.01 H new ATOM 0 HE2 TYR A 137 -10.196 -1.175 -9.145 1.00 61.40 H new ATOM 0 HH TYR A 137 -11.129 -4.306 -10.242 1.00 4.14 H new ATOM 2143 N GLY A 138 -15.642 0.522 -3.884 1.00 33.12 N ATOM 2144 CA GLY A 138 -16.162 0.824 -2.565 1.00 25.14 C ATOM 2145 C GLY A 138 -15.067 1.198 -1.584 1.00 50.43 C ATOM 2146 O GLY A 138 -15.286 1.201 -0.373 1.00 45.02 O ATOM 0 H GLY A 138 -15.616 1.314 -4.527 1.00 33.12 H new ATOM 0 HA2 GLY A 138 -16.876 1.644 -2.638 1.00 25.14 H new ATOM 0 HA3 GLY A 138 -16.707 -0.040 -2.185 1.00 25.14 H new ATOM 2150 N ILE A 139 -13.884 1.511 -2.107 1.00 40.13 N ATOM 2151 CA ILE A 139 -12.754 1.884 -1.266 1.00 3.43 C ATOM 2152 C ILE A 139 -12.374 3.349 -1.457 1.00 25.20 C ATOM 2153 O ILE A 139 -12.668 3.946 -2.493 1.00 64.13 O ATOM 2154 CB ILE A 139 -11.526 1.011 -1.550 1.00 52.44 C ATOM 2155 CG1 ILE A 139 -11.342 0.821 -3.050 1.00 1.52 C ATOM 2156 CG2 ILE A 139 -11.663 -0.332 -0.851 1.00 10.34 C ATOM 2157 CD1 ILE A 139 -10.111 0.026 -3.388 1.00 64.42 C ATOM 0 H ILE A 139 -13.685 1.513 -3.107 1.00 40.13 H new ATOM 0 HA ILE A 139 -13.073 1.727 -0.235 1.00 3.43 H new ATOM 0 HB ILE A 139 -10.642 1.515 -1.160 1.00 52.44 H new ATOM 0 HG12 ILE A 139 -12.218 0.317 -3.458 1.00 1.52 H new ATOM 0 HG13 ILE A 139 -11.282 1.797 -3.531 1.00 1.52 H new ATOM 0 HG21 ILE A 139 -10.785 -0.943 -1.061 1.00 10.34 H new ATOM 0 HG22 ILE A 139 -11.748 -0.175 0.224 1.00 10.34 H new ATOM 0 HG23 ILE A 139 -12.555 -0.842 -1.215 1.00 10.34 H new ATOM 0 HD11 ILE A 139 -10.031 -0.078 -4.470 1.00 64.42 H new ATOM 0 HD12 ILE A 139 -9.229 0.541 -3.006 1.00 64.42 H new ATOM 0 HD13 ILE A 139 -10.180 -0.962 -2.933 1.00 64.42 H new ATOM 2169 N PRO A 140 -11.709 3.948 -0.455 1.00 43.22 N ATOM 2170 CA PRO A 140 -11.285 5.349 -0.516 1.00 12.21 C ATOM 2171 C PRO A 140 -10.111 5.558 -1.466 1.00 34.42 C ATOM 2172 O PRO A 140 -9.321 4.644 -1.702 1.00 41.14 O ATOM 2173 CB PRO A 140 -10.869 5.655 0.923 1.00 32.13 C ATOM 2174 CG PRO A 140 -10.454 4.339 1.485 1.00 73.32 C ATOM 2175 CD PRO A 140 -11.317 3.305 0.814 1.00 42.33 C ATOM 0 HA PRO A 140 -12.075 5.999 -0.893 1.00 12.21 H new ATOM 0 HB2 PRO A 140 -10.051 6.375 0.954 1.00 32.13 H new ATOM 0 HB3 PRO A 140 -11.694 6.086 1.491 1.00 32.13 H new ATOM 0 HG2 PRO A 140 -9.398 4.149 1.292 1.00 73.32 H new ATOM 0 HG3 PRO A 140 -10.590 4.317 2.566 1.00 73.32 H new ATOM 0 HD2 PRO A 140 -10.770 2.378 0.641 1.00 42.33 H new ATOM 0 HD3 PRO A 140 -12.187 3.054 1.421 1.00 42.33 H new ATOM 2183 N TYR A 141 -10.001 6.767 -2.005 1.00 21.12 N ATOM 2184 CA TYR A 141 -8.921 7.099 -2.928 1.00 40.44 C ATOM 2185 C TYR A 141 -8.130 8.301 -2.422 1.00 21.25 C ATOM 2186 O TYR A 141 -8.671 9.398 -2.278 1.00 73.45 O ATOM 2187 CB TYR A 141 -9.485 7.384 -4.323 1.00 75.54 C ATOM 2188 CG TYR A 141 -8.471 7.963 -5.286 1.00 53.45 C ATOM 2189 CD1 TYR A 141 -7.465 7.172 -5.826 1.00 52.01 C ATOM 2190 CD2 TYR A 141 -8.520 9.302 -5.652 1.00 70.50 C ATOM 2191 CE1 TYR A 141 -6.537 7.700 -6.703 1.00 61.50 C ATOM 2192 CE2 TYR A 141 -7.597 9.837 -6.528 1.00 11.14 C ATOM 2193 CZ TYR A 141 -6.607 9.032 -7.051 1.00 3.10 C ATOM 2194 OH TYR A 141 -5.684 9.561 -7.924 1.00 62.25 O ATOM 0 H TYR A 141 -10.647 7.534 -1.819 1.00 21.12 H new ATOM 0 HA TYR A 141 -8.246 6.245 -2.989 1.00 40.44 H new ATOM 0 HB2 TYR A 141 -9.881 6.458 -4.740 1.00 75.54 H new ATOM 0 HB3 TYR A 141 -10.322 8.076 -4.232 1.00 75.54 H new ATOM 0 HD1 TYR A 141 -7.407 6.128 -5.556 1.00 52.01 H new ATOM 0 HD2 TYR A 141 -9.294 9.936 -5.244 1.00 70.50 H new ATOM 0 HE1 TYR A 141 -5.760 7.072 -7.114 1.00 61.50 H new ATOM 0 HE2 TYR A 141 -7.650 10.880 -6.802 1.00 11.14 H new ATOM 0 HH TYR A 141 -5.875 10.512 -8.065 1.00 62.25 H new ATOM 2204 N ILE A 142 -6.847 8.086 -2.151 1.00 12.11 N ATOM 2205 CA ILE A 142 -5.981 9.145 -1.659 1.00 4.42 C ATOM 2206 C ILE A 142 -4.798 9.367 -2.596 1.00 13.31 C ATOM 2207 O ILE A 142 -4.432 8.482 -3.369 1.00 12.23 O ATOM 2208 CB ILE A 142 -5.453 8.814 -0.252 1.00 75.34 C ATOM 2209 CG1 ILE A 142 -6.604 8.390 0.666 1.00 71.23 C ATOM 2210 CG2 ILE A 142 -4.717 10.009 0.325 1.00 61.41 C ATOM 2211 CD1 ILE A 142 -6.550 6.933 1.068 1.00 73.42 C ATOM 0 H ILE A 142 -6.385 7.184 -2.265 1.00 12.11 H new ATOM 0 HA ILE A 142 -6.578 10.056 -1.615 1.00 4.42 H new ATOM 0 HB ILE A 142 -4.754 7.981 -0.327 1.00 75.34 H new ATOM 0 HG12 ILE A 142 -6.588 9.007 1.564 1.00 71.23 H new ATOM 0 HG13 ILE A 142 -7.551 8.585 0.162 1.00 71.23 H new ATOM 0 HG21 ILE A 142 -4.348 9.763 1.321 1.00 61.41 H new ATOM 0 HG22 ILE A 142 -3.877 10.265 -0.320 1.00 61.41 H new ATOM 0 HG23 ILE A 142 -5.397 10.859 0.390 1.00 61.41 H new ATOM 0 HD11 ILE A 142 -7.395 6.703 1.717 1.00 73.42 H new ATOM 0 HD12 ILE A 142 -6.597 6.308 0.176 1.00 73.42 H new ATOM 0 HD13 ILE A 142 -5.619 6.737 1.600 1.00 73.42 H new ATOM 2223 N GLU A 143 -4.204 10.553 -2.520 1.00 21.34 N ATOM 2224 CA GLU A 143 -3.060 10.891 -3.361 1.00 0.32 C ATOM 2225 C GLU A 143 -1.868 11.315 -2.510 1.00 31.15 C ATOM 2226 O GLU A 143 -2.000 12.143 -1.608 1.00 4.42 O ATOM 2227 CB GLU A 143 -3.430 12.010 -4.336 1.00 73.33 C ATOM 2228 CG GLU A 143 -4.459 11.596 -5.376 1.00 4.35 C ATOM 2229 CD GLU A 143 -5.467 12.690 -5.668 1.00 64.14 C ATOM 2230 OE1 GLU A 143 -6.437 12.825 -4.893 1.00 61.00 O ATOM 2231 OE2 GLU A 143 -5.287 13.412 -6.671 1.00 3.33 O ATOM 0 H GLU A 143 -4.495 11.296 -1.885 1.00 21.34 H new ATOM 0 HA GLU A 143 -2.782 10.003 -3.928 1.00 0.32 H new ATOM 0 HB2 GLU A 143 -3.817 12.859 -3.772 1.00 73.33 H new ATOM 0 HB3 GLU A 143 -2.528 12.350 -4.845 1.00 73.33 H new ATOM 0 HG2 GLU A 143 -3.947 11.323 -6.299 1.00 4.35 H new ATOM 0 HG3 GLU A 143 -4.984 10.707 -5.028 1.00 4.35 H new ATOM 2238 N THR A 144 -0.704 10.743 -2.801 1.00 54.42 N ATOM 2239 CA THR A 144 0.511 11.064 -2.060 1.00 13.34 C ATOM 2240 C THR A 144 1.722 11.109 -2.986 1.00 13.43 C ATOM 2241 O THR A 144 1.629 10.763 -4.164 1.00 31.51 O ATOM 2242 CB THR A 144 0.741 10.037 -0.949 1.00 43.53 C ATOM 2243 OG1 THR A 144 1.079 8.775 -1.496 1.00 64.15 O ATOM 2244 CG2 THR A 144 -0.464 9.843 -0.055 1.00 31.25 C ATOM 0 H THR A 144 -0.576 10.056 -3.544 1.00 54.42 H new ATOM 0 HA THR A 144 0.383 12.051 -1.614 1.00 13.34 H new ATOM 0 HB THR A 144 1.557 10.438 -0.348 1.00 43.53 H new ATOM 0 HG1 THR A 144 1.224 8.132 -0.771 1.00 64.15 H new ATOM 0 HG21 THR A 144 -0.233 9.102 0.711 1.00 31.25 H new ATOM 0 HG22 THR A 144 -0.720 10.790 0.421 1.00 31.25 H new ATOM 0 HG23 THR A 144 -1.308 9.497 -0.652 1.00 31.25 H new ATOM 2252 N SER A 145 2.857 11.538 -2.444 1.00 60.44 N ATOM 2253 CA SER A 145 4.089 11.630 -3.219 1.00 23.34 C ATOM 2254 C SER A 145 5.294 11.230 -2.373 1.00 5.13 C ATOM 2255 O SER A 145 5.633 11.903 -1.399 1.00 73.52 O ATOM 2256 CB SER A 145 4.276 13.052 -3.752 1.00 30.33 C ATOM 2257 OG SER A 145 3.812 14.011 -2.818 1.00 62.41 O ATOM 0 H SER A 145 2.949 11.828 -1.470 1.00 60.44 H new ATOM 0 HA SER A 145 4.012 10.941 -4.060 1.00 23.34 H new ATOM 0 HB2 SER A 145 5.330 13.228 -3.966 1.00 30.33 H new ATOM 0 HB3 SER A 145 3.737 13.165 -4.693 1.00 30.33 H new ATOM 0 HG SER A 145 3.992 14.912 -3.158 1.00 62.41 H new ATOM 2263 N ALA A 146 5.935 10.128 -2.749 1.00 72.53 N ATOM 2264 CA ALA A 146 7.101 9.635 -2.024 1.00 54.10 C ATOM 2265 C ALA A 146 8.270 10.613 -2.115 1.00 32.23 C ATOM 2266 O ALA A 146 9.184 10.577 -1.292 1.00 64.33 O ATOM 2267 CB ALA A 146 7.512 8.270 -2.556 1.00 22.11 C ATOM 0 H ALA A 146 5.667 9.559 -3.552 1.00 72.53 H new ATOM 0 HA ALA A 146 6.827 9.541 -0.973 1.00 54.10 H new ATOM 0 HB1 ALA A 146 8.383 7.913 -2.007 1.00 22.11 H new ATOM 0 HB2 ALA A 146 6.689 7.567 -2.428 1.00 22.11 H new ATOM 0 HB3 ALA A 146 7.759 8.351 -3.615 1.00 22.11 H new ATOM 2273 N LYS A 147 8.239 11.484 -3.120 1.00 1.40 N ATOM 2274 CA LYS A 147 9.301 12.465 -3.313 1.00 10.24 C ATOM 2275 C LYS A 147 9.050 13.721 -2.485 1.00 60.15 C ATOM 2276 O LYS A 147 9.801 14.026 -1.558 1.00 22.14 O ATOM 2277 CB LYS A 147 9.419 12.833 -4.793 1.00 53.12 C ATOM 2278 CG LYS A 147 10.804 13.317 -5.191 1.00 42.31 C ATOM 2279 CD LYS A 147 11.750 12.154 -5.437 1.00 55.40 C ATOM 2280 CE LYS A 147 13.202 12.604 -5.428 1.00 41.32 C ATOM 2281 NZ LYS A 147 13.998 11.927 -6.488 1.00 60.23 N ATOM 0 H LYS A 147 7.491 11.530 -3.812 1.00 1.40 H new ATOM 0 HA LYS A 147 10.236 12.016 -2.978 1.00 10.24 H new ATOM 0 HB2 LYS A 147 9.160 11.963 -5.397 1.00 53.12 H new ATOM 0 HB3 LYS A 147 8.691 13.610 -5.025 1.00 53.12 H new ATOM 0 HG2 LYS A 147 10.733 13.926 -6.092 1.00 42.31 H new ATOM 0 HG3 LYS A 147 11.207 13.956 -4.405 1.00 42.31 H new ATOM 0 HD2 LYS A 147 11.599 11.393 -4.671 1.00 55.40 H new ATOM 0 HD3 LYS A 147 11.518 11.691 -6.396 1.00 55.40 H new ATOM 0 HE2 LYS A 147 13.249 13.683 -5.572 1.00 41.32 H new ATOM 0 HE3 LYS A 147 13.642 12.393 -4.453 1.00 41.32 H new ATOM 0 HZ1 LYS A 147 14.982 12.260 -6.449 1.00 60.23 H new ATOM 0 HZ2 LYS A 147 13.975 10.898 -6.336 1.00 60.23 H new ATOM 0 HZ3 LYS A 147 13.594 12.149 -7.420 1.00 60.23 H new ATOM 2295 N THR A 148 7.991 14.447 -2.827 1.00 22.33 N ATOM 2296 CA THR A 148 7.643 15.673 -2.117 1.00 73.41 C ATOM 2297 C THR A 148 7.117 15.371 -0.715 1.00 34.35 C ATOM 2298 O THR A 148 7.126 16.238 0.158 1.00 32.30 O ATOM 2299 CB THR A 148 6.598 16.465 -2.905 1.00 33.03 C ATOM 2300 OG1 THR A 148 5.610 15.600 -3.442 1.00 51.32 O ATOM 2301 CG2 THR A 148 7.188 17.261 -4.049 1.00 11.50 C ATOM 0 H THR A 148 7.359 14.208 -3.591 1.00 22.33 H new ATOM 0 HA THR A 148 8.549 16.271 -2.021 1.00 73.41 H new ATOM 0 HB THR A 148 6.162 17.161 -2.188 1.00 33.03 H new ATOM 0 HG1 THR A 148 5.533 14.802 -2.879 1.00 51.32 H new ATOM 0 HG21 THR A 148 6.393 17.799 -4.566 1.00 11.50 H new ATOM 0 HG22 THR A 148 7.915 17.974 -3.660 1.00 11.50 H new ATOM 0 HG23 THR A 148 7.681 16.584 -4.747 1.00 11.50 H new ATOM 2309 N ARG A 149 6.658 14.140 -0.505 1.00 14.54 N ATOM 2310 CA ARG A 149 6.128 13.735 0.793 1.00 32.45 C ATOM 2311 C ARG A 149 4.865 14.521 1.130 1.00 71.41 C ATOM 2312 O ARG A 149 4.855 15.336 2.053 1.00 22.33 O ATOM 2313 CB ARG A 149 7.181 13.939 1.885 1.00 11.21 C ATOM 2314 CG ARG A 149 6.848 13.239 3.192 1.00 21.24 C ATOM 2315 CD ARG A 149 7.749 13.712 4.321 1.00 43.41 C ATOM 2316 NE ARG A 149 7.219 13.350 5.634 1.00 50.53 N ATOM 2317 CZ ARG A 149 7.602 13.923 6.773 1.00 43.44 C ATOM 2318 NH1 ARG A 149 8.514 14.887 6.764 1.00 15.44 N ATOM 2319 NH2 ARG A 149 7.071 13.533 7.923 1.00 43.41 N ATOM 0 H ARG A 149 6.642 13.408 -1.215 1.00 14.54 H new ATOM 0 HA ARG A 149 5.873 12.676 0.742 1.00 32.45 H new ATOM 0 HB2 ARG A 149 8.143 13.575 1.523 1.00 11.21 H new ATOM 0 HB3 ARG A 149 7.294 15.007 2.073 1.00 11.21 H new ATOM 0 HG2 ARG A 149 5.807 13.428 3.452 1.00 21.24 H new ATOM 0 HG3 ARG A 149 6.955 12.162 3.067 1.00 21.24 H new ATOM 0 HD2 ARG A 149 8.741 13.278 4.199 1.00 43.41 H new ATOM 0 HD3 ARG A 149 7.865 14.794 4.263 1.00 43.41 H new ATOM 0 HE ARG A 149 6.514 12.615 5.680 1.00 50.53 H new ATOM 0 HH11 ARG A 149 8.925 15.192 5.882 1.00 15.44 H new ATOM 0 HH12 ARG A 149 8.804 15.323 7.639 1.00 15.44 H new ATOM 0 HH21 ARG A 149 6.369 12.794 7.936 1.00 43.41 H new ATOM 0 HH22 ARG A 149 7.365 13.972 8.795 1.00 43.41 H new ATOM 2333 N GLN A 150 3.801 14.272 0.373 1.00 41.13 N ATOM 2334 CA GLN A 150 2.532 14.957 0.588 1.00 64.02 C ATOM 2335 C GLN A 150 1.434 13.967 0.965 1.00 61.14 C ATOM 2336 O GLN A 150 1.135 13.039 0.215 1.00 31.44 O ATOM 2337 CB GLN A 150 2.130 15.729 -0.671 1.00 63.13 C ATOM 2338 CG GLN A 150 0.776 16.414 -0.563 1.00 30.44 C ATOM 2339 CD GLN A 150 0.836 17.887 -0.912 1.00 10.42 C ATOM 2340 OE1 GLN A 150 0.771 18.749 -0.036 1.00 10.22 O ATOM 2341 NE2 GLN A 150 0.961 18.182 -2.200 1.00 41.21 N ATOM 0 H GLN A 150 3.793 13.601 -0.395 1.00 41.13 H new ATOM 0 HA GLN A 150 2.660 15.658 1.413 1.00 64.02 H new ATOM 0 HB2 GLN A 150 2.891 16.480 -0.884 1.00 63.13 H new ATOM 0 HB3 GLN A 150 2.113 15.042 -1.517 1.00 63.13 H new ATOM 0 HG2 GLN A 150 0.068 15.916 -1.226 1.00 30.44 H new ATOM 0 HG3 GLN A 150 0.396 16.301 0.452 1.00 30.44 H new ATOM 0 HE21 GLN A 150 1.011 17.434 -2.892 1.00 41.21 H new ATOM 0 HE22 GLN A 150 1.007 19.156 -2.498 1.00 41.21 H new ATOM 2350 N GLY A 151 0.834 14.175 2.133 1.00 55.33 N ATOM 2351 CA GLY A 151 -0.228 13.298 2.592 1.00 2.14 C ATOM 2352 C GLY A 151 0.174 11.835 2.586 1.00 25.44 C ATOM 2353 O GLY A 151 -0.675 10.953 2.452 1.00 34.35 O ATOM 0 H GLY A 151 1.065 14.937 2.771 1.00 55.33 H new ATOM 0 HA2 GLY A 151 -0.520 13.586 3.602 1.00 2.14 H new ATOM 0 HA3 GLY A 151 -1.104 13.432 1.957 1.00 2.14 H new ATOM 2357 N VAL A 152 1.470 11.576 2.732 1.00 34.40 N ATOM 2358 CA VAL A 152 1.978 10.210 2.744 1.00 45.43 C ATOM 2359 C VAL A 152 1.294 9.379 3.825 1.00 51.03 C ATOM 2360 O VAL A 152 0.722 8.326 3.545 1.00 23.42 O ATOM 2361 CB VAL A 152 3.501 10.181 2.973 1.00 24.42 C ATOM 2362 CG1 VAL A 152 4.032 8.759 2.870 1.00 32.32 C ATOM 2363 CG2 VAL A 152 4.206 11.096 1.982 1.00 64.31 C ATOM 0 H VAL A 152 2.186 12.294 2.843 1.00 34.40 H new ATOM 0 HA VAL A 152 1.757 9.780 1.767 1.00 45.43 H new ATOM 0 HB VAL A 152 3.706 10.546 3.979 1.00 24.42 H new ATOM 0 HG11 VAL A 152 5.109 8.760 3.035 1.00 32.32 H new ATOM 0 HG12 VAL A 152 3.550 8.135 3.623 1.00 32.32 H new ATOM 0 HG13 VAL A 152 3.817 8.361 1.878 1.00 32.32 H new ATOM 0 HG21 VAL A 152 5.281 11.063 2.158 1.00 64.31 H new ATOM 0 HG22 VAL A 152 3.994 10.764 0.966 1.00 64.31 H new ATOM 0 HG23 VAL A 152 3.848 12.117 2.112 1.00 64.31 H new ATOM 2373 N GLU A 153 1.353 9.863 5.061 1.00 31.33 N ATOM 2374 CA GLU A 153 0.736 9.168 6.184 1.00 11.40 C ATOM 2375 C GLU A 153 -0.784 9.162 6.051 1.00 22.33 C ATOM 2376 O GLU A 153 -1.457 8.258 6.546 1.00 4.40 O ATOM 2377 CB GLU A 153 1.141 9.825 7.505 1.00 10.33 C ATOM 2378 CG GLU A 153 2.644 9.976 7.673 1.00 14.32 C ATOM 2379 CD GLU A 153 3.034 10.405 9.074 1.00 13.22 C ATOM 2380 OE1 GLU A 153 2.205 11.051 9.750 1.00 53.32 O ATOM 2381 OE2 GLU A 153 4.168 10.094 9.496 1.00 55.30 O ATOM 0 H GLU A 153 1.822 10.734 5.310 1.00 31.33 H new ATOM 0 HA GLU A 153 1.088 8.137 6.177 1.00 11.40 H new ATOM 0 HB2 GLU A 153 0.676 10.809 7.570 1.00 10.33 H new ATOM 0 HB3 GLU A 153 0.749 9.232 8.331 1.00 10.33 H new ATOM 0 HG2 GLU A 153 3.129 9.028 7.439 1.00 14.32 H new ATOM 0 HG3 GLU A 153 3.014 10.709 6.956 1.00 14.32 H new ATOM 2388 N ASP A 154 -1.319 10.176 5.378 1.00 21.13 N ATOM 2389 CA ASP A 154 -2.760 10.288 5.178 1.00 5.53 C ATOM 2390 C ASP A 154 -3.305 9.060 4.454 1.00 71.24 C ATOM 2391 O ASP A 154 -4.412 8.601 4.735 1.00 30.22 O ATOM 2392 CB ASP A 154 -3.088 11.555 4.384 1.00 32.20 C ATOM 2393 CG ASP A 154 -4.046 12.469 5.124 1.00 21.33 C ATOM 2394 OD1 ASP A 154 -3.811 12.730 6.322 1.00 41.44 O ATOM 2395 OD2 ASP A 154 -5.030 12.925 4.504 1.00 20.31 O ATOM 0 H ASP A 154 -0.776 10.932 4.962 1.00 21.13 H new ATOM 0 HA ASP A 154 -3.236 10.349 6.157 1.00 5.53 H new ATOM 0 HB2 ASP A 154 -2.166 12.096 4.171 1.00 32.20 H new ATOM 0 HB3 ASP A 154 -3.524 11.277 3.424 1.00 32.20 H new ATOM 2400 N ALA A 155 -2.519 8.534 3.520 1.00 13.23 N ATOM 2401 CA ALA A 155 -2.921 7.360 2.755 1.00 4.22 C ATOM 2402 C ALA A 155 -2.896 6.106 3.623 1.00 71.14 C ATOM 2403 O ALA A 155 -3.852 5.331 3.637 1.00 74.14 O ATOM 2404 CB ALA A 155 -2.017 7.186 1.544 1.00 43.12 C ATOM 0 H ALA A 155 -1.600 8.903 3.275 1.00 13.23 H new ATOM 0 HA ALA A 155 -3.944 7.511 2.411 1.00 4.22 H new ATOM 0 HB1 ALA A 155 -2.328 6.306 0.981 1.00 43.12 H new ATOM 0 HB2 ALA A 155 -2.088 8.068 0.907 1.00 43.12 H new ATOM 0 HB3 ALA A 155 -0.986 7.060 1.875 1.00 43.12 H new ATOM 2410 N PHE A 156 -1.798 5.915 4.346 1.00 12.11 N ATOM 2411 CA PHE A 156 -1.648 4.757 5.218 1.00 41.15 C ATOM 2412 C PHE A 156 -2.724 4.750 6.298 1.00 22.51 C ATOM 2413 O PHE A 156 -3.379 3.734 6.531 1.00 53.22 O ATOM 2414 CB PHE A 156 -0.263 4.758 5.863 1.00 24.34 C ATOM 2415 CG PHE A 156 0.822 4.256 4.955 1.00 22.14 C ATOM 2416 CD1 PHE A 156 1.147 2.910 4.923 1.00 2.25 C ATOM 2417 CD2 PHE A 156 1.516 5.130 4.135 1.00 25.33 C ATOM 2418 CE1 PHE A 156 2.146 2.444 4.088 1.00 14.11 C ATOM 2419 CE2 PHE A 156 2.515 4.671 3.298 1.00 14.11 C ATOM 2420 CZ PHE A 156 2.830 3.326 3.275 1.00 32.35 C ATOM 0 H PHE A 156 -0.998 6.548 4.345 1.00 12.11 H new ATOM 0 HA PHE A 156 -1.759 3.858 4.613 1.00 41.15 H new ATOM 0 HB2 PHE A 156 -0.020 5.772 6.180 1.00 24.34 H new ATOM 0 HB3 PHE A 156 -0.289 4.141 6.761 1.00 24.34 H new ATOM 0 HD1 PHE A 156 0.614 2.217 5.557 1.00 2.25 H new ATOM 0 HD2 PHE A 156 1.274 6.182 4.150 1.00 25.33 H new ATOM 0 HE1 PHE A 156 2.391 1.392 4.072 1.00 14.11 H new ATOM 0 HE2 PHE A 156 3.049 5.362 2.663 1.00 14.11 H new ATOM 0 HZ PHE A 156 3.610 2.965 2.622 1.00 32.35 H new ATOM 2430 N TYR A 157 -2.901 5.893 6.955 1.00 20.03 N ATOM 2431 CA TYR A 157 -3.899 6.025 8.012 1.00 13.41 C ATOM 2432 C TYR A 157 -5.260 5.521 7.543 1.00 13.15 C ATOM 2433 O TYR A 157 -6.051 5.008 8.334 1.00 52.22 O ATOM 2434 CB TYR A 157 -4.009 7.484 8.459 1.00 54.43 C ATOM 2435 CG TYR A 157 -2.837 7.954 9.292 1.00 2.12 C ATOM 2436 CD1 TYR A 157 -2.312 7.155 10.300 1.00 3.23 C ATOM 2437 CD2 TYR A 157 -2.256 9.196 9.070 1.00 12.11 C ATOM 2438 CE1 TYR A 157 -1.242 7.580 11.063 1.00 33.03 C ATOM 2439 CE2 TYR A 157 -1.185 9.629 9.829 1.00 25.44 C ATOM 2440 CZ TYR A 157 -0.682 8.817 10.824 1.00 64.25 C ATOM 2441 OH TYR A 157 0.384 9.245 11.582 1.00 13.05 O ATOM 0 H TYR A 157 -2.366 6.742 6.774 1.00 20.03 H new ATOM 0 HA TYR A 157 -3.578 5.416 8.857 1.00 13.41 H new ATOM 0 HB2 TYR A 157 -4.095 8.119 7.578 1.00 54.43 H new ATOM 0 HB3 TYR A 157 -4.926 7.611 9.034 1.00 54.43 H new ATOM 0 HD1 TYR A 157 -2.748 6.185 10.490 1.00 3.23 H new ATOM 0 HD2 TYR A 157 -2.648 9.834 8.291 1.00 12.11 H new ATOM 0 HE1 TYR A 157 -0.846 6.947 11.843 1.00 33.03 H new ATOM 0 HE2 TYR A 157 -0.745 10.598 9.644 1.00 25.44 H new ATOM 0 HH TYR A 157 0.974 9.802 11.032 1.00 13.05 H new ATOM 2451 N THR A 158 -5.524 5.668 6.248 1.00 12.21 N ATOM 2452 CA THR A 158 -6.782 5.227 5.669 1.00 15.51 C ATOM 2453 C THR A 158 -6.970 3.725 5.858 1.00 42.42 C ATOM 2454 O THR A 158 -8.074 3.256 6.131 1.00 34.22 O ATOM 2455 CB THR A 158 -6.822 5.574 4.182 1.00 52.23 C ATOM 2456 OG1 THR A 158 -6.353 6.893 3.962 1.00 63.02 O ATOM 2457 CG2 THR A 158 -8.204 5.472 3.583 1.00 40.23 C ATOM 0 H THR A 158 -4.879 6.091 5.580 1.00 12.21 H new ATOM 0 HA THR A 158 -7.595 5.742 6.181 1.00 15.51 H new ATOM 0 HB THR A 158 -6.178 4.841 3.696 1.00 52.23 H new ATOM 0 HG1 THR A 158 -5.374 6.890 3.924 1.00 63.02 H new ATOM 0 HG21 THR A 158 -8.162 5.731 2.525 1.00 40.23 H new ATOM 0 HG22 THR A 158 -8.574 4.452 3.692 1.00 40.23 H new ATOM 0 HG23 THR A 158 -8.876 6.159 4.099 1.00 40.23 H new ATOM 2465 N LEU A 159 -5.881 2.976 5.711 1.00 75.23 N ATOM 2466 CA LEU A 159 -5.923 1.527 5.865 1.00 31.14 C ATOM 2467 C LEU A 159 -6.436 1.140 7.249 1.00 10.31 C ATOM 2468 O LEU A 159 -7.316 0.289 7.380 1.00 34.41 O ATOM 2469 CB LEU A 159 -4.535 0.927 5.637 1.00 3.13 C ATOM 2470 CG LEU A 159 -4.529 -0.483 5.047 1.00 45.30 C ATOM 2471 CD1 LEU A 159 -5.353 -1.425 5.911 1.00 21.31 C ATOM 2472 CD2 LEU A 159 -5.059 -0.466 3.621 1.00 21.42 C ATOM 0 H LEU A 159 -4.959 3.349 5.485 1.00 75.23 H new ATOM 0 HA LEU A 159 -6.610 1.129 5.118 1.00 31.14 H new ATOM 0 HB2 LEU A 159 -3.976 1.585 4.972 1.00 3.13 H new ATOM 0 HB3 LEU A 159 -4.003 0.909 6.588 1.00 3.13 H new ATOM 0 HG LEU A 159 -3.501 -0.844 5.028 1.00 45.30 H new ATOM 0 HD11 LEU A 159 -5.338 -2.424 5.476 1.00 21.31 H new ATOM 0 HD12 LEU A 159 -4.931 -1.460 6.916 1.00 21.31 H new ATOM 0 HD13 LEU A 159 -6.381 -1.067 5.961 1.00 21.31 H new ATOM 0 HD21 LEU A 159 -5.048 -1.478 3.217 1.00 21.42 H new ATOM 0 HD22 LEU A 159 -6.080 -0.085 3.617 1.00 21.42 H new ATOM 0 HD23 LEU A 159 -4.429 0.177 3.006 1.00 21.42 H new ATOM 2484 N VAL A 160 -5.882 1.771 8.280 1.00 54.24 N ATOM 2485 CA VAL A 160 -6.286 1.491 9.653 1.00 44.15 C ATOM 2486 C VAL A 160 -7.779 1.734 9.845 1.00 52.12 C ATOM 2487 O VAL A 160 -8.455 0.983 10.548 1.00 44.22 O ATOM 2488 CB VAL A 160 -5.503 2.356 10.658 1.00 2.42 C ATOM 2489 CG1 VAL A 160 -5.798 1.917 12.084 1.00 61.21 C ATOM 2490 CG2 VAL A 160 -4.009 2.294 10.367 1.00 63.14 C ATOM 0 H VAL A 160 -5.153 2.479 8.190 1.00 54.24 H new ATOM 0 HA VAL A 160 -6.063 0.441 9.840 1.00 44.15 H new ATOM 0 HB VAL A 160 -5.826 3.391 10.549 1.00 2.42 H new ATOM 0 HG11 VAL A 160 -5.236 2.540 12.780 1.00 61.21 H new ATOM 0 HG12 VAL A 160 -6.864 2.021 12.284 1.00 61.21 H new ATOM 0 HG13 VAL A 160 -5.505 0.875 12.212 1.00 61.21 H new ATOM 0 HG21 VAL A 160 -3.472 2.911 11.087 1.00 63.14 H new ATOM 0 HG22 VAL A 160 -3.665 1.263 10.446 1.00 63.14 H new ATOM 0 HG23 VAL A 160 -3.819 2.664 9.359 1.00 63.14 H new ATOM 2500 N ARG A 161 -8.287 2.787 9.213 1.00 35.31 N ATOM 2501 CA ARG A 161 -9.701 3.127 9.312 1.00 4.42 C ATOM 2502 C ARG A 161 -10.559 2.102 8.577 1.00 2.12 C ATOM 2503 O ARG A 161 -11.705 1.853 8.952 1.00 31.05 O ATOM 2504 CB ARG A 161 -9.953 4.524 8.740 1.00 63.43 C ATOM 2505 CG ARG A 161 -9.357 5.642 9.580 1.00 74.00 C ATOM 2506 CD ARG A 161 -10.218 6.895 9.533 1.00 61.10 C ATOM 2507 NE ARG A 161 -10.484 7.427 10.856 1.00 54.05 N ATOM 2508 CZ ARG A 161 -11.385 8.368 11.094 1.00 12.22 C ATOM 2509 NH1 ARG A 161 -12.112 8.873 10.104 1.00 70.01 N ATOM 2510 NH2 ARG A 161 -11.560 8.806 12.322 1.00 61.01 N ATOM 0 H ARG A 161 -7.741 3.419 8.627 1.00 35.31 H new ATOM 0 HA ARG A 161 -9.978 3.118 10.366 1.00 4.42 H new ATOM 0 HB2 ARG A 161 -9.537 4.576 7.734 1.00 63.43 H new ATOM 0 HB3 ARG A 161 -11.028 4.682 8.650 1.00 63.43 H new ATOM 0 HG2 ARG A 161 -9.255 5.308 10.613 1.00 74.00 H new ATOM 0 HG3 ARG A 161 -8.355 5.874 9.220 1.00 74.00 H new ATOM 0 HD2 ARG A 161 -9.719 7.655 8.931 1.00 61.10 H new ATOM 0 HD3 ARG A 161 -11.162 6.667 9.038 1.00 61.10 H new ATOM 0 HE ARG A 161 -9.950 7.058 11.643 1.00 54.05 H new ATOM 0 HH11 ARG A 161 -11.979 8.536 9.150 1.00 70.01 H new ATOM 0 HH12 ARG A 161 -12.804 9.597 10.297 1.00 70.01 H new ATOM 0 HH21 ARG A 161 -11.003 8.421 13.085 1.00 61.01 H new ATOM 0 HH22 ARG A 161 -12.252 9.531 12.511 1.00 61.01 H new ATOM 2524 N GLU A 162 -9.995 1.509 7.529 1.00 44.05 N ATOM 2525 CA GLU A 162 -10.707 0.510 6.741 1.00 52.42 C ATOM 2526 C GLU A 162 -10.851 -0.794 7.520 1.00 44.35 C ATOM 2527 O GLU A 162 -11.945 -1.348 7.626 1.00 52.12 O ATOM 2528 CB GLU A 162 -9.975 0.253 5.423 1.00 4.24 C ATOM 2529 CG GLU A 162 -10.448 1.139 4.282 1.00 34.43 C ATOM 2530 CD GLU A 162 -11.559 0.501 3.471 1.00 42.02 C ATOM 2531 OE1 GLU A 162 -11.443 -0.699 3.146 1.00 41.10 O ATOM 2532 OE2 GLU A 162 -12.545 1.202 3.160 1.00 33.02 O ATOM 0 H GLU A 162 -9.047 1.703 7.206 1.00 44.05 H new ATOM 0 HA GLU A 162 -11.703 0.895 6.525 1.00 52.42 H new ATOM 0 HB2 GLU A 162 -8.907 0.408 5.574 1.00 4.24 H new ATOM 0 HB3 GLU A 162 -10.108 -0.791 5.140 1.00 4.24 H new ATOM 0 HG2 GLU A 162 -10.797 2.089 4.686 1.00 34.43 H new ATOM 0 HG3 GLU A 162 -9.606 1.361 3.626 1.00 34.43 H new ATOM 2539 N ILE A 163 -9.739 -1.279 8.064 1.00 13.42 N ATOM 2540 CA ILE A 163 -9.739 -2.511 8.831 1.00 24.00 C ATOM 2541 C ILE A 163 -10.620 -2.389 10.069 1.00 65.15 C ATOM 2542 O ILE A 163 -11.405 -3.287 10.377 1.00 22.22 O ATOM 2543 CB ILE A 163 -8.313 -2.888 9.261 1.00 73.43 C ATOM 2544 CG1 ILE A 163 -7.391 -2.932 8.041 1.00 4.14 C ATOM 2545 CG2 ILE A 163 -8.320 -4.224 9.979 1.00 4.31 C ATOM 2546 CD1 ILE A 163 -6.008 -3.455 8.347 1.00 64.53 C ATOM 0 H ILE A 163 -8.825 -0.833 7.985 1.00 13.42 H new ATOM 0 HA ILE A 163 -10.140 -3.293 8.186 1.00 24.00 H new ATOM 0 HB ILE A 163 -7.937 -2.131 9.949 1.00 73.43 H new ATOM 0 HG12 ILE A 163 -7.846 -3.559 7.275 1.00 4.14 H new ATOM 0 HG13 ILE A 163 -7.307 -1.929 7.623 1.00 4.14 H new ATOM 0 HG21 ILE A 163 -7.304 -4.481 10.279 1.00 4.31 H new ATOM 0 HG22 ILE A 163 -8.954 -4.159 10.863 1.00 4.31 H new ATOM 0 HG23 ILE A 163 -8.707 -4.994 9.311 1.00 4.31 H new ATOM 0 HD11 ILE A 163 -5.410 -3.458 7.436 1.00 64.53 H new ATOM 0 HD12 ILE A 163 -5.533 -2.815 9.090 1.00 64.53 H new ATOM 0 HD13 ILE A 163 -6.081 -4.471 8.736 1.00 64.53 H new ATOM 2558 N ARG A 164 -10.484 -1.272 10.776 1.00 51.12 N ATOM 2559 CA ARG A 164 -11.265 -1.030 11.983 1.00 72.33 C ATOM 2560 C ARG A 164 -12.760 -1.094 11.688 1.00 51.04 C ATOM 2561 O ARG A 164 -13.525 -1.703 12.437 1.00 62.43 O ATOM 2562 CB ARG A 164 -10.909 0.332 12.581 1.00 22.54 C ATOM 2563 CG ARG A 164 -9.666 0.303 13.454 1.00 13.33 C ATOM 2564 CD ARG A 164 -9.551 1.559 14.301 1.00 61.42 C ATOM 2565 NE ARG A 164 -10.619 1.650 15.294 1.00 74.30 N ATOM 2566 CZ ARG A 164 -10.622 0.980 16.444 1.00 31.14 C ATOM 2567 NH1 ARG A 164 -9.618 0.167 16.749 1.00 72.03 N ATOM 2568 NH2 ARG A 164 -11.631 1.123 17.292 1.00 54.25 N ATOM 0 H ARG A 164 -9.840 -0.520 10.533 1.00 51.12 H new ATOM 0 HA ARG A 164 -11.023 -1.811 12.704 1.00 72.33 H new ATOM 0 HB2 ARG A 164 -10.759 1.047 11.772 1.00 22.54 H new ATOM 0 HB3 ARG A 164 -11.751 0.692 13.173 1.00 22.54 H new ATOM 0 HG2 ARG A 164 -9.696 -0.573 14.102 1.00 13.33 H new ATOM 0 HG3 ARG A 164 -8.781 0.204 12.826 1.00 13.33 H new ATOM 0 HD2 ARG A 164 -8.585 1.568 14.806 1.00 61.42 H new ATOM 0 HD3 ARG A 164 -9.581 2.436 13.655 1.00 61.42 H new ATOM 0 HE ARG A 164 -11.409 2.263 15.094 1.00 74.30 H new ATOM 0 HH11 ARG A 164 -8.839 0.053 16.101 1.00 72.03 H new ATOM 0 HH12 ARG A 164 -9.626 -0.344 17.632 1.00 72.03 H new ATOM 0 HH21 ARG A 164 -12.405 1.747 17.063 1.00 54.25 H new ATOM 0 HH22 ARG A 164 -11.633 0.609 18.173 1.00 54.25 H new ATOM 2582 N GLN A 165 -13.171 -0.464 10.593 1.00 33.55 N ATOM 2583 CA GLN A 165 -14.575 -0.452 10.200 1.00 11.30 C ATOM 2584 C GLN A 165 -14.969 -1.762 9.520 1.00 41.04 C ATOM 2585 O GLN A 165 -16.148 -2.112 9.468 1.00 63.25 O ATOM 2586 CB GLN A 165 -14.859 0.729 9.277 1.00 73.34 C ATOM 2587 CG GLN A 165 -14.267 0.553 7.900 1.00 75.03 C ATOM 2588 CD GLN A 165 -14.581 1.709 6.970 1.00 55.13 C ATOM 2589 OE1 GLN A 165 -15.450 1.606 6.105 1.00 31.01 O ATOM 2590 NE2 GLN A 165 -13.871 2.818 7.144 1.00 74.43 N ATOM 0 H GLN A 165 -12.552 0.045 9.962 1.00 33.55 H new ATOM 0 HA GLN A 165 -15.176 -0.346 11.103 1.00 11.30 H new ATOM 0 HB2 GLN A 165 -15.937 0.864 9.189 1.00 73.34 H new ATOM 0 HB3 GLN A 165 -14.459 1.639 9.725 1.00 73.34 H new ATOM 0 HG2 GLN A 165 -13.186 0.446 7.986 1.00 75.03 H new ATOM 0 HG3 GLN A 165 -14.645 -0.371 7.463 1.00 75.03 H new ATOM 0 HE21 GLN A 165 -13.160 2.859 7.874 1.00 74.43 H new ATOM 0 HE22 GLN A 165 -14.037 3.629 6.547 1.00 74.43 H new ATOM 2599 N HIS A 166 -13.978 -2.482 9.000 1.00 55.22 N ATOM 2600 CA HIS A 166 -14.230 -3.751 8.327 1.00 1.12 C ATOM 2601 C HIS A 166 -13.334 -4.851 8.888 1.00 74.31 C ATOM 2602 O HIS A 166 -13.771 -5.543 9.833 1.00 51.52 O ATOM 2603 CB HIS A 166 -14.003 -3.605 6.820 1.00 34.21 C ATOM 2604 CG HIS A 166 -15.198 -3.974 5.997 1.00 3.33 C ATOM 2605 ND1 HIS A 166 -16.265 -3.124 5.795 1.00 11.31 N ATOM 2606 CD2 HIS A 166 -15.492 -5.111 5.321 1.00 1.13 C ATOM 2607 CE1 HIS A 166 -17.163 -3.721 5.032 1.00 11.13 C ATOM 2608 NE2 HIS A 166 -16.718 -4.927 4.731 1.00 15.52 N ATOM 2609 OXT HIS A 166 -12.205 -5.012 8.379 1.00 63.42 O ATOM 0 H HIS A 166 -12.996 -2.208 9.032 1.00 55.22 H new ATOM 0 HA HIS A 166 -15.269 -4.031 8.504 1.00 1.12 H new ATOM 0 HB2 HIS A 166 -13.725 -2.574 6.601 1.00 34.21 H new ATOM 0 HB3 HIS A 166 -13.161 -4.232 6.525 1.00 34.21 H new ATOM 0 HD2 HIS A 166 -14.877 -5.996 5.258 1.00 1.13 H new ATOM 0 HE1 HIS A 166 -18.102 -3.295 4.709 1.00 11.13 H new ATOM 0 HE2 HIS A 166 -17.206 -5.611 4.153 1.00 15.52 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 14.191 1.836 -5.747 1.00 21.44 P HETATM 2620 O1G GNP A 201 12.793 2.585 -6.020 1.00 73.21 O HETATM 2621 O2G GNP A 201 14.237 1.545 -4.164 1.00 63.40 O HETATM 2622 O3G GNP A 201 15.359 2.611 -6.223 1.00 52.11 O HETATM 2623 N3B GNP A 201 14.065 0.387 -6.465 1.00 24.15 N HETATM 2624 PB GNP A 201 12.533 -0.136 -6.373 1.00 13.45 P HETATM 2625 O1B GNP A 201 12.472 -1.450 -7.053 1.00 12.41 O HETATM 2626 O2B GNP A 201 12.088 -0.051 -4.964 1.00 22.32 O HETATM 2627 O3A GNP A 201 11.730 0.951 -7.247 1.00 41.33 O HETATM 2628 PA GNP A 201 12.090 1.164 -8.802 1.00 40.11 P HETATM 2629 O1A GNP A 201 10.834 1.156 -9.584 1.00 25.32 O HETATM 2630 O2A GNP A 201 13.145 0.186 -9.151 1.00 31.41 O HETATM 2631 O5' GNP A 201 12.716 2.648 -8.816 1.00 63.14 O HETATM 2632 C5' GNP A 201 11.848 3.784 -8.848 1.00 70.12 C HETATM 2633 C4' GNP A 201 12.651 5.086 -8.895 1.00 64.24 C HETATM 2634 O4' GNP A 201 11.738 6.195 -8.793 1.00 72.42 O HETATM 2635 C3' GNP A 201 13.527 5.172 -7.644 1.00 4.23 C HETATM 2636 O3' GNP A 201 14.521 6.189 -7.796 1.00 63.24 O HETATM 2637 C2' GNP A 201 12.467 5.603 -6.635 1.00 41.12 C HETATM 2638 O2' GNP A 201 13.096 6.140 -5.468 1.00 33.42 O HETATM 2639 C1' GNP A 201 11.853 6.731 -7.463 1.00 63.22 C HETATM 2640 N9 GNP A 201 10.539 7.143 -6.919 1.00 52.31 N HETATM 2641 C8 GNP A 201 9.745 6.401 -6.150 1.00 4.14 C HETATM 2642 N7 GNP A 201 8.649 7.093 -5.849 1.00 33.11 N HETATM 2643 C5 GNP A 201 8.743 8.286 -6.429 1.00 23.00 C HETATM 2644 C6 GNP A 201 7.907 9.395 -6.455 1.00 24.42 C HETATM 2645 O6 GNP A 201 6.833 9.387 -5.854 1.00 70.41 O HETATM 2646 N1 GNP A 201 8.311 10.523 -7.178 1.00 32.34 N HETATM 2647 C2 GNP A 201 9.539 10.501 -7.851 1.00 34.44 C HETATM 2648 N2 GNP A 201 9.934 11.566 -8.542 1.00 55.41 N HETATM 2649 N3 GNP A 201 10.319 9.411 -7.801 1.00 65.22 N HETATM 2650 C4 GNP A 201 9.950 8.319 -7.114 1.00 13.54 C HETATM 0 HO3' GNP A 201 14.574 6.720 -6.974 1.00 63.24 H new HETATM 0 HO2' GNP A 201 12.410 6.416 -4.825 1.00 33.42 H new HETATM 0 HNB3 GNP A 201 14.833 -0.118 -6.907 1.00 24.15 H new HETATM 0 HN22 GNP A 201 10.828 11.553 -9.033 1.00 55.41 H new HETATM 0 HN21 GNP A 201 9.343 12.396 -8.581 1.00 55.41 H new HETATM 0 H5'2 GNP A 201 11.206 3.780 -7.967 1.00 70.12 H new HETATM 0 H5'1 GNP A 201 11.195 3.723 -9.719 1.00 70.12 H new HETATM 0 HN1 GNP A 201 7.718 11.352 -7.214 1.00 32.34 H new HETATM 0 H8 GNP A 201 9.959 5.385 -5.819 1.00 4.14 H new HETATM 0 H4' GNP A 201 13.237 5.110 -9.814 1.00 64.24 H new HETATM 0 H3' GNP A 201 14.080 4.267 -7.390 1.00 4.23 H new HETATM 0 H2' GNP A 201 11.787 4.831 -6.275 1.00 41.12 H new HETATM 0 H1' GNP A 201 12.465 7.633 -7.446 1.00 63.22 H new HETATM 2664 MG MG A 202 12.417 1.349 -3.178 1.00 54.01 MG HETATM 2665 C13 KOB A 203 6.988 -13.770 6.342 1.00 3.32 C HETATM 2666 C12 KOB A 203 6.713 -12.418 6.516 1.00 24.20 C HETATM 2667 C11 KOB A 203 5.677 -12.024 7.356 1.00 35.14 C HETATM 2668 F11 KOB A 203 5.415 -10.714 7.535 1.00 72.11 F HETATM 2669 C10 KOB A 203 4.916 -12.980 8.018 1.00 72.01 C HETATM 2670 C9 KOB A 203 5.191 -14.331 7.842 1.00 23.32 C HETATM 2671 C8 KOB A 203 6.229 -14.728 7.005 1.00 4.02 C HETATM 2672 N8 KOB A 203 6.512 -16.016 6.823 1.00 64.23 N HETATM 2673 C7 KOB A 203 5.822 -16.978 7.431 1.00 21.15 C HETATM 2674 S7 KOB A 203 4.509 -16.597 8.524 1.00 51.34 S HETATM 2675 N7 KOB A 203 6.136 -18.253 7.221 1.00 61.24 N HETATM 2676 N6 KOB A 203 7.060 -18.558 6.468 1.00 32.11 N HETATM 2677 C6 KOB A 203 6.812 -18.848 5.193 1.00 42.42 C HETATM 2678 C5 KOB A 203 5.507 -18.796 4.716 1.00 63.15 C HETATM 2679 C4 KOB A 203 5.249 -19.109 3.386 1.00 23.14 C HETATM 2680 C3 KOB A 203 6.288 -19.469 2.537 1.00 0.44 C HETATM 2681 N3 KOB A 203 6.033 -19.778 1.268 1.00 44.12 N HETATM 2682 O3B KOB A 203 7.095 -20.145 0.399 1.00 43.20 O HETATM 2683 O3A KOB A 203 4.698 -19.741 0.784 1.00 61.45 O HETATM 2684 C2 KOB A 203 7.592 -19.516 3.015 1.00 45.02 C HETATM 2685 C1 KOB A 203 7.854 -19.205 4.345 1.00 31.42 C HETATM 2686 N1 KOB A 203 9.103 -19.256 4.801 1.00 20.41 N HETATM 2687 O1B KOB A 203 9.380 -18.946 6.160 1.00 0.13 O HETATM 2688 O1A KOB A 203 10.162 -19.623 3.928 1.00 74.31 O HETATM 0 HE2 KOB A 203 7.308 -11.668 5.995 1.00 24.20 H new HETATM 0 HE1 KOB A 203 4.103 -12.670 8.675 1.00 72.01 H new HETATM 0 HD2 KOB A 203 7.800 -14.079 5.684 1.00 3.32 H new HETATM 0 HD1 KOB A 203 4.593 -15.080 8.360 1.00 23.32 H new HETATM 0 HAD KOB A 203 7.278 -16.273 6.201 1.00 64.23 H new HETATM 0 HAC KOB A 203 5.605 -18.987 7.690 1.00 61.24 H new HETATM 0 HAB KOB A 203 8.016 -18.589 6.821 1.00 32.11 H new HETATM 0 H5 KOB A 203 4.691 -18.512 5.381 1.00 63.15 H new HETATM 0 H4 KOB A 203 4.227 -19.072 3.008 1.00 23.14 H new HETATM 0 H2 KOB A 203 8.408 -19.796 2.349 1.00 45.02 H new HETATM 2699 O HOH A 301 11.608 3.236 -4.220 1.00 12.53 O HETATM 2702 O HOH A 302 13.010 -0.391 -1.906 1.00 54.22 O HETATM 2705 O HOH A 303 12.780 2.991 -1.692 1.00 24.54 O