USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=43 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 119:sc= 0.946 USER MOD Set 1.2: A 148 THR OG1 : rot 151:sc= 0.278 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.641 K(o=-0.71,f=-8!) USER MOD Set 2.2: A 137 TYR OH : rot -28:sc= -1.35! USER MOD Set 3.1: A 87 THR OG1 : rot -30:sc= 1.12 USER MOD Set 3.2: A 124 THR OG1 : rot -20:sc= 2.12 USER MOD Single : A 1 MET CE :methyl -139:sc= -0.403 (180deg=-1.4!) USER MOD Single : A 1 MET N :NH3+ -123:sc= 1.4 (180deg=-0.182) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 165:sc= -2.13 USER MOD Single : A 5 LYS NZ :NH3+ -145:sc= 0.348 (180deg=-0.0111) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 77:sc= 1.24 USER MOD Single : A 22 GLN : amide:sc= -0.951 K(o=-0.95,f=-3.6!) USER MOD Single : A 25 GLN :FLIP amide:sc= -0.372 F(o=-1.2,f=-0.37) USER MOD Single : A 26 ASN : amide:sc= -0.905 X(o=-0.91,f=-0.98) USER MOD Single : A 27 HIS : no HE2:sc= -1.4 K(o=-1.4,f=-3.8!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot -82:sc= 0.63 USER MOD Single : A 40 TYR OH : rot 180:sc= -0.0186 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= -0.179 X(o=-0.18,f=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 70:sc= -1.22 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 178:sc= -7.13! (180deg=-7.36!) USER MOD Single : A 70 GLN : amide:sc= -3.56! C(o=-3.6!,f=-6.8!) USER MOD Single : A 71 TYR OH : rot -22:sc= 0.385 USER MOD Single : A 72 MET CE :methyl -154:sc= -0.0971 (180deg=-1.22) USER MOD Single : A 74 THR OG1 : rot 180:sc= -1.43 USER MOD Single : A 80 CYS SG : rot 180:sc= -1.11 USER MOD Single : A 85 ASN :FLIP amide:sc= -0.301 F(o=-2.7,f=-0.3) USER MOD Single : A 86 ASN : amide:sc= -0.194 K(o=-0.19,f=-2.6!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 160:sc= -0.372 USER MOD Single : A 95 GLN : amide:sc= -0.822 K(o=-0.82,f=-2.7!) USER MOD Single : A 96 TYR OH : rot -86:sc= -0.541 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0.26) USER MOD Single : A 101 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.313) 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 -166:sc= -3.8! (180deg=-5.03!) USER MOD Single : A 116 ASN : amide:sc= -4.86! C(o=-4.9!,f=-10!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 180:sc= -0.036 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc=-0.00196 X(o=-0.002,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 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 107:sc= 1.16 USER MOD Single : A 158 THR OG1 : rot 71:sc= 1.07 USER MOD Single : A 165 GLN : amide:sc= -0.211 X(o=-0.21,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 135:sc= 0.104 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.979 1.848 23.161 1.00 31.50 N ATOM 2 CA MET A 1 -2.207 2.067 21.709 1.00 22.31 C ATOM 3 C MET A 1 -2.754 0.812 21.039 1.00 53.24 C ATOM 4 O MET A 1 -2.595 -0.297 21.549 1.00 0.14 O ATOM 5 CB MET A 1 -0.883 2.478 21.062 1.00 34.42 C ATOM 6 CG MET A 1 0.227 1.456 21.244 1.00 21.23 C ATOM 7 SD MET A 1 1.059 1.610 22.836 1.00 40.41 S ATOM 8 CE MET A 1 1.706 3.276 22.720 1.00 5.23 C ATOM 0 H1 MET A 1 -2.519 2.549 23.707 1.00 31.50 H new ATOM 0 H2 MET A 1 -2.292 0.891 23.421 1.00 31.50 H new ATOM 0 H3 MET A 1 -0.966 1.950 23.373 1.00 31.50 H new ATOM 0 HA MET A 1 -2.948 2.856 21.580 1.00 22.31 H new ATOM 0 HB2 MET A 1 -1.044 2.641 19.996 1.00 34.42 H new ATOM 0 HB3 MET A 1 -0.562 3.430 21.485 1.00 34.42 H new ATOM 0 HG2 MET A 1 -0.189 0.453 21.152 1.00 21.23 H new ATOM 0 HG3 MET A 1 0.958 1.573 20.444 1.00 21.23 H new ATOM 0 HE1 MET A 1 2.716 3.304 23.130 1.00 5.23 H new ATOM 0 HE2 MET A 1 1.730 3.585 21.675 1.00 5.23 H new ATOM 0 HE3 MET A 1 1.067 3.955 23.285 1.00 5.23 H new ATOM 18 N THR A 2 -3.403 0.999 19.897 1.00 52.32 N ATOM 19 CA THR A 2 -3.982 -0.111 19.152 1.00 12.11 C ATOM 20 C THR A 2 -3.045 -0.562 18.033 1.00 51.23 C ATOM 21 O THR A 2 -2.418 0.259 17.365 1.00 44.43 O ATOM 22 CB THR A 2 -5.349 0.300 18.588 1.00 12.04 C ATOM 23 OG1 THR A 2 -6.394 -0.215 19.393 1.00 11.01 O ATOM 24 CG2 THR A 2 -5.596 -0.166 17.170 1.00 32.00 C ATOM 0 H THR A 2 -3.542 1.913 19.465 1.00 52.32 H new ATOM 0 HA THR A 2 -4.120 -0.955 19.828 1.00 12.11 H new ATOM 0 HB THR A 2 -5.337 1.390 18.590 1.00 12.04 H new ATOM 0 HG1 THR A 2 -7.259 0.058 19.021 1.00 11.01 H new ATOM 0 HG21 THR A 2 -6.583 0.164 16.845 1.00 32.00 H new ATOM 0 HG22 THR A 2 -4.837 0.256 16.511 1.00 32.00 H new ATOM 0 HG23 THR A 2 -5.547 -1.254 17.131 1.00 32.00 H new ATOM 32 N GLU A 3 -2.961 -1.873 17.833 1.00 12.44 N ATOM 33 CA GLU A 3 -2.108 -2.436 16.793 1.00 64.11 C ATOM 34 C GLU A 3 -2.855 -2.507 15.465 1.00 65.33 C ATOM 35 O GLU A 3 -4.047 -2.812 15.429 1.00 53.44 O ATOM 36 CB GLU A 3 -1.623 -3.830 17.200 1.00 44.34 C ATOM 37 CG GLU A 3 -0.113 -3.932 17.339 1.00 31.41 C ATOM 38 CD GLU A 3 0.356 -5.354 17.575 1.00 51.44 C ATOM 39 OE1 GLU A 3 0.333 -6.154 16.616 1.00 32.11 O ATOM 40 OE2 GLU A 3 0.747 -5.668 18.719 1.00 34.21 O ATOM 0 H GLU A 3 -3.474 -2.566 18.378 1.00 12.44 H new ATOM 0 HA GLU A 3 -1.243 -1.784 16.669 1.00 64.11 H new ATOM 0 HB2 GLU A 3 -2.086 -4.104 18.148 1.00 44.34 H new ATOM 0 HB3 GLU A 3 -1.961 -4.554 16.459 1.00 44.34 H new ATOM 0 HG2 GLU A 3 0.358 -3.543 16.436 1.00 31.41 H new ATOM 0 HG3 GLU A 3 0.215 -3.303 18.166 1.00 31.41 H new ATOM 47 N TYR A 4 -2.149 -2.223 14.376 1.00 61.45 N ATOM 48 CA TYR A 4 -2.752 -2.254 13.049 1.00 22.31 C ATOM 49 C TYR A 4 -1.845 -2.963 12.050 1.00 3.32 C ATOM 50 O TYR A 4 -0.620 -2.909 12.159 1.00 13.24 O ATOM 51 CB TYR A 4 -3.047 -0.834 12.567 1.00 31.21 C ATOM 52 CG TYR A 4 -4.299 -0.239 13.171 1.00 21.02 C ATOM 53 CD1 TYR A 4 -5.517 -0.901 13.082 1.00 64.33 C ATOM 54 CD2 TYR A 4 -4.262 0.982 13.832 1.00 54.42 C ATOM 55 CE1 TYR A 4 -6.663 -0.362 13.634 1.00 0.12 C ATOM 56 CE2 TYR A 4 -5.404 1.527 14.388 1.00 62.34 C ATOM 57 CZ TYR A 4 -6.601 0.851 14.286 1.00 25.33 C ATOM 58 OH TYR A 4 -7.740 1.389 14.838 1.00 31.22 O ATOM 0 H TYR A 4 -1.161 -1.969 14.386 1.00 61.45 H new ATOM 0 HA TYR A 4 -3.687 -2.810 13.118 1.00 22.31 H new ATOM 0 HB2 TYR A 4 -2.198 -0.194 12.807 1.00 31.21 H new ATOM 0 HB3 TYR A 4 -3.145 -0.840 11.481 1.00 31.21 H new ATOM 0 HD1 TYR A 4 -5.569 -1.852 12.573 1.00 64.33 H new ATOM 0 HD2 TYR A 4 -3.326 1.514 13.913 1.00 54.42 H new ATOM 0 HE1 TYR A 4 -7.603 -0.888 13.555 1.00 0.12 H new ATOM 0 HE2 TYR A 4 -5.359 2.477 14.899 1.00 62.34 H new ATOM 0 HH TYR A 4 -7.495 2.108 15.457 1.00 31.22 H new ATOM 68 N LYS A 5 -2.457 -3.625 11.074 1.00 32.44 N ATOM 69 CA LYS A 5 -1.710 -4.344 10.051 1.00 61.01 C ATOM 70 C LYS A 5 -1.938 -3.723 8.677 1.00 21.45 C ATOM 71 O LYS A 5 -3.059 -3.710 8.169 1.00 23.11 O ATOM 72 CB LYS A 5 -2.120 -5.818 10.033 1.00 52.32 C ATOM 73 CG LYS A 5 -1.127 -6.732 10.726 1.00 32.15 C ATOM 74 CD LYS A 5 -0.145 -7.333 9.737 1.00 63.22 C ATOM 75 CE LYS A 5 0.826 -8.272 10.427 1.00 52.15 C ATOM 76 NZ LYS A 5 1.788 -7.534 11.291 1.00 22.42 N ATOM 0 H LYS A 5 -3.470 -3.678 10.971 1.00 32.44 H new ATOM 0 HA LYS A 5 -0.649 -4.273 10.291 1.00 61.01 H new ATOM 0 HB2 LYS A 5 -3.093 -5.922 10.513 1.00 52.32 H new ATOM 0 HB3 LYS A 5 -2.238 -6.141 8.999 1.00 52.32 H new ATOM 0 HG2 LYS A 5 -0.583 -6.171 11.486 1.00 32.15 H new ATOM 0 HG3 LYS A 5 -1.662 -7.530 11.240 1.00 32.15 H new ATOM 0 HD2 LYS A 5 -0.690 -7.874 8.963 1.00 63.22 H new ATOM 0 HD3 LYS A 5 0.408 -6.536 9.240 1.00 63.22 H new ATOM 0 HE2 LYS A 5 0.271 -8.989 11.031 1.00 52.15 H new ATOM 0 HE3 LYS A 5 1.374 -8.843 9.678 1.00 52.15 H new ATOM 0 HZ1 LYS A 5 2.713 -8.009 11.265 1.00 22.42 H new ATOM 0 HZ2 LYS A 5 1.890 -6.559 10.943 1.00 22.42 H new ATOM 0 HZ3 LYS A 5 1.434 -7.517 12.269 1.00 22.42 H new ATOM 90 N LEU A 6 -0.868 -3.209 8.080 1.00 14.31 N ATOM 91 CA LEU A 6 -0.953 -2.587 6.764 1.00 15.13 C ATOM 92 C LEU A 6 -0.199 -3.409 5.725 1.00 34.03 C ATOM 93 O LEU A 6 1.013 -3.264 5.564 1.00 22.03 O ATOM 94 CB LEU A 6 -0.392 -1.164 6.810 1.00 40.52 C ATOM 95 CG LEU A 6 -1.082 -0.225 7.802 1.00 4.32 C ATOM 96 CD1 LEU A 6 -2.590 -0.246 7.600 1.00 11.41 C ATOM 97 CD2 LEU A 6 -0.727 -0.607 9.232 1.00 45.52 C ATOM 0 H LEU A 6 0.068 -3.211 8.486 1.00 14.31 H new ATOM 0 HA LEU A 6 -2.004 -2.546 6.477 1.00 15.13 H new ATOM 0 HB2 LEU A 6 0.668 -1.216 7.060 1.00 40.52 H new ATOM 0 HB3 LEU A 6 -0.463 -0.730 5.813 1.00 40.52 H new ATOM 0 HG LEU A 6 -0.728 0.789 7.619 1.00 4.32 H new ATOM 0 HD11 LEU A 6 -3.062 0.428 8.315 1.00 11.41 H new ATOM 0 HD12 LEU A 6 -2.826 0.077 6.586 1.00 11.41 H new ATOM 0 HD13 LEU A 6 -2.964 -1.258 7.754 1.00 11.41 H new ATOM 0 HD21 LEU A 6 -1.226 0.071 9.924 1.00 45.52 H new ATOM 0 HD22 LEU A 6 -1.052 -1.629 9.427 1.00 45.52 H new ATOM 0 HD23 LEU A 6 0.352 -0.537 9.370 1.00 45.52 H new ATOM 109 N VAL A 7 -0.923 -4.273 5.021 1.00 30.05 N ATOM 110 CA VAL A 7 -0.324 -5.117 3.999 1.00 4.31 C ATOM 111 C VAL A 7 -0.227 -4.378 2.668 1.00 65.03 C ATOM 112 O VAL A 7 -1.215 -4.241 1.948 1.00 51.10 O ATOM 113 CB VAL A 7 -1.136 -6.413 3.805 1.00 64.53 C ATOM 114 CG1 VAL A 7 -0.534 -7.270 2.702 1.00 54.23 C ATOM 115 CG2 VAL A 7 -1.212 -7.192 5.109 1.00 2.25 C ATOM 0 H VAL A 7 -1.927 -4.406 5.142 1.00 30.05 H new ATOM 0 HA VAL A 7 0.680 -5.374 4.338 1.00 4.31 H new ATOM 0 HB VAL A 7 -2.148 -6.140 3.506 1.00 64.53 H new ATOM 0 HG11 VAL A 7 -1.124 -8.179 2.584 1.00 54.23 H new ATOM 0 HG12 VAL A 7 -0.536 -6.712 1.766 1.00 54.23 H new ATOM 0 HG13 VAL A 7 0.490 -7.534 2.965 1.00 54.23 H new ATOM 0 HG21 VAL A 7 -1.789 -8.104 4.955 1.00 2.25 H new ATOM 0 HG22 VAL A 7 -0.205 -7.450 5.438 1.00 2.25 H new ATOM 0 HG23 VAL A 7 -1.697 -6.581 5.870 1.00 2.25 H new ATOM 125 N VAL A 8 0.972 -3.906 2.348 1.00 64.42 N ATOM 126 CA VAL A 8 1.201 -3.184 1.106 1.00 41.24 C ATOM 127 C VAL A 8 1.400 -4.147 -0.058 1.00 73.23 C ATOM 128 O VAL A 8 2.080 -5.165 0.073 1.00 32.40 O ATOM 129 CB VAL A 8 2.429 -2.262 1.216 1.00 53.31 C ATOM 130 CG1 VAL A 8 2.615 -1.462 -0.062 1.00 13.12 C ATOM 131 CG2 VAL A 8 2.294 -1.339 2.417 1.00 74.31 C ATOM 0 H VAL A 8 1.801 -4.011 2.933 1.00 64.42 H new ATOM 0 HA VAL A 8 0.316 -2.576 0.921 1.00 41.24 H new ATOM 0 HB VAL A 8 3.314 -2.882 1.358 1.00 53.31 H new ATOM 0 HG11 VAL A 8 3.488 -0.817 0.036 1.00 13.12 H new ATOM 0 HG12 VAL A 8 2.760 -2.144 -0.900 1.00 13.12 H new ATOM 0 HG13 VAL A 8 1.730 -0.851 -0.241 1.00 13.12 H new ATOM 0 HG21 VAL A 8 3.170 -0.694 2.480 1.00 74.31 H new ATOM 0 HG22 VAL A 8 1.399 -0.726 2.306 1.00 74.31 H new ATOM 0 HG23 VAL A 8 2.215 -1.935 3.327 1.00 74.31 H new ATOM 141 N VAL A 9 0.805 -3.816 -1.198 1.00 23.11 N ATOM 142 CA VAL A 9 0.919 -4.648 -2.389 1.00 72.34 C ATOM 143 C VAL A 9 1.146 -3.795 -3.632 1.00 1.12 C ATOM 144 O VAL A 9 0.698 -2.650 -3.702 1.00 63.42 O ATOM 145 CB VAL A 9 -0.337 -5.520 -2.591 1.00 24.31 C ATOM 146 CG1 VAL A 9 -0.562 -6.422 -1.387 1.00 61.51 C ATOM 147 CG2 VAL A 9 -1.561 -4.653 -2.850 1.00 33.34 C ATOM 0 H VAL A 9 0.239 -2.977 -1.322 1.00 23.11 H new ATOM 0 HA VAL A 9 1.779 -5.301 -2.240 1.00 72.34 H new ATOM 0 HB VAL A 9 -0.177 -6.150 -3.466 1.00 24.31 H new ATOM 0 HG11 VAL A 9 -1.453 -7.029 -1.549 1.00 61.51 H new ATOM 0 HG12 VAL A 9 0.302 -7.073 -1.254 1.00 61.51 H new ATOM 0 HG13 VAL A 9 -0.697 -5.811 -0.495 1.00 61.51 H new ATOM 0 HG21 VAL A 9 -2.435 -5.289 -2.989 1.00 33.34 H new ATOM 0 HG22 VAL A 9 -1.726 -3.992 -1.999 1.00 33.34 H new ATOM 0 HG23 VAL A 9 -1.400 -4.056 -3.747 1.00 33.34 H new ATOM 157 N GLY A 10 1.846 -4.358 -4.610 1.00 75.21 N ATOM 158 CA GLY A 10 2.123 -3.633 -5.836 1.00 21.34 C ATOM 159 C GLY A 10 3.312 -4.198 -6.587 1.00 1.25 C ATOM 160 O GLY A 10 3.970 -5.125 -6.115 1.00 42.31 O ATOM 0 H GLY A 10 2.227 -5.304 -4.576 1.00 75.21 H new ATOM 0 HA2 GLY A 10 1.243 -3.663 -6.479 1.00 21.34 H new ATOM 0 HA3 GLY A 10 2.310 -2.585 -5.601 1.00 21.34 H new ATOM 164 N ALA A 11 3.588 -3.639 -7.761 1.00 51.05 N ATOM 165 CA ALA A 11 4.706 -4.093 -8.579 1.00 11.31 C ATOM 166 C ALA A 11 6.014 -3.457 -8.122 1.00 1.11 C ATOM 167 O ALA A 11 6.012 -2.447 -7.420 1.00 2.40 O ATOM 168 CB ALA A 11 4.448 -3.779 -10.045 1.00 1.44 C ATOM 0 H ALA A 11 3.053 -2.871 -8.167 1.00 51.05 H new ATOM 0 HA ALA A 11 4.797 -5.173 -8.460 1.00 11.31 H new ATOM 0 HB1 ALA A 11 5.291 -4.123 -10.645 1.00 1.44 H new ATOM 0 HB2 ALA A 11 3.540 -4.285 -10.371 1.00 1.44 H new ATOM 0 HB3 ALA A 11 4.329 -2.703 -10.171 1.00 1.44 H new ATOM 174 N GLY A 12 7.129 -4.056 -8.524 1.00 65.55 N ATOM 175 CA GLY A 12 8.429 -3.534 -8.145 1.00 74.33 C ATOM 176 C GLY A 12 8.688 -2.144 -8.697 1.00 0.32 C ATOM 177 O GLY A 12 9.553 -1.425 -8.199 1.00 71.02 O ATOM 0 H GLY A 12 7.156 -4.894 -9.105 1.00 65.55 H new ATOM 0 HA2 GLY A 12 8.502 -3.508 -7.058 1.00 74.33 H new ATOM 0 HA3 GLY A 12 9.205 -4.212 -8.500 1.00 74.33 H new ATOM 181 N GLY A 13 7.940 -1.765 -9.730 1.00 73.10 N ATOM 182 CA GLY A 13 8.116 -0.455 -10.329 1.00 64.02 C ATOM 183 C GLY A 13 6.989 0.501 -9.990 1.00 5.45 C ATOM 184 O GLY A 13 6.558 1.286 -10.836 1.00 24.54 O ATOM 0 H GLY A 13 7.217 -2.341 -10.161 1.00 73.10 H new ATOM 0 HA2 GLY A 13 9.061 -0.030 -9.991 1.00 64.02 H new ATOM 0 HA3 GLY A 13 8.183 -0.561 -11.412 1.00 64.02 H new ATOM 188 N VAL A 14 6.509 0.438 -8.752 1.00 41.21 N ATOM 189 CA VAL A 14 5.425 1.307 -8.308 1.00 72.04 C ATOM 190 C VAL A 14 5.889 2.258 -7.207 1.00 64.31 C ATOM 191 O VAL A 14 5.439 3.401 -7.131 1.00 61.04 O ATOM 192 CB VAL A 14 4.220 0.492 -7.798 1.00 5.32 C ATOM 193 CG1 VAL A 14 3.714 -0.447 -8.882 1.00 13.14 C ATOM 194 CG2 VAL A 14 4.584 -0.285 -6.540 1.00 73.31 C ATOM 0 H VAL A 14 6.853 -0.205 -8.039 1.00 41.21 H new ATOM 0 HA VAL A 14 5.117 1.890 -9.176 1.00 72.04 H new ATOM 0 HB VAL A 14 3.420 1.188 -7.545 1.00 5.32 H new ATOM 0 HG11 VAL A 14 2.863 -1.014 -8.504 1.00 13.14 H new ATOM 0 HG12 VAL A 14 3.406 0.134 -9.751 1.00 13.14 H new ATOM 0 HG13 VAL A 14 4.510 -1.134 -9.169 1.00 13.14 H new ATOM 0 HG21 VAL A 14 3.718 -0.852 -6.199 1.00 73.31 H new ATOM 0 HG22 VAL A 14 5.403 -0.970 -6.760 1.00 73.31 H new ATOM 0 HG23 VAL A 14 4.892 0.410 -5.759 1.00 73.31 H new ATOM 204 N GLY A 15 6.790 1.778 -6.355 1.00 70.00 N ATOM 205 CA GLY A 15 7.295 2.598 -5.270 1.00 14.23 C ATOM 206 C GLY A 15 6.685 2.229 -3.932 1.00 55.12 C ATOM 207 O GLY A 15 6.643 3.048 -3.014 1.00 51.14 O ATOM 0 H GLY A 15 7.179 0.836 -6.397 1.00 70.00 H new ATOM 0 HA2 GLY A 15 8.378 2.493 -5.213 1.00 14.23 H new ATOM 0 HA3 GLY A 15 7.087 3.646 -5.484 1.00 14.23 H new ATOM 211 N LYS A 16 6.210 0.992 -3.821 1.00 73.54 N ATOM 212 CA LYS A 16 5.597 0.515 -2.586 1.00 5.44 C ATOM 213 C LYS A 16 6.596 0.546 -1.434 1.00 35.11 C ATOM 214 O LYS A 16 6.265 0.966 -0.325 1.00 61.54 O ATOM 215 CB LYS A 16 5.060 -0.905 -2.773 1.00 62.33 C ATOM 216 CG LYS A 16 6.097 -1.884 -3.299 1.00 52.33 C ATOM 217 CD LYS A 16 6.713 -2.704 -2.175 1.00 64.21 C ATOM 218 CE LYS A 16 6.235 -4.147 -2.209 1.00 72.04 C ATOM 219 NZ LYS A 16 5.043 -4.358 -1.344 1.00 63.24 N ATOM 0 H LYS A 16 6.238 0.302 -4.572 1.00 73.54 H new ATOM 0 HA LYS A 16 4.768 1.180 -2.342 1.00 5.44 H new ATOM 0 HB2 LYS A 16 4.680 -1.269 -1.819 1.00 62.33 H new ATOM 0 HB3 LYS A 16 4.216 -0.877 -3.462 1.00 62.33 H new ATOM 0 HG2 LYS A 16 5.633 -2.551 -4.025 1.00 52.33 H new ATOM 0 HG3 LYS A 16 6.881 -1.338 -3.824 1.00 52.33 H new ATOM 0 HD2 LYS A 16 7.800 -2.678 -2.258 1.00 64.21 H new ATOM 0 HD3 LYS A 16 6.456 -2.257 -1.215 1.00 64.21 H new ATOM 0 HE2 LYS A 16 5.993 -4.425 -3.235 1.00 72.04 H new ATOM 0 HE3 LYS A 16 7.041 -4.804 -1.883 1.00 72.04 H new ATOM 0 HZ1 LYS A 16 4.749 -5.354 -1.395 1.00 63.24 H new ATOM 0 HZ2 LYS A 16 5.281 -4.117 -0.361 1.00 63.24 H new ATOM 0 HZ3 LYS A 16 4.265 -3.750 -1.671 1.00 63.24 H new ATOM 233 N SER A 17 7.819 0.101 -1.703 1.00 41.10 N ATOM 234 CA SER A 17 8.864 0.081 -0.685 1.00 11.22 C ATOM 235 C SER A 17 9.256 1.498 -0.283 1.00 12.50 C ATOM 236 O SER A 17 9.609 1.752 0.869 1.00 53.14 O ATOM 237 CB SER A 17 10.091 -0.677 -1.195 1.00 43.35 C ATOM 238 OG SER A 17 10.539 -0.150 -2.432 1.00 51.40 O ATOM 0 H SER A 17 8.111 -0.250 -2.615 1.00 41.10 H new ATOM 0 HA SER A 17 8.471 -0.432 0.193 1.00 11.22 H new ATOM 0 HB2 SER A 17 10.892 -0.616 -0.459 1.00 43.35 H new ATOM 0 HB3 SER A 17 9.847 -1.733 -1.313 1.00 43.35 H new ATOM 244 N ALA A 18 9.188 2.419 -1.239 1.00 32.33 N ATOM 245 CA ALA A 18 9.534 3.812 -0.983 1.00 42.44 C ATOM 246 C ALA A 18 8.555 4.443 0.001 1.00 73.54 C ATOM 247 O ALA A 18 8.960 5.080 0.973 1.00 33.40 O ATOM 248 CB ALA A 18 9.559 4.598 -2.285 1.00 74.33 C ATOM 0 H ALA A 18 8.897 2.226 -2.197 1.00 32.33 H new ATOM 0 HA ALA A 18 10.529 3.841 -0.538 1.00 42.44 H new ATOM 0 HB1 ALA A 18 9.819 5.636 -2.078 1.00 74.33 H new ATOM 0 HB2 ALA A 18 10.300 4.165 -2.957 1.00 74.33 H new ATOM 0 HB3 ALA A 18 8.576 4.556 -2.754 1.00 74.33 H new ATOM 254 N LEU A 19 7.264 4.260 -0.259 1.00 75.34 N ATOM 255 CA LEU A 19 6.226 4.809 0.605 1.00 41.30 C ATOM 256 C LEU A 19 6.266 4.157 1.984 1.00 60.43 C ATOM 257 O LEU A 19 5.888 4.770 2.982 1.00 21.25 O ATOM 258 CB LEU A 19 4.847 4.607 -0.027 1.00 34.35 C ATOM 259 CG LEU A 19 4.645 5.296 -1.377 1.00 3.23 C ATOM 260 CD1 LEU A 19 3.252 5.012 -1.918 1.00 1.05 C ATOM 261 CD2 LEU A 19 4.874 6.794 -1.249 1.00 40.15 C ATOM 0 H LEU A 19 6.913 3.736 -1.061 1.00 75.34 H new ATOM 0 HA LEU A 19 6.412 5.877 0.721 1.00 41.30 H new ATOM 0 HB2 LEU A 19 4.675 3.538 -0.153 1.00 34.35 H new ATOM 0 HB3 LEU A 19 4.090 4.972 0.667 1.00 34.35 H new ATOM 0 HG LEU A 19 5.374 4.896 -2.081 1.00 3.23 H new ATOM 0 HD11 LEU A 19 3.126 5.510 -2.879 1.00 1.05 H new ATOM 0 HD12 LEU A 19 3.124 3.937 -2.047 1.00 1.05 H new ATOM 0 HD13 LEU A 19 2.506 5.385 -1.216 1.00 1.05 H new ATOM 0 HD21 LEU A 19 4.726 7.269 -2.219 1.00 40.15 H new ATOM 0 HD22 LEU A 19 4.168 7.210 -0.530 1.00 40.15 H new ATOM 0 HD23 LEU A 19 5.892 6.978 -0.906 1.00 40.15 H new ATOM 273 N THR A 20 6.727 2.911 2.031 1.00 54.11 N ATOM 274 CA THR A 20 6.817 2.175 3.287 1.00 51.12 C ATOM 275 C THR A 20 7.707 2.908 4.286 1.00 2.35 C ATOM 276 O THR A 20 7.285 3.212 5.401 1.00 44.14 O ATOM 277 CB THR A 20 7.360 0.767 3.039 1.00 13.43 C ATOM 278 OG1 THR A 20 6.543 0.070 2.116 1.00 70.41 O ATOM 279 CG2 THR A 20 7.449 -0.071 4.297 1.00 44.23 C ATOM 0 H THR A 20 7.044 2.390 1.214 1.00 54.11 H new ATOM 0 HA THR A 20 5.814 2.101 3.708 1.00 51.12 H new ATOM 0 HB THR A 20 8.366 0.911 2.646 1.00 13.43 H new ATOM 0 HG1 THR A 20 6.730 0.388 1.208 1.00 70.41 H new ATOM 0 HG21 THR A 20 7.842 -1.057 4.050 1.00 44.23 H new ATOM 0 HG22 THR A 20 8.113 0.415 5.012 1.00 44.23 H new ATOM 0 HG23 THR A 20 6.457 -0.175 4.736 1.00 44.23 H new ATOM 287 N ILE A 21 8.941 3.189 3.879 1.00 51.21 N ATOM 288 CA ILE A 21 9.888 3.884 4.732 1.00 52.12 C ATOM 289 C ILE A 21 9.375 5.280 5.087 1.00 10.11 C ATOM 290 O ILE A 21 9.676 5.807 6.158 1.00 21.32 O ATOM 291 CB ILE A 21 11.269 3.981 4.044 1.00 62.33 C ATOM 292 CG1 ILE A 21 12.080 2.710 4.305 1.00 23.11 C ATOM 293 CG2 ILE A 21 12.037 5.204 4.517 1.00 23.02 C ATOM 294 CD1 ILE A 21 11.378 1.442 3.870 1.00 2.41 C ATOM 0 H ILE A 21 9.306 2.943 2.959 1.00 51.21 H new ATOM 0 HA ILE A 21 9.997 3.312 5.653 1.00 52.12 H new ATOM 0 HB ILE A 21 11.105 4.084 2.971 1.00 62.33 H new ATOM 0 HG12 ILE A 21 13.034 2.784 3.783 1.00 23.11 H new ATOM 0 HG13 ILE A 21 12.304 2.644 5.370 1.00 23.11 H new ATOM 0 HG21 ILE A 21 13.004 5.243 4.015 1.00 23.02 H new ATOM 0 HG22 ILE A 21 11.469 6.104 4.282 1.00 23.02 H new ATOM 0 HG23 ILE A 21 12.190 5.143 5.594 1.00 23.02 H new ATOM 0 HD11 ILE A 21 12.012 0.582 4.086 1.00 2.41 H new ATOM 0 HD12 ILE A 21 10.437 1.343 4.411 1.00 2.41 H new ATOM 0 HD13 ILE A 21 11.178 1.486 2.799 1.00 2.41 H new ATOM 306 N GLN A 22 8.600 5.870 4.184 1.00 33.41 N ATOM 307 CA GLN A 22 8.047 7.201 4.406 1.00 44.30 C ATOM 308 C GLN A 22 7.113 7.204 5.612 1.00 70.24 C ATOM 309 O GLN A 22 7.155 8.114 6.440 1.00 41.05 O ATOM 310 CB GLN A 22 7.296 7.679 3.162 1.00 53.32 C ATOM 311 CG GLN A 22 8.203 7.970 1.978 1.00 52.22 C ATOM 312 CD GLN A 22 8.860 9.334 2.068 1.00 64.55 C ATOM 313 OE1 GLN A 22 8.374 10.225 2.763 1.00 0.30 O ATOM 314 NE2 GLN A 22 9.973 9.503 1.362 1.00 44.32 N ATOM 0 H GLN A 22 8.341 5.448 3.292 1.00 33.41 H new ATOM 0 HA GLN A 22 8.873 7.884 4.605 1.00 44.30 H new ATOM 0 HB2 GLN A 22 6.568 6.921 2.874 1.00 53.32 H new ATOM 0 HB3 GLN A 22 6.736 8.581 3.410 1.00 53.32 H new ATOM 0 HG2 GLN A 22 8.975 7.202 1.919 1.00 52.22 H new ATOM 0 HG3 GLN A 22 7.623 7.910 1.057 1.00 52.22 H new ATOM 0 HE21 GLN A 22 10.341 8.736 0.799 1.00 44.32 H new ATOM 0 HE22 GLN A 22 10.459 10.399 1.383 1.00 44.32 H new ATOM 323 N LEU A 23 6.272 6.180 5.706 1.00 33.13 N ATOM 324 CA LEU A 23 5.330 6.064 6.813 1.00 23.24 C ATOM 325 C LEU A 23 6.028 5.595 8.090 1.00 21.44 C ATOM 326 O LEU A 23 5.421 5.564 9.161 1.00 31.24 O ATOM 327 CB LEU A 23 4.202 5.096 6.448 1.00 63.23 C ATOM 328 CG LEU A 23 2.804 5.539 6.883 1.00 35.13 C ATOM 329 CD1 LEU A 23 2.722 5.634 8.399 1.00 53.43 C ATOM 330 CD2 LEU A 23 2.446 6.871 6.243 1.00 14.41 C ATOM 0 H LEU A 23 6.223 5.418 5.029 1.00 33.13 H new ATOM 0 HA LEU A 23 4.910 7.052 7.000 1.00 23.24 H new ATOM 0 HB2 LEU A 23 4.202 4.953 5.367 1.00 63.23 H new ATOM 0 HB3 LEU A 23 4.416 4.126 6.898 1.00 63.23 H new ATOM 0 HG LEU A 23 2.085 4.792 6.548 1.00 35.13 H new ATOM 0 HD11 LEU A 23 1.720 5.950 8.690 1.00 53.43 H new ATOM 0 HD12 LEU A 23 2.936 4.659 8.837 1.00 53.43 H new ATOM 0 HD13 LEU A 23 3.451 6.361 8.758 1.00 53.43 H new ATOM 0 HD21 LEU A 23 1.448 7.172 6.563 1.00 14.41 H new ATOM 0 HD22 LEU A 23 3.169 7.628 6.549 1.00 14.41 H new ATOM 0 HD23 LEU A 23 2.464 6.770 5.158 1.00 14.41 H new ATOM 342 N ILE A 24 7.302 5.229 7.974 1.00 3.25 N ATOM 343 CA ILE A 24 8.070 4.762 9.122 1.00 72.43 C ATOM 344 C ILE A 24 9.065 5.822 9.589 1.00 13.21 C ATOM 345 O ILE A 24 8.906 6.409 10.659 1.00 32.05 O ATOM 346 CB ILE A 24 8.830 3.460 8.794 1.00 3.42 C ATOM 347 CG1 ILE A 24 7.849 2.372 8.351 1.00 23.14 C ATOM 348 CG2 ILE A 24 9.639 2.991 9.996 1.00 54.12 C ATOM 349 CD1 ILE A 24 6.964 1.865 9.468 1.00 5.55 C ATOM 0 H ILE A 24 7.823 5.247 7.097 1.00 3.25 H new ATOM 0 HA ILE A 24 7.357 4.565 9.923 1.00 72.43 H new ATOM 0 HB ILE A 24 9.522 3.661 7.976 1.00 3.42 H new ATOM 0 HG12 ILE A 24 7.221 2.764 7.551 1.00 23.14 H new ATOM 0 HG13 ILE A 24 8.410 1.535 7.935 1.00 23.14 H new ATOM 0 HG21 ILE A 24 10.167 2.072 9.743 1.00 54.12 H new ATOM 0 HG22 ILE A 24 10.361 3.760 10.271 1.00 54.12 H new ATOM 0 HG23 ILE A 24 8.969 2.805 10.835 1.00 54.12 H new ATOM 0 HD11 ILE A 24 6.295 1.096 9.082 1.00 5.55 H new ATOM 0 HD12 ILE A 24 7.583 1.443 10.259 1.00 5.55 H new ATOM 0 HD13 ILE A 24 6.376 2.690 9.869 1.00 5.55 H new ATOM 361 N GLN A 25 10.095 6.056 8.782 1.00 54.13 N ATOM 362 CA GLN A 25 11.119 7.039 9.115 1.00 63.30 C ATOM 363 C GLN A 25 10.836 8.386 8.451 1.00 21.43 C ATOM 364 O GLN A 25 11.353 9.417 8.880 1.00 52.31 O ATOM 365 CB GLN A 25 12.497 6.526 8.694 1.00 42.41 C ATOM 366 CG GLN A 25 12.749 5.081 9.093 1.00 72.03 C ATOM 367 CD GLN A 25 14.100 4.572 8.632 1.00 62.43 C ATOM 368 OE1 GLN A 25 14.131 3.337 8.145 1.00 43.21 O flip ATOM 369 NE2 GLN A 25 15.104 5.280 8.712 1.00 52.34 N flip ATOM 0 H GLN A 25 10.242 5.578 7.893 1.00 54.13 H new ATOM 0 HA GLN A 25 11.104 7.187 10.195 1.00 63.30 H new ATOM 0 HB2 GLN A 25 12.597 6.620 7.613 1.00 42.41 H new ATOM 0 HB3 GLN A 25 13.264 7.158 9.141 1.00 42.41 H new ATOM 0 HG2 GLN A 25 12.683 4.991 10.177 1.00 72.03 H new ATOM 0 HG3 GLN A 25 11.965 4.451 8.672 1.00 72.03 H new ATOM 0 HE21 GLN A 25 15.034 6.224 9.093 1.00 52.34 H new ATOM 0 HE22 GLN A 25 16.006 4.923 8.397 1.00 52.34 H new ATOM 378 N ASN A 26 10.012 8.372 7.407 1.00 22.41 N ATOM 379 CA ASN A 26 9.662 9.595 6.691 1.00 51.01 C ATOM 380 C ASN A 26 10.882 10.192 5.996 1.00 32.22 C ATOM 381 O ASN A 26 11.439 11.193 6.446 1.00 72.24 O ATOM 382 CB ASN A 26 9.053 10.620 7.652 1.00 71.24 C ATOM 383 CG ASN A 26 7.539 10.652 7.578 1.00 13.43 C ATOM 384 OD1 ASN A 26 6.963 10.977 6.540 1.00 2.03 O ATOM 385 ND2 ASN A 26 6.885 10.315 8.684 1.00 65.21 N ATOM 0 H ASN A 26 9.574 7.528 7.038 1.00 22.41 H new ATOM 0 HA ASN A 26 8.925 9.339 5.930 1.00 51.01 H new ATOM 0 HB2 ASN A 26 9.360 10.385 8.671 1.00 71.24 H new ATOM 0 HB3 ASN A 26 9.447 11.610 7.421 1.00 71.24 H new ATOM 0 HD21 ASN A 26 5.865 10.319 8.695 1.00 65.21 H new ATOM 0 HD22 ASN A 26 7.403 10.052 9.523 1.00 65.21 H new ATOM 392 N HIS A 27 11.288 9.572 4.892 1.00 74.44 N ATOM 393 CA HIS A 27 12.438 10.043 4.127 1.00 54.45 C ATOM 394 C HIS A 27 12.685 9.145 2.916 1.00 53.24 C ATOM 395 O HIS A 27 12.170 8.029 2.843 1.00 24.33 O ATOM 396 CB HIS A 27 13.687 10.107 5.023 1.00 73.45 C ATOM 397 CG HIS A 27 14.640 8.962 4.845 1.00 35.24 C ATOM 398 ND1 HIS A 27 14.246 7.641 4.875 1.00 21.21 N ATOM 399 CD2 HIS A 27 15.977 8.949 4.629 1.00 33.13 C ATOM 400 CE1 HIS A 27 15.299 6.865 4.686 1.00 63.11 C ATOM 401 NE2 HIS A 27 16.360 7.634 4.534 1.00 60.52 N ATOM 0 H HIS A 27 10.837 8.742 4.507 1.00 74.44 H new ATOM 0 HA HIS A 27 12.223 11.048 3.764 1.00 54.45 H new ATOM 0 HB2 HIS A 27 14.216 11.038 4.821 1.00 73.45 H new ATOM 0 HB3 HIS A 27 13.370 10.140 6.065 1.00 73.45 H new ATOM 0 HD1 HIS A 27 13.291 7.314 5.020 1.00 21.21 H new ATOM 0 HD2 HIS A 27 16.621 9.812 4.547 1.00 33.13 H new ATOM 0 HE1 HIS A 27 15.292 5.785 4.660 1.00 63.11 H new ATOM 410 N PHE A 28 13.475 9.639 1.969 1.00 43.52 N ATOM 411 CA PHE A 28 13.788 8.879 0.765 1.00 53.30 C ATOM 412 C PHE A 28 14.669 7.680 1.096 1.00 70.34 C ATOM 413 O PHE A 28 15.637 7.797 1.847 1.00 64.43 O ATOM 414 CB PHE A 28 14.488 9.773 -0.260 1.00 42.33 C ATOM 415 CG PHE A 28 14.524 9.186 -1.643 1.00 44.33 C ATOM 416 CD1 PHE A 28 13.392 8.604 -2.191 1.00 3.21 C ATOM 417 CD2 PHE A 28 15.688 9.218 -2.394 1.00 23.02 C ATOM 418 CE1 PHE A 28 13.421 8.064 -3.463 1.00 64.53 C ATOM 419 CE2 PHE A 28 15.722 8.680 -3.666 1.00 3.22 C ATOM 420 CZ PHE A 28 14.587 8.102 -4.201 1.00 23.33 C ATOM 0 H PHE A 28 13.910 10.561 2.012 1.00 43.52 H new ATOM 0 HA PHE A 28 12.853 8.515 0.340 1.00 53.30 H new ATOM 0 HB2 PHE A 28 13.980 10.737 -0.296 1.00 42.33 H new ATOM 0 HB3 PHE A 28 15.509 9.963 0.072 1.00 42.33 H new ATOM 0 HD1 PHE A 28 12.477 8.572 -1.618 1.00 3.21 H new ATOM 0 HD2 PHE A 28 16.578 9.668 -1.981 1.00 23.02 H new ATOM 0 HE1 PHE A 28 12.532 7.613 -3.879 1.00 64.53 H new ATOM 0 HE2 PHE A 28 16.635 8.711 -4.242 1.00 3.22 H new ATOM 0 HZ PHE A 28 14.612 7.681 -5.195 1.00 23.33 H new ATOM 430 N VAL A 29 14.329 6.525 0.530 1.00 64.54 N ATOM 431 CA VAL A 29 15.093 5.306 0.768 1.00 64.52 C ATOM 432 C VAL A 29 16.554 5.496 0.371 1.00 33.13 C ATOM 433 O VAL A 29 16.857 5.901 -0.751 1.00 54.44 O ATOM 434 CB VAL A 29 14.484 4.105 0.006 1.00 74.02 C ATOM 435 CG1 VAL A 29 15.542 3.062 -0.335 1.00 71.14 C ATOM 436 CG2 VAL A 29 13.367 3.481 0.826 1.00 65.21 C ATOM 0 H VAL A 29 13.531 6.409 -0.095 1.00 64.54 H new ATOM 0 HA VAL A 29 15.046 5.091 1.836 1.00 64.52 H new ATOM 0 HB VAL A 29 14.074 4.475 -0.934 1.00 74.02 H new ATOM 0 HG11 VAL A 29 15.077 2.234 -0.870 1.00 71.14 H new ATOM 0 HG12 VAL A 29 16.310 3.514 -0.963 1.00 71.14 H new ATOM 0 HG13 VAL A 29 15.997 2.691 0.584 1.00 71.14 H new ATOM 0 HG21 VAL A 29 12.944 2.636 0.282 1.00 65.21 H new ATOM 0 HG22 VAL A 29 13.765 3.135 1.780 1.00 65.21 H new ATOM 0 HG23 VAL A 29 12.589 4.223 1.005 1.00 65.21 H new ATOM 446 N ASP A 30 17.450 5.198 1.306 1.00 41.33 N ATOM 447 CA ASP A 30 18.885 5.330 1.076 1.00 13.01 C ATOM 448 C ASP A 30 19.665 5.021 2.352 1.00 63.53 C ATOM 449 O ASP A 30 20.749 4.442 2.304 1.00 50.44 O ATOM 450 CB ASP A 30 19.222 6.744 0.588 1.00 1.14 C ATOM 451 CG ASP A 30 20.711 6.951 0.383 1.00 34.34 C ATOM 452 OD1 ASP A 30 21.352 6.076 -0.236 1.00 31.14 O ATOM 453 OD2 ASP A 30 21.236 7.987 0.842 1.00 2.10 O ATOM 0 H ASP A 30 17.205 4.861 2.237 1.00 41.33 H new ATOM 0 HA ASP A 30 19.173 4.613 0.307 1.00 13.01 H new ATOM 0 HB2 ASP A 30 18.700 6.935 -0.350 1.00 1.14 H new ATOM 0 HB3 ASP A 30 18.854 7.471 1.312 1.00 1.14 H new ATOM 458 N GLU A 31 19.104 5.416 3.492 1.00 11.43 N ATOM 459 CA GLU A 31 19.746 5.186 4.782 1.00 23.51 C ATOM 460 C GLU A 31 18.994 4.134 5.596 1.00 51.10 C ATOM 461 O GLU A 31 19.540 3.564 6.541 1.00 42.43 O ATOM 462 CB GLU A 31 19.830 6.494 5.570 1.00 74.44 C ATOM 463 CG GLU A 31 20.328 6.317 6.995 1.00 2.13 C ATOM 464 CD GLU A 31 21.740 5.769 7.057 1.00 12.02 C ATOM 465 OE1 GLU A 31 22.451 5.843 6.033 1.00 41.54 O ATOM 466 OE2 GLU A 31 22.135 5.265 8.129 1.00 2.44 O ATOM 0 H GLU A 31 18.206 5.897 3.548 1.00 11.43 H new ATOM 0 HA GLU A 31 20.753 4.814 4.594 1.00 23.51 H new ATOM 0 HB2 GLU A 31 20.493 7.182 5.046 1.00 74.44 H new ATOM 0 HB3 GLU A 31 18.844 6.958 5.594 1.00 74.44 H new ATOM 0 HG2 GLU A 31 20.292 7.277 7.510 1.00 2.13 H new ATOM 0 HG3 GLU A 31 19.657 5.644 7.529 1.00 2.13 H new ATOM 473 N TYR A 32 17.739 3.882 5.232 1.00 11.30 N ATOM 474 CA TYR A 32 16.921 2.901 5.939 1.00 21.04 C ATOM 475 C TYR A 32 17.636 1.554 6.023 1.00 15.40 C ATOM 476 O TYR A 32 18.341 1.155 5.096 1.00 34.20 O ATOM 477 CB TYR A 32 15.561 2.743 5.244 1.00 64.41 C ATOM 478 CG TYR A 32 15.569 1.776 4.077 1.00 35.04 C ATOM 479 CD1 TYR A 32 16.450 1.943 3.016 1.00 21.42 C ATOM 480 CD2 TYR A 32 14.696 0.696 4.041 1.00 74.12 C ATOM 481 CE1 TYR A 32 16.460 1.061 1.952 1.00 14.45 C ATOM 482 CE2 TYR A 32 14.700 -0.190 2.981 1.00 63.43 C ATOM 483 CZ TYR A 32 15.583 -0.003 1.939 1.00 41.41 C ATOM 484 OH TYR A 32 15.591 -0.883 0.882 1.00 54.43 O ATOM 0 H TYR A 32 17.268 4.342 4.453 1.00 11.30 H new ATOM 0 HA TYR A 32 16.757 3.261 6.955 1.00 21.04 H new ATOM 0 HB2 TYR A 32 14.828 2.405 5.977 1.00 64.41 H new ATOM 0 HB3 TYR A 32 15.231 3.720 4.890 1.00 64.41 H new ATOM 0 HD1 TYR A 32 17.138 2.775 3.023 1.00 21.42 H new ATOM 0 HD2 TYR A 32 14.003 0.546 4.855 1.00 74.12 H new ATOM 0 HE1 TYR A 32 17.151 1.204 1.135 1.00 14.45 H new ATOM 0 HE2 TYR A 32 14.015 -1.025 2.969 1.00 63.43 H new ATOM 0 HH TYR A 32 14.913 -1.576 1.028 1.00 54.43 H new ATOM 494 N ASP A 33 17.452 0.859 7.142 1.00 41.34 N ATOM 495 CA ASP A 33 18.083 -0.442 7.347 1.00 64.41 C ATOM 496 C ASP A 33 17.802 -1.382 6.174 1.00 70.44 C ATOM 497 O ASP A 33 16.653 -1.742 5.920 1.00 30.53 O ATOM 498 CB ASP A 33 17.593 -1.078 8.650 1.00 52.13 C ATOM 499 CG ASP A 33 16.102 -0.898 8.866 1.00 12.10 C ATOM 500 OD1 ASP A 33 15.326 -1.188 7.931 1.00 64.25 O ATOM 501 OD2 ASP A 33 15.710 -0.467 9.971 1.00 54.21 O ATOM 0 H ASP A 33 16.872 1.174 7.920 1.00 41.34 H new ATOM 0 HA ASP A 33 19.159 -0.282 7.411 1.00 64.41 H new ATOM 0 HB2 ASP A 33 17.829 -2.142 8.641 1.00 52.13 H new ATOM 0 HB3 ASP A 33 18.133 -0.639 9.489 1.00 52.13 H new ATOM 506 N PRO A 34 18.852 -1.795 5.441 1.00 23.33 N ATOM 507 CA PRO A 34 18.707 -2.696 4.296 1.00 42.13 C ATOM 508 C PRO A 34 18.479 -4.144 4.720 1.00 34.33 C ATOM 509 O PRO A 34 18.008 -4.965 3.933 1.00 55.25 O ATOM 510 CB PRO A 34 20.043 -2.554 3.571 1.00 20.55 C ATOM 511 CG PRO A 34 21.020 -2.221 4.646 1.00 75.21 C ATOM 512 CD PRO A 34 20.261 -1.418 5.671 1.00 11.44 C ATOM 0 HA PRO A 34 17.842 -2.444 3.683 1.00 42.13 H new ATOM 0 HB2 PRO A 34 20.316 -3.477 3.059 1.00 20.55 H new ATOM 0 HB3 PRO A 34 20.003 -1.770 2.815 1.00 20.55 H new ATOM 0 HG2 PRO A 34 21.434 -3.126 5.090 1.00 75.21 H new ATOM 0 HG3 PRO A 34 21.858 -1.650 4.247 1.00 75.21 H new ATOM 0 HD2 PRO A 34 20.580 -1.660 6.685 1.00 11.44 H new ATOM 0 HD3 PRO A 34 20.416 -0.348 5.535 1.00 11.44 H new ATOM 520 N SER A 35 18.818 -4.452 5.969 1.00 30.32 N ATOM 521 CA SER A 35 18.651 -5.800 6.496 1.00 53.42 C ATOM 522 C SER A 35 17.175 -6.159 6.623 1.00 65.44 C ATOM 523 O SER A 35 16.642 -6.931 5.826 1.00 55.44 O ATOM 524 CB SER A 35 19.337 -5.925 7.858 1.00 63.12 C ATOM 525 OG SER A 35 20.703 -6.275 7.711 1.00 54.50 O ATOM 0 H SER A 35 19.210 -3.785 6.634 1.00 30.32 H new ATOM 0 HA SER A 35 19.115 -6.495 5.796 1.00 53.42 H new ATOM 0 HB2 SER A 35 19.256 -4.981 8.397 1.00 63.12 H new ATOM 0 HB3 SER A 35 18.828 -6.679 8.457 1.00 63.12 H new ATOM 0 HG SER A 35 21.119 -6.347 8.595 1.00 54.50 H new ATOM 531 N ILE A 36 16.525 -5.596 7.632 1.00 71.31 N ATOM 532 CA ILE A 36 15.110 -5.855 7.871 1.00 54.33 C ATOM 533 C ILE A 36 14.242 -5.250 6.771 1.00 75.41 C ATOM 534 O ILE A 36 14.659 -4.325 6.075 1.00 23.40 O ATOM 535 CB ILE A 36 14.659 -5.299 9.238 1.00 51.24 C ATOM 536 CG1 ILE A 36 14.723 -3.768 9.249 1.00 14.55 C ATOM 537 CG2 ILE A 36 15.518 -5.879 10.353 1.00 53.31 C ATOM 538 CD1 ILE A 36 13.364 -3.109 9.346 1.00 41.43 C ATOM 0 H ILE A 36 16.955 -4.956 8.300 1.00 71.31 H new ATOM 0 HA ILE A 36 14.983 -6.938 7.870 1.00 54.33 H new ATOM 0 HB ILE A 36 13.624 -5.596 9.407 1.00 51.24 H new ATOM 0 HG12 ILE A 36 15.336 -3.444 10.090 1.00 14.55 H new ATOM 0 HG13 ILE A 36 15.220 -3.426 8.341 1.00 14.55 H new ATOM 0 HG21 ILE A 36 15.189 -5.478 11.312 1.00 53.31 H new ATOM 0 HG22 ILE A 36 15.420 -6.965 10.361 1.00 53.31 H new ATOM 0 HG23 ILE A 36 16.561 -5.610 10.186 1.00 53.31 H new ATOM 0 HD11 ILE A 36 13.484 -2.026 9.349 1.00 41.43 H new ATOM 0 HD12 ILE A 36 12.755 -3.404 8.492 1.00 41.43 H new ATOM 0 HD13 ILE A 36 12.873 -3.422 10.267 1.00 41.43 H new ATOM 550 N GLU A 37 13.030 -5.778 6.626 1.00 23.21 N ATOM 551 CA GLU A 37 12.094 -5.291 5.614 1.00 3.51 C ATOM 552 C GLU A 37 10.801 -6.103 5.629 1.00 4.34 C ATOM 553 O GLU A 37 9.728 -5.590 5.312 1.00 11.21 O ATOM 554 CB GLU A 37 12.742 -5.325 4.219 1.00 0.33 C ATOM 555 CG GLU A 37 12.251 -6.452 3.319 1.00 62.13 C ATOM 556 CD GLU A 37 12.914 -6.440 1.955 1.00 14.34 C ATOM 557 OE1 GLU A 37 13.147 -5.336 1.419 1.00 30.31 O ATOM 558 OE2 GLU A 37 13.199 -7.533 1.423 1.00 34.35 O ATOM 0 H GLU A 37 12.672 -6.544 7.196 1.00 23.21 H new ATOM 0 HA GLU A 37 11.844 -4.257 5.853 1.00 3.51 H new ATOM 0 HB2 GLU A 37 12.554 -4.373 3.722 1.00 0.33 H new ATOM 0 HB3 GLU A 37 13.822 -5.416 4.336 1.00 0.33 H new ATOM 0 HG2 GLU A 37 12.443 -7.409 3.804 1.00 62.13 H new ATOM 0 HG3 GLU A 37 11.171 -6.369 3.195 1.00 62.13 H new ATOM 565 N ASP A 38 10.916 -7.374 5.995 1.00 60.11 N ATOM 566 CA ASP A 38 9.764 -8.270 6.052 1.00 10.21 C ATOM 567 C ASP A 38 8.584 -7.615 6.768 1.00 71.20 C ATOM 568 O ASP A 38 7.428 -7.926 6.488 1.00 61.01 O ATOM 569 CB ASP A 38 10.143 -9.574 6.758 1.00 40.23 C ATOM 570 CG ASP A 38 10.517 -9.360 8.212 1.00 22.00 C ATOM 571 OD1 ASP A 38 11.550 -8.707 8.469 1.00 3.20 O ATOM 572 OD2 ASP A 38 9.778 -9.846 9.094 1.00 24.13 O ATOM 0 H ASP A 38 11.800 -7.810 6.258 1.00 60.11 H new ATOM 0 HA ASP A 38 9.461 -8.489 5.028 1.00 10.21 H new ATOM 0 HB2 ASP A 38 9.307 -10.271 6.700 1.00 40.23 H new ATOM 0 HB3 ASP A 38 10.980 -10.036 6.235 1.00 40.23 H new ATOM 577 N SER A 39 8.885 -6.708 7.692 1.00 44.42 N ATOM 578 CA SER A 39 7.846 -6.013 8.444 1.00 22.12 C ATOM 579 C SER A 39 8.375 -4.708 9.030 1.00 12.12 C ATOM 580 O SER A 39 9.569 -4.574 9.297 1.00 75.43 O ATOM 581 CB SER A 39 7.313 -6.909 9.563 1.00 3.00 C ATOM 582 OG SER A 39 8.369 -7.583 10.225 1.00 13.20 O ATOM 0 H SER A 39 9.837 -6.438 7.938 1.00 44.42 H new ATOM 0 HA SER A 39 7.033 -5.777 7.757 1.00 22.12 H new ATOM 0 HB2 SER A 39 6.756 -6.307 10.281 1.00 3.00 H new ATOM 0 HB3 SER A 39 6.616 -7.637 9.149 1.00 3.00 H new ATOM 0 HG SER A 39 8.620 -8.380 9.713 1.00 13.20 H new ATOM 588 N TYR A 40 7.476 -3.750 9.229 1.00 73.31 N ATOM 589 CA TYR A 40 7.849 -2.454 9.785 1.00 31.13 C ATOM 590 C TYR A 40 6.905 -2.059 10.917 1.00 51.04 C ATOM 591 O TYR A 40 5.862 -2.682 11.113 1.00 14.11 O ATOM 592 CB TYR A 40 7.831 -1.383 8.693 1.00 10.41 C ATOM 593 CG TYR A 40 8.930 -1.544 7.667 1.00 43.34 C ATOM 594 CD1 TYR A 40 8.784 -2.417 6.596 1.00 52.03 C ATOM 595 CD2 TYR A 40 10.112 -0.821 7.768 1.00 35.44 C ATOM 596 CE1 TYR A 40 9.786 -2.566 5.656 1.00 54.12 C ATOM 597 CE2 TYR A 40 11.118 -0.965 6.831 1.00 53.12 C ATOM 598 CZ TYR A 40 10.950 -1.838 5.777 1.00 74.41 C ATOM 599 OH TYR A 40 11.949 -1.984 4.843 1.00 21.23 O ATOM 0 H TYR A 40 6.484 -3.846 9.014 1.00 73.31 H new ATOM 0 HA TYR A 40 8.859 -2.534 10.188 1.00 31.13 H new ATOM 0 HB2 TYR A 40 6.866 -1.409 8.186 1.00 10.41 H new ATOM 0 HB3 TYR A 40 7.921 -0.401 9.158 1.00 10.41 H new ATOM 0 HD1 TYR A 40 7.873 -2.988 6.497 1.00 52.03 H new ATOM 0 HD2 TYR A 40 10.247 -0.136 8.592 1.00 35.44 H new ATOM 0 HE1 TYR A 40 9.657 -3.250 4.830 1.00 54.12 H new ATOM 0 HE2 TYR A 40 12.031 -0.396 6.924 1.00 53.12 H new ATOM 0 HH TYR A 40 12.701 -1.399 5.074 1.00 21.23 H new ATOM 609 N ARG A 41 7.278 -1.021 11.658 1.00 51.22 N ATOM 610 CA ARG A 41 6.462 -0.545 12.769 1.00 2.33 C ATOM 611 C ARG A 41 6.569 0.970 12.914 1.00 2.03 C ATOM 612 O ARG A 41 7.634 1.550 12.699 1.00 62.22 O ATOM 613 CB ARG A 41 6.891 -1.225 14.071 1.00 24.34 C ATOM 614 CG ARG A 41 6.180 -2.543 14.331 1.00 61.52 C ATOM 615 CD ARG A 41 6.721 -3.236 15.572 1.00 61.43 C ATOM 616 NE ARG A 41 5.665 -3.539 16.534 1.00 23.21 N ATOM 617 CZ ARG A 41 5.805 -4.395 17.544 1.00 74.04 C ATOM 618 NH1 ARG A 41 6.953 -5.035 17.726 1.00 44.30 N ATOM 619 NH2 ARG A 41 4.793 -4.613 18.373 1.00 65.03 N ATOM 0 H ARG A 41 8.139 -0.494 11.510 1.00 51.22 H new ATOM 0 HA ARG A 41 5.423 -0.799 12.559 1.00 2.33 H new ATOM 0 HB2 ARG A 41 7.966 -1.401 14.042 1.00 24.34 H new ATOM 0 HB3 ARG A 41 6.701 -0.549 14.904 1.00 24.34 H new ATOM 0 HG2 ARG A 41 5.112 -2.363 14.451 1.00 61.52 H new ATOM 0 HG3 ARG A 41 6.298 -3.197 13.467 1.00 61.52 H new ATOM 0 HD2 ARG A 41 7.223 -4.159 15.282 1.00 61.43 H new ATOM 0 HD3 ARG A 41 7.470 -2.601 16.044 1.00 61.43 H new ATOM 0 HE ARG A 41 4.767 -3.067 16.426 1.00 23.21 H new ATOM 0 HH11 ARG A 41 7.734 -4.872 17.090 1.00 44.30 H new ATOM 0 HH12 ARG A 41 7.055 -5.690 18.502 1.00 44.30 H new ATOM 0 HH21 ARG A 41 3.908 -4.125 18.237 1.00 65.03 H new ATOM 0 HH22 ARG A 41 4.900 -5.269 19.147 1.00 65.03 H new ATOM 633 N LYS A 42 5.460 1.604 13.280 1.00 60.13 N ATOM 634 CA LYS A 42 5.431 3.052 13.454 1.00 51.25 C ATOM 635 C LYS A 42 4.376 3.458 14.477 1.00 34.15 C ATOM 636 O LYS A 42 3.333 2.817 14.599 1.00 41.50 O ATOM 637 CB LYS A 42 5.152 3.743 12.117 1.00 40.31 C ATOM 638 CG LYS A 42 5.018 5.255 12.222 1.00 10.11 C ATOM 639 CD LYS A 42 6.374 5.926 12.378 1.00 15.21 C ATOM 640 CE LYS A 42 6.284 7.428 12.162 1.00 54.11 C ATOM 641 NZ LYS A 42 6.785 8.190 13.339 1.00 1.43 N ATOM 0 H LYS A 42 4.571 1.139 13.462 1.00 60.13 H new ATOM 0 HA LYS A 42 6.408 3.366 13.822 1.00 51.25 H new ATOM 0 HB2 LYS A 42 5.957 3.507 11.422 1.00 40.31 H new ATOM 0 HB3 LYS A 42 4.235 3.335 11.693 1.00 40.31 H new ATOM 0 HG2 LYS A 42 4.521 5.640 11.332 1.00 10.11 H new ATOM 0 HG3 LYS A 42 4.386 5.507 13.074 1.00 10.11 H new ATOM 0 HD2 LYS A 42 6.768 5.724 13.374 1.00 15.21 H new ATOM 0 HD3 LYS A 42 7.077 5.497 11.664 1.00 15.21 H new ATOM 0 HE2 LYS A 42 6.861 7.703 11.279 1.00 54.11 H new ATOM 0 HE3 LYS A 42 5.248 7.705 11.965 1.00 54.11 H new ATOM 0 HZ1 LYS A 42 6.706 9.210 13.151 1.00 1.43 H new ATOM 0 HZ2 LYS A 42 6.218 7.947 14.177 1.00 1.43 H new ATOM 0 HZ3 LYS A 42 7.781 7.946 13.512 1.00 1.43 H new ATOM 655 N GLN A 43 4.657 4.533 15.201 1.00 13.11 N ATOM 656 CA GLN A 43 3.737 5.040 16.210 1.00 70.53 C ATOM 657 C GLN A 43 3.160 6.383 15.780 1.00 33.12 C ATOM 658 O GLN A 43 3.893 7.356 15.602 1.00 11.23 O ATOM 659 CB GLN A 43 4.449 5.183 17.555 1.00 72.23 C ATOM 660 CG GLN A 43 3.500 5.356 18.727 1.00 54.34 C ATOM 661 CD GLN A 43 4.010 6.353 19.749 1.00 63.23 C ATOM 662 OE1 GLN A 43 5.107 6.200 20.288 1.00 62.33 O ATOM 663 NE2 GLN A 43 3.216 7.382 20.021 1.00 30.13 N ATOM 0 H GLN A 43 5.518 5.072 15.108 1.00 13.11 H new ATOM 0 HA GLN A 43 2.920 4.327 16.318 1.00 70.53 H new ATOM 0 HB2 GLN A 43 5.067 4.302 17.725 1.00 72.23 H new ATOM 0 HB3 GLN A 43 5.121 6.040 17.512 1.00 72.23 H new ATOM 0 HG2 GLN A 43 2.529 5.685 18.358 1.00 54.34 H new ATOM 0 HG3 GLN A 43 3.347 4.391 19.211 1.00 54.34 H new ATOM 0 HE21 GLN A 43 2.315 7.469 19.551 1.00 30.13 H new ATOM 0 HE22 GLN A 43 3.507 8.085 20.700 1.00 30.13 H new ATOM 672 N VAL A 44 1.846 6.427 15.606 1.00 11.00 N ATOM 673 CA VAL A 44 1.174 7.649 15.188 1.00 3.25 C ATOM 674 C VAL A 44 -0.135 7.851 15.946 1.00 30.33 C ATOM 675 O VAL A 44 -0.492 7.053 16.813 1.00 11.10 O ATOM 676 CB VAL A 44 0.887 7.634 13.673 1.00 23.30 C ATOM 677 CG1 VAL A 44 2.180 7.467 12.889 1.00 3.22 C ATOM 678 CG2 VAL A 44 -0.099 6.529 13.323 1.00 63.11 C ATOM 0 H VAL A 44 1.225 5.631 15.748 1.00 11.00 H new ATOM 0 HA VAL A 44 1.846 8.476 15.417 1.00 3.25 H new ATOM 0 HB VAL A 44 0.438 8.589 13.399 1.00 23.30 H new ATOM 0 HG11 VAL A 44 1.960 7.458 11.822 1.00 3.22 H new ATOM 0 HG12 VAL A 44 2.852 8.295 13.114 1.00 3.22 H new ATOM 0 HG13 VAL A 44 2.656 6.527 13.169 1.00 3.22 H new ATOM 0 HG21 VAL A 44 -0.288 6.536 12.249 1.00 63.11 H new ATOM 0 HG22 VAL A 44 0.318 5.564 13.612 1.00 63.11 H new ATOM 0 HG23 VAL A 44 -1.035 6.694 13.857 1.00 63.11 H new ATOM 688 N VAL A 45 -0.847 8.922 15.609 1.00 4.41 N ATOM 689 CA VAL A 45 -2.118 9.229 16.254 1.00 34.33 C ATOM 690 C VAL A 45 -3.224 9.418 15.220 1.00 54.41 C ATOM 691 O VAL A 45 -3.298 10.450 14.554 1.00 12.00 O ATOM 692 CB VAL A 45 -2.014 10.491 17.130 1.00 3.11 C ATOM 693 CG1 VAL A 45 -1.616 11.690 16.289 1.00 75.12 C ATOM 694 CG2 VAL A 45 -3.324 10.750 17.859 1.00 71.53 C ATOM 0 H VAL A 45 -0.565 9.591 14.893 1.00 4.41 H new ATOM 0 HA VAL A 45 -2.366 8.381 16.892 1.00 34.33 H new ATOM 0 HB VAL A 45 -1.239 10.327 17.879 1.00 3.11 H new ATOM 0 HG11 VAL A 45 -1.547 12.573 16.924 1.00 75.12 H new ATOM 0 HG12 VAL A 45 -0.649 11.502 15.822 1.00 75.12 H new ATOM 0 HG13 VAL A 45 -2.366 11.857 15.516 1.00 75.12 H new ATOM 0 HG21 VAL A 45 -3.228 11.646 18.472 1.00 71.53 H new ATOM 0 HG22 VAL A 45 -4.123 10.892 17.132 1.00 71.53 H new ATOM 0 HG23 VAL A 45 -3.560 9.898 18.496 1.00 71.53 H new ATOM 704 N ILE A 46 -4.080 8.410 15.089 1.00 72.15 N ATOM 705 CA ILE A 46 -5.181 8.459 14.135 1.00 62.04 C ATOM 706 C ILE A 46 -6.420 9.094 14.758 1.00 72.44 C ATOM 707 O ILE A 46 -7.042 8.519 15.652 1.00 2.14 O ATOM 708 CB ILE A 46 -5.541 7.051 13.624 1.00 42.42 C ATOM 709 CG1 ILE A 46 -4.279 6.320 13.149 1.00 41.30 C ATOM 710 CG2 ILE A 46 -6.577 7.137 12.510 1.00 22.22 C ATOM 711 CD1 ILE A 46 -3.824 6.714 11.758 1.00 14.05 C ATOM 0 H ILE A 46 -4.032 7.548 15.633 1.00 72.15 H new ATOM 0 HA ILE A 46 -4.847 9.069 13.296 1.00 62.04 H new ATOM 0 HB ILE A 46 -5.976 6.480 14.444 1.00 42.42 H new ATOM 0 HG12 ILE A 46 -3.471 6.517 13.854 1.00 41.30 H new ATOM 0 HG13 ILE A 46 -4.465 5.246 13.169 1.00 41.30 H new ATOM 0 HG21 ILE A 46 -6.820 6.133 12.161 1.00 22.22 H new ATOM 0 HG22 ILE A 46 -7.479 7.618 12.888 1.00 22.22 H new ATOM 0 HG23 ILE A 46 -6.174 7.722 11.683 1.00 22.22 H new ATOM 0 HD11 ILE A 46 -2.927 6.153 11.496 1.00 14.05 H new ATOM 0 HD12 ILE A 46 -4.613 6.491 11.040 1.00 14.05 H new ATOM 0 HD13 ILE A 46 -3.604 7.781 11.736 1.00 14.05 H new ATOM 723 N ASP A 47 -6.774 10.283 14.280 1.00 14.10 N ATOM 724 CA ASP A 47 -7.940 10.996 14.789 1.00 71.34 C ATOM 725 C ASP A 47 -7.804 11.264 16.285 1.00 32.32 C ATOM 726 O ASP A 47 -8.768 11.137 17.040 1.00 42.40 O ATOM 727 CB ASP A 47 -9.214 10.193 14.516 1.00 21.34 C ATOM 728 CG ASP A 47 -10.471 11.017 14.715 1.00 35.51 C ATOM 729 OD1 ASP A 47 -10.710 11.939 13.907 1.00 61.41 O ATOM 730 OD2 ASP A 47 -11.216 10.740 15.678 1.00 4.10 O ATOM 0 H ASP A 47 -6.270 10.773 13.541 1.00 14.10 H new ATOM 0 HA ASP A 47 -8.004 11.953 14.271 1.00 71.34 H new ATOM 0 HB2 ASP A 47 -9.189 9.814 13.494 1.00 21.34 H new ATOM 0 HB3 ASP A 47 -9.243 9.327 15.177 1.00 21.34 H new ATOM 735 N GLY A 48 -6.600 11.636 16.706 1.00 1.01 N ATOM 736 CA GLY A 48 -6.358 11.916 18.109 1.00 51.31 C ATOM 737 C GLY A 48 -6.289 10.657 18.952 1.00 52.44 C ATOM 738 O GLY A 48 -6.501 10.703 20.164 1.00 61.52 O ATOM 0 H GLY A 48 -5.787 11.749 16.100 1.00 1.01 H new ATOM 0 HA2 GLY A 48 -5.423 12.468 18.210 1.00 51.31 H new ATOM 0 HA3 GLY A 48 -7.151 12.560 18.489 1.00 51.31 H new ATOM 742 N GLU A 49 -5.991 9.531 18.312 1.00 42.41 N ATOM 743 CA GLU A 49 -5.894 8.256 19.014 1.00 61.41 C ATOM 744 C GLU A 49 -4.596 7.539 18.658 1.00 14.44 C ATOM 745 O GLU A 49 -4.445 7.019 17.553 1.00 1.31 O ATOM 746 CB GLU A 49 -7.091 7.367 18.674 1.00 62.53 C ATOM 747 CG GLU A 49 -7.085 6.035 19.408 1.00 14.24 C ATOM 748 CD GLU A 49 -8.310 5.842 20.281 1.00 75.51 C ATOM 749 OE1 GLU A 49 -9.404 6.290 19.876 1.00 63.55 O ATOM 750 OE2 GLU A 49 -8.176 5.243 21.369 1.00 45.34 O ATOM 0 H GLU A 49 -5.813 9.475 17.309 1.00 42.41 H new ATOM 0 HA GLU A 49 -5.896 8.459 20.085 1.00 61.41 H new ATOM 0 HB2 GLU A 49 -8.010 7.901 18.914 1.00 62.53 H new ATOM 0 HB3 GLU A 49 -7.102 7.181 17.600 1.00 62.53 H new ATOM 0 HG2 GLU A 49 -7.031 5.225 18.681 1.00 14.24 H new ATOM 0 HG3 GLU A 49 -6.190 5.969 20.026 1.00 14.24 H new ATOM 757 N THR A 50 -3.662 7.517 19.603 1.00 52.11 N ATOM 758 CA THR A 50 -2.375 6.865 19.391 1.00 41.01 C ATOM 759 C THR A 50 -2.555 5.381 19.087 1.00 44.23 C ATOM 760 O THR A 50 -3.143 4.642 19.876 1.00 52.50 O ATOM 761 CB THR A 50 -1.485 7.040 20.622 1.00 12.44 C ATOM 762 OG1 THR A 50 -1.278 8.414 20.900 1.00 34.24 O ATOM 763 CG2 THR A 50 -0.125 6.391 20.477 1.00 10.24 C ATOM 0 H THR A 50 -3.772 7.943 20.523 1.00 52.11 H new ATOM 0 HA THR A 50 -1.896 7.335 18.532 1.00 41.01 H new ATOM 0 HB THR A 50 -2.019 6.548 21.435 1.00 12.44 H new ATOM 0 HG1 THR A 50 -0.708 8.505 21.692 1.00 34.24 H new ATOM 0 HG21 THR A 50 0.454 6.554 21.386 1.00 10.24 H new ATOM 0 HG22 THR A 50 -0.248 5.321 20.312 1.00 10.24 H new ATOM 0 HG23 THR A 50 0.400 6.831 19.629 1.00 10.24 H new ATOM 771 N CYS A 51 -2.040 4.952 17.940 1.00 51.11 N ATOM 772 CA CYS A 51 -2.137 3.556 17.532 1.00 5.13 C ATOM 773 C CYS A 51 -0.895 3.134 16.755 1.00 4.20 C ATOM 774 O CYS A 51 -0.316 3.925 16.011 1.00 35.11 O ATOM 775 CB CYS A 51 -3.387 3.331 16.680 1.00 42.14 C ATOM 776 SG CYS A 51 -4.931 3.795 17.498 1.00 12.05 S ATOM 0 H CYS A 51 -1.551 5.552 17.276 1.00 51.11 H new ATOM 0 HA CYS A 51 -2.210 2.945 18.432 1.00 5.13 H new ATOM 0 HB2 CYS A 51 -3.292 3.902 15.756 1.00 42.14 H new ATOM 0 HB3 CYS A 51 -3.438 2.279 16.400 1.00 42.14 H new ATOM 0 HG CYS A 51 -4.984 5.088 17.623 1.00 12.05 H new ATOM 782 N LEU A 52 -0.490 1.882 16.934 1.00 44.05 N ATOM 783 CA LEU A 52 0.684 1.354 16.252 1.00 53.23 C ATOM 784 C LEU A 52 0.356 0.998 14.805 1.00 72.02 C ATOM 785 O LEU A 52 -0.738 0.521 14.505 1.00 62.04 O ATOM 786 CB LEU A 52 1.216 0.121 16.989 1.00 54.44 C ATOM 787 CG LEU A 52 2.634 0.258 17.549 1.00 43.42 C ATOM 788 CD1 LEU A 52 3.659 0.191 16.427 1.00 2.31 C ATOM 789 CD2 LEU A 52 2.779 1.555 18.331 1.00 1.40 C ATOM 0 H LEU A 52 -0.958 1.214 17.546 1.00 44.05 H new ATOM 0 HA LEU A 52 1.453 2.126 16.251 1.00 53.23 H new ATOM 0 HB2 LEU A 52 0.539 -0.111 17.811 1.00 54.44 H new ATOM 0 HB3 LEU A 52 1.193 -0.729 16.307 1.00 54.44 H new ATOM 0 HG LEU A 52 2.816 -0.573 18.230 1.00 43.42 H new ATOM 0 HD11 LEU A 52 4.661 0.290 16.844 1.00 2.31 H new ATOM 0 HD12 LEU A 52 3.573 -0.766 15.912 1.00 2.31 H new ATOM 0 HD13 LEU A 52 3.478 1.001 15.720 1.00 2.31 H new ATOM 0 HD21 LEU A 52 3.794 1.633 18.721 1.00 1.40 H new ATOM 0 HD22 LEU A 52 2.576 2.401 17.674 1.00 1.40 H new ATOM 0 HD23 LEU A 52 2.071 1.561 19.160 1.00 1.40 H new ATOM 801 N LEU A 53 1.313 1.233 13.915 1.00 62.23 N ATOM 802 CA LEU A 53 1.130 0.938 12.499 1.00 31.25 C ATOM 803 C LEU A 53 2.204 -0.026 12.007 1.00 32.12 C ATOM 804 O LEU A 53 3.372 0.342 11.884 1.00 74.12 O ATOM 805 CB LEU A 53 1.167 2.228 11.676 1.00 41.54 C ATOM 806 CG LEU A 53 0.158 3.299 12.099 1.00 65.15 C ATOM 807 CD1 LEU A 53 0.164 4.454 11.110 1.00 12.14 C ATOM 808 CD2 LEU A 53 -1.238 2.703 12.217 1.00 75.44 C ATOM 0 H LEU A 53 2.224 1.627 14.149 1.00 62.23 H new ATOM 0 HA LEU A 53 0.155 0.467 12.372 1.00 31.25 H new ATOM 0 HB2 LEU A 53 2.170 2.651 11.738 1.00 41.54 H new ATOM 0 HB3 LEU A 53 0.991 1.978 10.630 1.00 41.54 H new ATOM 0 HG LEU A 53 0.451 3.681 13.077 1.00 65.15 H new ATOM 0 HD11 LEU A 53 -0.559 5.207 11.425 1.00 12.14 H new ATOM 0 HD12 LEU A 53 1.159 4.898 11.075 1.00 12.14 H new ATOM 0 HD13 LEU A 53 -0.104 4.086 10.119 1.00 12.14 H new ATOM 0 HD21 LEU A 53 -1.941 3.480 12.519 1.00 75.44 H new ATOM 0 HD22 LEU A 53 -1.541 2.293 11.254 1.00 75.44 H new ATOM 0 HD23 LEU A 53 -1.233 1.909 12.964 1.00 75.44 H new ATOM 820 N ASP A 54 1.802 -1.261 11.732 1.00 75.32 N ATOM 821 CA ASP A 54 2.732 -2.278 11.259 1.00 10.34 C ATOM 822 C ASP A 54 2.680 -2.403 9.740 1.00 65.43 C ATOM 823 O ASP A 54 1.862 -3.145 9.196 1.00 51.22 O ATOM 824 CB ASP A 54 2.417 -3.628 11.906 1.00 0.14 C ATOM 825 CG ASP A 54 3.667 -4.362 12.349 1.00 71.54 C ATOM 826 OD1 ASP A 54 4.431 -4.816 11.472 1.00 64.04 O ATOM 827 OD2 ASP A 54 3.881 -4.484 13.574 1.00 54.20 O ATOM 0 H ASP A 54 0.839 -1.582 11.828 1.00 75.32 H new ATOM 0 HA ASP A 54 3.739 -1.973 11.544 1.00 10.34 H new ATOM 0 HB2 ASP A 54 1.766 -3.472 12.766 1.00 0.14 H new ATOM 0 HB3 ASP A 54 1.867 -4.248 11.198 1.00 0.14 H new ATOM 832 N ILE A 55 3.562 -1.676 9.060 1.00 73.51 N ATOM 833 CA ILE A 55 3.617 -1.713 7.605 1.00 31.20 C ATOM 834 C ILE A 55 4.329 -2.971 7.124 1.00 62.52 C ATOM 835 O ILE A 55 5.529 -3.142 7.340 1.00 23.35 O ATOM 836 CB ILE A 55 4.327 -0.470 7.030 1.00 55.12 C ATOM 837 CG1 ILE A 55 3.574 0.798 7.431 1.00 64.52 C ATOM 838 CG2 ILE A 55 4.436 -0.567 5.514 1.00 30.52 C ATOM 839 CD1 ILE A 55 2.154 0.847 6.908 1.00 1.33 C ATOM 0 H ILE A 55 4.246 -1.056 9.493 1.00 73.51 H new ATOM 0 HA ILE A 55 2.588 -1.719 7.246 1.00 31.20 H new ATOM 0 HB ILE A 55 5.335 -0.425 7.442 1.00 55.12 H new ATOM 0 HG12 ILE A 55 3.555 0.872 8.518 1.00 64.52 H new ATOM 0 HG13 ILE A 55 4.119 1.667 7.062 1.00 64.52 H new ATOM 0 HG21 ILE A 55 4.940 0.319 5.128 1.00 30.52 H new ATOM 0 HG22 ILE A 55 5.008 -1.455 5.246 1.00 30.52 H new ATOM 0 HG23 ILE A 55 3.438 -0.635 5.081 1.00 30.52 H new ATOM 0 HD11 ILE A 55 1.679 1.774 7.230 1.00 1.33 H new ATOM 0 HD12 ILE A 55 2.166 0.805 5.819 1.00 1.33 H new ATOM 0 HD13 ILE A 55 1.593 -0.003 7.298 1.00 1.33 H new ATOM 851 N LEU A 56 3.577 -3.849 6.476 1.00 11.34 N ATOM 852 CA LEU A 56 4.124 -5.097 5.964 1.00 62.44 C ATOM 853 C LEU A 56 4.677 -4.914 4.554 1.00 62.42 C ATOM 854 O LEU A 56 3.945 -4.563 3.629 1.00 31.40 O ATOM 855 CB LEU A 56 3.043 -6.177 5.972 1.00 44.44 C ATOM 856 CG LEU A 56 3.416 -7.489 5.279 1.00 43.24 C ATOM 857 CD1 LEU A 56 4.875 -7.844 5.533 1.00 70.00 C ATOM 858 CD2 LEU A 56 2.503 -8.606 5.755 1.00 51.13 C ATOM 0 H LEU A 56 2.582 -3.719 6.292 1.00 11.34 H new ATOM 0 HA LEU A 56 4.946 -5.405 6.611 1.00 62.44 H new ATOM 0 HB2 LEU A 56 2.780 -6.395 7.007 1.00 44.44 H new ATOM 0 HB3 LEU A 56 2.149 -5.775 5.494 1.00 44.44 H new ATOM 0 HG LEU A 56 3.286 -7.361 4.204 1.00 43.24 H new ATOM 0 HD11 LEU A 56 5.115 -8.781 5.030 1.00 70.00 H new ATOM 0 HD12 LEU A 56 5.515 -7.051 5.147 1.00 70.00 H new ATOM 0 HD13 LEU A 56 5.041 -7.955 6.605 1.00 70.00 H new ATOM 0 HD21 LEU A 56 2.776 -9.536 5.256 1.00 51.13 H new ATOM 0 HD22 LEU A 56 2.608 -8.728 6.833 1.00 51.13 H new ATOM 0 HD23 LEU A 56 1.469 -8.357 5.517 1.00 51.13 H new ATOM 870 N ASP A 57 5.974 -5.157 4.400 1.00 4.51 N ATOM 871 CA ASP A 57 6.628 -5.022 3.104 1.00 32.01 C ATOM 872 C ASP A 57 7.025 -6.387 2.554 1.00 52.31 C ATOM 873 O ASP A 57 7.954 -7.022 3.053 1.00 75.35 O ATOM 874 CB ASP A 57 7.864 -4.129 3.222 1.00 53.25 C ATOM 875 CG ASP A 57 8.092 -3.289 1.981 1.00 40.25 C ATOM 876 OD1 ASP A 57 7.869 -3.806 0.865 1.00 53.13 O ATOM 877 OD2 ASP A 57 8.493 -2.115 2.123 1.00 54.31 O ATOM 0 H ASP A 57 6.593 -5.448 5.157 1.00 4.51 H new ATOM 0 HA ASP A 57 5.921 -4.561 2.414 1.00 32.01 H new ATOM 0 HB2 ASP A 57 7.754 -3.473 4.086 1.00 53.25 H new ATOM 0 HB3 ASP A 57 8.741 -4.750 3.403 1.00 53.25 H new ATOM 882 N THR A 58 6.315 -6.834 1.523 1.00 33.25 N ATOM 883 CA THR A 58 6.596 -8.124 0.906 1.00 33.13 C ATOM 884 C THR A 58 7.446 -7.951 -0.348 1.00 4.31 C ATOM 885 O THR A 58 7.898 -6.849 -0.656 1.00 64.13 O ATOM 886 CB THR A 58 5.292 -8.847 0.558 1.00 75.15 C ATOM 887 OG1 THR A 58 4.755 -8.357 -0.657 1.00 1.22 O ATOM 888 CG2 THR A 58 4.224 -8.708 1.622 1.00 25.43 C ATOM 0 H THR A 58 5.542 -6.322 1.098 1.00 33.25 H new ATOM 0 HA THR A 58 7.154 -8.727 1.623 1.00 33.13 H new ATOM 0 HB THR A 58 5.562 -9.900 0.475 1.00 75.15 H new ATOM 0 HG1 THR A 58 3.923 -8.833 -0.862 1.00 1.22 H new ATOM 0 HG21 THR A 58 3.328 -9.244 1.310 1.00 25.43 H new ATOM 0 HG22 THR A 58 4.589 -9.126 2.560 1.00 25.43 H new ATOM 0 HG23 THR A 58 3.985 -7.654 1.763 1.00 25.43 H new ATOM 896 N ALA A 59 7.658 -9.047 -1.067 1.00 63.32 N ATOM 897 CA ALA A 59 8.454 -9.016 -2.288 1.00 33.32 C ATOM 898 C ALA A 59 7.746 -8.228 -3.385 1.00 50.54 C ATOM 899 O ALA A 59 6.707 -8.649 -3.894 1.00 64.21 O ATOM 900 CB ALA A 59 8.751 -10.432 -2.759 1.00 54.34 C ATOM 0 H ALA A 59 7.290 -9.967 -0.826 1.00 63.32 H new ATOM 0 HA ALA A 59 9.396 -8.513 -2.067 1.00 33.32 H new ATOM 0 HB1 ALA A 59 9.346 -10.395 -3.672 1.00 54.34 H new ATOM 0 HB2 ALA A 59 9.305 -10.964 -1.986 1.00 54.34 H new ATOM 0 HB3 ALA A 59 7.815 -10.953 -2.958 1.00 54.34 H new ATOM 906 N GLY A 60 8.317 -7.083 -3.744 1.00 63.33 N ATOM 907 CA GLY A 60 7.728 -6.253 -4.779 1.00 0.22 C ATOM 908 C GLY A 60 7.825 -6.881 -6.156 1.00 4.52 C ATOM 909 O GLY A 60 7.044 -6.555 -7.050 1.00 40.24 O ATOM 0 H GLY A 60 9.177 -6.715 -3.337 1.00 63.33 H new ATOM 0 HA2 GLY A 60 6.680 -6.070 -4.540 1.00 0.22 H new ATOM 0 HA3 GLY A 60 8.227 -5.284 -4.790 1.00 0.22 H new ATOM 913 N GLN A 61 8.786 -7.784 -6.329 1.00 14.23 N ATOM 914 CA GLN A 61 8.979 -8.455 -7.608 1.00 34.20 C ATOM 915 C GLN A 61 8.011 -9.624 -7.763 1.00 33.41 C ATOM 916 O GLN A 61 7.014 -9.525 -8.478 1.00 31.20 O ATOM 917 CB GLN A 61 10.422 -8.950 -7.736 1.00 3.13 C ATOM 918 CG GLN A 61 11.442 -7.828 -7.840 1.00 21.53 C ATOM 919 CD GLN A 61 11.889 -7.577 -9.267 1.00 22.32 C ATOM 920 OE1 GLN A 61 12.633 -8.370 -9.846 1.00 64.31 O ATOM 921 NE2 GLN A 61 11.436 -6.470 -9.843 1.00 72.11 N ATOM 0 H GLN A 61 9.441 -8.067 -5.600 1.00 14.23 H new ATOM 0 HA GLN A 61 8.778 -7.735 -8.401 1.00 34.20 H new ATOM 0 HB2 GLN A 61 10.663 -9.570 -6.872 1.00 3.13 H new ATOM 0 HB3 GLN A 61 10.502 -9.586 -8.617 1.00 3.13 H new ATOM 0 HG2 GLN A 61 11.013 -6.913 -7.431 1.00 21.53 H new ATOM 0 HG3 GLN A 61 12.311 -8.074 -7.229 1.00 21.53 H new ATOM 0 HE21 GLN A 61 10.821 -5.841 -9.326 1.00 72.11 H new ATOM 0 HE22 GLN A 61 11.702 -6.249 -10.802 1.00 72.11 H new ATOM 930 N GLU A 62 8.311 -10.730 -7.090 1.00 50.23 N ATOM 931 CA GLU A 62 7.466 -11.917 -7.156 1.00 3.43 C ATOM 932 C GLU A 62 7.986 -13.010 -6.223 1.00 62.00 C ATOM 933 O GLU A 62 8.810 -12.749 -5.347 1.00 41.11 O ATOM 934 CB GLU A 62 7.398 -12.435 -8.594 1.00 52.33 C ATOM 935 CG GLU A 62 8.705 -13.028 -9.083 1.00 71.22 C ATOM 936 CD GLU A 62 9.033 -12.626 -10.508 1.00 12.25 C ATOM 937 OE1 GLU A 62 9.372 -11.444 -10.729 1.00 63.41 O ATOM 938 OE2 GLU A 62 8.952 -13.494 -11.403 1.00 40.43 O ATOM 0 H GLU A 62 9.132 -10.829 -6.493 1.00 50.23 H new ATOM 0 HA GLU A 62 6.463 -11.642 -6.830 1.00 3.43 H new ATOM 0 HB2 GLU A 62 6.616 -13.191 -8.663 1.00 52.33 H new ATOM 0 HB3 GLU A 62 7.109 -11.617 -9.254 1.00 52.33 H new ATOM 0 HG2 GLU A 62 9.513 -12.709 -8.425 1.00 71.22 H new ATOM 0 HG3 GLU A 62 8.653 -14.115 -9.019 1.00 71.22 H new ATOM 945 N GLU A 63 7.501 -14.234 -6.419 1.00 65.23 N ATOM 946 CA GLU A 63 7.916 -15.369 -5.598 1.00 10.01 C ATOM 947 C GLU A 63 7.325 -15.277 -4.196 1.00 35.30 C ATOM 948 O GLU A 63 6.585 -14.344 -3.882 1.00 30.21 O ATOM 949 CB GLU A 63 9.443 -15.445 -5.515 1.00 75.14 C ATOM 950 CG GLU A 63 10.136 -15.232 -6.851 1.00 54.45 C ATOM 951 CD GLU A 63 11.375 -16.091 -7.007 1.00 22.54 C ATOM 952 OE1 GLU A 63 11.232 -17.282 -7.355 1.00 65.23 O ATOM 953 OE2 GLU A 63 12.489 -15.572 -6.782 1.00 54.21 O ATOM 0 H GLU A 63 6.819 -14.465 -7.141 1.00 65.23 H new ATOM 0 HA GLU A 63 7.541 -16.276 -6.072 1.00 10.01 H new ATOM 0 HB2 GLU A 63 9.798 -14.696 -4.807 1.00 75.14 H new ATOM 0 HB3 GLU A 63 9.729 -16.419 -5.118 1.00 75.14 H new ATOM 0 HG2 GLU A 63 9.439 -15.456 -7.658 1.00 54.45 H new ATOM 0 HG3 GLU A 63 10.411 -14.182 -6.950 1.00 54.45 H new ATOM 960 N TYR A 64 7.654 -16.255 -3.359 1.00 44.43 N ATOM 961 CA TYR A 64 7.155 -16.292 -1.990 1.00 50.04 C ATOM 962 C TYR A 64 5.632 -16.358 -1.967 1.00 71.22 C ATOM 963 O TYR A 64 4.997 -15.918 -1.009 1.00 54.02 O ATOM 964 CB TYR A 64 7.641 -15.069 -1.209 1.00 74.45 C ATOM 965 CG TYR A 64 8.836 -15.354 -0.327 1.00 73.21 C ATOM 966 CD1 TYR A 64 8.922 -16.536 0.400 1.00 62.22 C ATOM 967 CD2 TYR A 64 9.878 -14.444 -0.221 1.00 62.22 C ATOM 968 CE1 TYR A 64 10.011 -16.801 1.205 1.00 73.21 C ATOM 969 CE2 TYR A 64 10.971 -14.702 0.583 1.00 64.41 C ATOM 970 CZ TYR A 64 11.034 -15.882 1.294 1.00 23.25 C ATOM 971 OH TYR A 64 12.121 -16.141 2.096 1.00 51.43 O ATOM 0 H TYR A 64 8.265 -17.034 -3.606 1.00 44.43 H new ATOM 0 HA TYR A 64 7.545 -17.191 -1.514 1.00 50.04 H new ATOM 0 HB2 TYR A 64 7.899 -14.277 -1.912 1.00 74.45 H new ATOM 0 HB3 TYR A 64 6.825 -14.694 -0.592 1.00 74.45 H new ATOM 0 HD1 TYR A 64 8.123 -17.259 0.334 1.00 62.22 H new ATOM 0 HD2 TYR A 64 9.834 -13.519 -0.776 1.00 62.22 H new ATOM 0 HE1 TYR A 64 10.061 -17.724 1.763 1.00 73.21 H new ATOM 0 HE2 TYR A 64 11.773 -13.982 0.655 1.00 64.41 H new ATOM 0 HH TYR A 64 12.751 -15.392 2.045 1.00 51.43 H new ATOM 981 N SER A 65 5.050 -16.916 -3.026 1.00 13.41 N ATOM 982 CA SER A 65 3.601 -17.044 -3.117 1.00 63.42 C ATOM 983 C SER A 65 3.070 -17.901 -1.974 1.00 44.51 C ATOM 984 O SER A 65 1.951 -17.704 -1.501 1.00 45.03 O ATOM 985 CB SER A 65 3.202 -17.654 -4.460 1.00 51.24 C ATOM 986 OG SER A 65 3.362 -19.062 -4.452 1.00 35.24 O ATOM 0 H SER A 65 5.559 -17.285 -3.829 1.00 13.41 H new ATOM 0 HA SER A 65 3.163 -16.049 -3.041 1.00 63.42 H new ATOM 0 HB2 SER A 65 2.164 -17.405 -4.681 1.00 51.24 H new ATOM 0 HB3 SER A 65 3.810 -17.221 -5.254 1.00 51.24 H new ATOM 0 HG SER A 65 3.098 -19.426 -5.323 1.00 35.24 H new ATOM 992 N ALA A 66 3.892 -18.846 -1.528 1.00 2.42 N ATOM 993 CA ALA A 66 3.526 -19.734 -0.431 1.00 41.34 C ATOM 994 C ALA A 66 3.108 -18.934 0.795 1.00 2.45 C ATOM 995 O ALA A 66 2.004 -19.093 1.316 1.00 43.43 O ATOM 996 CB ALA A 66 4.699 -20.639 -0.087 1.00 2.41 C ATOM 0 H ALA A 66 4.821 -19.017 -1.912 1.00 2.42 H new ATOM 0 HA ALA A 66 2.680 -20.344 -0.747 1.00 41.34 H new ATOM 0 HB1 ALA A 66 4.420 -21.300 0.733 1.00 2.41 H new ATOM 0 HB2 ALA A 66 4.966 -21.236 -0.959 1.00 2.41 H new ATOM 0 HB3 ALA A 66 5.553 -20.031 0.212 1.00 2.41 H new ATOM 1002 N MET A 67 4.008 -18.072 1.244 1.00 24.14 N ATOM 1003 CA MET A 67 3.765 -17.230 2.405 1.00 63.32 C ATOM 1004 C MET A 67 2.985 -15.977 2.018 1.00 62.45 C ATOM 1005 O MET A 67 2.337 -15.359 2.859 1.00 11.45 O ATOM 1006 CB MET A 67 5.093 -16.869 3.060 1.00 63.22 C ATOM 1007 CG MET A 67 5.935 -18.094 3.385 1.00 30.23 C ATOM 1008 SD MET A 67 7.676 -17.872 2.989 1.00 44.11 S ATOM 1009 CE MET A 67 8.160 -16.729 4.275 1.00 30.02 C ATOM 0 H MET A 67 4.924 -17.937 0.816 1.00 24.14 H new ATOM 0 HA MET A 67 3.157 -17.782 3.122 1.00 63.32 H new ATOM 0 HB2 MET A 67 5.655 -16.212 2.396 1.00 63.22 H new ATOM 0 HB3 MET A 67 4.902 -16.310 3.976 1.00 63.22 H new ATOM 0 HG2 MET A 67 5.836 -18.326 4.445 1.00 30.23 H new ATOM 0 HG3 MET A 67 5.549 -18.951 2.833 1.00 30.23 H new ATOM 0 HE1 MET A 67 9.226 -16.517 4.191 1.00 30.02 H new ATOM 0 HE2 MET A 67 7.596 -15.802 4.169 1.00 30.02 H new ATOM 0 HE3 MET A 67 7.953 -17.170 5.250 1.00 30.02 H new ATOM 1019 N ARG A 68 3.034 -15.608 0.738 1.00 72.14 N ATOM 1020 CA ARG A 68 2.307 -14.435 0.258 1.00 14.20 C ATOM 1021 C ARG A 68 0.859 -14.478 0.734 1.00 2.11 C ATOM 1022 O ARG A 68 0.238 -13.442 0.973 1.00 61.40 O ATOM 1023 CB ARG A 68 2.351 -14.369 -1.269 1.00 50.51 C ATOM 1024 CG ARG A 68 1.827 -13.062 -1.843 1.00 22.23 C ATOM 1025 CD ARG A 68 2.190 -12.917 -3.312 1.00 63.45 C ATOM 1026 NE ARG A 68 1.706 -14.039 -4.112 1.00 12.32 N ATOM 1027 CZ ARG A 68 2.051 -14.245 -5.381 1.00 43.55 C ATOM 1028 NH1 ARG A 68 2.878 -13.407 -5.994 1.00 61.01 N ATOM 1029 NH2 ARG A 68 1.568 -15.290 -6.038 1.00 31.20 N ATOM 0 H ARG A 68 3.566 -16.101 0.020 1.00 72.14 H new ATOM 0 HA ARG A 68 2.786 -13.544 0.663 1.00 14.20 H new ATOM 0 HB2 ARG A 68 3.379 -14.514 -1.600 1.00 50.51 H new ATOM 0 HB3 ARG A 68 1.766 -15.194 -1.676 1.00 50.51 H new ATOM 0 HG2 ARG A 68 0.744 -13.021 -1.728 1.00 22.23 H new ATOM 0 HG3 ARG A 68 2.239 -12.224 -1.280 1.00 22.23 H new ATOM 0 HD2 ARG A 68 1.769 -11.989 -3.699 1.00 63.45 H new ATOM 0 HD3 ARG A 68 3.273 -12.842 -3.411 1.00 63.45 H new ATOM 0 HE ARG A 68 1.067 -14.702 -3.673 1.00 12.32 H new ATOM 0 HH11 ARG A 68 3.252 -12.601 -5.493 1.00 61.01 H new ATOM 0 HH12 ARG A 68 3.140 -13.569 -6.967 1.00 61.01 H new ATOM 0 HH21 ARG A 68 0.932 -15.936 -5.571 1.00 31.20 H new ATOM 0 HH22 ARG A 68 1.832 -15.448 -7.010 1.00 31.20 H new ATOM 1043 N ASP A 69 0.333 -15.692 0.881 1.00 1.42 N ATOM 1044 CA ASP A 69 -1.035 -15.887 1.341 1.00 63.14 C ATOM 1045 C ASP A 69 -1.142 -15.561 2.827 1.00 73.14 C ATOM 1046 O ASP A 69 -2.163 -15.054 3.294 1.00 72.02 O ATOM 1047 CB ASP A 69 -1.479 -17.330 1.084 1.00 34.34 C ATOM 1048 CG ASP A 69 -2.617 -17.418 0.085 1.00 21.21 C ATOM 1049 OD1 ASP A 69 -2.775 -16.478 -0.721 1.00 54.14 O ATOM 1050 OD2 ASP A 69 -3.350 -18.430 0.109 1.00 73.20 O ATOM 0 H ASP A 69 0.838 -16.557 0.687 1.00 1.42 H new ATOM 0 HA ASP A 69 -1.690 -15.215 0.786 1.00 63.14 H new ATOM 0 HB2 ASP A 69 -0.631 -17.908 0.716 1.00 34.34 H new ATOM 0 HB3 ASP A 69 -1.790 -17.784 2.025 1.00 34.34 H new ATOM 1055 N GLN A 70 -0.070 -15.848 3.561 1.00 64.01 N ATOM 1056 CA GLN A 70 -0.021 -15.580 4.994 1.00 62.31 C ATOM 1057 C GLN A 70 -0.273 -14.100 5.263 1.00 72.33 C ATOM 1058 O GLN A 70 -1.086 -13.739 6.112 1.00 11.44 O ATOM 1059 CB GLN A 70 1.346 -16.003 5.556 1.00 23.14 C ATOM 1060 CG GLN A 70 1.645 -15.480 6.954 1.00 11.44 C ATOM 1061 CD GLN A 70 0.867 -16.216 8.028 1.00 60.55 C ATOM 1062 OE1 GLN A 70 -0.355 -16.337 7.951 1.00 53.44 O ATOM 1063 NE2 GLN A 70 1.573 -16.712 9.037 1.00 23.25 N ATOM 0 H GLN A 70 0.780 -16.268 3.184 1.00 64.01 H new ATOM 0 HA GLN A 70 -0.800 -16.157 5.491 1.00 62.31 H new ATOM 0 HB2 GLN A 70 1.397 -17.092 5.571 1.00 23.14 H new ATOM 0 HB3 GLN A 70 2.126 -15.657 4.878 1.00 23.14 H new ATOM 0 HG2 GLN A 70 2.712 -15.575 7.153 1.00 11.44 H new ATOM 0 HG3 GLN A 70 1.406 -14.418 7.000 1.00 11.44 H new ATOM 0 HE21 GLN A 70 2.585 -16.588 9.061 1.00 23.25 H new ATOM 0 HE22 GLN A 70 1.103 -17.217 9.789 1.00 23.25 H new ATOM 1072 N TYR A 71 0.433 -13.251 4.527 1.00 61.30 N ATOM 1073 CA TYR A 71 0.303 -11.806 4.671 1.00 42.32 C ATOM 1074 C TYR A 71 -1.156 -11.365 4.589 1.00 63.25 C ATOM 1075 O TYR A 71 -1.566 -10.419 5.262 1.00 53.24 O ATOM 1076 CB TYR A 71 1.142 -11.108 3.604 1.00 53.24 C ATOM 1077 CG TYR A 71 2.622 -11.379 3.761 1.00 75.24 C ATOM 1078 CD1 TYR A 71 3.215 -11.352 5.015 1.00 20.13 C ATOM 1079 CD2 TYR A 71 3.421 -11.675 2.665 1.00 52.43 C ATOM 1080 CE1 TYR A 71 4.561 -11.606 5.174 1.00 41.21 C ATOM 1081 CE2 TYR A 71 4.770 -11.933 2.819 1.00 73.24 C ATOM 1082 CZ TYR A 71 5.335 -11.896 4.074 1.00 35.43 C ATOM 1083 OH TYR A 71 6.677 -12.154 4.229 1.00 61.24 O ATOM 0 H TYR A 71 1.107 -13.541 3.819 1.00 61.30 H new ATOM 0 HA TYR A 71 0.670 -11.522 5.657 1.00 42.32 H new ATOM 0 HB2 TYR A 71 0.818 -11.439 2.617 1.00 53.24 H new ATOM 0 HB3 TYR A 71 0.966 -10.034 3.653 1.00 53.24 H new ATOM 0 HD1 TYR A 71 2.612 -11.128 5.882 1.00 20.13 H new ATOM 0 HD2 TYR A 71 2.982 -11.704 1.678 1.00 52.43 H new ATOM 0 HE1 TYR A 71 5.006 -11.577 6.158 1.00 41.21 H new ATOM 0 HE2 TYR A 71 5.379 -12.163 1.957 1.00 73.24 H new ATOM 0 HH TYR A 71 6.990 -11.762 5.071 1.00 61.24 H new ATOM 1093 N MET A 72 -1.939 -12.065 3.777 1.00 41.43 N ATOM 1094 CA MET A 72 -3.353 -11.748 3.630 1.00 1.31 C ATOM 1095 C MET A 72 -4.122 -12.190 4.870 1.00 40.52 C ATOM 1096 O MET A 72 -5.028 -11.499 5.335 1.00 41.34 O ATOM 1097 CB MET A 72 -3.928 -12.432 2.387 1.00 55.40 C ATOM 1098 CG MET A 72 -3.038 -12.315 1.160 1.00 53.41 C ATOM 1099 SD MET A 72 -3.975 -12.032 -0.356 1.00 34.55 S ATOM 1100 CE MET A 72 -2.769 -11.149 -1.343 1.00 71.41 C ATOM 0 H MET A 72 -1.620 -12.853 3.213 1.00 41.43 H new ATOM 0 HA MET A 72 -3.456 -10.669 3.514 1.00 1.31 H new ATOM 0 HB2 MET A 72 -4.093 -13.487 2.607 1.00 55.40 H new ATOM 0 HB3 MET A 72 -4.902 -11.998 2.162 1.00 55.40 H new ATOM 0 HG2 MET A 72 -2.333 -11.496 1.304 1.00 53.41 H new ATOM 0 HG3 MET A 72 -2.450 -13.227 1.054 1.00 53.41 H new ATOM 0 HE1 MET A 72 -3.284 -10.520 -2.069 1.00 71.41 H new ATOM 0 HE2 MET A 72 -2.154 -10.526 -0.694 1.00 71.41 H new ATOM 0 HE3 MET A 72 -2.135 -11.864 -1.867 1.00 71.41 H new ATOM 1110 N ARG A 73 -3.744 -13.349 5.401 1.00 63.44 N ATOM 1111 CA ARG A 73 -4.384 -13.899 6.591 1.00 61.34 C ATOM 1112 C ARG A 73 -3.833 -13.260 7.867 1.00 34.13 C ATOM 1113 O ARG A 73 -4.431 -13.381 8.936 1.00 60.33 O ATOM 1114 CB ARG A 73 -4.181 -15.413 6.641 1.00 24.01 C ATOM 1115 CG ARG A 73 -4.564 -16.116 5.351 1.00 4.22 C ATOM 1116 CD ARG A 73 -4.446 -17.623 5.482 1.00 73.23 C ATOM 1117 NE ARG A 73 -3.152 -18.027 6.028 1.00 43.02 N ATOM 1118 CZ ARG A 73 -2.901 -19.237 6.522 1.00 74.24 C ATOM 1119 NH1 ARG A 73 -3.852 -20.163 6.545 1.00 2.04 N ATOM 1120 NH2 ARG A 73 -1.696 -19.522 6.996 1.00 20.35 N ATOM 0 H ARG A 73 -2.994 -13.928 5.023 1.00 63.44 H new ATOM 0 HA ARG A 73 -5.449 -13.675 6.533 1.00 61.34 H new ATOM 0 HB2 ARG A 73 -3.135 -15.625 6.865 1.00 24.01 H new ATOM 0 HB3 ARG A 73 -4.772 -15.824 7.459 1.00 24.01 H new ATOM 0 HG2 ARG A 73 -5.587 -15.852 5.082 1.00 4.22 H new ATOM 0 HG3 ARG A 73 -3.922 -15.769 4.542 1.00 4.22 H new ATOM 0 HD2 ARG A 73 -5.243 -17.994 6.127 1.00 73.23 H new ATOM 0 HD3 ARG A 73 -4.586 -18.084 4.504 1.00 73.23 H new ATOM 0 HE ARG A 73 -2.397 -17.341 6.031 1.00 43.02 H new ATOM 0 HH11 ARG A 73 -4.781 -19.949 6.183 1.00 2.04 H new ATOM 0 HH12 ARG A 73 -3.653 -21.089 6.925 1.00 2.04 H new ATOM 0 HH21 ARG A 73 -0.962 -18.814 6.982 1.00 20.35 H new ATOM 0 HH22 ARG A 73 -1.503 -20.449 7.375 1.00 20.35 H new ATOM 1134 N THR A 74 -2.693 -12.582 7.751 1.00 4.40 N ATOM 1135 CA THR A 74 -2.071 -11.929 8.899 1.00 32.41 C ATOM 1136 C THR A 74 -2.373 -10.432 8.908 1.00 33.33 C ATOM 1137 O THR A 74 -2.169 -9.757 9.917 1.00 52.30 O ATOM 1138 CB THR A 74 -0.554 -12.140 8.882 1.00 42.33 C ATOM 1139 OG1 THR A 74 0.016 -11.571 7.719 1.00 13.12 O ATOM 1140 CG2 THR A 74 -0.136 -13.594 8.930 1.00 53.14 C ATOM 0 H THR A 74 -2.183 -12.471 6.875 1.00 4.40 H new ATOM 0 HA THR A 74 -2.488 -12.379 9.800 1.00 32.41 H new ATOM 0 HB THR A 74 -0.192 -11.652 9.787 1.00 42.33 H new ATOM 0 HG1 THR A 74 0.985 -11.714 7.726 1.00 13.12 H new ATOM 0 HG21 THR A 74 0.952 -13.661 8.915 1.00 53.14 H new ATOM 0 HG22 THR A 74 -0.515 -14.051 9.844 1.00 53.14 H new ATOM 0 HG23 THR A 74 -0.544 -14.119 8.066 1.00 53.14 H new ATOM 1148 N GLY A 75 -2.843 -9.912 7.775 1.00 61.03 N ATOM 1149 CA GLY A 75 -3.141 -8.497 7.681 1.00 4.40 C ATOM 1150 C GLY A 75 -4.615 -8.180 7.833 1.00 53.44 C ATOM 1151 O GLY A 75 -5.472 -9.042 7.633 1.00 51.44 O ATOM 0 H GLY A 75 -3.021 -10.446 6.925 1.00 61.03 H new ATOM 0 HA2 GLY A 75 -2.581 -7.964 8.449 1.00 4.40 H new ATOM 0 HA3 GLY A 75 -2.794 -8.124 6.717 1.00 4.40 H new ATOM 1155 N GLU A 76 -4.905 -6.930 8.183 1.00 22.02 N ATOM 1156 CA GLU A 76 -6.280 -6.475 8.359 1.00 31.45 C ATOM 1157 C GLU A 76 -6.712 -5.588 7.193 1.00 61.04 C ATOM 1158 O GLU A 76 -7.898 -5.302 7.025 1.00 43.34 O ATOM 1159 CB GLU A 76 -6.418 -5.704 9.674 1.00 34.14 C ATOM 1160 CG GLU A 76 -6.114 -6.540 10.906 1.00 51.34 C ATOM 1161 CD GLU A 76 -7.032 -6.222 12.069 1.00 1.33 C ATOM 1162 OE1 GLU A 76 -7.232 -5.023 12.357 1.00 12.01 O ATOM 1163 OE2 GLU A 76 -7.551 -7.172 12.693 1.00 73.11 O ATOM 0 H GLU A 76 -4.201 -6.211 8.351 1.00 22.02 H new ATOM 0 HA GLU A 76 -6.926 -7.352 8.387 1.00 31.45 H new ATOM 0 HB2 GLU A 76 -5.747 -4.845 9.654 1.00 34.14 H new ATOM 0 HB3 GLU A 76 -7.433 -5.314 9.752 1.00 34.14 H new ATOM 0 HG2 GLU A 76 -6.205 -7.597 10.655 1.00 51.34 H new ATOM 0 HG3 GLU A 76 -5.080 -6.372 11.208 1.00 51.34 H new ATOM 1170 N GLY A 77 -5.743 -5.153 6.392 1.00 3.42 N ATOM 1171 CA GLY A 77 -6.042 -4.303 5.255 1.00 70.41 C ATOM 1172 C GLY A 77 -5.015 -4.448 4.149 1.00 12.14 C ATOM 1173 O GLY A 77 -3.973 -5.074 4.343 1.00 61.34 O ATOM 0 H GLY A 77 -4.755 -5.375 6.511 1.00 3.42 H new ATOM 0 HA2 GLY A 77 -7.030 -4.552 4.867 1.00 70.41 H new ATOM 0 HA3 GLY A 77 -6.080 -3.263 5.580 1.00 70.41 H new ATOM 1177 N PHE A 78 -5.303 -3.872 2.987 1.00 60.14 N ATOM 1178 CA PHE A 78 -4.385 -3.952 1.856 1.00 63.13 C ATOM 1179 C PHE A 78 -4.287 -2.616 1.127 1.00 22.02 C ATOM 1180 O PHE A 78 -5.285 -1.918 0.949 1.00 23.21 O ATOM 1181 CB PHE A 78 -4.833 -5.045 0.884 1.00 4.53 C ATOM 1182 CG PHE A 78 -4.946 -6.401 1.521 1.00 42.11 C ATOM 1183 CD1 PHE A 78 -3.811 -7.089 1.919 1.00 31.15 C ATOM 1184 CD2 PHE A 78 -6.185 -6.985 1.726 1.00 4.00 C ATOM 1185 CE1 PHE A 78 -3.910 -8.334 2.509 1.00 32.11 C ATOM 1186 CE2 PHE A 78 -6.290 -8.230 2.315 1.00 62.43 C ATOM 1187 CZ PHE A 78 -5.151 -8.906 2.707 1.00 73.30 C ATOM 0 H PHE A 78 -6.159 -3.348 2.804 1.00 60.14 H new ATOM 0 HA PHE A 78 -3.398 -4.201 2.245 1.00 63.13 H new ATOM 0 HB2 PHE A 78 -5.798 -4.770 0.459 1.00 4.53 H new ATOM 0 HB3 PHE A 78 -4.125 -5.098 0.057 1.00 4.53 H new ATOM 0 HD1 PHE A 78 -2.838 -6.647 1.766 1.00 31.15 H new ATOM 0 HD2 PHE A 78 -7.079 -6.461 1.422 1.00 4.00 H new ATOM 0 HE1 PHE A 78 -3.018 -8.860 2.815 1.00 32.11 H new ATOM 0 HE2 PHE A 78 -7.262 -8.675 2.469 1.00 62.43 H new ATOM 0 HZ PHE A 78 -5.231 -9.880 3.167 1.00 73.30 H new ATOM 1197 N LEU A 79 -3.076 -2.269 0.703 1.00 62.13 N ATOM 1198 CA LEU A 79 -2.842 -1.021 -0.011 1.00 2.23 C ATOM 1199 C LEU A 79 -2.173 -1.285 -1.356 1.00 63.22 C ATOM 1200 O LEU A 79 -1.087 -1.861 -1.417 1.00 35.42 O ATOM 1201 CB LEU A 79 -1.975 -0.082 0.830 1.00 50.51 C ATOM 1202 CG LEU A 79 -2.470 1.364 0.900 1.00 43.24 C ATOM 1203 CD1 LEU A 79 -3.296 1.579 2.157 1.00 42.25 C ATOM 1204 CD2 LEU A 79 -1.296 2.331 0.859 1.00 21.03 C ATOM 0 H LEU A 79 -2.240 -2.837 0.842 1.00 62.13 H new ATOM 0 HA LEU A 79 -3.806 -0.546 -0.191 1.00 2.23 H new ATOM 0 HB2 LEU A 79 -1.913 -0.479 1.843 1.00 50.51 H new ATOM 0 HB3 LEU A 79 -0.963 -0.085 0.424 1.00 50.51 H new ATOM 0 HG LEU A 79 -3.103 1.557 0.034 1.00 43.24 H new ATOM 0 HD11 LEU A 79 -3.641 2.612 2.193 1.00 42.25 H new ATOM 0 HD12 LEU A 79 -4.156 0.909 2.146 1.00 42.25 H new ATOM 0 HD13 LEU A 79 -2.684 1.370 3.035 1.00 42.25 H new ATOM 0 HD21 LEU A 79 -1.666 3.355 0.910 1.00 21.03 H new ATOM 0 HD22 LEU A 79 -0.638 2.141 1.707 1.00 21.03 H new ATOM 0 HD23 LEU A 79 -0.742 2.191 -0.069 1.00 21.03 H new ATOM 1216 N CYS A 80 -2.829 -0.861 -2.431 1.00 21.02 N ATOM 1217 CA CYS A 80 -2.296 -1.053 -3.775 1.00 62.54 C ATOM 1218 C CYS A 80 -1.593 0.207 -4.268 1.00 51.34 C ATOM 1219 O CYS A 80 -2.221 1.252 -4.443 1.00 21.13 O ATOM 1220 CB CYS A 80 -3.417 -1.438 -4.742 1.00 11.44 C ATOM 1221 SG CYS A 80 -3.870 -3.188 -4.689 1.00 10.24 S ATOM 0 H CYS A 80 -3.729 -0.383 -2.398 1.00 21.02 H new ATOM 0 HA CYS A 80 -1.566 -1.862 -3.736 1.00 62.54 H new ATOM 0 HB2 CYS A 80 -4.299 -0.839 -4.516 1.00 11.44 H new ATOM 0 HB3 CYS A 80 -3.110 -1.184 -5.757 1.00 11.44 H new ATOM 0 HG CYS A 80 -4.827 -3.415 -5.539 1.00 10.24 H new ATOM 1227 N VAL A 81 -0.288 0.101 -4.492 1.00 60.25 N ATOM 1228 CA VAL A 81 0.500 1.233 -4.966 1.00 60.31 C ATOM 1229 C VAL A 81 0.935 1.030 -6.413 1.00 5.42 C ATOM 1230 O VAL A 81 1.603 0.049 -6.740 1.00 2.30 O ATOM 1231 CB VAL A 81 1.748 1.456 -4.090 1.00 0.44 C ATOM 1232 CG1 VAL A 81 2.515 2.687 -4.550 1.00 65.12 C ATOM 1233 CG2 VAL A 81 1.355 1.582 -2.626 1.00 13.30 C ATOM 0 H VAL A 81 0.246 -0.757 -4.353 1.00 60.25 H new ATOM 0 HA VAL A 81 -0.139 2.114 -4.902 1.00 60.31 H new ATOM 0 HB VAL A 81 2.402 0.590 -4.196 1.00 0.44 H new ATOM 0 HG11 VAL A 81 3.392 2.826 -3.918 1.00 65.12 H new ATOM 0 HG12 VAL A 81 2.831 2.553 -5.585 1.00 65.12 H new ATOM 0 HG13 VAL A 81 1.872 3.564 -4.477 1.00 65.12 H new ATOM 0 HG21 VAL A 81 2.248 1.739 -2.022 1.00 13.30 H new ATOM 0 HG22 VAL A 81 0.680 2.429 -2.502 1.00 13.30 H new ATOM 0 HG23 VAL A 81 0.855 0.669 -2.304 1.00 13.30 H new ATOM 1243 N PHE A 82 0.554 1.966 -7.275 1.00 42.03 N ATOM 1244 CA PHE A 82 0.908 1.893 -8.687 1.00 4.43 C ATOM 1245 C PHE A 82 1.372 3.253 -9.201 1.00 61.30 C ATOM 1246 O PHE A 82 0.829 4.289 -8.819 1.00 1.14 O ATOM 1247 CB PHE A 82 -0.285 1.396 -9.510 1.00 5.12 C ATOM 1248 CG PHE A 82 -1.381 2.414 -9.665 1.00 20.52 C ATOM 1249 CD1 PHE A 82 -2.219 2.717 -8.605 1.00 32.23 C ATOM 1250 CD2 PHE A 82 -1.571 3.066 -10.873 1.00 51.10 C ATOM 1251 CE1 PHE A 82 -3.226 3.652 -8.745 1.00 3.42 C ATOM 1252 CE2 PHE A 82 -2.577 4.003 -11.019 1.00 41.21 C ATOM 1253 CZ PHE A 82 -3.405 4.296 -9.954 1.00 21.42 C ATOM 0 H PHE A 82 0.000 2.784 -7.021 1.00 42.03 H new ATOM 0 HA PHE A 82 1.730 1.186 -8.796 1.00 4.43 H new ATOM 0 HB2 PHE A 82 0.066 1.100 -10.499 1.00 5.12 H new ATOM 0 HB3 PHE A 82 -0.695 0.504 -9.037 1.00 5.12 H new ATOM 0 HD1 PHE A 82 -2.084 2.216 -7.658 1.00 32.23 H new ATOM 0 HD2 PHE A 82 -0.926 2.840 -11.709 1.00 51.10 H new ATOM 0 HE1 PHE A 82 -3.873 3.879 -7.910 1.00 3.42 H new ATOM 0 HE2 PHE A 82 -2.715 4.505 -11.965 1.00 41.21 H new ATOM 0 HZ PHE A 82 -4.192 5.028 -10.066 1.00 21.42 H new ATOM 1263 N ALA A 83 2.377 3.241 -10.068 1.00 11.35 N ATOM 1264 CA ALA A 83 2.911 4.475 -10.631 1.00 10.43 C ATOM 1265 C ALA A 83 2.139 4.886 -11.880 1.00 60.31 C ATOM 1266 O ALA A 83 2.029 4.118 -12.836 1.00 73.35 O ATOM 1267 CB ALA A 83 4.389 4.313 -10.950 1.00 71.25 C ATOM 0 H ALA A 83 2.838 2.392 -10.396 1.00 11.35 H new ATOM 0 HA ALA A 83 2.796 5.265 -9.888 1.00 10.43 H new ATOM 0 HB1 ALA A 83 4.775 5.242 -11.370 1.00 71.25 H new ATOM 0 HB2 ALA A 83 4.934 4.073 -10.037 1.00 71.25 H new ATOM 0 HB3 ALA A 83 4.519 3.507 -11.672 1.00 71.25 H new ATOM 1273 N ILE A 84 1.606 6.104 -11.864 1.00 63.13 N ATOM 1274 CA ILE A 84 0.844 6.622 -12.995 1.00 44.32 C ATOM 1275 C ILE A 84 1.666 6.583 -14.276 1.00 61.30 C ATOM 1276 O ILE A 84 1.128 6.408 -15.369 1.00 22.44 O ATOM 1277 CB ILE A 84 0.381 8.068 -12.740 1.00 32.00 C ATOM 1278 CG1 ILE A 84 1.552 8.928 -12.264 1.00 34.00 C ATOM 1279 CG2 ILE A 84 -0.739 8.086 -11.717 1.00 64.12 C ATOM 1280 CD1 ILE A 84 1.382 10.401 -12.565 1.00 24.03 C ATOM 0 H ILE A 84 1.688 6.751 -11.080 1.00 63.13 H new ATOM 0 HA ILE A 84 -0.030 5.981 -13.109 1.00 44.32 H new ATOM 0 HB ILE A 84 0.007 8.484 -13.675 1.00 32.00 H new ATOM 0 HG12 ILE A 84 1.675 8.797 -11.189 1.00 34.00 H new ATOM 0 HG13 ILE A 84 2.468 8.573 -12.735 1.00 34.00 H new ATOM 0 HG21 ILE A 84 -1.058 9.114 -11.545 1.00 64.12 H new ATOM 0 HG22 ILE A 84 -1.581 7.502 -12.089 1.00 64.12 H new ATOM 0 HG23 ILE A 84 -0.384 7.655 -10.781 1.00 64.12 H new ATOM 0 HD11 ILE A 84 2.250 10.950 -12.199 1.00 24.03 H new ATOM 0 HD12 ILE A 84 1.290 10.544 -13.642 1.00 24.03 H new ATOM 0 HD13 ILE A 84 0.484 10.772 -12.071 1.00 24.03 H new ATOM 1292 N ASN A 85 2.975 6.746 -14.131 1.00 2.42 N ATOM 1293 CA ASN A 85 3.880 6.729 -15.274 1.00 51.24 C ATOM 1294 C ASN A 85 3.951 5.337 -15.895 1.00 23.53 C ATOM 1295 O ASN A 85 4.271 5.189 -17.074 1.00 51.13 O ATOM 1296 CB ASN A 85 5.278 7.184 -14.850 1.00 25.10 C ATOM 1297 CG ASN A 85 5.974 7.993 -15.927 1.00 55.13 C ATOM 1298 OD1 ASN A 85 6.518 9.142 -15.545 1.00 23.04 O flip ATOM 1299 ND2 ASN A 85 6.022 7.590 -17.089 1.00 62.23 N flip ATOM 0 H ASN A 85 3.434 6.892 -13.232 1.00 2.42 H new ATOM 0 HA ASN A 85 3.491 7.419 -16.023 1.00 51.24 H new ATOM 0 HB2 ASN A 85 5.203 7.782 -13.942 1.00 25.10 H new ATOM 0 HB3 ASN A 85 5.883 6.311 -14.607 1.00 25.10 H new ATOM 0 HD21 ASN A 85 5.590 6.700 -17.338 1.00 62.23 H new ATOM 0 HD22 ASN A 85 6.494 8.146 -17.802 1.00 62.23 H new ATOM 1306 N ASN A 86 3.652 4.317 -15.094 1.00 24.22 N ATOM 1307 CA ASN A 86 3.684 2.938 -15.569 1.00 12.42 C ATOM 1308 C ASN A 86 2.282 2.337 -15.589 1.00 72.10 C ATOM 1309 O ASN A 86 1.738 1.969 -14.548 1.00 23.10 O ATOM 1310 CB ASN A 86 4.600 2.094 -14.682 1.00 3.43 C ATOM 1311 CG ASN A 86 5.340 1.027 -15.465 1.00 43.00 C ATOM 1312 OD1 ASN A 86 5.371 1.053 -16.695 1.00 33.32 O ATOM 1313 ND2 ASN A 86 5.941 0.081 -14.753 1.00 40.42 N ATOM 0 H ASN A 86 3.385 4.420 -14.115 1.00 24.22 H new ATOM 0 HA ASN A 86 4.074 2.939 -16.587 1.00 12.42 H new ATOM 0 HB2 ASN A 86 5.322 2.744 -14.187 1.00 3.43 H new ATOM 0 HB3 ASN A 86 4.008 1.621 -13.899 1.00 3.43 H new ATOM 0 HD21 ASN A 86 6.455 -0.664 -15.225 1.00 40.42 H new ATOM 0 HD22 ASN A 86 5.889 0.099 -13.734 1.00 40.42 H new ATOM 1320 N THR A 87 1.703 2.238 -16.782 1.00 73.41 N ATOM 1321 CA THR A 87 0.365 1.680 -16.938 1.00 42.34 C ATOM 1322 C THR A 87 0.336 0.206 -16.539 1.00 23.53 C ATOM 1323 O THR A 87 -0.714 -0.329 -16.183 1.00 14.12 O ATOM 1324 CB THR A 87 -0.110 1.836 -18.384 1.00 72.40 C ATOM 1325 OG1 THR A 87 0.278 3.094 -18.906 1.00 11.24 O ATOM 1326 CG2 THR A 87 -1.611 1.717 -18.537 1.00 50.44 C ATOM 0 H THR A 87 2.140 2.537 -17.654 1.00 73.41 H new ATOM 0 HA THR A 87 -0.307 2.229 -16.279 1.00 42.34 H new ATOM 0 HB THR A 87 0.360 1.020 -18.932 1.00 72.40 H new ATOM 0 HG1 THR A 87 0.316 3.752 -18.180 1.00 11.24 H new ATOM 0 HG21 THR A 87 -1.880 1.837 -19.586 1.00 50.44 H new ATOM 0 HG22 THR A 87 -1.936 0.736 -18.189 1.00 50.44 H new ATOM 0 HG23 THR A 87 -2.100 2.492 -17.946 1.00 50.44 H new ATOM 1334 N LYS A 88 1.495 -0.444 -16.599 1.00 60.54 N ATOM 1335 CA LYS A 88 1.602 -1.850 -16.243 1.00 15.11 C ATOM 1336 C LYS A 88 1.201 -2.071 -14.787 1.00 0.02 C ATOM 1337 O LYS A 88 0.468 -3.007 -14.469 1.00 62.31 O ATOM 1338 CB LYS A 88 3.034 -2.335 -16.486 1.00 60.34 C ATOM 1339 CG LYS A 88 3.359 -3.655 -15.809 1.00 11.34 C ATOM 1340 CD LYS A 88 4.081 -4.607 -16.749 1.00 34.31 C ATOM 1341 CE LYS A 88 5.354 -3.988 -17.300 1.00 60.52 C ATOM 1342 NZ LYS A 88 6.531 -4.882 -17.121 1.00 44.33 N ATOM 0 H LYS A 88 2.373 -0.016 -16.892 1.00 60.54 H new ATOM 0 HA LYS A 88 0.920 -2.425 -16.870 1.00 15.11 H new ATOM 0 HB2 LYS A 88 3.195 -2.439 -17.559 1.00 60.34 H new ATOM 0 HB3 LYS A 88 3.730 -1.575 -16.131 1.00 60.34 H new ATOM 0 HG2 LYS A 88 3.979 -3.471 -14.931 1.00 11.34 H new ATOM 0 HG3 LYS A 88 2.438 -4.120 -15.457 1.00 11.34 H new ATOM 0 HD2 LYS A 88 4.323 -5.529 -16.220 1.00 34.31 H new ATOM 0 HD3 LYS A 88 3.420 -4.877 -17.573 1.00 34.31 H new ATOM 0 HE2 LYS A 88 5.222 -3.770 -18.360 1.00 60.52 H new ATOM 0 HE3 LYS A 88 5.541 -3.038 -16.800 1.00 60.52 H new ATOM 0 HZ1 LYS A 88 7.379 -4.422 -17.510 1.00 44.33 H new ATOM 0 HZ2 LYS A 88 6.673 -5.070 -16.108 1.00 44.33 H new ATOM 0 HZ3 LYS A 88 6.364 -5.779 -17.619 1.00 44.33 H new ATOM 1356 N SER A 89 1.686 -1.201 -13.906 1.00 4.13 N ATOM 1357 CA SER A 89 1.378 -1.300 -12.483 1.00 34.10 C ATOM 1358 C SER A 89 -0.129 -1.271 -12.251 1.00 31.14 C ATOM 1359 O SER A 89 -0.645 -1.958 -11.369 1.00 2.43 O ATOM 1360 CB SER A 89 2.047 -0.159 -11.715 1.00 51.02 C ATOM 1361 OG SER A 89 3.420 -0.054 -12.050 1.00 34.41 O ATOM 0 H SER A 89 2.294 -0.420 -14.152 1.00 4.13 H new ATOM 0 HA SER A 89 1.766 -2.251 -12.117 1.00 34.10 H new ATOM 0 HB2 SER A 89 1.542 0.780 -11.940 1.00 51.02 H new ATOM 0 HB3 SER A 89 1.943 -0.328 -10.643 1.00 51.02 H new ATOM 0 HG SER A 89 3.746 0.840 -11.816 1.00 34.41 H new ATOM 1367 N PHE A 90 -0.829 -0.472 -13.050 1.00 23.20 N ATOM 1368 CA PHE A 90 -2.277 -0.355 -12.934 1.00 72.51 C ATOM 1369 C PHE A 90 -2.954 -1.695 -13.204 1.00 11.01 C ATOM 1370 O PHE A 90 -4.029 -1.977 -12.674 1.00 35.42 O ATOM 1371 CB PHE A 90 -2.802 0.701 -13.910 1.00 12.20 C ATOM 1372 CG PHE A 90 -4.243 1.063 -13.686 1.00 40.14 C ATOM 1373 CD1 PHE A 90 -4.726 1.281 -12.406 1.00 2.41 C ATOM 1374 CD2 PHE A 90 -5.114 1.184 -14.757 1.00 12.23 C ATOM 1375 CE1 PHE A 90 -6.051 1.615 -12.197 1.00 54.53 C ATOM 1376 CE2 PHE A 90 -6.440 1.517 -14.555 1.00 44.43 C ATOM 1377 CZ PHE A 90 -6.909 1.733 -13.273 1.00 5.04 C ATOM 0 H PHE A 90 -0.417 0.104 -13.784 1.00 23.20 H new ATOM 0 HA PHE A 90 -2.513 -0.049 -11.915 1.00 72.51 H new ATOM 0 HB2 PHE A 90 -2.192 1.600 -13.822 1.00 12.20 H new ATOM 0 HB3 PHE A 90 -2.683 0.333 -14.929 1.00 12.20 H new ATOM 0 HD1 PHE A 90 -4.059 1.189 -11.561 1.00 2.41 H new ATOM 0 HD2 PHE A 90 -4.753 1.016 -15.761 1.00 12.23 H new ATOM 0 HE1 PHE A 90 -6.415 1.783 -11.194 1.00 54.53 H new ATOM 0 HE2 PHE A 90 -7.109 1.608 -15.398 1.00 44.43 H new ATOM 0 HZ PHE A 90 -7.945 1.994 -13.113 1.00 5.04 H new ATOM 1387 N GLU A 91 -2.317 -2.518 -14.030 1.00 33.52 N ATOM 1388 CA GLU A 91 -2.856 -3.830 -14.371 1.00 35.20 C ATOM 1389 C GLU A 91 -2.723 -4.794 -13.197 1.00 75.20 C ATOM 1390 O GLU A 91 -3.552 -5.687 -13.017 1.00 62.34 O ATOM 1391 CB GLU A 91 -2.136 -4.397 -15.596 1.00 41.54 C ATOM 1392 CG GLU A 91 -1.956 -3.387 -16.718 1.00 14.44 C ATOM 1393 CD GLU A 91 -1.439 -4.020 -17.995 1.00 21.41 C ATOM 1394 OE1 GLU A 91 -0.298 -4.527 -17.986 1.00 34.05 O ATOM 1395 OE2 GLU A 91 -2.175 -4.008 -19.004 1.00 24.05 O ATOM 0 H GLU A 91 -1.426 -2.300 -14.476 1.00 33.52 H new ATOM 0 HA GLU A 91 -3.915 -3.712 -14.603 1.00 35.20 H new ATOM 0 HB2 GLU A 91 -1.157 -4.768 -15.292 1.00 41.54 H new ATOM 0 HB3 GLU A 91 -2.698 -5.251 -15.974 1.00 41.54 H new ATOM 0 HG2 GLU A 91 -2.910 -2.899 -16.919 1.00 14.44 H new ATOM 0 HG3 GLU A 91 -1.262 -2.611 -16.395 1.00 14.44 H new ATOM 1402 N ASP A 92 -1.675 -4.609 -12.400 1.00 13.31 N ATOM 1403 CA ASP A 92 -1.434 -5.464 -11.243 1.00 0.43 C ATOM 1404 C ASP A 92 -2.439 -5.172 -10.132 1.00 71.43 C ATOM 1405 O ASP A 92 -2.811 -6.064 -9.369 1.00 71.34 O ATOM 1406 CB ASP A 92 -0.009 -5.265 -10.723 1.00 41.51 C ATOM 1407 CG ASP A 92 1.039 -5.628 -11.757 1.00 10.20 C ATOM 1408 OD1 ASP A 92 1.456 -6.805 -11.792 1.00 52.01 O ATOM 1409 OD2 ASP A 92 1.442 -4.735 -12.532 1.00 53.33 O ATOM 0 H ASP A 92 -0.980 -3.875 -12.534 1.00 13.31 H new ATOM 0 HA ASP A 92 -1.557 -6.501 -11.557 1.00 0.43 H new ATOM 0 HB2 ASP A 92 0.124 -4.225 -10.424 1.00 41.51 H new ATOM 0 HB3 ASP A 92 0.138 -5.874 -9.831 1.00 41.51 H new ATOM 1414 N ILE A 93 -2.876 -3.921 -10.048 1.00 35.02 N ATOM 1415 CA ILE A 93 -3.840 -3.517 -9.032 1.00 63.21 C ATOM 1416 C ILE A 93 -5.152 -4.280 -9.190 1.00 50.22 C ATOM 1417 O ILE A 93 -5.874 -4.502 -8.218 1.00 74.23 O ATOM 1418 CB ILE A 93 -4.126 -2.002 -9.095 1.00 13.10 C ATOM 1419 CG1 ILE A 93 -2.826 -1.202 -9.053 1.00 25.22 C ATOM 1420 CG2 ILE A 93 -5.029 -1.580 -7.952 1.00 20.42 C ATOM 1421 CD1 ILE A 93 -1.888 -1.614 -7.938 1.00 23.11 C ATOM 0 H ILE A 93 -2.578 -3.170 -10.670 1.00 35.02 H new ATOM 0 HA ILE A 93 -3.398 -3.753 -8.064 1.00 63.21 H new ATOM 0 HB ILE A 93 -4.632 -1.796 -10.038 1.00 13.10 H new ATOM 0 HG12 ILE A 93 -2.311 -1.313 -10.007 1.00 25.22 H new ATOM 0 HG13 ILE A 93 -3.065 -0.144 -8.941 1.00 25.22 H new ATOM 0 HG21 ILE A 93 -5.218 -0.508 -8.015 1.00 20.42 H new ATOM 0 HG22 ILE A 93 -5.974 -2.120 -8.016 1.00 20.42 H new ATOM 0 HG23 ILE A 93 -4.545 -1.808 -7.002 1.00 20.42 H new ATOM 0 HD11 ILE A 93 -0.988 -1.000 -7.974 1.00 23.11 H new ATOM 0 HD12 ILE A 93 -2.383 -1.476 -6.977 1.00 23.11 H new ATOM 0 HD13 ILE A 93 -1.617 -2.663 -8.059 1.00 23.11 H new ATOM 1433 N HIS A 94 -5.453 -4.681 -10.421 1.00 72.34 N ATOM 1434 CA HIS A 94 -6.676 -5.421 -10.708 1.00 32.24 C ATOM 1435 C HIS A 94 -6.574 -6.855 -10.193 1.00 42.25 C ATOM 1436 O HIS A 94 -7.418 -7.309 -9.421 1.00 75.41 O ATOM 1437 CB HIS A 94 -6.953 -5.418 -12.215 1.00 71.30 C ATOM 1438 CG HIS A 94 -8.041 -6.359 -12.635 1.00 25.25 C ATOM 1439 ND1 HIS A 94 -9.382 -6.077 -12.482 1.00 72.13 N ATOM 1440 CD2 HIS A 94 -7.979 -7.586 -13.205 1.00 30.11 C ATOM 1441 CE1 HIS A 94 -10.097 -7.091 -12.938 1.00 11.34 C ATOM 1442 NE2 HIS A 94 -9.270 -8.018 -13.382 1.00 5.23 N ATOM 0 H HIS A 94 -4.866 -4.506 -11.236 1.00 72.34 H new ATOM 0 HA HIS A 94 -7.503 -4.931 -10.195 1.00 32.24 H new ATOM 0 HB2 HIS A 94 -7.221 -4.407 -12.523 1.00 71.30 H new ATOM 0 HB3 HIS A 94 -6.036 -5.679 -12.743 1.00 71.30 H new ATOM 0 HD1 HIS A 94 -9.763 -5.220 -12.080 1.00 72.13 H new ATOM 0 HD2 HIS A 94 -7.081 -8.124 -13.471 1.00 30.11 H new ATOM 0 HE1 HIS A 94 -11.175 -7.150 -12.946 1.00 11.34 H new ATOM 1451 N GLN A 95 -5.537 -7.563 -10.629 1.00 72.50 N ATOM 1452 CA GLN A 95 -5.327 -8.945 -10.215 1.00 31.30 C ATOM 1453 C GLN A 95 -5.018 -9.030 -8.724 1.00 34.43 C ATOM 1454 O GLN A 95 -5.315 -10.034 -8.076 1.00 71.54 O ATOM 1455 CB GLN A 95 -4.191 -9.575 -11.021 1.00 60.54 C ATOM 1456 CG GLN A 95 -2.873 -8.831 -10.897 1.00 13.02 C ATOM 1457 CD GLN A 95 -2.020 -9.342 -9.753 1.00 33.01 C ATOM 1458 OE1 GLN A 95 -2.193 -10.470 -9.290 1.00 0.02 O ATOM 1459 NE2 GLN A 95 -1.093 -8.512 -9.289 1.00 43.42 N ATOM 0 H GLN A 95 -4.829 -7.202 -11.269 1.00 72.50 H new ATOM 0 HA GLN A 95 -6.248 -9.496 -10.406 1.00 31.30 H new ATOM 0 HB2 GLN A 95 -4.050 -10.604 -10.691 1.00 60.54 H new ATOM 0 HB3 GLN A 95 -4.480 -9.613 -12.071 1.00 60.54 H new ATOM 0 HG2 GLN A 95 -2.317 -8.926 -11.830 1.00 13.02 H new ATOM 0 HG3 GLN A 95 -3.072 -7.769 -10.751 1.00 13.02 H new ATOM 0 HE21 GLN A 95 -0.984 -7.586 -9.703 1.00 43.42 H new ATOM 0 HE22 GLN A 95 -0.490 -8.800 -8.519 1.00 43.42 H new ATOM 1468 N TYR A 96 -4.420 -7.973 -8.184 1.00 21.30 N ATOM 1469 CA TYR A 96 -4.072 -7.932 -6.768 1.00 70.10 C ATOM 1470 C TYR A 96 -5.310 -8.118 -5.896 1.00 71.41 C ATOM 1471 O TYR A 96 -5.276 -8.840 -4.899 1.00 10.12 O ATOM 1472 CB TYR A 96 -3.385 -6.608 -6.427 1.00 63.40 C ATOM 1473 CG TYR A 96 -1.875 -6.680 -6.476 1.00 72.10 C ATOM 1474 CD1 TYR A 96 -1.184 -7.665 -5.781 1.00 10.20 C ATOM 1475 CD2 TYR A 96 -1.140 -5.763 -7.218 1.00 21.34 C ATOM 1476 CE1 TYR A 96 0.196 -7.734 -5.824 1.00 63.02 C ATOM 1477 CE2 TYR A 96 0.240 -5.826 -7.266 1.00 3.33 C ATOM 1478 CZ TYR A 96 0.902 -6.813 -6.568 1.00 3.42 C ATOM 1479 OH TYR A 96 2.276 -6.879 -6.613 1.00 63.20 O ATOM 0 H TYR A 96 -4.166 -7.134 -8.705 1.00 21.30 H new ATOM 0 HA TYR A 96 -3.383 -8.752 -6.566 1.00 70.10 H new ATOM 0 HB2 TYR A 96 -3.727 -5.841 -7.122 1.00 63.40 H new ATOM 0 HB3 TYR A 96 -3.693 -6.294 -5.430 1.00 63.40 H new ATOM 0 HD1 TYR A 96 -1.734 -8.389 -5.198 1.00 10.20 H new ATOM 0 HD2 TYR A 96 -1.656 -4.988 -7.766 1.00 21.34 H new ATOM 0 HE1 TYR A 96 0.718 -8.505 -5.278 1.00 63.02 H new ATOM 0 HE2 TYR A 96 0.796 -5.106 -7.847 1.00 3.33 H new ATOM 0 HH TYR A 96 2.652 -6.389 -5.852 1.00 63.20 H new ATOM 1489 N ARG A 97 -6.403 -7.465 -6.278 1.00 54.24 N ATOM 1490 CA ARG A 97 -7.652 -7.562 -5.531 1.00 2.52 C ATOM 1491 C ARG A 97 -8.206 -8.982 -5.587 1.00 15.23 C ATOM 1492 O ARG A 97 -8.811 -9.460 -4.628 1.00 10.31 O ATOM 1493 CB ARG A 97 -8.682 -6.577 -6.086 1.00 54.12 C ATOM 1494 CG ARG A 97 -9.688 -6.101 -5.050 1.00 54.51 C ATOM 1495 CD ARG A 97 -10.003 -4.621 -5.212 1.00 0.14 C ATOM 1496 NE ARG A 97 -9.048 -3.776 -4.497 1.00 42.11 N ATOM 1497 CZ ARG A 97 -8.020 -3.154 -5.073 1.00 2.22 C ATOM 1498 NH1 ARG A 97 -7.800 -3.273 -6.377 1.00 33.44 N ATOM 1499 NH2 ARG A 97 -7.206 -2.407 -4.339 1.00 40.51 N ATOM 0 H ARG A 97 -6.449 -6.863 -7.100 1.00 54.24 H new ATOM 0 HA ARG A 97 -7.446 -7.310 -4.491 1.00 2.52 H new ATOM 0 HB2 ARG A 97 -8.161 -5.713 -6.498 1.00 54.12 H new ATOM 0 HB3 ARG A 97 -9.217 -7.049 -6.910 1.00 54.12 H new ATOM 0 HG2 ARG A 97 -10.606 -6.681 -5.141 1.00 54.51 H new ATOM 0 HG3 ARG A 97 -9.294 -6.282 -4.050 1.00 54.51 H new ATOM 0 HD2 ARG A 97 -9.994 -4.362 -6.271 1.00 0.14 H new ATOM 0 HD3 ARG A 97 -11.009 -4.422 -4.844 1.00 0.14 H new ATOM 0 HE ARG A 97 -9.177 -3.655 -3.492 1.00 42.11 H new ATOM 0 HH11 ARG A 97 -8.421 -3.845 -6.949 1.00 33.44 H new ATOM 0 HH12 ARG A 97 -7.010 -2.792 -6.807 1.00 33.44 H new ATOM 0 HH21 ARG A 97 -7.368 -2.310 -3.337 1.00 40.51 H new ATOM 0 HH22 ARG A 97 -6.418 -1.930 -4.777 1.00 40.51 H new ATOM 1513 N GLU A 98 -7.993 -9.652 -6.715 1.00 32.21 N ATOM 1514 CA GLU A 98 -8.468 -11.019 -6.893 1.00 63.14 C ATOM 1515 C GLU A 98 -7.871 -11.939 -5.833 1.00 63.34 C ATOM 1516 O GLU A 98 -8.576 -12.748 -5.229 1.00 33.32 O ATOM 1517 CB GLU A 98 -8.111 -11.529 -8.290 1.00 3.03 C ATOM 1518 CG GLU A 98 -8.754 -10.730 -9.412 1.00 73.52 C ATOM 1519 CD GLU A 98 -9.801 -11.524 -10.170 1.00 15.24 C ATOM 1520 OE1 GLU A 98 -10.444 -12.399 -9.553 1.00 73.43 O ATOM 1521 OE2 GLU A 98 -9.978 -11.270 -11.380 1.00 33.44 O ATOM 0 H GLU A 98 -7.495 -9.270 -7.519 1.00 32.21 H new ATOM 0 HA GLU A 98 -9.552 -11.020 -6.783 1.00 63.14 H new ATOM 0 HB2 GLU A 98 -7.028 -11.503 -8.411 1.00 3.03 H new ATOM 0 HB3 GLU A 98 -8.417 -12.572 -8.376 1.00 3.03 H new ATOM 0 HG2 GLU A 98 -9.214 -9.833 -8.997 1.00 73.52 H new ATOM 0 HG3 GLU A 98 -7.981 -10.399 -10.106 1.00 73.52 H new ATOM 1528 N GLN A 99 -6.568 -11.803 -5.607 1.00 11.45 N ATOM 1529 CA GLN A 99 -5.876 -12.616 -4.615 1.00 44.35 C ATOM 1530 C GLN A 99 -6.407 -12.322 -3.216 1.00 12.54 C ATOM 1531 O GLN A 99 -6.581 -13.229 -2.402 1.00 55.42 O ATOM 1532 CB GLN A 99 -4.369 -12.353 -4.673 1.00 24.31 C ATOM 1533 CG GLN A 99 -3.551 -13.582 -5.032 1.00 71.43 C ATOM 1534 CD GLN A 99 -2.962 -14.265 -3.813 1.00 13.34 C ATOM 1535 OE1 GLN A 99 -3.621 -14.397 -2.782 1.00 54.51 O ATOM 1536 NE2 GLN A 99 -1.714 -14.703 -3.926 1.00 12.21 N ATOM 0 H GLN A 99 -5.971 -11.137 -6.098 1.00 11.45 H new ATOM 0 HA GLN A 99 -6.060 -13.666 -4.841 1.00 44.35 H new ATOM 0 HB2 GLN A 99 -4.173 -11.570 -5.405 1.00 24.31 H new ATOM 0 HB3 GLN A 99 -4.037 -11.975 -3.706 1.00 24.31 H new ATOM 0 HG2 GLN A 99 -4.181 -14.289 -5.571 1.00 71.43 H new ATOM 0 HG3 GLN A 99 -2.746 -13.294 -5.707 1.00 71.43 H new ATOM 0 HE21 GLN A 99 -1.205 -14.572 -4.800 1.00 12.21 H new ATOM 0 HE22 GLN A 99 -1.264 -15.170 -3.139 1.00 12.21 H new ATOM 1545 N ILE A 100 -6.662 -11.046 -2.947 1.00 51.32 N ATOM 1546 CA ILE A 100 -7.176 -10.622 -1.651 1.00 22.55 C ATOM 1547 C ILE A 100 -8.543 -11.243 -1.373 1.00 34.05 C ATOM 1548 O ILE A 100 -8.753 -11.862 -0.330 1.00 42.12 O ATOM 1549 CB ILE A 100 -7.286 -9.084 -1.579 1.00 15.30 C ATOM 1550 CG1 ILE A 100 -5.896 -8.454 -1.666 1.00 11.40 C ATOM 1551 CG2 ILE A 100 -7.991 -8.645 -0.303 1.00 41.41 C ATOM 1552 CD1 ILE A 100 -5.923 -6.972 -1.968 1.00 13.31 C ATOM 0 H ILE A 100 -6.520 -10.286 -3.612 1.00 51.32 H new ATOM 0 HA ILE A 100 -6.472 -10.965 -0.893 1.00 22.55 H new ATOM 0 HB ILE A 100 -7.882 -8.743 -2.425 1.00 15.30 H new ATOM 0 HG12 ILE A 100 -5.373 -8.615 -0.723 1.00 11.40 H new ATOM 0 HG13 ILE A 100 -5.322 -8.964 -2.440 1.00 11.40 H new ATOM 0 HG21 ILE A 100 -8.055 -7.557 -0.278 1.00 41.41 H new ATOM 0 HG22 ILE A 100 -8.995 -9.068 -0.278 1.00 41.41 H new ATOM 0 HG23 ILE A 100 -7.428 -8.995 0.562 1.00 41.41 H new ATOM 0 HD11 ILE A 100 -4.903 -6.592 -2.015 1.00 13.31 H new ATOM 0 HD12 ILE A 100 -6.417 -6.805 -2.925 1.00 13.31 H new ATOM 0 HD13 ILE A 100 -6.469 -6.450 -1.182 1.00 13.31 H new ATOM 1564 N LYS A 101 -9.469 -11.068 -2.310 1.00 50.33 N ATOM 1565 CA LYS A 101 -10.818 -11.606 -2.164 1.00 74.12 C ATOM 1566 C LYS A 101 -10.787 -13.104 -1.871 1.00 34.52 C ATOM 1567 O LYS A 101 -11.617 -13.615 -1.120 1.00 13.13 O ATOM 1568 CB LYS A 101 -11.636 -11.335 -3.427 1.00 15.33 C ATOM 1569 CG LYS A 101 -12.100 -9.892 -3.550 1.00 73.32 C ATOM 1570 CD LYS A 101 -12.917 -9.674 -4.812 1.00 13.21 C ATOM 1571 CE LYS A 101 -12.837 -8.231 -5.283 1.00 51.25 C ATOM 1572 NZ LYS A 101 -14.121 -7.768 -5.878 1.00 4.33 N ATOM 0 H LYS A 101 -9.311 -10.558 -3.179 1.00 50.33 H new ATOM 0 HA LYS A 101 -11.289 -11.105 -1.319 1.00 74.12 H new ATOM 0 HB2 LYS A 101 -11.037 -11.592 -4.301 1.00 15.33 H new ATOM 0 HB3 LYS A 101 -12.507 -11.990 -3.434 1.00 15.33 H new ATOM 0 HG2 LYS A 101 -12.698 -9.626 -2.678 1.00 73.32 H new ATOM 0 HG3 LYS A 101 -11.234 -9.230 -3.557 1.00 73.32 H new ATOM 0 HD2 LYS A 101 -12.556 -10.336 -5.599 1.00 13.21 H new ATOM 0 HD3 LYS A 101 -13.957 -9.940 -4.624 1.00 13.21 H new ATOM 0 HE2 LYS A 101 -12.574 -7.589 -4.442 1.00 51.25 H new ATOM 0 HE3 LYS A 101 -12.040 -8.133 -6.020 1.00 51.25 H new ATOM 0 HZ1 LYS A 101 -13.927 -7.062 -6.617 1.00 4.33 H new ATOM 0 HZ2 LYS A 101 -14.622 -8.578 -6.296 1.00 4.33 H new ATOM 0 HZ3 LYS A 101 -14.712 -7.340 -5.137 1.00 4.33 H new ATOM 1586 N ARG A 102 -9.828 -13.804 -2.469 1.00 10.44 N ATOM 1587 CA ARG A 102 -9.696 -15.240 -2.268 1.00 64.25 C ATOM 1588 C ARG A 102 -9.428 -15.565 -0.802 1.00 31.12 C ATOM 1589 O ARG A 102 -10.194 -16.290 -0.167 1.00 70.21 O ATOM 1590 CB ARG A 102 -8.570 -15.793 -3.141 1.00 10.45 C ATOM 1591 CG ARG A 102 -8.930 -17.096 -3.827 1.00 54.43 C ATOM 1592 CD ARG A 102 -7.893 -17.488 -4.867 1.00 42.52 C ATOM 1593 NE ARG A 102 -7.748 -18.937 -4.975 1.00 63.44 N ATOM 1594 CZ ARG A 102 -7.137 -19.548 -5.987 1.00 54.14 C ATOM 1595 NH1 ARG A 102 -6.611 -18.840 -6.979 1.00 22.03 N ATOM 1596 NH2 ARG A 102 -7.050 -20.871 -6.008 1.00 34.21 N ATOM 0 H ARG A 102 -9.132 -13.399 -3.096 1.00 10.44 H new ATOM 0 HA ARG A 102 -10.636 -15.711 -2.556 1.00 64.25 H new ATOM 0 HB2 ARG A 102 -8.308 -15.052 -3.897 1.00 10.45 H new ATOM 0 HB3 ARG A 102 -7.684 -15.947 -2.525 1.00 10.45 H new ATOM 0 HG2 ARG A 102 -9.016 -17.888 -3.083 1.00 54.43 H new ATOM 0 HG3 ARG A 102 -9.905 -16.999 -4.304 1.00 54.43 H new ATOM 0 HD2 ARG A 102 -8.179 -17.079 -5.836 1.00 42.52 H new ATOM 0 HD3 ARG A 102 -6.932 -17.046 -4.605 1.00 42.52 H new ATOM 0 HE ARG A 102 -8.138 -19.515 -4.231 1.00 63.44 H new ATOM 0 HH11 ARG A 102 -6.674 -17.822 -6.968 1.00 22.03 H new ATOM 0 HH12 ARG A 102 -6.144 -19.314 -7.752 1.00 22.03 H new ATOM 0 HH21 ARG A 102 -7.451 -21.421 -5.248 1.00 34.21 H new ATOM 0 HH22 ARG A 102 -6.582 -21.339 -6.784 1.00 34.21 H new ATOM 1610 N VAL A 103 -8.337 -15.023 -0.269 1.00 2.43 N ATOM 1611 CA VAL A 103 -7.972 -15.256 1.121 1.00 51.21 C ATOM 1612 C VAL A 103 -9.037 -14.706 2.063 1.00 43.33 C ATOM 1613 O VAL A 103 -9.593 -15.435 2.885 1.00 43.20 O ATOM 1614 CB VAL A 103 -6.616 -14.608 1.460 1.00 73.23 C ATOM 1615 CG1 VAL A 103 -6.174 -14.991 2.864 1.00 74.34 C ATOM 1616 CG2 VAL A 103 -5.564 -15.005 0.435 1.00 23.31 C ATOM 0 H VAL A 103 -7.692 -14.420 -0.780 1.00 2.43 H new ATOM 0 HA VAL A 103 -7.893 -16.335 1.255 1.00 51.21 H new ATOM 0 HB VAL A 103 -6.734 -13.525 1.426 1.00 73.23 H new ATOM 0 HG11 VAL A 103 -5.214 -14.523 3.084 1.00 74.34 H new ATOM 0 HG12 VAL A 103 -6.917 -14.651 3.585 1.00 74.34 H new ATOM 0 HG13 VAL A 103 -6.073 -16.074 2.931 1.00 74.34 H new ATOM 0 HG21 VAL A 103 -4.613 -14.538 0.690 1.00 23.31 H new ATOM 0 HG22 VAL A 103 -5.448 -16.089 0.434 1.00 23.31 H new ATOM 0 HG23 VAL A 103 -5.877 -14.673 -0.555 1.00 23.31 H new ATOM 1626 N LYS A 104 -9.317 -13.413 1.936 1.00 64.13 N ATOM 1627 CA LYS A 104 -10.316 -12.758 2.769 1.00 71.14 C ATOM 1628 C LYS A 104 -11.683 -13.411 2.599 1.00 64.22 C ATOM 1629 O LYS A 104 -12.510 -13.390 3.510 1.00 73.31 O ATOM 1630 CB LYS A 104 -10.406 -11.275 2.412 1.00 71.23 C ATOM 1631 CG LYS A 104 -9.069 -10.552 2.445 1.00 65.32 C ATOM 1632 CD LYS A 104 -8.490 -10.520 3.849 1.00 65.42 C ATOM 1633 CE LYS A 104 -8.656 -9.150 4.477 1.00 31.40 C ATOM 1634 NZ LYS A 104 -8.957 -9.236 5.933 1.00 61.31 N ATOM 0 H LYS A 104 -8.864 -12.797 1.261 1.00 64.13 H new ATOM 0 HA LYS A 104 -10.010 -12.863 3.810 1.00 71.14 H new ATOM 0 HB2 LYS A 104 -10.837 -11.177 1.416 1.00 71.23 H new ATOM 0 HB3 LYS A 104 -11.090 -10.785 3.105 1.00 71.23 H new ATOM 0 HG2 LYS A 104 -8.369 -11.048 1.772 1.00 65.32 H new ATOM 0 HG3 LYS A 104 -9.196 -9.533 2.079 1.00 65.32 H new ATOM 0 HD2 LYS A 104 -8.985 -11.269 4.467 1.00 65.42 H new ATOM 0 HD3 LYS A 104 -7.433 -10.782 3.816 1.00 65.42 H new ATOM 0 HE2 LYS A 104 -7.745 -8.571 4.329 1.00 31.40 H new ATOM 0 HE3 LYS A 104 -9.460 -8.615 3.972 1.00 31.40 H new ATOM 0 HZ1 LYS A 104 -9.063 -8.278 6.323 1.00 61.31 H new ATOM 0 HZ2 LYS A 104 -9.840 -9.767 6.074 1.00 61.31 H new ATOM 0 HZ3 LYS A 104 -8.178 -9.724 6.420 1.00 61.31 H new ATOM 1648 N ASP A 105 -11.916 -13.989 1.424 1.00 32.34 N ATOM 1649 CA ASP A 105 -13.185 -14.644 1.133 1.00 32.52 C ATOM 1650 C ASP A 105 -14.333 -13.642 1.184 1.00 71.53 C ATOM 1651 O ASP A 105 -15.341 -13.867 1.854 1.00 61.33 O ATOM 1652 CB ASP A 105 -13.434 -15.782 2.124 1.00 20.33 C ATOM 1653 CG ASP A 105 -14.456 -16.779 1.614 1.00 60.41 C ATOM 1654 OD1 ASP A 105 -15.388 -16.359 0.897 1.00 61.33 O ATOM 1655 OD2 ASP A 105 -14.325 -17.980 1.933 1.00 71.20 O ATOM 0 H ASP A 105 -11.242 -14.016 0.659 1.00 32.34 H new ATOM 0 HA ASP A 105 -13.134 -15.058 0.126 1.00 32.52 H new ATOM 0 HB2 ASP A 105 -12.495 -16.298 2.324 1.00 20.33 H new ATOM 0 HB3 ASP A 105 -13.777 -15.367 3.072 1.00 20.33 H new ATOM 1660 N SER A 106 -14.171 -12.532 0.470 1.00 52.14 N ATOM 1661 CA SER A 106 -15.190 -11.491 0.432 1.00 74.31 C ATOM 1662 C SER A 106 -14.789 -10.375 -0.527 1.00 2.44 C ATOM 1663 O SER A 106 -13.621 -9.992 -0.596 1.00 4.12 O ATOM 1664 CB SER A 106 -15.417 -10.922 1.834 1.00 33.14 C ATOM 1665 OG SER A 106 -16.799 -10.770 2.106 1.00 53.45 O ATOM 0 H SER A 106 -13.343 -12.331 -0.090 1.00 52.14 H new ATOM 0 HA SER A 106 -16.119 -11.935 0.074 1.00 74.31 H new ATOM 0 HB2 SER A 106 -14.968 -11.583 2.575 1.00 33.14 H new ATOM 0 HB3 SER A 106 -14.917 -9.957 1.923 1.00 33.14 H new ATOM 0 HG SER A 106 -16.917 -10.407 3.008 1.00 53.45 H new ATOM 1671 N ASP A 107 -15.764 -9.858 -1.267 1.00 43.43 N ATOM 1672 CA ASP A 107 -15.512 -8.786 -2.224 1.00 65.13 C ATOM 1673 C ASP A 107 -15.314 -7.452 -1.511 1.00 64.04 C ATOM 1674 O ASP A 107 -14.500 -6.629 -1.929 1.00 33.53 O ATOM 1675 CB ASP A 107 -16.670 -8.679 -3.218 1.00 2.31 C ATOM 1676 CG ASP A 107 -17.980 -8.321 -2.544 1.00 53.35 C ATOM 1677 OD1 ASP A 107 -18.349 -9.003 -1.564 1.00 41.31 O ATOM 1678 OD2 ASP A 107 -18.637 -7.360 -2.996 1.00 5.42 O ATOM 0 H ASP A 107 -16.736 -10.164 -1.223 1.00 43.43 H new ATOM 0 HA ASP A 107 -14.597 -9.026 -2.766 1.00 65.13 H new ATOM 0 HB2 ASP A 107 -16.433 -7.925 -3.968 1.00 2.31 H new ATOM 0 HB3 ASP A 107 -16.782 -9.627 -3.744 1.00 2.31 H new ATOM 1683 N ASP A 108 -16.066 -7.244 -0.436 1.00 54.02 N ATOM 1684 CA ASP A 108 -15.974 -6.009 0.333 1.00 54.15 C ATOM 1685 C ASP A 108 -14.942 -6.132 1.449 1.00 73.11 C ATOM 1686 O ASP A 108 -15.269 -6.519 2.571 1.00 52.12 O ATOM 1687 CB ASP A 108 -17.339 -5.649 0.923 1.00 21.44 C ATOM 1688 CG ASP A 108 -18.366 -5.330 -0.147 1.00 5.42 C ATOM 1689 OD1 ASP A 108 -18.046 -4.542 -1.061 1.00 15.04 O ATOM 1690 OD2 ASP A 108 -19.489 -5.870 -0.070 1.00 51.43 O ATOM 0 H ASP A 108 -16.746 -7.915 -0.078 1.00 54.02 H new ATOM 0 HA ASP A 108 -15.655 -5.216 -0.343 1.00 54.15 H new ATOM 0 HB2 ASP A 108 -17.699 -6.478 1.532 1.00 21.44 H new ATOM 0 HB3 ASP A 108 -17.230 -4.791 1.586 1.00 21.44 H new ATOM 1695 N VAL A 109 -13.695 -5.794 1.135 1.00 13.14 N ATOM 1696 CA VAL A 109 -12.614 -5.860 2.114 1.00 1.42 C ATOM 1697 C VAL A 109 -11.955 -4.495 2.292 1.00 4.01 C ATOM 1698 O VAL A 109 -11.962 -3.669 1.380 1.00 53.01 O ATOM 1699 CB VAL A 109 -11.534 -6.895 1.724 1.00 33.52 C ATOM 1700 CG1 VAL A 109 -11.780 -8.215 2.435 1.00 21.14 C ATOM 1701 CG2 VAL A 109 -11.482 -7.101 0.217 1.00 30.13 C ATOM 0 H VAL A 109 -13.408 -5.472 0.211 1.00 13.14 H new ATOM 0 HA VAL A 109 -13.068 -6.175 3.053 1.00 1.42 H new ATOM 0 HB VAL A 109 -10.567 -6.503 2.040 1.00 33.52 H new ATOM 0 HG11 VAL A 109 -11.010 -8.932 2.149 1.00 21.14 H new ATOM 0 HG12 VAL A 109 -11.747 -8.059 3.513 1.00 21.14 H new ATOM 0 HG13 VAL A 109 -12.759 -8.603 2.154 1.00 21.14 H new ATOM 0 HG21 VAL A 109 -10.712 -7.835 -0.024 1.00 30.13 H new ATOM 0 HG22 VAL A 109 -12.449 -7.461 -0.135 1.00 30.13 H new ATOM 0 HG23 VAL A 109 -11.247 -6.155 -0.272 1.00 30.13 H new ATOM 1711 N PRO A 110 -11.376 -4.240 3.478 1.00 54.13 N ATOM 1712 CA PRO A 110 -10.713 -2.967 3.777 1.00 41.13 C ATOM 1713 C PRO A 110 -9.389 -2.810 3.037 1.00 43.53 C ATOM 1714 O PRO A 110 -8.402 -3.471 3.361 1.00 24.53 O ATOM 1715 CB PRO A 110 -10.477 -3.039 5.286 1.00 32.45 C ATOM 1716 CG PRO A 110 -10.386 -4.496 5.581 1.00 53.31 C ATOM 1717 CD PRO A 110 -11.327 -5.171 4.622 1.00 64.32 C ATOM 0 HA PRO A 110 -11.313 -2.113 3.464 1.00 41.13 H new ATOM 0 HB2 PRO A 110 -9.562 -2.519 5.570 1.00 32.45 H new ATOM 0 HB3 PRO A 110 -11.293 -2.573 5.838 1.00 32.45 H new ATOM 0 HG2 PRO A 110 -9.367 -4.858 5.448 1.00 53.31 H new ATOM 0 HG3 PRO A 110 -10.666 -4.703 6.614 1.00 53.31 H new ATOM 0 HD2 PRO A 110 -10.961 -6.154 4.325 1.00 64.32 H new ATOM 0 HD3 PRO A 110 -12.313 -5.318 5.063 1.00 64.32 H new ATOM 1725 N MET A 111 -9.373 -1.925 2.046 1.00 72.21 N ATOM 1726 CA MET A 111 -8.170 -1.673 1.262 1.00 25.33 C ATOM 1727 C MET A 111 -8.247 -0.313 0.578 1.00 74.31 C ATOM 1728 O MET A 111 -9.313 0.298 0.508 1.00 2.43 O ATOM 1729 CB MET A 111 -7.970 -2.771 0.215 1.00 12.35 C ATOM 1730 CG MET A 111 -9.049 -2.800 -0.856 1.00 70.42 C ATOM 1731 SD MET A 111 -10.074 -4.277 -0.772 1.00 2.01 S ATOM 1732 CE MET A 111 -8.921 -5.507 -1.369 1.00 53.15 C ATOM 0 H MET A 111 -10.181 -1.369 1.766 1.00 72.21 H new ATOM 0 HA MET A 111 -7.318 -1.675 1.942 1.00 25.33 H new ATOM 0 HB2 MET A 111 -7.000 -2.632 -0.263 1.00 12.35 H new ATOM 0 HB3 MET A 111 -7.943 -3.738 0.717 1.00 12.35 H new ATOM 0 HG2 MET A 111 -9.681 -1.918 -0.753 1.00 70.42 H new ATOM 0 HG3 MET A 111 -8.581 -2.743 -1.839 1.00 70.42 H new ATOM 0 HE1 MET A 111 -9.460 -6.422 -1.614 1.00 53.15 H new ATOM 0 HE2 MET A 111 -8.418 -5.132 -2.260 1.00 53.15 H new ATOM 0 HE3 MET A 111 -8.181 -5.718 -0.597 1.00 53.15 H new ATOM 1742 N VAL A 112 -7.111 0.158 0.076 1.00 11.54 N ATOM 1743 CA VAL A 112 -7.056 1.446 -0.600 1.00 40.40 C ATOM 1744 C VAL A 112 -6.073 1.420 -1.764 1.00 72.43 C ATOM 1745 O VAL A 112 -5.096 0.671 -1.750 1.00 62.10 O ATOM 1746 CB VAL A 112 -6.656 2.570 0.372 1.00 61.14 C ATOM 1747 CG1 VAL A 112 -6.793 3.929 -0.296 1.00 50.21 C ATOM 1748 CG2 VAL A 112 -7.495 2.502 1.638 1.00 43.44 C ATOM 0 H VAL A 112 -6.218 -0.333 0.125 1.00 11.54 H new ATOM 0 HA VAL A 112 -8.057 1.644 -0.983 1.00 40.40 H new ATOM 0 HB VAL A 112 -5.611 2.432 0.648 1.00 61.14 H new ATOM 0 HG11 VAL A 112 -6.506 4.711 0.407 1.00 50.21 H new ATOM 0 HG12 VAL A 112 -6.144 3.971 -1.171 1.00 50.21 H new ATOM 0 HG13 VAL A 112 -7.828 4.080 -0.604 1.00 50.21 H new ATOM 0 HG21 VAL A 112 -7.199 3.304 2.314 1.00 43.44 H new ATOM 0 HG22 VAL A 112 -8.549 2.613 1.383 1.00 43.44 H new ATOM 0 HG23 VAL A 112 -7.340 1.540 2.126 1.00 43.44 H new ATOM 1758 N LEU A 113 -6.339 2.244 -2.772 1.00 51.52 N ATOM 1759 CA LEU A 113 -5.482 2.320 -3.947 1.00 14.52 C ATOM 1760 C LEU A 113 -4.763 3.664 -4.011 1.00 71.14 C ATOM 1761 O LEU A 113 -5.392 4.708 -4.183 1.00 45.43 O ATOM 1762 CB LEU A 113 -6.307 2.108 -5.219 1.00 1.41 C ATOM 1763 CG LEU A 113 -5.529 2.237 -6.531 1.00 22.43 C ATOM 1764 CD1 LEU A 113 -4.180 1.542 -6.425 1.00 61.43 C ATOM 1765 CD2 LEU A 113 -6.336 1.663 -7.685 1.00 65.11 C ATOM 0 H LEU A 113 -7.144 2.870 -2.798 1.00 51.52 H new ATOM 0 HA LEU A 113 -4.733 1.532 -3.872 1.00 14.52 H new ATOM 0 HB2 LEU A 113 -6.758 1.117 -5.179 1.00 1.41 H new ATOM 0 HB3 LEU A 113 -7.124 2.830 -5.227 1.00 1.41 H new ATOM 0 HG LEU A 113 -5.354 3.295 -6.724 1.00 22.43 H new ATOM 0 HD11 LEU A 113 -3.643 1.645 -7.368 1.00 61.43 H new ATOM 0 HD12 LEU A 113 -3.598 1.997 -5.624 1.00 61.43 H new ATOM 0 HD13 LEU A 113 -4.332 0.485 -6.208 1.00 61.43 H new ATOM 0 HD21 LEU A 113 -5.769 1.762 -8.611 1.00 65.11 H new ATOM 0 HD22 LEU A 113 -6.541 0.609 -7.497 1.00 65.11 H new ATOM 0 HD23 LEU A 113 -7.277 2.205 -7.776 1.00 65.11 H new ATOM 1777 N VAL A 114 -3.442 3.630 -3.871 1.00 15.35 N ATOM 1778 CA VAL A 114 -2.637 4.843 -3.912 1.00 22.22 C ATOM 1779 C VAL A 114 -1.943 4.997 -5.261 1.00 63.44 C ATOM 1780 O VAL A 114 -1.530 4.013 -5.873 1.00 20.40 O ATOM 1781 CB VAL A 114 -1.573 4.849 -2.798 1.00 72.44 C ATOM 1782 CG1 VAL A 114 -0.916 6.216 -2.696 1.00 50.11 C ATOM 1783 CG2 VAL A 114 -2.189 4.444 -1.467 1.00 4.33 C ATOM 0 H VAL A 114 -2.907 2.774 -3.728 1.00 15.35 H new ATOM 0 HA VAL A 114 -3.319 5.680 -3.759 1.00 22.22 H new ATOM 0 HB VAL A 114 -0.804 4.119 -3.052 1.00 72.44 H new ATOM 0 HG11 VAL A 114 -0.167 6.202 -1.904 1.00 50.11 H new ATOM 0 HG12 VAL A 114 -0.437 6.461 -3.644 1.00 50.11 H new ATOM 0 HG13 VAL A 114 -1.672 6.967 -2.467 1.00 50.11 H new ATOM 0 HG21 VAL A 114 -1.422 4.454 -0.693 1.00 4.33 H new ATOM 0 HG22 VAL A 114 -2.980 5.146 -1.203 1.00 4.33 H new ATOM 0 HG23 VAL A 114 -2.607 3.441 -1.550 1.00 4.33 H new ATOM 1793 N GLY A 115 -1.817 6.239 -5.718 1.00 11.15 N ATOM 1794 CA GLY A 115 -1.171 6.499 -6.991 1.00 3.13 C ATOM 1795 C GLY A 115 0.153 7.220 -6.832 1.00 10.22 C ATOM 1796 O GLY A 115 0.214 8.446 -6.922 1.00 74.31 O ATOM 0 H GLY A 115 -2.151 7.070 -5.229 1.00 11.15 H new ATOM 0 HA2 GLY A 115 -1.007 5.555 -7.511 1.00 3.13 H new ATOM 0 HA3 GLY A 115 -1.834 7.097 -7.616 1.00 3.13 H new ATOM 1800 N ASN A 116 1.215 6.458 -6.593 1.00 1.50 N ATOM 1801 CA ASN A 116 2.544 7.032 -6.419 1.00 50.02 C ATOM 1802 C ASN A 116 3.018 7.707 -7.702 1.00 3.14 C ATOM 1803 O ASN A 116 2.404 7.556 -8.759 1.00 23.34 O ATOM 1804 CB ASN A 116 3.538 5.947 -6.001 1.00 75.31 C ATOM 1805 CG ASN A 116 4.529 6.439 -4.965 1.00 30.30 C ATOM 1806 OD1 ASN A 116 4.469 7.588 -4.527 1.00 60.03 O ATOM 1807 ND2 ASN A 116 5.449 5.569 -4.566 1.00 20.43 N ATOM 0 H ASN A 116 1.181 5.442 -6.515 1.00 1.50 H new ATOM 0 HA ASN A 116 2.488 7.786 -5.634 1.00 50.02 H new ATOM 0 HB2 ASN A 116 2.992 5.093 -5.601 1.00 75.31 H new ATOM 0 HB3 ASN A 116 4.079 5.596 -6.880 1.00 75.31 H new ATOM 0 HD21 ASN A 116 6.142 5.843 -3.870 1.00 20.43 H new ATOM 0 HD22 ASN A 116 5.462 4.626 -4.955 1.00 20.43 H new ATOM 1814 N LYS A 117 4.115 8.450 -7.602 1.00 20.23 N ATOM 1815 CA LYS A 117 4.674 9.149 -8.754 1.00 73.14 C ATOM 1816 C LYS A 117 3.678 10.159 -9.316 1.00 71.43 C ATOM 1817 O LYS A 117 3.391 10.167 -10.513 1.00 42.31 O ATOM 1818 CB LYS A 117 5.072 8.146 -9.840 1.00 64.12 C ATOM 1819 CG LYS A 117 5.901 6.983 -9.318 1.00 31.30 C ATOM 1820 CD LYS A 117 7.022 6.621 -10.278 1.00 34.13 C ATOM 1821 CE LYS A 117 7.826 5.433 -9.775 1.00 65.03 C ATOM 1822 NZ LYS A 117 8.125 4.463 -10.865 1.00 73.15 N ATOM 0 H LYS A 117 4.635 8.584 -6.735 1.00 20.23 H new ATOM 0 HA LYS A 117 5.562 9.689 -8.425 1.00 73.14 H new ATOM 0 HB2 LYS A 117 4.170 7.756 -10.311 1.00 64.12 H new ATOM 0 HB3 LYS A 117 5.637 8.666 -10.614 1.00 64.12 H new ATOM 0 HG2 LYS A 117 6.322 7.243 -8.347 1.00 31.30 H new ATOM 0 HG3 LYS A 117 5.258 6.116 -9.165 1.00 31.30 H new ATOM 0 HD2 LYS A 117 6.603 6.389 -11.257 1.00 34.13 H new ATOM 0 HD3 LYS A 117 7.682 7.479 -10.408 1.00 34.13 H new ATOM 0 HE2 LYS A 117 8.760 5.786 -9.337 1.00 65.03 H new ATOM 0 HE3 LYS A 117 7.272 4.929 -8.983 1.00 65.03 H new ATOM 0 HZ1 LYS A 117 8.674 3.668 -10.481 1.00 73.15 H new ATOM 0 HZ2 LYS A 117 7.234 4.107 -11.266 1.00 73.15 H new ATOM 0 HZ3 LYS A 117 8.675 4.936 -11.610 1.00 73.15 H new ATOM 1836 N CYS A 118 3.155 11.013 -8.442 1.00 64.33 N ATOM 1837 CA CYS A 118 2.192 12.030 -8.849 1.00 24.32 C ATOM 1838 C CYS A 118 2.895 13.303 -9.320 1.00 25.15 C ATOM 1839 O CYS A 118 2.274 14.175 -9.927 1.00 34.23 O ATOM 1840 CB CYS A 118 1.246 12.357 -7.692 1.00 43.22 C ATOM 1841 SG CYS A 118 -0.280 13.185 -8.196 1.00 15.20 S ATOM 0 H CYS A 118 3.382 11.021 -7.448 1.00 64.33 H new ATOM 0 HA CYS A 118 1.616 11.629 -9.683 1.00 24.32 H new ATOM 0 HB2 CYS A 118 0.991 11.433 -7.173 1.00 43.22 H new ATOM 0 HB3 CYS A 118 1.770 12.990 -6.976 1.00 43.22 H new ATOM 0 HG CYS A 118 -1.014 13.417 -7.148 1.00 15.20 H new ATOM 1847 N ASP A 119 4.192 13.406 -9.035 1.00 63.40 N ATOM 1848 CA ASP A 119 4.970 14.575 -9.431 1.00 14.24 C ATOM 1849 C ASP A 119 5.609 14.378 -10.805 1.00 14.40 C ATOM 1850 O ASP A 119 6.019 15.343 -11.450 1.00 73.22 O ATOM 1851 CB ASP A 119 6.054 14.865 -8.391 1.00 30.14 C ATOM 1852 CG ASP A 119 7.056 13.734 -8.269 1.00 62.35 C ATOM 1853 OD1 ASP A 119 6.629 12.584 -8.033 1.00 61.44 O ATOM 1854 OD2 ASP A 119 8.269 13.997 -8.410 1.00 1.21 O ATOM 0 H ASP A 119 4.724 12.695 -8.533 1.00 63.40 H new ATOM 0 HA ASP A 119 4.289 15.424 -9.491 1.00 14.24 H new ATOM 0 HB2 ASP A 119 6.577 15.782 -8.662 1.00 30.14 H new ATOM 0 HB3 ASP A 119 5.587 15.039 -7.422 1.00 30.14 H new ATOM 1859 N LEU A 120 5.694 13.125 -11.248 1.00 33.31 N ATOM 1860 CA LEU A 120 6.287 12.808 -12.545 1.00 42.33 C ATOM 1861 C LEU A 120 5.722 13.703 -13.645 1.00 43.05 C ATOM 1862 O LEU A 120 4.641 14.274 -13.501 1.00 25.31 O ATOM 1863 CB LEU A 120 6.043 11.339 -12.893 1.00 72.52 C ATOM 1864 CG LEU A 120 7.093 10.362 -12.358 1.00 31.42 C ATOM 1865 CD1 LEU A 120 8.404 10.522 -13.112 1.00 52.32 C ATOM 1866 CD2 LEU A 120 7.305 10.572 -10.865 1.00 31.14 C ATOM 0 H LEU A 120 5.360 12.314 -10.728 1.00 33.31 H new ATOM 0 HA LEU A 120 7.360 12.988 -12.476 1.00 42.33 H new ATOM 0 HB2 LEU A 120 5.067 11.047 -12.506 1.00 72.52 H new ATOM 0 HB3 LEU A 120 5.998 11.241 -13.978 1.00 72.52 H new ATOM 0 HG LEU A 120 6.730 9.346 -12.514 1.00 31.42 H new ATOM 0 HD11 LEU A 120 9.138 9.819 -12.718 1.00 52.32 H new ATOM 0 HD12 LEU A 120 8.242 10.321 -14.171 1.00 52.32 H new ATOM 0 HD13 LEU A 120 8.773 11.540 -12.988 1.00 52.32 H new ATOM 0 HD21 LEU A 120 8.055 9.869 -10.502 1.00 31.14 H new ATOM 0 HD22 LEU A 120 7.647 11.592 -10.686 1.00 31.14 H new ATOM 0 HD23 LEU A 120 6.366 10.406 -10.337 1.00 31.14 H new ATOM 1878 N ALA A 121 6.463 13.822 -14.742 1.00 70.00 N ATOM 1879 CA ALA A 121 6.039 14.648 -15.866 1.00 64.14 C ATOM 1880 C ALA A 121 5.759 13.797 -17.099 1.00 62.22 C ATOM 1881 O ALA A 121 6.118 14.168 -18.217 1.00 74.14 O ATOM 1882 CB ALA A 121 7.096 15.698 -16.175 1.00 73.10 C ATOM 0 H ALA A 121 7.361 13.356 -14.876 1.00 70.00 H new ATOM 0 HA ALA A 121 5.113 15.150 -15.587 1.00 64.14 H new ATOM 0 HB1 ALA A 121 6.768 16.308 -17.016 1.00 73.10 H new ATOM 0 HB2 ALA A 121 7.244 16.333 -15.302 1.00 73.10 H new ATOM 0 HB3 ALA A 121 8.035 15.206 -16.429 1.00 73.10 H new ATOM 1888 N ALA A 122 5.117 12.653 -16.888 1.00 55.32 N ATOM 1889 CA ALA A 122 4.788 11.748 -17.983 1.00 53.01 C ATOM 1890 C ALA A 122 3.822 10.660 -17.523 1.00 25.22 C ATOM 1891 O ALA A 122 4.105 9.468 -17.649 1.00 3.30 O ATOM 1892 CB ALA A 122 6.056 11.128 -18.553 1.00 13.23 C ATOM 0 H ALA A 122 4.814 12.331 -15.969 1.00 55.32 H new ATOM 0 HA ALA A 122 4.296 12.325 -18.766 1.00 53.01 H new ATOM 0 HB1 ALA A 122 5.796 10.454 -19.370 1.00 13.23 H new ATOM 0 HB2 ALA A 122 6.710 11.916 -18.926 1.00 13.23 H new ATOM 0 HB3 ALA A 122 6.571 10.569 -17.772 1.00 13.23 H new ATOM 1898 N ARG A 123 2.680 11.078 -16.989 1.00 53.20 N ATOM 1899 CA ARG A 123 1.672 10.144 -16.509 1.00 72.11 C ATOM 1900 C ARG A 123 1.029 9.390 -17.667 1.00 55.41 C ATOM 1901 O ARG A 123 0.523 9.997 -18.611 1.00 23.25 O ATOM 1902 CB ARG A 123 0.599 10.896 -15.726 1.00 72.22 C ATOM 1903 CG ARG A 123 0.013 12.068 -16.493 1.00 54.02 C ATOM 1904 CD ARG A 123 -1.504 12.062 -16.451 1.00 32.13 C ATOM 1905 NE ARG A 123 -2.068 10.952 -17.215 1.00 32.13 N ATOM 1906 CZ ARG A 123 -2.181 10.947 -18.542 1.00 61.34 C ATOM 1907 NH1 ARG A 123 -1.777 11.992 -19.253 1.00 32.24 N ATOM 1908 NH2 ARG A 123 -2.700 9.894 -19.159 1.00 41.24 N ATOM 0 H ARG A 123 2.430 12.061 -16.878 1.00 53.20 H new ATOM 0 HA ARG A 123 2.161 9.420 -15.857 1.00 72.11 H new ATOM 0 HB2 ARG A 123 -0.202 10.205 -15.463 1.00 72.22 H new ATOM 0 HB3 ARG A 123 1.027 11.259 -14.791 1.00 72.22 H new ATOM 0 HG2 ARG A 123 0.385 13.002 -16.072 1.00 54.02 H new ATOM 0 HG3 ARG A 123 0.349 12.030 -17.529 1.00 54.02 H new ATOM 0 HD2 ARG A 123 -1.838 11.996 -15.415 1.00 32.13 H new ATOM 0 HD3 ARG A 123 -1.881 13.004 -16.848 1.00 32.13 H new ATOM 0 HE ARG A 123 -2.394 10.133 -16.702 1.00 32.13 H new ATOM 0 HH11 ARG A 123 -1.377 12.805 -18.783 1.00 32.24 H new ATOM 0 HH12 ARG A 123 -1.866 11.983 -20.269 1.00 32.24 H new ATOM 0 HH21 ARG A 123 -3.013 9.088 -18.617 1.00 41.24 H new ATOM 0 HH22 ARG A 123 -2.787 9.890 -20.175 1.00 41.24 H new ATOM 1922 N THR A 124 1.043 8.066 -17.584 1.00 33.22 N ATOM 1923 CA THR A 124 0.452 7.230 -18.622 1.00 3.20 C ATOM 1924 C THR A 124 -0.987 6.870 -18.266 1.00 23.23 C ATOM 1925 O THR A 124 -1.806 6.601 -19.145 1.00 75.34 O ATOM 1926 CB THR A 124 1.278 5.957 -18.816 1.00 72.51 C ATOM 1927 OG1 THR A 124 1.206 5.133 -17.666 1.00 31.45 O ATOM 1928 CG2 THR A 124 2.740 6.229 -19.095 1.00 33.02 C ATOM 0 H THR A 124 1.457 7.548 -16.809 1.00 33.22 H new ATOM 0 HA THR A 124 0.450 7.794 -19.555 1.00 3.20 H new ATOM 0 HB THR A 124 0.845 5.461 -19.685 1.00 72.51 H new ATOM 0 HG1 THR A 124 0.928 5.671 -16.895 1.00 31.45 H new ATOM 0 HG21 THR A 124 3.268 5.284 -19.222 1.00 33.02 H new ATOM 0 HG22 THR A 124 2.833 6.822 -20.005 1.00 33.02 H new ATOM 0 HG23 THR A 124 3.174 6.777 -18.259 1.00 33.02 H new ATOM 1936 N VAL A 125 -1.285 6.862 -16.970 1.00 23.43 N ATOM 1937 CA VAL A 125 -2.613 6.534 -16.489 1.00 20.41 C ATOM 1938 C VAL A 125 -3.220 7.707 -15.722 1.00 3.13 C ATOM 1939 O VAL A 125 -2.925 7.908 -14.544 1.00 2.14 O ATOM 1940 CB VAL A 125 -2.565 5.300 -15.573 1.00 12.50 C ATOM 1941 CG1 VAL A 125 -3.954 4.950 -15.080 1.00 51.25 C ATOM 1942 CG2 VAL A 125 -1.933 4.121 -16.298 1.00 44.45 C ATOM 0 H VAL A 125 -0.615 7.082 -16.233 1.00 23.43 H new ATOM 0 HA VAL A 125 -3.236 6.317 -17.357 1.00 20.41 H new ATOM 0 HB VAL A 125 -1.947 5.536 -14.707 1.00 12.50 H new ATOM 0 HG11 VAL A 125 -3.901 4.074 -14.433 1.00 51.25 H new ATOM 0 HG12 VAL A 125 -4.364 5.790 -14.520 1.00 51.25 H new ATOM 0 HG13 VAL A 125 -4.599 4.733 -15.932 1.00 51.25 H new ATOM 0 HG21 VAL A 125 -1.908 3.257 -15.634 1.00 44.45 H new ATOM 0 HG22 VAL A 125 -2.521 3.881 -17.184 1.00 44.45 H new ATOM 0 HG23 VAL A 125 -0.917 4.379 -16.596 1.00 44.45 H new ATOM 1952 N GLU A 126 -4.067 8.477 -16.396 1.00 32.11 N ATOM 1953 CA GLU A 126 -4.712 9.627 -15.773 1.00 72.13 C ATOM 1954 C GLU A 126 -5.583 9.192 -14.599 1.00 52.34 C ATOM 1955 O GLU A 126 -5.953 8.023 -14.489 1.00 21.31 O ATOM 1956 CB GLU A 126 -5.558 10.384 -16.799 1.00 43.25 C ATOM 1957 CG GLU A 126 -6.453 9.482 -17.634 1.00 74.51 C ATOM 1958 CD GLU A 126 -7.522 10.253 -18.386 1.00 45.44 C ATOM 1959 OE1 GLU A 126 -7.535 11.498 -18.292 1.00 14.42 O ATOM 1960 OE2 GLU A 126 -8.347 9.609 -19.068 1.00 54.32 O ATOM 0 H GLU A 126 -4.323 8.326 -17.372 1.00 32.11 H new ATOM 0 HA GLU A 126 -3.932 10.290 -15.398 1.00 72.13 H new ATOM 0 HB2 GLU A 126 -6.177 11.115 -16.279 1.00 43.25 H new ATOM 0 HB3 GLU A 126 -4.897 10.941 -17.463 1.00 43.25 H new ATOM 0 HG2 GLU A 126 -5.841 8.928 -18.346 1.00 74.51 H new ATOM 0 HG3 GLU A 126 -6.929 8.748 -16.985 1.00 74.51 H new ATOM 1967 N SER A 127 -5.906 10.138 -13.723 1.00 31.44 N ATOM 1968 CA SER A 127 -6.733 9.851 -12.556 1.00 64.31 C ATOM 1969 C SER A 127 -8.070 9.242 -12.970 1.00 1.43 C ATOM 1970 O SER A 127 -8.659 8.453 -12.232 1.00 3.14 O ATOM 1971 CB SER A 127 -6.970 11.127 -11.746 1.00 52.31 C ATOM 1972 OG SER A 127 -8.018 11.901 -12.304 1.00 22.24 O ATOM 0 H SER A 127 -5.608 11.110 -13.799 1.00 31.44 H new ATOM 0 HA SER A 127 -6.202 9.128 -11.936 1.00 64.31 H new ATOM 0 HB2 SER A 127 -7.215 10.867 -10.716 1.00 52.31 H new ATOM 0 HB3 SER A 127 -6.054 11.717 -11.716 1.00 52.31 H new ATOM 0 HG SER A 127 -8.150 12.710 -11.766 1.00 22.24 H new ATOM 1978 N ARG A 128 -8.540 9.613 -14.157 1.00 20.21 N ATOM 1979 CA ARG A 128 -9.806 9.103 -14.672 1.00 10.42 C ATOM 1980 C ARG A 128 -9.767 7.582 -14.797 1.00 20.42 C ATOM 1981 O ARG A 128 -10.700 6.891 -14.389 1.00 72.24 O ATOM 1982 CB ARG A 128 -10.116 9.736 -16.031 1.00 30.24 C ATOM 1983 CG ARG A 128 -11.337 9.147 -16.721 1.00 0.45 C ATOM 1984 CD ARG A 128 -12.607 9.405 -15.925 1.00 24.51 C ATOM 1985 NE ARG A 128 -13.806 9.060 -16.685 1.00 51.43 N ATOM 1986 CZ ARG A 128 -15.016 8.934 -16.144 1.00 53.21 C ATOM 1987 NH1 ARG A 128 -15.191 9.124 -14.842 1.00 41.32 N ATOM 1988 NH2 ARG A 128 -16.053 8.618 -16.907 1.00 72.20 N ATOM 0 H ARG A 128 -8.063 10.265 -14.780 1.00 20.21 H new ATOM 0 HA ARG A 128 -10.595 9.369 -13.968 1.00 10.42 H new ATOM 0 HB2 ARG A 128 -10.268 10.807 -15.896 1.00 30.24 H new ATOM 0 HB3 ARG A 128 -9.250 9.617 -16.682 1.00 30.24 H new ATOM 0 HG2 ARG A 128 -11.437 9.579 -17.717 1.00 0.45 H new ATOM 0 HG3 ARG A 128 -11.200 8.074 -16.851 1.00 0.45 H new ATOM 0 HD2 ARG A 128 -12.582 8.824 -15.003 1.00 24.51 H new ATOM 0 HD3 ARG A 128 -12.649 10.456 -15.638 1.00 24.51 H new ATOM 0 HE ARG A 128 -13.711 8.907 -17.689 1.00 51.43 H new ATOM 0 HH11 ARG A 128 -14.396 9.368 -14.251 1.00 41.32 H new ATOM 0 HH12 ARG A 128 -16.120 9.026 -14.433 1.00 41.32 H new ATOM 0 HH21 ARG A 128 -15.924 8.471 -17.908 1.00 72.20 H new ATOM 0 HH22 ARG A 128 -16.980 8.521 -16.493 1.00 72.20 H new ATOM 2002 N GLN A 129 -8.681 7.068 -15.366 1.00 30.30 N ATOM 2003 CA GLN A 129 -8.520 5.630 -15.547 1.00 43.43 C ATOM 2004 C GLN A 129 -8.420 4.919 -14.201 1.00 61.00 C ATOM 2005 O GLN A 129 -8.928 3.810 -14.035 1.00 71.43 O ATOM 2006 CB GLN A 129 -7.275 5.336 -16.387 1.00 1.21 C ATOM 2007 CG GLN A 129 -7.132 6.240 -17.600 1.00 41.32 C ATOM 2008 CD GLN A 129 -6.852 5.468 -18.875 1.00 74.21 C ATOM 2009 OE1 GLN A 129 -7.761 5.184 -19.654 1.00 25.14 O ATOM 2010 NE2 GLN A 129 -5.588 5.124 -19.093 1.00 50.23 N ATOM 0 H GLN A 129 -7.900 7.626 -15.710 1.00 30.30 H new ATOM 0 HA GLN A 129 -9.399 5.255 -16.070 1.00 43.43 H new ATOM 0 HB2 GLN A 129 -6.390 5.442 -15.759 1.00 1.21 H new ATOM 0 HB3 GLN A 129 -7.308 4.298 -16.719 1.00 1.21 H new ATOM 0 HG2 GLN A 129 -8.046 6.821 -17.725 1.00 41.32 H new ATOM 0 HG3 GLN A 129 -6.324 6.951 -17.425 1.00 41.32 H new ATOM 0 HE21 GLN A 129 -4.866 5.381 -18.420 1.00 50.23 H new ATOM 0 HE22 GLN A 129 -5.339 4.603 -19.934 1.00 50.23 H new ATOM 2019 N ALA A 130 -7.760 5.564 -13.245 1.00 62.44 N ATOM 2020 CA ALA A 130 -7.593 4.992 -11.914 1.00 12.14 C ATOM 2021 C ALA A 130 -8.893 5.055 -11.121 1.00 54.02 C ATOM 2022 O ALA A 130 -9.275 4.089 -10.458 1.00 35.21 O ATOM 2023 CB ALA A 130 -6.481 5.714 -11.167 1.00 22.44 C ATOM 0 H ALA A 130 -7.332 6.482 -13.367 1.00 62.44 H new ATOM 0 HA ALA A 130 -7.319 3.943 -12.028 1.00 12.14 H new ATOM 0 HB1 ALA A 130 -6.366 5.278 -10.175 1.00 22.44 H new ATOM 0 HB2 ALA A 130 -5.546 5.612 -11.719 1.00 22.44 H new ATOM 0 HB3 ALA A 130 -6.733 6.770 -11.072 1.00 22.44 H new ATOM 2029 N GLN A 131 -9.570 6.196 -11.191 1.00 75.30 N ATOM 2030 CA GLN A 131 -10.828 6.384 -10.479 1.00 43.41 C ATOM 2031 C GLN A 131 -11.897 5.428 -10.999 1.00 21.54 C ATOM 2032 O GLN A 131 -12.757 4.973 -10.245 1.00 23.40 O ATOM 2033 CB GLN A 131 -11.306 7.832 -10.619 1.00 3.55 C ATOM 2034 CG GLN A 131 -11.027 8.685 -9.392 1.00 30.12 C ATOM 2035 CD GLN A 131 -12.295 9.161 -8.710 1.00 13.44 C ATOM 2036 OE1 GLN A 131 -12.858 10.194 -9.072 1.00 51.30 O ATOM 2037 NE2 GLN A 131 -12.750 8.408 -7.716 1.00 53.02 N ATOM 0 H GLN A 131 -9.268 7.005 -11.734 1.00 75.30 H new ATOM 0 HA GLN A 131 -10.656 6.167 -9.425 1.00 43.41 H new ATOM 0 HB2 GLN A 131 -10.821 8.284 -11.484 1.00 3.55 H new ATOM 0 HB3 GLN A 131 -12.378 7.835 -10.817 1.00 3.55 H new ATOM 0 HG2 GLN A 131 -10.432 8.110 -8.683 1.00 30.12 H new ATOM 0 HG3 GLN A 131 -10.430 9.549 -9.683 1.00 30.12 H new ATOM 0 HE21 GLN A 131 -12.251 7.559 -7.449 1.00 53.02 H new ATOM 0 HE22 GLN A 131 -13.599 8.678 -7.219 1.00 53.02 H new ATOM 2046 N ASP A 132 -11.838 5.129 -12.293 1.00 20.13 N ATOM 2047 CA ASP A 132 -12.801 4.228 -12.914 1.00 31.52 C ATOM 2048 C ASP A 132 -12.681 2.820 -12.339 1.00 14.44 C ATOM 2049 O ASP A 132 -13.679 2.119 -12.175 1.00 61.33 O ATOM 2050 CB ASP A 132 -12.595 4.192 -14.429 1.00 54.40 C ATOM 2051 CG ASP A 132 -13.836 3.734 -15.171 1.00 44.04 C ATOM 2052 OD1 ASP A 132 -14.897 4.371 -15.002 1.00 21.34 O ATOM 2053 OD2 ASP A 132 -13.746 2.739 -15.920 1.00 0.15 O ATOM 0 H ASP A 132 -11.133 5.498 -12.931 1.00 20.13 H new ATOM 0 HA ASP A 132 -13.801 4.604 -12.699 1.00 31.52 H new ATOM 0 HB2 ASP A 132 -12.312 5.185 -14.778 1.00 54.40 H new ATOM 0 HB3 ASP A 132 -11.767 3.524 -14.664 1.00 54.40 H new ATOM 2058 N LEU A 133 -11.453 2.413 -12.036 1.00 53.11 N ATOM 2059 CA LEU A 133 -11.203 1.088 -11.480 1.00 42.11 C ATOM 2060 C LEU A 133 -11.542 1.049 -9.993 1.00 54.54 C ATOM 2061 O LEU A 133 -12.282 0.177 -9.538 1.00 4.04 O ATOM 2062 CB LEU A 133 -9.741 0.691 -11.694 1.00 62.33 C ATOM 2063 CG LEU A 133 -9.316 -0.617 -11.022 1.00 34.43 C ATOM 2064 CD1 LEU A 133 -9.914 -1.813 -11.749 1.00 4.43 C ATOM 2065 CD2 LEU A 133 -7.799 -0.719 -10.972 1.00 22.11 C ATOM 0 H LEU A 133 -10.616 2.981 -12.166 1.00 53.11 H new ATOM 0 HA LEU A 133 -11.845 0.376 -11.998 1.00 42.11 H new ATOM 0 HB2 LEU A 133 -9.557 0.607 -12.765 1.00 62.33 H new ATOM 0 HB3 LEU A 133 -9.105 1.495 -11.323 1.00 62.33 H new ATOM 0 HG LEU A 133 -9.694 -0.619 -10.000 1.00 34.43 H new ATOM 0 HD11 LEU A 133 -9.600 -2.733 -11.256 1.00 4.43 H new ATOM 0 HD12 LEU A 133 -11.002 -1.744 -11.730 1.00 4.43 H new ATOM 0 HD13 LEU A 133 -9.569 -1.820 -12.783 1.00 4.43 H new ATOM 0 HD21 LEU A 133 -7.513 -1.655 -10.491 1.00 22.11 H new ATOM 0 HD22 LEU A 133 -7.399 -0.695 -11.986 1.00 22.11 H new ATOM 0 HD23 LEU A 133 -7.397 0.119 -10.403 1.00 22.11 H new ATOM 2077 N ALA A 134 -10.997 1.999 -9.241 1.00 33.00 N ATOM 2078 CA ALA A 134 -11.243 2.073 -7.806 1.00 10.51 C ATOM 2079 C ALA A 134 -12.731 2.223 -7.511 1.00 53.12 C ATOM 2080 O ALA A 134 -13.244 1.651 -6.549 1.00 72.13 O ATOM 2081 CB ALA A 134 -10.463 3.229 -7.196 1.00 64.23 C ATOM 0 H ALA A 134 -10.382 2.728 -9.602 1.00 33.00 H new ATOM 0 HA ALA A 134 -10.902 1.141 -7.355 1.00 10.51 H new ATOM 0 HB1 ALA A 134 -10.656 3.273 -6.124 1.00 64.23 H new ATOM 0 HB2 ALA A 134 -9.397 3.079 -7.367 1.00 64.23 H new ATOM 0 HB3 ALA A 134 -10.777 4.164 -7.659 1.00 64.23 H new ATOM 2087 N ARG A 135 -13.419 2.996 -8.345 1.00 55.42 N ATOM 2088 CA ARG A 135 -14.850 3.221 -8.174 1.00 62.21 C ATOM 2089 C ARG A 135 -15.636 1.925 -8.360 1.00 32.44 C ATOM 2090 O ARG A 135 -16.750 1.788 -7.855 1.00 20.33 O ATOM 2091 CB ARG A 135 -15.344 4.276 -9.166 1.00 35.32 C ATOM 2092 CG ARG A 135 -16.823 4.597 -9.027 1.00 42.14 C ATOM 2093 CD ARG A 135 -17.129 6.018 -9.471 1.00 31.52 C ATOM 2094 NE ARG A 135 -18.407 6.110 -10.172 1.00 34.13 N ATOM 2095 CZ ARG A 135 -18.948 7.255 -10.580 1.00 53.32 C ATOM 2096 NH1 ARG A 135 -18.327 8.407 -10.358 1.00 53.05 N ATOM 2097 NH2 ARG A 135 -20.114 7.250 -11.213 1.00 44.14 N ATOM 0 H ARG A 135 -13.009 3.477 -9.146 1.00 55.42 H new ATOM 0 HA ARG A 135 -15.014 3.580 -7.158 1.00 62.21 H new ATOM 0 HB2 ARG A 135 -14.768 5.191 -9.028 1.00 35.32 H new ATOM 0 HB3 ARG A 135 -15.150 3.928 -10.180 1.00 35.32 H new ATOM 0 HG2 ARG A 135 -17.406 3.895 -9.623 1.00 42.14 H new ATOM 0 HG3 ARG A 135 -17.129 4.465 -7.989 1.00 42.14 H new ATOM 0 HD2 ARG A 135 -17.145 6.674 -8.601 1.00 31.52 H new ATOM 0 HD3 ARG A 135 -16.331 6.373 -10.123 1.00 31.52 H new ATOM 0 HE ARG A 135 -18.915 5.245 -10.360 1.00 34.13 H new ATOM 0 HH11 ARG A 135 -17.430 8.418 -9.872 1.00 53.05 H new ATOM 0 HH12 ARG A 135 -18.747 9.282 -10.673 1.00 53.05 H new ATOM 0 HH21 ARG A 135 -20.596 6.368 -11.387 1.00 44.14 H new ATOM 0 HH22 ARG A 135 -20.528 8.128 -11.526 1.00 44.14 H new ATOM 2111 N SER A 136 -15.050 0.977 -9.085 1.00 23.13 N ATOM 2112 CA SER A 136 -15.699 -0.305 -9.332 1.00 34.21 C ATOM 2113 C SER A 136 -15.587 -1.210 -8.111 1.00 13.45 C ATOM 2114 O SER A 136 -16.542 -1.893 -7.741 1.00 22.41 O ATOM 2115 CB SER A 136 -15.076 -0.991 -10.550 1.00 44.23 C ATOM 2116 OG SER A 136 -15.427 -2.363 -10.598 1.00 53.43 O ATOM 0 H SER A 136 -14.128 1.073 -9.511 1.00 23.13 H new ATOM 0 HA SER A 136 -16.754 -0.119 -9.531 1.00 34.21 H new ATOM 0 HB2 SER A 136 -15.410 -0.495 -11.461 1.00 44.23 H new ATOM 0 HB3 SER A 136 -13.991 -0.891 -10.512 1.00 44.23 H new ATOM 0 HG SER A 136 -15.018 -2.778 -11.386 1.00 53.43 H new ATOM 2122 N TYR A 137 -14.414 -1.206 -7.488 1.00 14.34 N ATOM 2123 CA TYR A 137 -14.173 -2.023 -6.305 1.00 44.34 C ATOM 2124 C TYR A 137 -14.862 -1.428 -5.079 1.00 71.11 C ATOM 2125 O TYR A 137 -15.088 -2.121 -4.087 1.00 24.34 O ATOM 2126 CB TYR A 137 -12.672 -2.149 -6.045 1.00 20.33 C ATOM 2127 CG TYR A 137 -11.911 -2.804 -7.176 1.00 60.45 C ATOM 2128 CD1 TYR A 137 -12.415 -3.927 -7.821 1.00 11.24 C ATOM 2129 CD2 TYR A 137 -10.687 -2.299 -7.598 1.00 62.30 C ATOM 2130 CE1 TYR A 137 -11.720 -4.528 -8.854 1.00 71.11 C ATOM 2131 CE2 TYR A 137 -9.987 -2.894 -8.630 1.00 35.42 C ATOM 2132 CZ TYR A 137 -10.508 -4.008 -9.255 1.00 31.11 C ATOM 2133 OH TYR A 137 -9.814 -4.606 -10.283 1.00 74.31 O ATOM 0 H TYR A 137 -13.614 -0.645 -7.783 1.00 14.34 H new ATOM 0 HA TYR A 137 -14.590 -3.013 -6.489 1.00 44.34 H new ATOM 0 HB2 TYR A 137 -12.258 -1.156 -5.868 1.00 20.33 H new ATOM 0 HB3 TYR A 137 -12.518 -2.726 -5.133 1.00 20.33 H new ATOM 0 HD1 TYR A 137 -13.365 -4.337 -7.510 1.00 11.24 H new ATOM 0 HD2 TYR A 137 -10.276 -1.427 -7.111 1.00 62.30 H new ATOM 0 HE1 TYR A 137 -12.125 -5.401 -9.345 1.00 71.11 H new ATOM 0 HE2 TYR A 137 -9.037 -2.489 -8.946 1.00 35.42 H new ATOM 0 HH TYR A 137 -10.036 -5.560 -10.316 1.00 74.31 H new ATOM 2143 N GLY A 138 -15.188 -0.141 -5.150 1.00 71.33 N ATOM 2144 CA GLY A 138 -15.841 0.520 -4.037 1.00 54.23 C ATOM 2145 C GLY A 138 -14.853 1.023 -3.003 1.00 33.52 C ATOM 2146 O GLY A 138 -15.227 1.310 -1.866 1.00 24.21 O ATOM 0 H GLY A 138 -15.011 0.455 -5.959 1.00 71.33 H new ATOM 0 HA2 GLY A 138 -16.430 1.358 -4.410 1.00 54.23 H new ATOM 0 HA3 GLY A 138 -16.537 -0.173 -3.564 1.00 54.23 H new ATOM 2150 N ILE A 139 -13.587 1.130 -3.397 1.00 15.31 N ATOM 2151 CA ILE A 139 -12.543 1.602 -2.494 1.00 1.31 C ATOM 2152 C ILE A 139 -12.082 3.009 -2.860 1.00 34.11 C ATOM 2153 O ILE A 139 -12.233 3.445 -4.001 1.00 55.43 O ATOM 2154 CB ILE A 139 -11.329 0.665 -2.490 1.00 22.41 C ATOM 2155 CG1 ILE A 139 -10.976 0.239 -3.906 1.00 21.32 C ATOM 2156 CG2 ILE A 139 -11.606 -0.551 -1.622 1.00 62.20 C ATOM 2157 CD1 ILE A 139 -9.726 -0.597 -3.967 1.00 10.14 C ATOM 0 H ILE A 139 -13.260 0.896 -4.335 1.00 15.31 H new ATOM 0 HA ILE A 139 -12.983 1.616 -1.497 1.00 1.31 H new ATOM 0 HB ILE A 139 -10.478 1.204 -2.074 1.00 22.41 H new ATOM 0 HG12 ILE A 139 -11.807 -0.326 -4.329 1.00 21.32 H new ATOM 0 HG13 ILE A 139 -10.845 1.126 -4.526 1.00 21.32 H new ATOM 0 HG21 ILE A 139 -10.736 -1.208 -1.628 1.00 62.20 H new ATOM 0 HG22 ILE A 139 -11.811 -0.230 -0.601 1.00 62.20 H new ATOM 0 HG23 ILE A 139 -12.469 -1.089 -2.014 1.00 62.20 H new ATOM 0 HD11 ILE A 139 -9.523 -0.872 -5.002 1.00 10.14 H new ATOM 0 HD12 ILE A 139 -8.886 -0.025 -3.572 1.00 10.14 H new ATOM 0 HD13 ILE A 139 -9.863 -1.500 -3.372 1.00 10.14 H new ATOM 2169 N PRO A 140 -11.510 3.740 -1.889 1.00 14.13 N ATOM 2170 CA PRO A 140 -11.024 5.105 -2.111 1.00 51.23 C ATOM 2171 C PRO A 140 -9.743 5.136 -2.938 1.00 34.41 C ATOM 2172 O PRO A 140 -8.978 4.171 -2.952 1.00 13.03 O ATOM 2173 CB PRO A 140 -10.763 5.621 -0.696 1.00 40.44 C ATOM 2174 CG PRO A 140 -10.467 4.399 0.104 1.00 73.35 C ATOM 2175 CD PRO A 140 -11.292 3.294 -0.499 1.00 30.42 C ATOM 0 HA PRO A 140 -11.738 5.707 -2.673 1.00 51.23 H new ATOM 0 HB2 PRO A 140 -9.926 6.319 -0.677 1.00 40.44 H new ATOM 0 HB3 PRO A 140 -11.630 6.152 -0.302 1.00 40.44 H new ATOM 0 HG2 PRO A 140 -9.405 4.157 0.067 1.00 73.35 H new ATOM 0 HG3 PRO A 140 -10.723 4.549 1.153 1.00 73.35 H new ATOM 0 HD2 PRO A 140 -10.769 2.338 -0.462 1.00 30.42 H new ATOM 0 HD3 PRO A 140 -12.235 3.162 0.032 1.00 30.42 H new ATOM 2183 N TYR A 141 -9.516 6.250 -3.627 1.00 71.44 N ATOM 2184 CA TYR A 141 -8.327 6.406 -4.458 1.00 50.23 C ATOM 2185 C TYR A 141 -7.569 7.679 -4.090 1.00 12.33 C ATOM 2186 O TYR A 141 -8.097 8.785 -4.210 1.00 50.51 O ATOM 2187 CB TYR A 141 -8.719 6.434 -5.940 1.00 35.41 C ATOM 2188 CG TYR A 141 -7.590 6.835 -6.865 1.00 12.21 C ATOM 2189 CD1 TYR A 141 -6.478 6.019 -7.031 1.00 22.41 C ATOM 2190 CD2 TYR A 141 -7.638 8.031 -7.570 1.00 32.34 C ATOM 2191 CE1 TYR A 141 -5.445 6.384 -7.874 1.00 23.11 C ATOM 2192 CE2 TYR A 141 -6.609 8.402 -8.415 1.00 70.13 C ATOM 2193 CZ TYR A 141 -5.516 7.576 -8.563 1.00 71.22 C ATOM 2194 OH TYR A 141 -4.490 7.943 -9.403 1.00 61.13 O ATOM 0 H TYR A 141 -10.139 7.057 -3.626 1.00 71.44 H new ATOM 0 HA TYR A 141 -7.671 5.554 -4.280 1.00 50.23 H new ATOM 0 HB2 TYR A 141 -9.079 5.447 -6.229 1.00 35.41 H new ATOM 0 HB3 TYR A 141 -9.549 7.128 -6.073 1.00 35.41 H new ATOM 0 HD1 TYR A 141 -6.420 5.084 -6.493 1.00 22.41 H new ATOM 0 HD2 TYR A 141 -8.493 8.681 -7.456 1.00 32.34 H new ATOM 0 HE1 TYR A 141 -4.587 5.739 -7.992 1.00 23.11 H new ATOM 0 HE2 TYR A 141 -6.661 9.335 -8.957 1.00 70.13 H new ATOM 0 HH TYR A 141 -4.696 8.809 -9.812 1.00 61.13 H new ATOM 2204 N ILE A 142 -6.328 7.514 -3.643 1.00 62.34 N ATOM 2205 CA ILE A 142 -5.496 8.643 -3.260 1.00 21.31 C ATOM 2206 C ILE A 142 -4.252 8.730 -4.140 1.00 2.54 C ATOM 2207 O ILE A 142 -3.827 7.737 -4.729 1.00 4.43 O ATOM 2208 CB ILE A 142 -5.064 8.539 -1.786 1.00 0.10 C ATOM 2209 CG1 ILE A 142 -6.282 8.313 -0.887 1.00 62.41 C ATOM 2210 CG2 ILE A 142 -4.313 9.790 -1.367 1.00 54.31 C ATOM 2211 CD1 ILE A 142 -6.387 6.900 -0.357 1.00 72.34 C ATOM 0 H ILE A 142 -5.878 6.605 -3.538 1.00 62.34 H new ATOM 0 HA ILE A 142 -6.095 9.544 -3.394 1.00 21.31 H new ATOM 0 HB ILE A 142 -4.396 7.685 -1.678 1.00 0.10 H new ATOM 0 HG12 ILE A 142 -6.237 9.005 -0.046 1.00 62.41 H new ATOM 0 HG13 ILE A 142 -7.186 8.551 -1.447 1.00 62.41 H new ATOM 0 HG21 ILE A 142 -4.014 9.702 -0.323 1.00 54.31 H new ATOM 0 HG22 ILE A 142 -3.426 9.908 -1.990 1.00 54.31 H new ATOM 0 HG23 ILE A 142 -4.959 10.660 -1.487 1.00 54.31 H new ATOM 0 HD11 ILE A 142 -7.273 6.812 0.272 1.00 72.34 H new ATOM 0 HD12 ILE A 142 -6.464 6.203 -1.192 1.00 72.34 H new ATOM 0 HD13 ILE A 142 -5.500 6.665 0.231 1.00 72.34 H new ATOM 2223 N GLU A 143 -3.673 9.923 -4.222 1.00 72.23 N ATOM 2224 CA GLU A 143 -2.478 10.139 -5.029 1.00 32.02 C ATOM 2225 C GLU A 143 -1.332 10.666 -4.172 1.00 52.55 C ATOM 2226 O GLU A 143 -1.505 11.608 -3.399 1.00 65.02 O ATOM 2227 CB GLU A 143 -2.773 11.121 -6.165 1.00 63.13 C ATOM 2228 CG GLU A 143 -3.974 10.729 -7.011 1.00 71.25 C ATOM 2229 CD GLU A 143 -5.032 11.814 -7.065 1.00 33.33 C ATOM 2230 OE1 GLU A 143 -5.336 12.399 -6.004 1.00 2.13 O ATOM 2231 OE2 GLU A 143 -5.556 12.078 -8.167 1.00 71.11 O ATOM 0 H GLU A 143 -4.012 10.755 -3.739 1.00 72.23 H new ATOM 0 HA GLU A 143 -2.180 9.181 -5.455 1.00 32.02 H new ATOM 0 HB2 GLU A 143 -2.944 12.111 -5.743 1.00 63.13 H new ATOM 0 HB3 GLU A 143 -1.895 11.195 -6.807 1.00 63.13 H new ATOM 0 HG2 GLU A 143 -3.641 10.501 -8.024 1.00 71.25 H new ATOM 0 HG3 GLU A 143 -4.415 9.817 -6.608 1.00 71.25 H new ATOM 2238 N THR A 144 -0.161 10.052 -4.312 1.00 71.31 N ATOM 2239 CA THR A 144 1.011 10.462 -3.548 1.00 11.11 C ATOM 2240 C THR A 144 2.273 10.384 -4.400 1.00 0.31 C ATOM 2241 O THR A 144 2.223 10.003 -5.569 1.00 73.41 O ATOM 2242 CB THR A 144 1.167 9.585 -2.304 1.00 52.35 C ATOM 2243 OG1 THR A 144 1.642 8.297 -2.655 1.00 4.33 O ATOM 2244 CG2 THR A 144 -0.124 9.403 -1.535 1.00 43.42 C ATOM 0 H THR A 144 0.001 9.270 -4.947 1.00 71.31 H new ATOM 0 HA THR A 144 0.867 11.497 -3.239 1.00 11.11 H new ATOM 0 HB THR A 144 1.880 10.110 -1.668 1.00 52.35 H new ATOM 0 HG1 THR A 144 1.737 7.752 -1.846 1.00 4.33 H new ATOM 0 HG21 THR A 144 0.057 8.771 -0.665 1.00 43.42 H new ATOM 0 HG22 THR A 144 -0.492 10.375 -1.207 1.00 43.42 H new ATOM 0 HG23 THR A 144 -0.867 8.931 -2.178 1.00 43.42 H new ATOM 2252 N SER A 145 3.405 10.749 -3.805 1.00 43.34 N ATOM 2253 CA SER A 145 4.682 10.721 -4.508 1.00 14.45 C ATOM 2254 C SER A 145 5.820 10.382 -3.552 1.00 52.31 C ATOM 2255 O SER A 145 6.086 11.118 -2.602 1.00 72.12 O ATOM 2256 CB SER A 145 4.948 12.070 -5.178 1.00 45.23 C ATOM 2257 OG SER A 145 4.455 13.138 -4.388 1.00 52.34 O ATOM 0 H SER A 145 3.463 11.067 -2.838 1.00 43.34 H new ATOM 0 HA SER A 145 4.631 9.947 -5.274 1.00 14.45 H new ATOM 0 HB2 SER A 145 6.019 12.196 -5.337 1.00 45.23 H new ATOM 0 HB3 SER A 145 4.475 12.091 -6.160 1.00 45.23 H new ATOM 0 HG SER A 145 5.198 13.721 -4.126 1.00 52.34 H new ATOM 2263 N ALA A 146 6.489 9.263 -3.808 1.00 50.13 N ATOM 2264 CA ALA A 146 7.598 8.826 -2.969 1.00 62.44 C ATOM 2265 C ALA A 146 8.792 9.769 -3.089 1.00 0.32 C ATOM 2266 O ALA A 146 9.639 9.828 -2.198 1.00 13.21 O ATOM 2267 CB ALA A 146 8.005 7.406 -3.334 1.00 15.31 C ATOM 0 H ALA A 146 6.282 8.642 -4.590 1.00 50.13 H new ATOM 0 HA ALA A 146 7.263 8.844 -1.932 1.00 62.44 H new ATOM 0 HB1 ALA A 146 8.834 7.091 -2.701 1.00 15.31 H new ATOM 0 HB2 ALA A 146 7.159 6.735 -3.185 1.00 15.31 H new ATOM 0 HB3 ALA A 146 8.314 7.373 -4.379 1.00 15.31 H new ATOM 2273 N LYS A 147 8.857 10.503 -4.196 1.00 63.24 N ATOM 2274 CA LYS A 147 9.951 11.439 -4.428 1.00 13.33 C ATOM 2275 C LYS A 147 9.689 12.774 -3.737 1.00 20.44 C ATOM 2276 O LYS A 147 10.446 13.190 -2.861 1.00 22.02 O ATOM 2277 CB LYS A 147 10.151 11.660 -5.929 1.00 14.54 C ATOM 2278 CG LYS A 147 11.527 12.198 -6.287 1.00 23.33 C ATOM 2279 CD LYS A 147 12.566 11.089 -6.322 1.00 75.21 C ATOM 2280 CE LYS A 147 13.970 11.643 -6.510 1.00 34.33 C ATOM 2281 NZ LYS A 147 14.681 10.982 -7.639 1.00 11.52 N ATOM 0 H LYS A 147 8.166 10.467 -4.945 1.00 63.24 H new ATOM 0 HA LYS A 147 10.858 11.006 -4.005 1.00 13.33 H new ATOM 0 HB2 LYS A 147 9.992 10.716 -6.451 1.00 14.54 H new ATOM 0 HB3 LYS A 147 9.393 12.355 -6.290 1.00 14.54 H new ATOM 0 HG2 LYS A 147 11.485 12.690 -7.259 1.00 23.33 H new ATOM 0 HG3 LYS A 147 11.824 12.954 -5.560 1.00 23.33 H new ATOM 0 HD2 LYS A 147 12.521 10.518 -5.395 1.00 75.21 H new ATOM 0 HD3 LYS A 147 12.335 10.399 -7.133 1.00 75.21 H new ATOM 0 HE2 LYS A 147 13.915 12.716 -6.694 1.00 34.33 H new ATOM 0 HE3 LYS A 147 14.541 11.506 -5.591 1.00 34.33 H new ATOM 0 HZ1 LYS A 147 15.634 11.388 -7.734 1.00 11.52 H new ATOM 0 HZ2 LYS A 147 14.756 9.962 -7.452 1.00 11.52 H new ATOM 0 HZ3 LYS A 147 14.150 11.134 -8.520 1.00 11.52 H new ATOM 2295 N THR A 148 8.614 13.443 -4.141 1.00 22.02 N ATOM 2296 CA THR A 148 8.255 14.735 -3.564 1.00 44.33 C ATOM 2297 C THR A 148 7.631 14.572 -2.180 1.00 62.15 C ATOM 2298 O THR A 148 7.592 15.520 -1.395 1.00 5.11 O ATOM 2299 CB THR A 148 7.287 15.480 -4.485 1.00 11.32 C ATOM 2300 OG1 THR A 148 6.361 14.583 -5.076 1.00 73.40 O ATOM 2301 CG2 THR A 148 7.981 16.232 -5.601 1.00 62.24 C ATOM 0 H THR A 148 7.976 13.113 -4.865 1.00 22.02 H new ATOM 0 HA THR A 148 9.171 15.316 -3.459 1.00 44.33 H new ATOM 0 HB THR A 148 6.779 16.202 -3.845 1.00 11.32 H new ATOM 0 HG1 THR A 148 5.521 15.053 -5.259 1.00 73.40 H new ATOM 0 HG21 THR A 148 7.237 16.738 -6.217 1.00 62.24 H new ATOM 0 HG22 THR A 148 8.661 16.969 -5.175 1.00 62.24 H new ATOM 0 HG23 THR A 148 8.545 15.531 -6.216 1.00 62.24 H new ATOM 2309 N ARG A 149 7.141 13.371 -1.884 1.00 24.25 N ATOM 2310 CA ARG A 149 6.519 13.099 -0.593 1.00 32.41 C ATOM 2311 C ARG A 149 5.286 13.976 -0.394 1.00 42.52 C ATOM 2312 O ARG A 149 5.246 14.817 0.505 1.00 63.52 O ATOM 2313 CB ARG A 149 7.522 13.333 0.541 1.00 11.01 C ATOM 2314 CG ARG A 149 6.937 13.118 1.929 1.00 51.21 C ATOM 2315 CD ARG A 149 7.145 14.334 2.818 1.00 74.21 C ATOM 2316 NE ARG A 149 6.137 14.421 3.872 1.00 4.10 N ATOM 2317 CZ ARG A 149 6.075 15.412 4.759 1.00 61.04 C ATOM 2318 NH1 ARG A 149 6.961 16.400 4.723 1.00 2.24 N ATOM 2319 NH2 ARG A 149 5.126 15.416 5.684 1.00 72.15 N ATOM 0 H ARG A 149 7.163 12.573 -2.519 1.00 24.25 H new ATOM 0 HA ARG A 149 6.207 12.055 -0.577 1.00 32.41 H new ATOM 0 HB2 ARG A 149 8.371 12.663 0.407 1.00 11.01 H new ATOM 0 HB3 ARG A 149 7.905 14.351 0.471 1.00 11.01 H new ATOM 0 HG2 ARG A 149 5.871 12.905 1.846 1.00 51.21 H new ATOM 0 HG3 ARG A 149 7.402 12.246 2.389 1.00 51.21 H new ATOM 0 HD2 ARG A 149 8.137 14.289 3.268 1.00 74.21 H new ATOM 0 HD3 ARG A 149 7.112 15.238 2.209 1.00 74.21 H new ATOM 0 HE ARG A 149 5.440 13.679 3.932 1.00 4.10 H new ATOM 0 HH11 ARG A 149 7.694 16.402 4.013 1.00 2.24 H new ATOM 0 HH12 ARG A 149 6.909 17.157 5.405 1.00 2.24 H new ATOM 0 HH21 ARG A 149 4.443 14.660 5.717 1.00 72.15 H new ATOM 0 HH22 ARG A 149 5.079 16.175 6.363 1.00 72.15 H new ATOM 2333 N GLN A 150 4.282 13.775 -1.241 1.00 41.40 N ATOM 2334 CA GLN A 150 3.047 14.547 -1.164 1.00 64.23 C ATOM 2335 C GLN A 150 1.869 13.655 -0.786 1.00 12.00 C ATOM 2336 O GLN A 150 1.548 12.700 -1.493 1.00 33.45 O ATOM 2337 CB GLN A 150 2.773 15.239 -2.501 1.00 44.13 C ATOM 2338 CG GLN A 150 1.474 16.028 -2.528 1.00 42.50 C ATOM 2339 CD GLN A 150 1.639 17.402 -3.142 1.00 71.44 C ATOM 2340 OE1 GLN A 150 1.573 18.418 -2.450 1.00 75.00 O ATOM 2341 NE2 GLN A 150 1.853 17.439 -4.451 1.00 62.42 N ATOM 0 H GLN A 150 4.300 13.083 -1.990 1.00 41.40 H new ATOM 0 HA GLN A 150 3.167 15.303 -0.388 1.00 64.23 H new ATOM 0 HB2 GLN A 150 3.600 15.911 -2.728 1.00 44.13 H new ATOM 0 HB3 GLN A 150 2.747 14.487 -3.290 1.00 44.13 H new ATOM 0 HG2 GLN A 150 0.726 15.470 -3.091 1.00 42.50 H new ATOM 0 HG3 GLN A 150 1.095 16.132 -1.511 1.00 42.50 H new ATOM 0 HE21 GLN A 150 1.900 16.571 -4.985 1.00 62.42 H new ATOM 0 HE22 GLN A 150 1.970 18.335 -4.923 1.00 62.42 H new ATOM 2350 N GLY A 151 1.226 13.976 0.333 1.00 40.02 N ATOM 2351 CA GLY A 151 0.088 13.197 0.786 1.00 13.44 C ATOM 2352 C GLY A 151 0.415 11.725 0.950 1.00 33.32 C ATOM 2353 O GLY A 151 -0.461 10.870 0.818 1.00 73.04 O ATOM 0 H GLY A 151 1.473 14.762 0.934 1.00 40.02 H new ATOM 0 HA2 GLY A 151 -0.264 13.595 1.738 1.00 13.44 H new ATOM 0 HA3 GLY A 151 -0.729 13.306 0.073 1.00 13.44 H new ATOM 2357 N VAL A 152 1.678 11.428 1.238 1.00 73.33 N ATOM 2358 CA VAL A 152 2.117 10.050 1.420 1.00 22.12 C ATOM 2359 C VAL A 152 1.320 9.362 2.524 1.00 31.14 C ATOM 2360 O VAL A 152 0.712 8.315 2.303 1.00 41.42 O ATOM 2361 CB VAL A 152 3.617 9.978 1.762 1.00 71.43 C ATOM 2362 CG1 VAL A 152 4.091 8.533 1.790 1.00 50.54 C ATOM 2363 CG2 VAL A 152 4.429 10.795 0.768 1.00 55.25 C ATOM 0 H VAL A 152 2.415 12.124 1.350 1.00 73.33 H new ATOM 0 HA VAL A 152 1.944 9.535 0.475 1.00 22.12 H new ATOM 0 HB VAL A 152 3.766 10.402 2.755 1.00 71.43 H new ATOM 0 HG11 VAL A 152 5.153 8.503 2.033 1.00 50.54 H new ATOM 0 HG12 VAL A 152 3.530 7.981 2.544 1.00 50.54 H new ATOM 0 HG13 VAL A 152 3.930 8.078 0.813 1.00 50.54 H new ATOM 0 HG21 VAL A 152 5.487 10.733 1.024 1.00 55.25 H new ATOM 0 HG22 VAL A 152 4.276 10.402 -0.237 1.00 55.25 H new ATOM 0 HG23 VAL A 152 4.107 11.836 0.804 1.00 55.25 H new ATOM 2373 N GLU A 153 1.327 9.958 3.711 1.00 72.21 N ATOM 2374 CA GLU A 153 0.602 9.402 4.848 1.00 15.41 C ATOM 2375 C GLU A 153 -0.904 9.458 4.611 1.00 43.45 C ATOM 2376 O GLU A 153 -1.655 8.634 5.133 1.00 72.21 O ATOM 2377 CB GLU A 153 0.956 10.160 6.129 1.00 53.41 C ATOM 2378 CG GLU A 153 2.451 10.299 6.361 1.00 62.42 C ATOM 2379 CD GLU A 153 2.828 10.160 7.823 1.00 71.44 C ATOM 2380 OE1 GLU A 153 2.128 10.745 8.676 1.00 53.22 O ATOM 2381 OE2 GLU A 153 3.824 9.465 8.116 1.00 62.24 O ATOM 0 H GLU A 153 1.826 10.825 3.911 1.00 72.21 H new ATOM 0 HA GLU A 153 0.898 8.359 4.959 1.00 15.41 H new ATOM 0 HB2 GLU A 153 0.509 11.153 6.088 1.00 53.41 H new ATOM 0 HB3 GLU A 153 0.511 9.645 6.980 1.00 53.41 H new ATOM 0 HG2 GLU A 153 2.977 9.542 5.780 1.00 62.42 H new ATOM 0 HG3 GLU A 153 2.783 11.270 5.994 1.00 62.42 H new ATOM 2388 N ASP A 154 -1.339 10.435 3.820 1.00 22.04 N ATOM 2389 CA ASP A 154 -2.756 10.597 3.513 1.00 60.22 C ATOM 2390 C ASP A 154 -3.337 9.313 2.927 1.00 52.42 C ATOM 2391 O ASP A 154 -4.499 8.982 3.163 1.00 55.32 O ATOM 2392 CB ASP A 154 -2.957 11.758 2.536 1.00 75.34 C ATOM 2393 CG ASP A 154 -4.017 12.734 3.008 1.00 22.13 C ATOM 2394 OD1 ASP A 154 -3.806 13.378 4.058 1.00 72.40 O ATOM 2395 OD2 ASP A 154 -5.058 12.854 2.329 1.00 60.40 O ATOM 0 H ASP A 154 -0.731 11.126 3.380 1.00 22.04 H new ATOM 0 HA ASP A 154 -3.282 10.819 4.442 1.00 60.22 H new ATOM 0 HB2 ASP A 154 -2.013 12.287 2.405 1.00 75.34 H new ATOM 0 HB3 ASP A 154 -3.239 11.363 1.560 1.00 75.34 H new ATOM 2400 N ALA A 155 -2.519 8.594 2.166 1.00 41.41 N ATOM 2401 CA ALA A 155 -2.950 7.346 1.549 1.00 73.42 C ATOM 2402 C ALA A 155 -3.007 6.221 2.578 1.00 20.21 C ATOM 2403 O ALA A 155 -3.924 5.399 2.565 1.00 1.53 O ATOM 2404 CB ALA A 155 -2.019 6.974 0.404 1.00 75.12 C ATOM 0 H ALA A 155 -1.554 8.854 1.962 1.00 41.41 H new ATOM 0 HA ALA A 155 -3.954 7.491 1.150 1.00 73.42 H new ATOM 0 HB1 ALA A 155 -2.353 6.040 -0.048 1.00 75.12 H new ATOM 0 HB2 ALA A 155 -2.031 7.765 -0.346 1.00 75.12 H new ATOM 0 HB3 ALA A 155 -1.005 6.851 0.785 1.00 75.12 H new ATOM 2410 N PHE A 156 -2.021 6.192 3.469 1.00 23.20 N ATOM 2411 CA PHE A 156 -1.958 5.170 4.507 1.00 10.03 C ATOM 2412 C PHE A 156 -3.079 5.359 5.522 1.00 33.14 C ATOM 2413 O PHE A 156 -3.809 4.420 5.841 1.00 12.21 O ATOM 2414 CB PHE A 156 -0.604 5.218 5.217 1.00 62.32 C ATOM 2415 CG PHE A 156 0.476 4.455 4.504 1.00 51.12 C ATOM 2416 CD1 PHE A 156 0.563 3.078 4.624 1.00 34.43 C ATOM 2417 CD2 PHE A 156 1.403 5.116 3.715 1.00 74.12 C ATOM 2418 CE1 PHE A 156 1.556 2.373 3.971 1.00 51.51 C ATOM 2419 CE2 PHE A 156 2.398 4.417 3.059 1.00 5.14 C ATOM 2420 CZ PHE A 156 2.475 3.044 3.187 1.00 74.04 C ATOM 0 H PHE A 156 -1.255 6.865 3.493 1.00 23.20 H new ATOM 0 HA PHE A 156 -2.079 4.197 4.032 1.00 10.03 H new ATOM 0 HB2 PHE A 156 -0.294 6.258 5.321 1.00 62.32 H new ATOM 0 HB3 PHE A 156 -0.717 4.817 6.224 1.00 62.32 H new ATOM 0 HD1 PHE A 156 -0.154 2.549 5.235 1.00 34.43 H new ATOM 0 HD2 PHE A 156 1.347 6.190 3.611 1.00 74.12 H new ATOM 0 HE1 PHE A 156 1.614 1.299 4.073 1.00 51.51 H new ATOM 0 HE2 PHE A 156 3.115 4.944 2.447 1.00 5.14 H new ATOM 0 HZ PHE A 156 3.252 2.496 2.675 1.00 74.04 H new ATOM 2430 N TYR A 157 -3.210 6.582 6.028 1.00 42.33 N ATOM 2431 CA TYR A 157 -4.241 6.900 7.010 1.00 50.54 C ATOM 2432 C TYR A 157 -5.626 6.517 6.495 1.00 15.23 C ATOM 2433 O TYR A 157 -6.497 6.120 7.268 1.00 55.03 O ATOM 2434 CB TYR A 157 -4.207 8.391 7.353 1.00 65.35 C ATOM 2435 CG TYR A 157 -2.981 8.809 8.134 1.00 21.52 C ATOM 2436 CD1 TYR A 157 -2.471 8.007 9.149 1.00 64.11 C ATOM 2437 CD2 TYR A 157 -2.332 10.005 7.856 1.00 34.02 C ATOM 2438 CE1 TYR A 157 -1.351 8.386 9.864 1.00 23.32 C ATOM 2439 CE2 TYR A 157 -1.211 10.391 8.567 1.00 20.12 C ATOM 2440 CZ TYR A 157 -0.725 9.579 9.569 1.00 63.33 C ATOM 2441 OH TYR A 157 0.390 9.960 10.278 1.00 3.41 O ATOM 0 H TYR A 157 -2.614 7.370 5.774 1.00 42.33 H new ATOM 0 HA TYR A 157 -4.037 6.321 7.911 1.00 50.54 H new ATOM 0 HB2 TYR A 157 -4.252 8.968 6.429 1.00 65.35 H new ATOM 0 HB3 TYR A 157 -5.097 8.642 7.930 1.00 65.35 H new ATOM 0 HD1 TYR A 157 -2.959 7.072 9.382 1.00 64.11 H new ATOM 0 HD2 TYR A 157 -2.709 10.644 7.071 1.00 34.02 H new ATOM 0 HE1 TYR A 157 -0.968 7.752 10.650 1.00 23.32 H new ATOM 0 HE2 TYR A 157 -0.718 11.325 8.338 1.00 20.12 H new ATOM 0 HH TYR A 157 1.186 9.856 9.716 1.00 3.41 H new ATOM 2451 N THR A 158 -5.821 6.639 5.186 1.00 5.22 N ATOM 2452 CA THR A 158 -7.094 6.305 4.569 1.00 54.11 C ATOM 2453 C THR A 158 -7.467 4.851 4.843 1.00 62.43 C ATOM 2454 O THR A 158 -8.642 4.521 5.004 1.00 1.03 O ATOM 2455 CB THR A 158 -7.022 6.554 3.063 1.00 33.05 C ATOM 2456 OG1 THR A 158 -6.697 7.906 2.794 1.00 53.43 O ATOM 2457 CG2 THR A 158 -8.312 6.243 2.345 1.00 31.12 C ATOM 0 H THR A 158 -5.110 6.968 4.533 1.00 5.22 H new ATOM 0 HA THR A 158 -7.865 6.942 5.003 1.00 54.11 H new ATOM 0 HB THR A 158 -6.248 5.880 2.695 1.00 33.05 H new ATOM 0 HG1 THR A 158 -5.761 8.071 3.033 1.00 53.43 H new ATOM 0 HG21 THR A 158 -8.193 6.441 1.280 1.00 31.12 H new ATOM 0 HG22 THR A 158 -8.567 5.193 2.492 1.00 31.12 H new ATOM 0 HG23 THR A 158 -9.110 6.869 2.743 1.00 31.12 H new ATOM 2465 N LEU A 159 -6.458 3.987 4.897 1.00 1.41 N ATOM 2466 CA LEU A 159 -6.681 2.570 5.155 1.00 25.00 C ATOM 2467 C LEU A 159 -7.091 2.342 6.606 1.00 0.53 C ATOM 2468 O LEU A 159 -7.904 1.466 6.901 1.00 71.52 O ATOM 2469 CB LEU A 159 -5.419 1.765 4.835 1.00 22.43 C ATOM 2470 CG LEU A 159 -5.562 0.247 4.976 1.00 62.32 C ATOM 2471 CD1 LEU A 159 -6.779 -0.251 4.212 1.00 1.33 C ATOM 2472 CD2 LEU A 159 -4.302 -0.453 4.489 1.00 11.41 C ATOM 0 H LEU A 159 -5.480 4.244 4.766 1.00 1.41 H new ATOM 0 HA LEU A 159 -7.491 2.231 4.509 1.00 25.00 H new ATOM 0 HB2 LEU A 159 -5.112 1.992 3.814 1.00 22.43 H new ATOM 0 HB3 LEU A 159 -4.617 2.101 5.492 1.00 22.43 H new ATOM 0 HG LEU A 159 -5.702 0.012 6.031 1.00 62.32 H new ATOM 0 HD11 LEU A 159 -6.862 -1.332 4.325 1.00 1.33 H new ATOM 0 HD12 LEU A 159 -7.676 0.225 4.607 1.00 1.33 H new ATOM 0 HD13 LEU A 159 -6.672 -0.004 3.156 1.00 1.33 H new ATOM 0 HD21 LEU A 159 -4.420 -1.531 4.596 1.00 11.41 H new ATOM 0 HD22 LEU A 159 -4.132 -0.209 3.440 1.00 11.41 H new ATOM 0 HD23 LEU A 159 -3.449 -0.121 5.081 1.00 11.41 H new ATOM 2484 N VAL A 160 -6.528 3.140 7.509 1.00 35.22 N ATOM 2485 CA VAL A 160 -6.840 3.027 8.928 1.00 33.11 C ATOM 2486 C VAL A 160 -8.334 3.201 9.173 1.00 33.33 C ATOM 2487 O VAL A 160 -8.955 2.406 9.880 1.00 73.12 O ATOM 2488 CB VAL A 160 -6.071 4.073 9.758 1.00 4.22 C ATOM 2489 CG1 VAL A 160 -6.279 3.833 11.245 1.00 43.13 C ATOM 2490 CG2 VAL A 160 -4.591 4.051 9.410 1.00 45.41 C ATOM 0 H VAL A 160 -5.854 3.871 7.282 1.00 35.22 H new ATOM 0 HA VAL A 160 -6.534 2.029 9.242 1.00 33.11 H new ATOM 0 HB VAL A 160 -6.463 5.061 9.514 1.00 4.22 H new ATOM 0 HG11 VAL A 160 -5.728 4.581 11.815 1.00 43.13 H new ATOM 0 HG12 VAL A 160 -7.341 3.906 11.480 1.00 43.13 H new ATOM 0 HG13 VAL A 160 -5.917 2.839 11.507 1.00 43.13 H new ATOM 0 HG21 VAL A 160 -4.066 4.797 10.007 1.00 45.41 H new ATOM 0 HG22 VAL A 160 -4.182 3.063 9.622 1.00 45.41 H new ATOM 0 HG23 VAL A 160 -4.463 4.277 8.352 1.00 45.41 H new ATOM 2500 N ARG A 161 -8.907 4.244 8.582 1.00 2.21 N ATOM 2501 CA ARG A 161 -10.330 4.522 8.733 1.00 21.51 C ATOM 2502 C ARG A 161 -11.168 3.431 8.074 1.00 63.22 C ATOM 2503 O ARG A 161 -12.291 3.157 8.498 1.00 45.34 O ATOM 2504 CB ARG A 161 -10.673 5.884 8.125 1.00 42.11 C ATOM 2505 CG ARG A 161 -9.712 6.990 8.530 1.00 44.22 C ATOM 2506 CD ARG A 161 -10.411 8.339 8.594 1.00 5.12 C ATOM 2507 NE ARG A 161 -9.882 9.183 9.648 1.00 15.42 N ATOM 2508 CZ ARG A 161 -10.303 10.419 9.870 1.00 34.12 C ATOM 2509 NH1 ARG A 161 -11.254 10.955 9.114 1.00 72.14 N ATOM 2510 NH2 ARG A 161 -9.774 11.121 10.848 1.00 31.30 N ATOM 0 H ARG A 161 -8.407 4.911 7.994 1.00 2.21 H new ATOM 0 HA ARG A 161 -10.561 4.540 9.798 1.00 21.51 H new ATOM 0 HB2 ARG A 161 -10.677 5.797 7.038 1.00 42.11 H new ATOM 0 HB3 ARG A 161 -11.683 6.163 8.426 1.00 42.11 H new ATOM 0 HG2 ARG A 161 -9.277 6.758 9.502 1.00 44.22 H new ATOM 0 HG3 ARG A 161 -8.890 7.039 7.816 1.00 44.22 H new ATOM 0 HD2 ARG A 161 -10.303 8.847 7.636 1.00 5.12 H new ATOM 0 HD3 ARG A 161 -11.478 8.186 8.755 1.00 5.12 H new ATOM 0 HE ARG A 161 -9.149 8.806 10.249 1.00 15.42 H new ATOM 0 HH11 ARG A 161 -11.667 10.414 8.354 1.00 72.14 H new ATOM 0 HH12 ARG A 161 -11.571 11.908 9.293 1.00 72.14 H new ATOM 0 HH21 ARG A 161 -9.043 10.713 11.431 1.00 31.30 H new ATOM 0 HH22 ARG A 161 -10.094 12.073 11.023 1.00 31.30 H new ATOM 2524 N GLU A 162 -10.615 2.810 7.037 1.00 70.41 N ATOM 2525 CA GLU A 162 -11.312 1.748 6.322 1.00 40.32 C ATOM 2526 C GLU A 162 -11.385 0.482 7.170 1.00 62.30 C ATOM 2527 O GLU A 162 -12.468 -0.054 7.410 1.00 74.02 O ATOM 2528 CB GLU A 162 -10.610 1.450 4.995 1.00 32.42 C ATOM 2529 CG GLU A 162 -11.570 1.221 3.839 1.00 65.23 C ATOM 2530 CD GLU A 162 -12.203 2.506 3.344 1.00 4.01 C ATOM 2531 OE1 GLU A 162 -11.595 3.580 3.536 1.00 71.13 O ATOM 2532 OE2 GLU A 162 -13.307 2.439 2.763 1.00 71.30 O ATOM 0 H GLU A 162 -9.686 3.024 6.673 1.00 70.41 H new ATOM 0 HA GLU A 162 -12.328 2.086 6.117 1.00 40.32 H new ATOM 0 HB2 GLU A 162 -9.949 2.281 4.748 1.00 32.42 H new ATOM 0 HB3 GLU A 162 -9.982 0.567 5.116 1.00 32.42 H new ATOM 0 HG2 GLU A 162 -11.036 0.743 3.017 1.00 65.23 H new ATOM 0 HG3 GLU A 162 -12.354 0.532 4.153 1.00 65.23 H new ATOM 2539 N ILE A 163 -10.228 0.010 7.625 1.00 3.11 N ATOM 2540 CA ILE A 163 -10.159 -1.184 8.446 1.00 42.04 C ATOM 2541 C ILE A 163 -10.975 -1.018 9.724 1.00 42.24 C ATOM 2542 O ILE A 163 -11.819 -1.853 10.048 1.00 40.30 O ATOM 2543 CB ILE A 163 -8.704 -1.496 8.806 1.00 31.41 C ATOM 2544 CG1 ILE A 163 -7.875 -1.652 7.542 1.00 42.22 C ATOM 2545 CG2 ILE A 163 -8.608 -2.754 9.645 1.00 64.51 C ATOM 2546 CD1 ILE A 163 -6.419 -1.843 7.837 1.00 44.21 C ATOM 0 H ILE A 163 -9.324 0.442 7.435 1.00 3.11 H new ATOM 0 HA ILE A 163 -10.576 -2.010 7.871 1.00 42.04 H new ATOM 0 HB ILE A 163 -8.314 -0.664 9.392 1.00 31.41 H new ATOM 0 HG12 ILE A 163 -8.243 -2.505 6.972 1.00 42.22 H new ATOM 0 HG13 ILE A 163 -8.004 -0.770 6.915 1.00 42.22 H new ATOM 0 HG21 ILE A 163 -7.564 -2.952 9.886 1.00 64.51 H new ATOM 0 HG22 ILE A 163 -9.174 -2.621 10.567 1.00 64.51 H new ATOM 0 HG23 ILE A 163 -9.017 -3.596 9.086 1.00 64.51 H new ATOM 0 HD11 ILE A 163 -5.869 -1.950 6.902 1.00 44.21 H new ATOM 0 HD12 ILE A 163 -6.042 -0.978 8.383 1.00 44.21 H new ATOM 0 HD13 ILE A 163 -6.285 -2.740 8.441 1.00 44.21 H new ATOM 2558 N ARG A 164 -10.717 0.071 10.443 1.00 32.43 N ATOM 2559 CA ARG A 164 -11.427 0.359 11.688 1.00 1.25 C ATOM 2560 C ARG A 164 -12.934 0.200 11.507 1.00 33.32 C ATOM 2561 O ARG A 164 -13.641 -0.211 12.427 1.00 5.21 O ATOM 2562 CB ARG A 164 -11.111 1.779 12.162 1.00 4.22 C ATOM 2563 CG ARG A 164 -9.821 1.886 12.959 1.00 35.25 C ATOM 2564 CD ARG A 164 -9.765 3.180 13.756 1.00 14.12 C ATOM 2565 NE ARG A 164 -9.941 4.355 12.906 1.00 2.42 N ATOM 2566 CZ ARG A 164 -10.292 5.555 13.363 1.00 73.15 C ATOM 2567 NH1 ARG A 164 -10.506 5.743 14.659 1.00 3.34 N ATOM 2568 NH2 ARG A 164 -10.428 6.570 12.521 1.00 43.22 N ATOM 0 H ARG A 164 -10.021 0.770 10.185 1.00 32.43 H new ATOM 0 HA ARG A 164 -11.091 -0.355 12.440 1.00 1.25 H new ATOM 0 HB2 ARG A 164 -11.047 2.436 11.295 1.00 4.22 H new ATOM 0 HB3 ARG A 164 -11.937 2.140 12.775 1.00 4.22 H new ATOM 0 HG2 ARG A 164 -9.739 1.036 13.637 1.00 35.25 H new ATOM 0 HG3 ARG A 164 -8.968 1.837 12.282 1.00 35.25 H new ATOM 0 HD2 ARG A 164 -10.540 3.168 14.522 1.00 14.12 H new ATOM 0 HD3 ARG A 164 -8.807 3.246 14.272 1.00 14.12 H new ATOM 0 HE ARG A 164 -9.786 4.250 11.903 1.00 2.42 H new ATOM 0 HH11 ARG A 164 -10.402 4.966 15.311 1.00 3.34 H new ATOM 0 HH12 ARG A 164 -10.775 6.665 15.003 1.00 3.34 H new ATOM 0 HH21 ARG A 164 -10.264 6.431 11.524 1.00 43.22 H new ATOM 0 HH22 ARG A 164 -10.697 7.490 12.870 1.00 43.22 H new ATOM 2582 N GLN A 165 -13.418 0.530 10.314 1.00 22.31 N ATOM 2583 CA GLN A 165 -14.840 0.426 10.008 1.00 25.32 C ATOM 2584 C GLN A 165 -15.208 -1.002 9.617 1.00 53.23 C ATOM 2585 O GLN A 165 -16.320 -1.460 9.877 1.00 74.13 O ATOM 2586 CB GLN A 165 -15.209 1.388 8.879 1.00 4.13 C ATOM 2587 CG GLN A 165 -15.679 2.748 9.369 1.00 14.13 C ATOM 2588 CD GLN A 165 -16.844 3.286 8.563 1.00 63.45 C ATOM 2589 OE1 GLN A 165 -17.778 3.870 9.112 1.00 50.20 O ATOM 2590 NE2 GLN A 165 -16.794 3.091 7.250 1.00 22.43 N ATOM 0 H GLN A 165 -12.845 0.872 9.542 1.00 22.31 H new ATOM 0 HA GLN A 165 -15.401 0.694 10.903 1.00 25.32 H new ATOM 0 HB2 GLN A 165 -14.343 1.524 8.231 1.00 4.13 H new ATOM 0 HB3 GLN A 165 -15.995 0.938 8.272 1.00 4.13 H new ATOM 0 HG2 GLN A 165 -15.971 2.672 10.416 1.00 14.13 H new ATOM 0 HG3 GLN A 165 -14.850 3.454 9.319 1.00 14.13 H new ATOM 0 HE21 GLN A 165 -16.000 2.601 6.837 1.00 22.43 H new ATOM 0 HE22 GLN A 165 -17.549 3.431 6.655 1.00 22.43 H new ATOM 2599 N HIS A 166 -14.266 -1.699 8.990 1.00 32.12 N ATOM 2600 CA HIS A 166 -14.490 -3.075 8.562 1.00 72.44 C ATOM 2601 C HIS A 166 -13.588 -4.037 9.330 1.00 51.40 C ATOM 2602 O HIS A 166 -14.021 -4.532 10.392 1.00 43.04 O ATOM 2603 CB HIS A 166 -14.241 -3.209 7.057 1.00 23.24 C ATOM 2604 CG HIS A 166 -15.458 -3.607 6.282 1.00 31.14 C ATOM 2605 ND1 HIS A 166 -16.079 -2.774 5.375 1.00 54.41 N ATOM 2606 CD2 HIS A 166 -16.172 -4.758 6.281 1.00 63.41 C ATOM 2607 CE1 HIS A 166 -17.121 -3.394 4.851 1.00 2.42 C ATOM 2608 NE2 HIS A 166 -17.198 -4.600 5.384 1.00 11.34 N ATOM 2609 OXT HIS A 166 -12.457 -4.288 8.863 1.00 71.02 O ATOM 0 H HIS A 166 -13.340 -1.333 8.767 1.00 32.12 H new ATOM 0 HA HIS A 166 -15.527 -3.333 8.775 1.00 72.44 H new ATOM 0 HB2 HIS A 166 -13.870 -2.259 6.672 1.00 23.24 H new ATOM 0 HB3 HIS A 166 -13.457 -3.948 6.891 1.00 23.24 H new ATOM 0 HD2 HIS A 166 -15.971 -5.637 6.876 1.00 63.41 H new ATOM 0 HE1 HIS A 166 -17.795 -2.985 4.113 1.00 2.42 H new ATOM 0 HE2 HIS A 166 -17.906 -5.301 5.164 1.00 11.34 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 14.562 0.278 -5.332 1.00 53.24 P HETATM 2620 O1G GNP A 201 13.228 1.162 -5.507 1.00 1.42 O HETATM 2621 O2G GNP A 201 14.560 -0.233 -3.805 1.00 25.40 O HETATM 2622 O3G GNP A 201 15.792 1.020 -5.686 1.00 53.14 O HETATM 2623 N3B GNP A 201 14.341 -1.043 -6.247 1.00 32.10 N HETATM 2624 PB GNP A 201 12.768 -1.439 -6.263 1.00 10.43 P HETATM 2625 O1B GNP A 201 12.646 -2.740 -6.959 1.00 41.40 O HETATM 2626 O2B GNP A 201 12.238 -1.325 -4.887 1.00 52.43 O HETATM 2627 O3A GNP A 201 12.115 -0.286 -7.177 1.00 65.21 O HETATM 2628 PA GNP A 201 12.446 -0.213 -8.751 1.00 51.25 P HETATM 2629 O1A GNP A 201 11.170 -0.201 -9.501 1.00 25.44 O HETATM 2630 O2A GNP A 201 13.429 -1.279 -9.049 1.00 21.21 O HETATM 2631 O5' GNP A 201 13.159 1.223 -8.894 1.00 73.41 O HETATM 2632 C5' GNP A 201 12.361 2.402 -9.028 1.00 50.42 C HETATM 2633 C4' GNP A 201 13.238 3.649 -9.153 1.00 62.45 C HETATM 2634 O4' GNP A 201 12.392 4.813 -9.151 1.00 53.01 O HETATM 2635 C3' GNP A 201 14.094 3.780 -7.893 1.00 12.22 C HETATM 2636 O3' GNP A 201 15.125 4.753 -8.083 1.00 61.25 O HETATM 2637 C2' GNP A 201 13.028 4.307 -6.937 1.00 51.32 C HETATM 2638 O2' GNP A 201 13.649 4.891 -5.789 1.00 22.44 O HETATM 2639 C1' GNP A 201 12.467 5.404 -7.841 1.00 75.40 C HETATM 2640 N9 GNP A 201 11.140 5.862 -7.369 1.00 53.22 N HETATM 2641 C8 GNP A 201 10.356 5.223 -6.503 1.00 30.31 C HETATM 2642 N7 GNP A 201 9.242 5.926 -6.314 1.00 21.10 N HETATM 2643 C5 GNP A 201 9.313 7.021 -7.064 1.00 22.54 C HETATM 2644 C6 GNP A 201 8.452 8.093 -7.260 1.00 1.21 C HETATM 2645 O6 GNP A 201 7.373 8.148 -6.672 1.00 0.21 O HETATM 2646 N1 GNP A 201 8.837 9.110 -8.141 1.00 44.05 N HETATM 2647 C2 GNP A 201 10.072 9.018 -8.795 1.00 42.40 C HETATM 2648 N2 GNP A 201 10.449 9.978 -9.635 1.00 23.11 N HETATM 2649 N3 GNP A 201 10.876 7.967 -8.579 1.00 41.31 N HETATM 2650 C4 GNP A 201 10.526 6.982 -7.739 1.00 22.43 C HETATM 0 HO3' GNP A 201 15.178 5.331 -7.294 1.00 61.25 H new HETATM 0 HO2' GNP A 201 12.959 5.229 -5.180 1.00 22.44 H new HETATM 0 HNB3 GNP A 201 15.079 -1.548 -6.738 1.00 32.10 H new HETATM 0 HN22 GNP A 201 11.348 9.914 -10.113 1.00 23.11 H new HETATM 0 HN21 GNP A 201 9.839 10.779 -9.801 1.00 23.11 H new HETATM 0 H5'2 GNP A 201 11.704 2.501 -8.164 1.00 50.42 H new HETATM 0 H5'1 GNP A 201 11.721 2.314 -9.906 1.00 50.42 H new HETATM 0 HN1 GNP A 201 8.225 9.909 -8.305 1.00 44.05 H new HETATM 0 H8 GNP A 201 10.590 4.272 -6.024 1.00 30.31 H new HETATM 0 H4' GNP A 201 13.839 3.570 -10.059 1.00 62.45 H new HETATM 0 H3' GNP A 201 14.612 2.875 -7.575 1.00 12.22 H new HETATM 0 H2' GNP A 201 12.314 3.579 -6.550 1.00 51.32 H new HETATM 0 H1' GNP A 201 13.098 6.293 -7.841 1.00 75.40 H new HETATM 2664 MG MG A 202 12.699 -0.279 -2.888 1.00 54.21 MG HETATM 2665 C13 KOB A 203 3.768 -12.588 8.575 1.00 34.22 C HETATM 2666 C12 KOB A 203 3.315 -11.574 9.411 1.00 71.42 C HETATM 2667 C11 KOB A 203 4.164 -10.525 9.743 1.00 11.11 C HETATM 2668 F11 KOB A 203 3.730 -9.540 10.554 1.00 12.31 F HETATM 2669 C10 KOB A 203 5.460 -10.488 9.241 1.00 52.45 C HETATM 2670 C9 KOB A 203 5.910 -11.503 8.405 1.00 65.14 C HETATM 2671 C8 KOB A 203 5.062 -12.553 8.069 1.00 74.43 C HETATM 2672 N8 KOB A 203 5.446 -13.518 7.237 1.00 52.13 N HETATM 2673 C7 KOB A 203 6.664 -13.568 6.703 1.00 71.50 C HETATM 2674 S7 KOB A 203 7.879 -12.357 7.048 1.00 12.42 S HETATM 2675 N7 KOB A 203 6.942 -14.576 5.880 1.00 24.02 N HETATM 2676 N6 KOB A 203 6.058 -15.400 5.656 1.00 50.12 N HETATM 2677 C6 KOB A 203 5.876 -16.445 6.459 1.00 30.40 C HETATM 2678 C5 KOB A 203 4.747 -17.233 6.265 1.00 43.13 C HETATM 2679 C4 KOB A 203 4.438 -18.231 7.182 1.00 62.30 C HETATM 2680 C3 KOB A 203 5.252 -18.439 8.289 1.00 11.52 C HETATM 2681 N3 KOB A 203 4.947 -19.388 9.169 1.00 34.21 N HETATM 2682 O3B KOB A 203 5.778 -19.601 10.302 1.00 11.33 O HETATM 2683 O3A KOB A 203 3.789 -20.188 8.978 1.00 1.21 O HETATM 2684 C2 KOB A 203 6.383 -17.653 8.478 1.00 3.12 C HETATM 2685 C1 KOB A 203 6.699 -16.658 7.561 1.00 44.44 C HETATM 2686 N1 KOB A 203 7.840 -15.990 7.713 1.00 31.20 N HETATM 2687 O1B KOB A 203 8.298 -15.087 6.716 1.00 30.14 O HETATM 2688 O1A KOB A 203 8.644 -16.228 8.860 1.00 42.51 O HETATM 0 HE2 KOB A 203 2.299 -11.601 9.804 1.00 71.42 H new HETATM 0 HE1 KOB A 203 6.123 -9.663 9.503 1.00 52.45 H new HETATM 0 HD2 KOB A 203 3.106 -13.414 8.315 1.00 34.22 H new HETATM 0 HD1 KOB A 203 6.927 -11.476 8.013 1.00 65.14 H new HETATM 0 HAD KOB A 203 4.778 -14.251 6.998 1.00 52.13 H new HETATM 0 HAC KOB A 203 7.862 -14.662 5.448 1.00 24.02 H new HETATM 0 HAB KOB A 203 5.455 -15.281 4.842 1.00 50.12 H new HETATM 0 H5 KOB A 203 4.107 -17.069 5.398 1.00 43.13 H new HETATM 0 H4 KOB A 203 3.555 -18.852 7.032 1.00 62.30 H new HETATM 0 H2 KOB A 203 7.022 -17.817 9.346 1.00 3.12 H new HETATM 2699 O HOH A 301 12.247 1.853 -3.634 1.00 72.41 O HETATM 2702 O HOH A 302 12.916 -2.264 -1.903 1.00 71.03 O HETATM 2705 O HOH A 303 13.245 1.035 -1.154 1.00 14.04 O