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 147 LYS NZ :NH3+ -148:sc= 0.174 (180deg=0) USER MOD Set 1.2: A 201 GNP O2' : rot -146:sc= 1.94 USER MOD Set 2.1: A 145 SER OG : rot -137:sc= 0.129 USER MOD Set 2.2: A 148 THR OG1 : rot 180:sc= 0.506 USER MOD Set 3.1: A 94 HIS : no HD1:sc= 0.65 K(o=0.69,f=-6.2!) USER MOD Set 3.2: A 137 TYR OH : rot 31:sc= 0.0413 USER MOD Set 4.1: A 87 THR OG1 : rot -29:sc= 1.25 USER MOD Set 4.2: A 124 THR OG1 : rot -116:sc= 1.35 USER MOD Set 5.1: A 72 MET CE :methyl -166:sc= -2! (180deg=-2.58!) USER MOD Set 5.2: A 99 GLN : amide:sc= -0.372 K(o=-2.4,f=-5) USER MOD Set 6.1: A 67 MET CE :methyl -176:sc= -2.17 (180deg=-1.6) USER MOD Set 6.2: A 71 TYR OH : rot -174:sc= 0.659 USER MOD Set 7.1: A 25 GLN : amide:sc= 0 X(o=-0.066,f=-0.066) USER MOD Set 7.2: A 27 HIS : no HE2:sc= -0.0663 K(o=-0.066,f=-6.4!) USER MOD Single : A 1 MET CE :methyl -150:sc= -0.33 (180deg=-1.29) USER MOD Single : A 1 MET N :NH3+ -128:sc= 1.4 (180deg=-0.0503) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= -1.09 USER MOD Single : A 5 LYS NZ :NH3+ -162:sc= -0.247 (180deg=-0.836) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 69:sc= 0.777 USER MOD Single : A 22 GLN : amide:sc= -0.288 K(o=-0.29,f=-2.2) USER MOD Single : A 26 ASN : amide:sc= -0.203 K(o=-0.2,f=-0.94) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -91:sc= 0.136 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= -1.8! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.136 F(o=-1.6,f=-0.14) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 14:sc= -0.158 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0893 USER MOD Single : A 70 GLN :FLIP amide:sc= -0.957 F(o=-1.6,f=-0.96) USER MOD Single : A 74 THR OG1 : rot -10:sc= -0.94! USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -2.1 K(o=-2.1,f=-5.2!) USER MOD Single : A 86 ASN : amide:sc= -0.0256 X(o=-0.026,f=-0.22) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -75:sc= 1.74 USER MOD Single : A 95 GLN : amide:sc= -1.05 K(o=-1,f=-3.6!) USER MOD Single : A 96 TYR OH : rot -79:sc= -0.247 USER MOD Single : A 101 LYS NZ :NH3+ 144:sc= -0.285 (180deg=-1.66) 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 -160:sc= -7.47! (180deg=-10.5!) USER MOD Single : A 116 ASN : amide:sc= -4.57 K(o=-4.6,f=-8.9!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 89:sc= -0.41 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0135 USER MOD Single : A 129 GLN : amide:sc= -0.0967 K(o=-0.097,f=-0.6) 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= -0.076 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= -0.58 USER MOD Single : A 158 THR OG1 : rot -11:sc= -0.301 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.0914 X(o=-0.091,f=-0.47) USER MOD Single : A 201 GNP O3' : rot 131:sc= 0.0983 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.564 -3.043 22.698 1.00 72.41 N ATOM 2 CA MET A 1 -3.923 -2.309 21.457 1.00 62.12 C ATOM 3 C MET A 1 -4.339 -3.271 20.348 1.00 74.43 C ATOM 4 O MET A 1 -4.200 -4.486 20.483 1.00 44.45 O ATOM 5 CB MET A 1 -2.716 -1.481 21.013 1.00 53.01 C ATOM 6 CG MET A 1 -1.504 -2.321 20.645 1.00 10.14 C ATOM 7 SD MET A 1 -0.514 -2.780 22.080 1.00 74.33 S ATOM 8 CE MET A 1 -0.003 -1.168 22.670 1.00 52.11 C ATOM 0 H1 MET A 1 -4.094 -2.648 23.501 1.00 72.41 H new ATOM 0 H2 MET A 1 -3.802 -4.049 22.587 1.00 72.41 H new ATOM 0 H3 MET A 1 -2.544 -2.947 22.876 1.00 72.41 H new ATOM 0 HA MET A 1 -4.772 -1.656 21.661 1.00 62.12 H new ATOM 0 HB2 MET A 1 -3.000 -0.872 20.155 1.00 53.01 H new ATOM 0 HB3 MET A 1 -2.442 -0.795 21.814 1.00 53.01 H new ATOM 0 HG2 MET A 1 -1.835 -3.225 20.133 1.00 10.14 H new ATOM 0 HG3 MET A 1 -0.882 -1.766 19.942 1.00 10.14 H new ATOM 0 HE1 MET A 1 0.968 -1.250 23.158 1.00 52.11 H new ATOM 0 HE2 MET A 1 0.071 -0.479 21.828 1.00 52.11 H new ATOM 0 HE3 MET A 1 -0.737 -0.792 23.383 1.00 52.11 H new ATOM 18 N THR A 2 -4.850 -2.718 19.253 1.00 64.44 N ATOM 19 CA THR A 2 -5.287 -3.527 18.122 1.00 14.30 C ATOM 20 C THR A 2 -4.157 -3.690 17.106 1.00 10.13 C ATOM 21 O THR A 2 -3.305 -2.813 16.962 1.00 31.30 O ATOM 22 CB THR A 2 -6.528 -2.894 17.469 1.00 61.35 C ATOM 23 OG1 THR A 2 -7.627 -3.786 17.525 1.00 15.01 O ATOM 24 CG2 THR A 2 -6.339 -2.499 16.017 1.00 71.14 C ATOM 0 H THR A 2 -4.971 -1.713 19.125 1.00 64.44 H new ATOM 0 HA THR A 2 -5.556 -4.520 18.484 1.00 14.30 H new ATOM 0 HB THR A 2 -6.709 -1.985 18.043 1.00 61.35 H new ATOM 0 HG1 THR A 2 -8.409 -3.368 17.107 1.00 15.01 H new ATOM 0 HG21 THR A 2 -7.262 -2.061 15.636 1.00 71.14 H new ATOM 0 HG22 THR A 2 -5.533 -1.769 15.940 1.00 71.14 H new ATOM 0 HG23 THR A 2 -6.086 -3.382 15.430 1.00 71.14 H new ATOM 32 N GLU A 3 -4.159 -4.819 16.404 1.00 23.35 N ATOM 33 CA GLU A 3 -3.137 -5.098 15.402 1.00 14.53 C ATOM 34 C GLU A 3 -3.685 -4.881 13.995 1.00 41.33 C ATOM 35 O GLU A 3 -4.513 -5.654 13.514 1.00 45.33 O ATOM 36 CB GLU A 3 -2.625 -6.533 15.551 1.00 55.21 C ATOM 37 CG GLU A 3 -1.235 -6.622 16.161 1.00 44.41 C ATOM 38 CD GLU A 3 -0.769 -8.053 16.343 1.00 51.21 C ATOM 39 OE1 GLU A 3 -1.264 -8.937 15.612 1.00 32.11 O ATOM 40 OE2 GLU A 3 0.091 -8.291 17.217 1.00 15.11 O ATOM 0 H GLU A 3 -4.857 -5.555 16.511 1.00 23.35 H new ATOM 0 HA GLU A 3 -2.308 -4.408 15.560 1.00 14.53 H new ATOM 0 HB2 GLU A 3 -3.322 -7.096 16.172 1.00 55.21 H new ATOM 0 HB3 GLU A 3 -2.614 -7.010 14.571 1.00 55.21 H new ATOM 0 HG2 GLU A 3 -0.528 -6.092 15.523 1.00 44.41 H new ATOM 0 HG3 GLU A 3 -1.233 -6.117 17.127 1.00 44.41 H new ATOM 47 N TYR A 4 -3.216 -3.824 13.339 1.00 25.03 N ATOM 48 CA TYR A 4 -3.658 -3.506 11.987 1.00 30.44 C ATOM 49 C TYR A 4 -2.674 -4.038 10.953 1.00 34.31 C ATOM 50 O TYR A 4 -1.535 -3.578 10.868 1.00 40.21 O ATOM 51 CB TYR A 4 -3.820 -1.994 11.823 1.00 74.51 C ATOM 52 CG TYR A 4 -5.130 -1.464 12.357 1.00 32.32 C ATOM 53 CD1 TYR A 4 -6.342 -1.965 11.900 1.00 75.31 C ATOM 54 CD2 TYR A 4 -5.155 -0.464 13.321 1.00 4.22 C ATOM 55 CE1 TYR A 4 -7.543 -1.484 12.387 1.00 71.31 C ATOM 56 CE2 TYR A 4 -6.351 0.022 13.814 1.00 54.21 C ATOM 57 CZ TYR A 4 -7.542 -0.491 13.343 1.00 1.23 C ATOM 58 OH TYR A 4 -8.735 -0.009 13.831 1.00 62.11 O ATOM 0 H TYR A 4 -2.530 -3.174 13.722 1.00 25.03 H new ATOM 0 HA TYR A 4 -4.622 -3.988 11.825 1.00 30.44 H new ATOM 0 HB2 TYR A 4 -2.999 -1.492 12.335 1.00 74.51 H new ATOM 0 HB3 TYR A 4 -3.739 -1.741 10.766 1.00 74.51 H new ATOM 0 HD1 TYR A 4 -6.346 -2.744 11.151 1.00 75.31 H new ATOM 0 HD2 TYR A 4 -4.224 -0.060 13.691 1.00 4.22 H new ATOM 0 HE1 TYR A 4 -8.477 -1.884 12.020 1.00 71.31 H new ATOM 0 HE2 TYR A 4 -6.353 0.799 14.564 1.00 54.21 H new ATOM 0 HH TYR A 4 -8.558 0.686 14.499 1.00 62.11 H new ATOM 68 N LYS A 5 -3.121 -5.011 10.167 1.00 11.24 N ATOM 69 CA LYS A 5 -2.281 -5.609 9.137 1.00 51.43 C ATOM 70 C LYS A 5 -2.296 -4.764 7.867 1.00 12.53 C ATOM 71 O LYS A 5 -3.231 -4.840 7.070 1.00 51.31 O ATOM 72 CB LYS A 5 -2.756 -7.029 8.825 1.00 1.24 C ATOM 73 CG LYS A 5 -1.690 -8.091 9.043 1.00 53.51 C ATOM 74 CD LYS A 5 -0.971 -8.430 7.748 1.00 2.33 C ATOM 75 CE LYS A 5 0.256 -9.293 7.993 1.00 32.41 C ATOM 76 NZ LYS A 5 0.989 -8.892 9.227 1.00 20.24 N ATOM 0 H LYS A 5 -4.061 -5.402 10.224 1.00 11.24 H new ATOM 0 HA LYS A 5 -1.259 -5.650 9.513 1.00 51.43 H new ATOM 0 HB2 LYS A 5 -3.619 -7.259 9.449 1.00 1.24 H new ATOM 0 HB3 LYS A 5 -3.092 -7.071 7.789 1.00 1.24 H new ATOM 0 HG2 LYS A 5 -0.968 -7.738 9.780 1.00 53.51 H new ATOM 0 HG3 LYS A 5 -2.149 -8.991 9.452 1.00 53.51 H new ATOM 0 HD2 LYS A 5 -1.655 -8.952 7.079 1.00 2.33 H new ATOM 0 HD3 LYS A 5 -0.674 -7.510 7.246 1.00 2.33 H new ATOM 0 HE2 LYS A 5 -0.047 -10.337 8.075 1.00 32.41 H new ATOM 0 HE3 LYS A 5 0.925 -9.222 7.136 1.00 32.41 H new ATOM 0 HZ1 LYS A 5 1.954 -9.280 9.199 1.00 20.24 H new ATOM 0 HZ2 LYS A 5 1.034 -7.854 9.282 1.00 20.24 H new ATOM 0 HZ3 LYS A 5 0.491 -9.262 10.062 1.00 20.24 H new ATOM 90 N LEU A 6 -1.254 -3.961 7.684 1.00 60.14 N ATOM 91 CA LEU A 6 -1.148 -3.104 6.510 1.00 3.11 C ATOM 92 C LEU A 6 -0.440 -3.833 5.372 1.00 14.43 C ATOM 93 O LEU A 6 0.789 -3.851 5.303 1.00 33.14 O ATOM 94 CB LEU A 6 -0.393 -1.820 6.859 1.00 11.44 C ATOM 95 CG LEU A 6 -1.265 -0.674 7.379 1.00 52.02 C ATOM 96 CD1 LEU A 6 -2.147 -0.127 6.267 1.00 13.41 C ATOM 97 CD2 LEU A 6 -2.111 -1.140 8.554 1.00 14.42 C ATOM 0 H LEU A 6 -0.471 -3.886 8.334 1.00 60.14 H new ATOM 0 HA LEU A 6 -2.155 -2.846 6.182 1.00 3.11 H new ATOM 0 HB2 LEU A 6 0.360 -2.053 7.612 1.00 11.44 H new ATOM 0 HB3 LEU A 6 0.139 -1.477 5.971 1.00 11.44 H new ATOM 0 HG LEU A 6 -0.612 0.128 7.723 1.00 52.02 H new ATOM 0 HD11 LEU A 6 -2.760 0.687 6.655 1.00 13.41 H new ATOM 0 HD12 LEU A 6 -1.521 0.245 5.456 1.00 13.41 H new ATOM 0 HD13 LEU A 6 -2.793 -0.920 5.892 1.00 13.41 H new ATOM 0 HD21 LEU A 6 -2.725 -0.313 8.911 1.00 14.42 H new ATOM 0 HD22 LEU A 6 -2.756 -1.959 8.236 1.00 14.42 H new ATOM 0 HD23 LEU A 6 -1.460 -1.482 9.358 1.00 14.42 H new ATOM 109 N VAL A 7 -1.223 -4.433 4.481 1.00 51.02 N ATOM 110 CA VAL A 7 -0.674 -5.163 3.348 1.00 14.54 C ATOM 111 C VAL A 7 -0.360 -4.223 2.190 1.00 33.23 C ATOM 112 O VAL A 7 -1.258 -3.799 1.462 1.00 12.25 O ATOM 113 CB VAL A 7 -1.650 -6.250 2.860 1.00 64.10 C ATOM 114 CG1 VAL A 7 -0.960 -7.184 1.882 1.00 53.10 C ATOM 115 CG2 VAL A 7 -2.223 -7.028 4.036 1.00 32.14 C ATOM 0 H VAL A 7 -2.242 -4.427 4.524 1.00 51.02 H new ATOM 0 HA VAL A 7 0.247 -5.635 3.689 1.00 14.54 H new ATOM 0 HB VAL A 7 -2.476 -5.762 2.343 1.00 64.10 H new ATOM 0 HG11 VAL A 7 -1.664 -7.946 1.548 1.00 53.10 H new ATOM 0 HG12 VAL A 7 -0.606 -6.614 1.023 1.00 53.10 H new ATOM 0 HG13 VAL A 7 -0.113 -7.664 2.373 1.00 53.10 H new ATOM 0 HG21 VAL A 7 -2.910 -7.790 3.668 1.00 32.14 H new ATOM 0 HG22 VAL A 7 -1.412 -7.505 4.586 1.00 32.14 H new ATOM 0 HG23 VAL A 7 -2.758 -6.346 4.697 1.00 32.14 H new ATOM 125 N VAL A 8 0.918 -3.898 2.027 1.00 42.24 N ATOM 126 CA VAL A 8 1.350 -3.006 0.962 1.00 61.23 C ATOM 127 C VAL A 8 1.572 -3.766 -0.341 1.00 42.02 C ATOM 128 O VAL A 8 2.492 -4.578 -0.448 1.00 2.22 O ATOM 129 CB VAL A 8 2.650 -2.275 1.343 1.00 42.24 C ATOM 130 CG1 VAL A 8 2.977 -1.202 0.320 1.00 63.43 C ATOM 131 CG2 VAL A 8 2.539 -1.678 2.738 1.00 3.41 C ATOM 0 H VAL A 8 1.673 -4.241 2.621 1.00 42.24 H new ATOM 0 HA VAL A 8 0.554 -2.275 0.819 1.00 61.23 H new ATOM 0 HB VAL A 8 3.465 -2.999 1.348 1.00 42.24 H new ATOM 0 HG11 VAL A 8 3.899 -0.696 0.606 1.00 63.43 H new ATOM 0 HG12 VAL A 8 3.104 -1.661 -0.661 1.00 63.43 H new ATOM 0 HG13 VAL A 8 2.163 -0.478 0.279 1.00 63.43 H new ATOM 0 HG21 VAL A 8 3.468 -1.165 2.989 1.00 3.41 H new ATOM 0 HG22 VAL A 8 1.713 -0.967 2.765 1.00 3.41 H new ATOM 0 HG23 VAL A 8 2.356 -2.473 3.461 1.00 3.41 H new ATOM 141 N VAL A 9 0.727 -3.496 -1.331 1.00 71.22 N ATOM 142 CA VAL A 9 0.834 -4.153 -2.628 1.00 0.42 C ATOM 143 C VAL A 9 1.308 -3.176 -3.700 1.00 42.40 C ATOM 144 O VAL A 9 1.617 -2.021 -3.407 1.00 63.52 O ATOM 145 CB VAL A 9 -0.511 -4.773 -3.059 1.00 41.13 C ATOM 146 CG1 VAL A 9 -1.012 -5.745 -2.003 1.00 20.23 C ATOM 147 CG2 VAL A 9 -1.546 -3.688 -3.327 1.00 21.21 C ATOM 0 H VAL A 9 -0.039 -2.827 -1.259 1.00 71.22 H new ATOM 0 HA VAL A 9 1.569 -4.951 -2.521 1.00 0.42 H new ATOM 0 HB VAL A 9 -0.352 -5.324 -3.986 1.00 41.13 H new ATOM 0 HG11 VAL A 9 -1.962 -6.173 -2.324 1.00 20.23 H new ATOM 0 HG12 VAL A 9 -0.282 -6.543 -1.867 1.00 20.23 H new ATOM 0 HG13 VAL A 9 -1.152 -5.217 -1.060 1.00 20.23 H new ATOM 0 HG21 VAL A 9 -2.486 -4.149 -3.629 1.00 21.21 H new ATOM 0 HG22 VAL A 9 -1.703 -3.103 -2.421 1.00 21.21 H new ATOM 0 HG23 VAL A 9 -1.190 -3.034 -4.123 1.00 21.21 H new ATOM 157 N GLY A 10 1.363 -3.646 -4.942 1.00 42.04 N ATOM 158 CA GLY A 10 1.800 -2.799 -6.037 1.00 22.34 C ATOM 159 C GLY A 10 2.922 -3.424 -6.841 1.00 60.42 C ATOM 160 O GLY A 10 3.576 -4.361 -6.382 1.00 22.32 O ATOM 0 H GLY A 10 1.113 -4.598 -5.210 1.00 42.04 H new ATOM 0 HA2 GLY A 10 0.955 -2.596 -6.695 1.00 22.34 H new ATOM 0 HA3 GLY A 10 2.132 -1.840 -5.640 1.00 22.34 H new ATOM 164 N ALA A 11 3.147 -2.904 -8.043 1.00 43.43 N ATOM 165 CA ALA A 11 4.198 -3.417 -8.913 1.00 4.40 C ATOM 166 C ALA A 11 5.572 -3.244 -8.275 1.00 61.54 C ATOM 167 O ALA A 11 5.726 -2.513 -7.296 1.00 0.33 O ATOM 168 CB ALA A 11 4.150 -2.721 -10.264 1.00 63.41 C ATOM 0 H ALA A 11 2.615 -2.128 -8.437 1.00 43.43 H new ATOM 0 HA ALA A 11 4.026 -4.483 -9.059 1.00 4.40 H new ATOM 0 HB1 ALA A 11 4.940 -3.114 -10.904 1.00 63.41 H new ATOM 0 HB2 ALA A 11 3.182 -2.900 -10.732 1.00 63.41 H new ATOM 0 HB3 ALA A 11 4.293 -1.649 -10.126 1.00 63.41 H new ATOM 174 N GLY A 12 6.568 -3.922 -8.836 1.00 20.24 N ATOM 175 CA GLY A 12 7.918 -3.832 -8.311 1.00 64.01 C ATOM 176 C GLY A 12 8.528 -2.451 -8.481 1.00 71.00 C ATOM 177 O GLY A 12 9.581 -2.162 -7.913 1.00 14.23 O ATOM 0 H GLY A 12 6.464 -4.533 -9.646 1.00 20.24 H new ATOM 0 HA2 GLY A 12 7.909 -4.092 -7.252 1.00 64.01 H new ATOM 0 HA3 GLY A 12 8.548 -4.566 -8.814 1.00 64.01 H new ATOM 181 N GLY A 13 7.872 -1.596 -9.262 1.00 14.54 N ATOM 182 CA GLY A 13 8.384 -0.255 -9.482 1.00 21.03 C ATOM 183 C GLY A 13 7.316 0.811 -9.325 1.00 52.45 C ATOM 184 O GLY A 13 7.070 1.591 -10.245 1.00 54.32 O ATOM 0 H GLY A 13 6.998 -1.807 -9.744 1.00 14.54 H new ATOM 0 HA2 GLY A 13 9.193 -0.059 -8.779 1.00 21.03 H new ATOM 0 HA3 GLY A 13 8.810 -0.193 -10.483 1.00 21.03 H new ATOM 188 N VAL A 14 6.680 0.846 -8.157 1.00 75.21 N ATOM 189 CA VAL A 14 5.633 1.827 -7.887 1.00 64.13 C ATOM 190 C VAL A 14 5.981 2.714 -6.690 1.00 43.51 C ATOM 191 O VAL A 14 5.256 3.661 -6.383 1.00 44.54 O ATOM 192 CB VAL A 14 4.278 1.141 -7.627 1.00 72.11 C ATOM 193 CG1 VAL A 14 3.852 0.326 -8.838 1.00 31.43 C ATOM 194 CG2 VAL A 14 4.347 0.266 -6.384 1.00 64.02 C ATOM 0 H VAL A 14 6.871 0.208 -7.384 1.00 75.21 H new ATOM 0 HA VAL A 14 5.557 2.451 -8.777 1.00 64.13 H new ATOM 0 HB VAL A 14 3.529 1.914 -7.455 1.00 72.11 H new ATOM 0 HG11 VAL A 14 2.893 -0.151 -8.636 1.00 31.43 H new ATOM 0 HG12 VAL A 14 3.756 0.982 -9.703 1.00 31.43 H new ATOM 0 HG13 VAL A 14 4.601 -0.438 -9.044 1.00 31.43 H new ATOM 0 HG21 VAL A 14 3.380 -0.209 -6.219 1.00 64.02 H new ATOM 0 HG22 VAL A 14 5.109 -0.501 -6.521 1.00 64.02 H new ATOM 0 HG23 VAL A 14 4.602 0.880 -5.520 1.00 64.02 H new ATOM 204 N GLY A 15 7.087 2.407 -6.016 1.00 33.43 N ATOM 205 CA GLY A 15 7.495 3.193 -4.866 1.00 22.14 C ATOM 206 C GLY A 15 6.704 2.857 -3.615 1.00 41.13 C ATOM 207 O GLY A 15 6.625 3.664 -2.688 1.00 11.31 O ATOM 0 H GLY A 15 7.706 1.630 -6.246 1.00 33.43 H new ATOM 0 HA2 GLY A 15 8.555 3.027 -4.676 1.00 22.14 H new ATOM 0 HA3 GLY A 15 7.374 4.252 -5.094 1.00 22.14 H new ATOM 211 N LYS A 16 6.115 1.665 -3.587 1.00 71.41 N ATOM 212 CA LYS A 16 5.327 1.227 -2.440 1.00 3.35 C ATOM 213 C LYS A 16 6.222 0.950 -1.235 1.00 13.41 C ATOM 214 O LYS A 16 5.864 1.260 -0.099 1.00 70.43 O ATOM 215 CB LYS A 16 4.526 -0.028 -2.795 1.00 41.30 C ATOM 216 CG LYS A 16 5.383 -1.172 -3.315 1.00 55.24 C ATOM 217 CD LYS A 16 5.623 -2.223 -2.244 1.00 14.31 C ATOM 218 CE LYS A 16 4.436 -3.163 -2.108 1.00 62.41 C ATOM 219 NZ LYS A 16 4.598 -4.387 -2.941 1.00 53.11 N ATOM 0 H LYS A 16 6.169 0.985 -4.346 1.00 71.41 H new ATOM 0 HA LYS A 16 4.637 2.029 -2.178 1.00 3.35 H new ATOM 0 HB2 LYS A 16 3.984 -0.364 -1.911 1.00 41.30 H new ATOM 0 HB3 LYS A 16 3.781 0.228 -3.548 1.00 41.30 H new ATOM 0 HG2 LYS A 16 4.894 -1.632 -4.174 1.00 55.24 H new ATOM 0 HG3 LYS A 16 6.339 -0.782 -3.663 1.00 55.24 H new ATOM 0 HD2 LYS A 16 6.516 -2.797 -2.490 1.00 14.31 H new ATOM 0 HD3 LYS A 16 5.812 -1.733 -1.289 1.00 14.31 H new ATOM 0 HE2 LYS A 16 4.317 -3.448 -1.063 1.00 62.41 H new ATOM 0 HE3 LYS A 16 3.525 -2.642 -2.402 1.00 62.41 H new ATOM 0 HZ1 LYS A 16 3.768 -5.002 -2.820 1.00 53.11 H new ATOM 0 HZ2 LYS A 16 4.686 -4.117 -3.941 1.00 53.11 H new ATOM 0 HZ3 LYS A 16 5.453 -4.898 -2.644 1.00 53.11 H new ATOM 233 N SER A 17 7.385 0.361 -1.492 1.00 43.02 N ATOM 234 CA SER A 17 8.331 0.038 -0.430 1.00 71.44 C ATOM 235 C SER A 17 8.994 1.298 0.121 1.00 42.44 C ATOM 236 O SER A 17 9.435 1.326 1.270 1.00 75.42 O ATOM 237 CB SER A 17 9.398 -0.928 -0.949 1.00 51.15 C ATOM 238 OG SER A 17 8.884 -1.750 -1.983 1.00 53.35 O ATOM 0 H SER A 17 7.695 0.097 -2.427 1.00 43.02 H new ATOM 0 HA SER A 17 7.778 -0.438 0.379 1.00 71.44 H new ATOM 0 HB2 SER A 17 10.254 -0.364 -1.320 1.00 51.15 H new ATOM 0 HB3 SER A 17 9.758 -1.551 -0.130 1.00 51.15 H new ATOM 244 N ALA A 18 9.065 2.337 -0.705 1.00 22.11 N ATOM 245 CA ALA A 18 9.677 3.597 -0.299 1.00 24.25 C ATOM 246 C ALA A 18 8.973 4.190 0.918 1.00 41.45 C ATOM 247 O ALA A 18 9.572 4.336 1.983 1.00 41.11 O ATOM 248 CB ALA A 18 9.661 4.587 -1.453 1.00 2.41 C ATOM 0 H ALA A 18 8.706 2.331 -1.660 1.00 22.11 H new ATOM 0 HA ALA A 18 10.711 3.393 -0.021 1.00 24.25 H new ATOM 0 HB1 ALA A 18 10.121 5.523 -1.136 1.00 2.41 H new ATOM 0 HB2 ALA A 18 10.219 4.175 -2.294 1.00 2.41 H new ATOM 0 HB3 ALA A 18 8.631 4.774 -1.758 1.00 2.41 H new ATOM 254 N LEU A 19 7.699 4.533 0.750 1.00 71.43 N ATOM 255 CA LEU A 19 6.913 5.116 1.833 1.00 70.20 C ATOM 256 C LEU A 19 6.897 4.205 3.058 1.00 55.34 C ATOM 257 O LEU A 19 6.777 4.674 4.190 1.00 20.31 O ATOM 258 CB LEU A 19 5.481 5.382 1.366 1.00 42.14 C ATOM 259 CG LEU A 19 4.867 4.276 0.500 1.00 3.55 C ATOM 260 CD1 LEU A 19 3.552 3.796 1.095 1.00 70.11 C ATOM 261 CD2 LEU A 19 4.662 4.767 -0.925 1.00 0.30 C ATOM 0 H LEU A 19 7.189 4.417 -0.126 1.00 71.43 H new ATOM 0 HA LEU A 19 7.381 6.059 2.114 1.00 70.20 H new ATOM 0 HB2 LEU A 19 4.850 5.529 2.243 1.00 42.14 H new ATOM 0 HB3 LEU A 19 5.466 6.315 0.802 1.00 42.14 H new ATOM 0 HG LEU A 19 5.559 3.434 0.478 1.00 3.55 H new ATOM 0 HD11 LEU A 19 3.133 3.011 0.465 1.00 70.11 H new ATOM 0 HD12 LEU A 19 3.728 3.403 2.096 1.00 70.11 H new ATOM 0 HD13 LEU A 19 2.852 4.630 1.150 1.00 70.11 H new ATOM 0 HD21 LEU A 19 4.225 3.969 -1.526 1.00 0.30 H new ATOM 0 HD22 LEU A 19 3.991 5.626 -0.921 1.00 0.30 H new ATOM 0 HD23 LEU A 19 5.622 5.058 -1.351 1.00 0.30 H new ATOM 273 N THR A 20 7.016 2.902 2.825 1.00 23.40 N ATOM 274 CA THR A 20 7.011 1.927 3.911 1.00 24.30 C ATOM 275 C THR A 20 8.071 2.261 4.957 1.00 3.41 C ATOM 276 O THR A 20 7.797 2.249 6.157 1.00 22.32 O ATOM 277 CB THR A 20 7.248 0.519 3.362 1.00 2.12 C ATOM 278 OG1 THR A 20 6.333 0.226 2.321 1.00 1.34 O ATOM 279 CG2 THR A 20 7.112 -0.562 4.411 1.00 11.03 C ATOM 0 H THR A 20 7.117 2.496 1.895 1.00 23.40 H new ATOM 0 HA THR A 20 6.033 1.965 4.390 1.00 24.30 H new ATOM 0 HB THR A 20 8.275 0.520 2.996 1.00 2.12 H new ATOM 0 HG1 THR A 20 6.538 0.780 1.539 1.00 1.34 H new ATOM 0 HG21 THR A 20 7.292 -1.536 3.956 1.00 11.03 H new ATOM 0 HG22 THR A 20 7.840 -0.392 5.205 1.00 11.03 H new ATOM 0 HG23 THR A 20 6.106 -0.538 4.830 1.00 11.03 H new ATOM 287 N ILE A 21 9.281 2.559 4.496 1.00 74.33 N ATOM 288 CA ILE A 21 10.377 2.895 5.388 1.00 63.34 C ATOM 289 C ILE A 21 10.210 4.310 5.942 1.00 5.13 C ATOM 290 O ILE A 21 10.595 4.591 7.076 1.00 11.34 O ATOM 291 CB ILE A 21 11.735 2.763 4.660 1.00 72.23 C ATOM 292 CG1 ILE A 21 12.219 1.314 4.709 1.00 54.21 C ATOM 293 CG2 ILE A 21 12.778 3.692 5.262 1.00 55.22 C ATOM 294 CD1 ILE A 21 11.237 0.326 4.117 1.00 3.25 C ATOM 0 H ILE A 21 9.525 2.574 3.506 1.00 74.33 H new ATOM 0 HA ILE A 21 10.360 2.193 6.221 1.00 63.34 H new ATOM 0 HB ILE A 21 11.591 3.055 3.620 1.00 72.23 H new ATOM 0 HG12 ILE A 21 13.165 1.238 4.174 1.00 54.21 H new ATOM 0 HG13 ILE A 21 12.416 1.041 5.746 1.00 54.21 H new ATOM 0 HG21 ILE A 21 13.721 3.575 4.728 1.00 55.22 H new ATOM 0 HG22 ILE A 21 12.438 4.724 5.177 1.00 55.22 H new ATOM 0 HG23 ILE A 21 12.923 3.443 6.313 1.00 55.22 H new ATOM 0 HD11 ILE A 21 11.648 -0.681 4.186 1.00 3.25 H new ATOM 0 HD12 ILE A 21 10.297 0.373 4.667 1.00 3.25 H new ATOM 0 HD13 ILE A 21 11.058 0.573 3.071 1.00 3.25 H new ATOM 306 N GLN A 22 9.630 5.193 5.135 1.00 2.22 N ATOM 307 CA GLN A 22 9.410 6.574 5.549 1.00 64.14 C ATOM 308 C GLN A 22 8.538 6.628 6.799 1.00 54.31 C ATOM 309 O GLN A 22 8.873 7.303 7.773 1.00 4.40 O ATOM 310 CB GLN A 22 8.754 7.370 4.419 1.00 54.43 C ATOM 311 CG GLN A 22 9.747 7.923 3.410 1.00 1.22 C ATOM 312 CD GLN A 22 10.605 9.033 3.985 1.00 24.15 C ATOM 313 OE1 GLN A 22 10.389 9.480 5.111 1.00 72.53 O ATOM 314 NE2 GLN A 22 11.585 9.485 3.211 1.00 45.12 N ATOM 0 H GLN A 22 9.305 4.977 4.193 1.00 2.22 H new ATOM 0 HA GLN A 22 10.378 7.020 5.780 1.00 64.14 H new ATOM 0 HB2 GLN A 22 8.041 6.729 3.901 1.00 54.43 H new ATOM 0 HB3 GLN A 22 8.187 8.196 4.849 1.00 54.43 H new ATOM 0 HG2 GLN A 22 10.390 7.116 3.059 1.00 1.22 H new ATOM 0 HG3 GLN A 22 9.206 8.300 2.542 1.00 1.22 H new ATOM 0 HE21 GLN A 22 11.728 9.085 2.284 1.00 45.12 H new ATOM 0 HE22 GLN A 22 12.195 10.232 3.544 1.00 45.12 H new ATOM 323 N LEU A 23 7.423 5.907 6.766 1.00 21.31 N ATOM 324 CA LEU A 23 6.504 5.865 7.897 1.00 22.12 C ATOM 325 C LEU A 23 7.184 5.257 9.119 1.00 23.43 C ATOM 326 O LEU A 23 7.305 5.901 10.161 1.00 53.35 O ATOM 327 CB LEU A 23 5.257 5.054 7.535 1.00 61.23 C ATOM 328 CG LEU A 23 4.317 4.751 8.703 1.00 63.41 C ATOM 329 CD1 LEU A 23 3.860 6.041 9.365 1.00 64.35 C ATOM 330 CD2 LEU A 23 3.124 3.938 8.228 1.00 62.44 C ATOM 0 H LEU A 23 7.133 5.343 5.967 1.00 21.31 H new ATOM 0 HA LEU A 23 6.207 6.886 8.136 1.00 22.12 H new ATOM 0 HB2 LEU A 23 4.699 5.596 6.772 1.00 61.23 H new ATOM 0 HB3 LEU A 23 5.573 4.111 7.089 1.00 61.23 H new ATOM 0 HG LEU A 23 4.860 4.161 9.442 1.00 63.41 H new ATOM 0 HD11 LEU A 23 3.192 5.808 10.194 1.00 64.35 H new ATOM 0 HD12 LEU A 23 4.727 6.585 9.740 1.00 64.35 H new ATOM 0 HD13 LEU A 23 3.333 6.657 8.636 1.00 64.35 H new ATOM 0 HD21 LEU A 23 2.465 3.731 9.072 1.00 62.44 H new ATOM 0 HD22 LEU A 23 2.578 4.501 7.471 1.00 62.44 H new ATOM 0 HD23 LEU A 23 3.472 2.998 7.800 1.00 62.44 H new ATOM 342 N ILE A 24 7.625 4.012 8.981 1.00 42.42 N ATOM 343 CA ILE A 24 8.296 3.308 10.069 1.00 44.22 C ATOM 344 C ILE A 24 9.499 4.100 10.573 1.00 50.33 C ATOM 345 O ILE A 24 9.557 4.484 11.741 1.00 25.22 O ATOM 346 CB ILE A 24 8.759 1.904 9.627 1.00 54.53 C ATOM 347 CG1 ILE A 24 7.566 1.077 9.142 1.00 34.25 C ATOM 348 CG2 ILE A 24 9.473 1.190 10.768 1.00 61.11 C ATOM 349 CD1 ILE A 24 6.621 0.671 10.252 1.00 4.50 C ATOM 0 H ILE A 24 7.530 3.467 8.124 1.00 42.42 H new ATOM 0 HA ILE A 24 7.572 3.203 10.877 1.00 44.22 H new ATOM 0 HB ILE A 24 9.461 2.018 8.801 1.00 54.53 H new ATOM 0 HG12 ILE A 24 7.014 1.652 8.398 1.00 34.25 H new ATOM 0 HG13 ILE A 24 7.934 0.181 8.643 1.00 34.25 H new ATOM 0 HG21 ILE A 24 9.792 0.202 10.436 1.00 61.11 H new ATOM 0 HG22 ILE A 24 10.345 1.770 11.071 1.00 61.11 H new ATOM 0 HG23 ILE A 24 8.794 1.087 11.614 1.00 61.11 H new ATOM 0 HD11 ILE A 24 5.800 0.088 9.835 1.00 4.50 H new ATOM 0 HD12 ILE A 24 7.158 0.069 10.985 1.00 4.50 H new ATOM 0 HD13 ILE A 24 6.224 1.563 10.736 1.00 4.50 H new ATOM 361 N GLN A 25 10.457 4.341 9.684 1.00 20.43 N ATOM 362 CA GLN A 25 11.656 5.087 10.039 1.00 3.44 C ATOM 363 C GLN A 25 11.583 6.515 9.471 1.00 24.24 C ATOM 364 O GLN A 25 10.606 7.223 9.717 1.00 52.01 O ATOM 365 CB GLN A 25 12.898 4.330 9.550 1.00 42.41 C ATOM 366 CG GLN A 25 12.905 2.863 9.948 1.00 4.31 C ATOM 367 CD GLN A 25 14.212 2.173 9.612 1.00 71.15 C ATOM 368 OE1 GLN A 25 15.249 2.454 10.214 1.00 14.52 O ATOM 369 NE2 GLN A 25 14.170 1.264 8.645 1.00 3.04 N ATOM 0 H GLN A 25 10.425 4.030 8.713 1.00 20.43 H new ATOM 0 HA GLN A 25 11.728 5.177 11.123 1.00 3.44 H new ATOM 0 HB2 GLN A 25 12.956 4.405 8.464 1.00 42.41 H new ATOM 0 HB3 GLN A 25 13.790 4.812 9.951 1.00 42.41 H new ATOM 0 HG2 GLN A 25 12.720 2.780 11.019 1.00 4.31 H new ATOM 0 HG3 GLN A 25 12.087 2.350 9.443 1.00 4.31 H new ATOM 0 HE21 GLN A 25 13.289 1.062 8.173 1.00 3.04 H new ATOM 0 HE22 GLN A 25 15.019 0.767 8.375 1.00 3.04 H new ATOM 378 N ASN A 26 12.598 6.947 8.716 1.00 12.14 N ATOM 379 CA ASN A 26 12.601 8.289 8.140 1.00 32.53 C ATOM 380 C ASN A 26 13.923 8.570 7.432 1.00 71.02 C ATOM 381 O ASN A 26 14.504 9.644 7.583 1.00 2.10 O ATOM 382 CB ASN A 26 12.359 9.341 9.228 1.00 41.23 C ATOM 383 CG ASN A 26 13.171 9.080 10.481 1.00 71.12 C ATOM 384 OD1 ASN A 26 14.389 8.911 10.422 1.00 63.42 O ATOM 385 ND2 ASN A 26 12.498 9.043 11.626 1.00 2.20 N ATOM 0 H ASN A 26 13.422 6.389 8.492 1.00 12.14 H new ATOM 0 HA ASN A 26 11.794 8.344 7.409 1.00 32.53 H new ATOM 0 HB2 ASN A 26 12.608 10.327 8.837 1.00 41.23 H new ATOM 0 HB3 ASN A 26 11.299 9.358 9.483 1.00 41.23 H new ATOM 0 HD21 ASN A 26 12.991 8.869 12.502 1.00 2.20 H new ATOM 0 HD22 ASN A 26 11.488 9.188 11.629 1.00 2.20 H new ATOM 392 N HIS A 27 14.394 7.596 6.660 1.00 22.42 N ATOM 393 CA HIS A 27 15.651 7.741 5.933 1.00 11.13 C ATOM 394 C HIS A 27 15.535 7.222 4.500 1.00 43.53 C ATOM 395 O HIS A 27 16.540 7.090 3.803 1.00 24.21 O ATOM 396 CB HIS A 27 16.768 6.992 6.663 1.00 12.21 C ATOM 397 CG HIS A 27 16.563 5.508 6.707 1.00 51.14 C ATOM 398 ND1 HIS A 27 16.554 4.714 5.578 1.00 1.22 N ATOM 399 CD2 HIS A 27 16.354 4.672 7.753 1.00 40.41 C ATOM 400 CE1 HIS A 27 16.347 3.457 5.927 1.00 10.01 C ATOM 401 NE2 HIS A 27 16.224 3.404 7.240 1.00 62.04 N ATOM 0 H HIS A 27 13.926 6.700 6.522 1.00 22.42 H new ATOM 0 HA HIS A 27 15.888 8.804 5.890 1.00 11.13 H new ATOM 0 HB2 HIS A 27 17.718 7.205 6.173 1.00 12.21 H new ATOM 0 HB3 HIS A 27 16.843 7.371 7.682 1.00 12.21 H new ATOM 0 HD1 HIS A 27 16.687 5.046 4.623 1.00 1.22 H new ATOM 0 HD2 HIS A 27 16.300 4.950 8.795 1.00 40.41 H new ATOM 0 HE1 HIS A 27 16.288 2.616 5.253 1.00 10.01 H new ATOM 410 N PHE A 28 14.312 6.925 4.063 1.00 12.31 N ATOM 411 CA PHE A 28 14.093 6.416 2.713 1.00 62.03 C ATOM 412 C PHE A 28 14.781 5.066 2.536 1.00 0.24 C ATOM 413 O PHE A 28 15.895 4.861 3.017 1.00 41.54 O ATOM 414 CB PHE A 28 14.620 7.415 1.678 1.00 21.35 C ATOM 415 CG PHE A 28 14.006 7.261 0.314 1.00 44.34 C ATOM 416 CD1 PHE A 28 14.289 6.152 -0.467 1.00 71.11 C ATOM 417 CD2 PHE A 28 13.152 8.229 -0.189 1.00 73.31 C ATOM 418 CE1 PHE A 28 13.731 6.010 -1.723 1.00 64.44 C ATOM 419 CE2 PHE A 28 12.590 8.092 -1.444 1.00 62.21 C ATOM 420 CZ PHE A 28 12.881 6.982 -2.212 1.00 43.03 C ATOM 0 H PHE A 28 13.464 7.028 4.621 1.00 12.31 H new ATOM 0 HA PHE A 28 13.022 6.285 2.562 1.00 62.03 H new ATOM 0 HB2 PHE A 28 14.434 8.427 2.037 1.00 21.35 H new ATOM 0 HB3 PHE A 28 15.701 7.300 1.594 1.00 21.35 H new ATOM 0 HD1 PHE A 28 14.954 5.389 -0.089 1.00 71.11 H new ATOM 0 HD2 PHE A 28 12.923 9.100 0.406 1.00 73.31 H new ATOM 0 HE1 PHE A 28 13.959 5.140 -2.321 1.00 64.44 H new ATOM 0 HE2 PHE A 28 11.924 8.852 -1.824 1.00 62.21 H new ATOM 0 HZ PHE A 28 12.444 6.874 -3.194 1.00 43.03 H new ATOM 430 N VAL A 29 14.112 4.143 1.850 1.00 33.53 N ATOM 431 CA VAL A 29 14.668 2.813 1.623 1.00 42.35 C ATOM 432 C VAL A 29 16.079 2.895 1.046 1.00 13.22 C ATOM 433 O VAL A 29 16.393 3.787 0.260 1.00 13.52 O ATOM 434 CB VAL A 29 13.769 1.979 0.686 1.00 43.31 C ATOM 435 CG1 VAL A 29 14.513 0.762 0.149 1.00 4.21 C ATOM 436 CG2 VAL A 29 12.506 1.553 1.414 1.00 3.45 C ATOM 0 H VAL A 29 13.188 4.291 1.443 1.00 33.53 H new ATOM 0 HA VAL A 29 14.714 2.317 2.592 1.00 42.35 H new ATOM 0 HB VAL A 29 13.492 2.603 -0.164 1.00 43.31 H new ATOM 0 HG11 VAL A 29 13.855 0.194 -0.508 1.00 4.21 H new ATOM 0 HG12 VAL A 29 15.390 1.089 -0.410 1.00 4.21 H new ATOM 0 HG13 VAL A 29 14.828 0.132 0.981 1.00 4.21 H new ATOM 0 HG21 VAL A 29 11.880 0.965 0.743 1.00 3.45 H new ATOM 0 HG22 VAL A 29 12.772 0.950 2.282 1.00 3.45 H new ATOM 0 HG23 VAL A 29 11.958 2.437 1.740 1.00 3.45 H new ATOM 446 N ASP A 30 16.920 1.949 1.448 1.00 34.25 N ATOM 447 CA ASP A 30 18.304 1.893 0.987 1.00 21.04 C ATOM 448 C ASP A 30 19.063 0.782 1.707 1.00 45.13 C ATOM 449 O ASP A 30 19.919 0.120 1.121 1.00 44.01 O ATOM 450 CB ASP A 30 19.006 3.237 1.218 1.00 23.12 C ATOM 451 CG ASP A 30 20.461 3.215 0.790 1.00 1.30 C ATOM 452 OD1 ASP A 30 20.735 2.818 -0.362 1.00 2.11 O ATOM 453 OD2 ASP A 30 21.326 3.596 1.607 1.00 51.50 O ATOM 0 H ASP A 30 16.666 1.205 2.097 1.00 34.25 H new ATOM 0 HA ASP A 30 18.296 1.680 -0.082 1.00 21.04 H new ATOM 0 HB2 ASP A 30 18.481 4.017 0.667 1.00 23.12 H new ATOM 0 HB3 ASP A 30 18.946 3.498 2.275 1.00 23.12 H new ATOM 458 N GLU A 31 18.742 0.586 2.983 1.00 53.35 N ATOM 459 CA GLU A 31 19.393 -0.442 3.785 1.00 74.41 C ATOM 460 C GLU A 31 18.466 -1.635 3.999 1.00 20.42 C ATOM 461 O GLU A 31 17.970 -1.859 5.103 1.00 74.42 O ATOM 462 CB GLU A 31 19.825 0.133 5.136 1.00 12.52 C ATOM 463 CG GLU A 31 18.761 0.991 5.801 1.00 61.32 C ATOM 464 CD GLU A 31 18.892 1.017 7.311 1.00 62.54 C ATOM 465 OE1 GLU A 31 19.663 1.853 7.826 1.00 73.22 O ATOM 466 OE2 GLU A 31 18.223 0.201 7.979 1.00 63.32 O ATOM 0 H GLU A 31 18.035 1.126 3.482 1.00 53.35 H new ATOM 0 HA GLU A 31 20.276 -0.784 3.245 1.00 74.41 H new ATOM 0 HB2 GLU A 31 20.087 -0.688 5.804 1.00 12.52 H new ATOM 0 HB3 GLU A 31 20.726 0.730 4.996 1.00 12.52 H new ATOM 0 HG2 GLU A 31 18.828 2.009 5.417 1.00 61.32 H new ATOM 0 HG3 GLU A 31 17.775 0.613 5.532 1.00 61.32 H new ATOM 473 N TYR A 32 18.239 -2.398 2.935 1.00 3.23 N ATOM 474 CA TYR A 32 17.373 -3.568 3.007 1.00 5.45 C ATOM 475 C TYR A 32 17.939 -4.713 2.172 1.00 4.54 C ATOM 476 O TYR A 32 18.719 -4.491 1.246 1.00 4.01 O ATOM 477 CB TYR A 32 15.959 -3.216 2.533 1.00 14.51 C ATOM 478 CG TYR A 32 15.843 -3.028 1.035 1.00 24.24 C ATOM 479 CD1 TYR A 32 16.212 -1.831 0.434 1.00 42.21 C ATOM 480 CD2 TYR A 32 15.363 -4.049 0.224 1.00 52.42 C ATOM 481 CE1 TYR A 32 16.106 -1.657 -0.933 1.00 55.03 C ATOM 482 CE2 TYR A 32 15.255 -3.882 -1.144 1.00 62.44 C ATOM 483 CZ TYR A 32 15.628 -2.685 -1.717 1.00 11.24 C ATOM 484 OH TYR A 32 15.522 -2.516 -3.078 1.00 5.20 O ATOM 0 H TYR A 32 18.642 -2.227 2.014 1.00 3.23 H new ATOM 0 HA TYR A 32 17.324 -3.892 4.047 1.00 5.45 H new ATOM 0 HB2 TYR A 32 15.275 -4.006 2.844 1.00 14.51 H new ATOM 0 HB3 TYR A 32 15.637 -2.301 3.030 1.00 14.51 H new ATOM 0 HD1 TYR A 32 16.588 -1.023 1.045 1.00 42.21 H new ATOM 0 HD2 TYR A 32 15.070 -4.988 0.669 1.00 52.42 H new ATOM 0 HE1 TYR A 32 16.396 -0.720 -1.385 1.00 55.03 H new ATOM 0 HE2 TYR A 32 14.880 -4.685 -1.761 1.00 62.44 H new ATOM 0 HH TYR A 32 15.169 -3.336 -3.483 1.00 5.20 H new ATOM 494 N ASP A 33 17.541 -5.937 2.504 1.00 22.23 N ATOM 495 CA ASP A 33 18.011 -7.113 1.783 1.00 62.32 C ATOM 496 C ASP A 33 16.838 -7.920 1.227 1.00 21.31 C ATOM 497 O ASP A 33 15.870 -8.188 1.938 1.00 73.25 O ATOM 498 CB ASP A 33 18.859 -7.995 2.701 1.00 12.45 C ATOM 499 CG ASP A 33 20.039 -8.615 1.978 1.00 64.01 C ATOM 500 OD1 ASP A 33 19.838 -9.625 1.272 1.00 43.11 O ATOM 501 OD2 ASP A 33 21.163 -8.091 2.119 1.00 21.01 O ATOM 0 H ASP A 33 16.895 -6.139 3.267 1.00 22.23 H new ATOM 0 HA ASP A 33 18.623 -6.773 0.948 1.00 62.32 H new ATOM 0 HB2 ASP A 33 19.222 -7.400 3.539 1.00 12.45 H new ATOM 0 HB3 ASP A 33 18.236 -8.786 3.118 1.00 12.45 H new ATOM 506 N PRO A 34 16.909 -8.322 -0.054 1.00 53.12 N ATOM 507 CA PRO A 34 15.846 -9.105 -0.693 1.00 0.14 C ATOM 508 C PRO A 34 15.772 -10.531 -0.155 1.00 43.43 C ATOM 509 O PRO A 34 14.783 -11.233 -0.367 1.00 74.05 O ATOM 510 CB PRO A 34 16.247 -9.111 -2.170 1.00 74.02 C ATOM 511 CG PRO A 34 17.725 -8.927 -2.162 1.00 53.34 C ATOM 512 CD PRO A 34 18.028 -8.052 -0.978 1.00 4.44 C ATOM 0 HA PRO A 34 14.860 -8.680 -0.507 1.00 0.14 H new ATOM 0 HB2 PRO A 34 15.967 -10.048 -2.652 1.00 74.02 H new ATOM 0 HB3 PRO A 34 15.751 -8.310 -2.718 1.00 74.02 H new ATOM 0 HG2 PRO A 34 18.237 -9.886 -2.080 1.00 53.34 H new ATOM 0 HG3 PRO A 34 18.065 -8.462 -3.088 1.00 53.34 H new ATOM 0 HD2 PRO A 34 18.989 -8.303 -0.529 1.00 4.44 H new ATOM 0 HD3 PRO A 34 18.072 -6.999 -1.258 1.00 4.44 H new ATOM 520 N SER A 35 16.823 -10.955 0.542 1.00 14.42 N ATOM 521 CA SER A 35 16.875 -12.298 1.110 1.00 72.31 C ATOM 522 C SER A 35 16.007 -12.410 2.362 1.00 42.23 C ATOM 523 O SER A 35 15.850 -13.496 2.920 1.00 74.41 O ATOM 524 CB SER A 35 18.320 -12.675 1.443 1.00 75.25 C ATOM 525 OG SER A 35 18.718 -12.122 2.686 1.00 34.42 O ATOM 0 H SER A 35 17.650 -10.387 0.727 1.00 14.42 H new ATOM 0 HA SER A 35 16.483 -12.989 0.364 1.00 72.31 H new ATOM 0 HB2 SER A 35 18.418 -13.760 1.476 1.00 75.25 H new ATOM 0 HB3 SER A 35 18.983 -12.319 0.654 1.00 75.25 H new ATOM 0 HG SER A 35 19.129 -11.245 2.537 1.00 34.42 H new ATOM 531 N ILE A 36 15.446 -11.287 2.804 1.00 53.42 N ATOM 532 CA ILE A 36 14.601 -11.275 3.991 1.00 31.54 C ATOM 533 C ILE A 36 13.282 -10.561 3.722 1.00 41.50 C ATOM 534 O ILE A 36 13.081 -9.984 2.653 1.00 62.35 O ATOM 535 CB ILE A 36 15.319 -10.608 5.182 1.00 21.11 C ATOM 536 CG1 ILE A 36 15.415 -9.091 4.981 1.00 62.31 C ATOM 537 CG2 ILE A 36 16.705 -11.210 5.359 1.00 51.31 C ATOM 538 CD1 ILE A 36 14.451 -8.307 5.844 1.00 32.40 C ATOM 0 H ILE A 36 15.562 -10.377 2.358 1.00 53.42 H new ATOM 0 HA ILE A 36 14.392 -12.314 4.246 1.00 31.54 H new ATOM 0 HB ILE A 36 14.736 -10.793 6.084 1.00 21.11 H new ATOM 0 HG12 ILE A 36 16.432 -8.767 5.200 1.00 62.31 H new ATOM 0 HG13 ILE A 36 15.225 -8.858 3.933 1.00 62.31 H new ATOM 0 HG21 ILE A 36 17.204 -10.733 6.202 1.00 51.31 H new ATOM 0 HG22 ILE A 36 16.616 -12.280 5.548 1.00 51.31 H new ATOM 0 HG23 ILE A 36 17.290 -11.050 4.453 1.00 51.31 H new ATOM 0 HD11 ILE A 36 14.573 -7.241 5.650 1.00 32.40 H new ATOM 0 HD12 ILE A 36 13.429 -8.603 5.609 1.00 32.40 H new ATOM 0 HD13 ILE A 36 14.655 -8.511 6.895 1.00 32.40 H new ATOM 550 N GLU A 37 12.386 -10.610 4.698 1.00 20.31 N ATOM 551 CA GLU A 37 11.082 -9.974 4.572 1.00 44.20 C ATOM 552 C GLU A 37 11.111 -8.553 5.127 1.00 71.44 C ATOM 553 O GLU A 37 11.269 -8.349 6.331 1.00 11.22 O ATOM 554 CB GLU A 37 10.025 -10.805 5.301 1.00 22.34 C ATOM 555 CG GLU A 37 8.885 -11.262 4.405 1.00 62.13 C ATOM 556 CD GLU A 37 8.246 -10.118 3.643 1.00 70.23 C ATOM 557 OE1 GLU A 37 7.501 -9.332 4.265 1.00 11.24 O ATOM 558 OE2 GLU A 37 8.491 -10.007 2.423 1.00 51.51 O ATOM 0 H GLU A 37 12.539 -11.085 5.588 1.00 20.31 H new ATOM 0 HA GLU A 37 10.827 -9.918 3.514 1.00 44.20 H new ATOM 0 HB2 GLU A 37 10.503 -11.680 5.741 1.00 22.34 H new ATOM 0 HB3 GLU A 37 9.617 -10.217 6.123 1.00 22.34 H new ATOM 0 HG2 GLU A 37 9.259 -12.001 3.697 1.00 62.13 H new ATOM 0 HG3 GLU A 37 8.127 -11.757 5.012 1.00 62.13 H new ATOM 565 N ASP A 38 10.959 -7.574 4.241 1.00 14.45 N ATOM 566 CA ASP A 38 10.968 -6.172 4.641 1.00 1.41 C ATOM 567 C ASP A 38 9.656 -5.792 5.323 1.00 0.12 C ATOM 568 O ASP A 38 8.878 -4.996 4.798 1.00 53.20 O ATOM 569 CB ASP A 38 11.205 -5.274 3.424 1.00 53.34 C ATOM 570 CG ASP A 38 12.677 -5.112 3.101 1.00 41.15 C ATOM 571 OD1 ASP A 38 13.492 -5.894 3.635 1.00 60.13 O ATOM 572 OD2 ASP A 38 13.016 -4.204 2.314 1.00 30.14 O ATOM 0 H ASP A 38 10.828 -7.726 3.241 1.00 14.45 H new ATOM 0 HA ASP A 38 11.781 -6.028 5.353 1.00 1.41 H new ATOM 0 HB2 ASP A 38 10.691 -5.695 2.560 1.00 53.34 H new ATOM 0 HB3 ASP A 38 10.767 -4.293 3.609 1.00 53.34 H new ATOM 577 N SER A 39 9.418 -6.369 6.497 1.00 3.43 N ATOM 578 CA SER A 39 8.202 -6.092 7.252 1.00 54.30 C ATOM 579 C SER A 39 8.523 -5.351 8.546 1.00 12.20 C ATOM 580 O SER A 39 9.517 -5.644 9.211 1.00 74.05 O ATOM 581 CB SER A 39 7.465 -7.395 7.567 1.00 44.45 C ATOM 582 OG SER A 39 8.242 -8.232 8.405 1.00 62.33 O ATOM 0 H SER A 39 10.051 -7.031 6.945 1.00 3.43 H new ATOM 0 HA SER A 39 7.560 -5.458 6.640 1.00 54.30 H new ATOM 0 HB2 SER A 39 6.515 -7.171 8.052 1.00 44.45 H new ATOM 0 HB3 SER A 39 7.233 -7.918 6.639 1.00 44.45 H new ATOM 0 HG SER A 39 7.747 -9.057 8.592 1.00 62.33 H new ATOM 588 N TYR A 40 7.675 -4.389 8.896 1.00 63.12 N ATOM 589 CA TYR A 40 7.870 -3.605 10.112 1.00 44.12 C ATOM 590 C TYR A 40 6.530 -3.262 10.754 1.00 53.44 C ATOM 591 O TYR A 40 5.477 -3.409 10.134 1.00 42.55 O ATOM 592 CB TYR A 40 8.644 -2.316 9.808 1.00 22.12 C ATOM 593 CG TYR A 40 9.488 -2.384 8.554 1.00 13.21 C ATOM 594 CD1 TYR A 40 8.912 -2.234 7.299 1.00 55.11 C ATOM 595 CD2 TYR A 40 10.858 -2.602 8.626 1.00 42.11 C ATOM 596 CE1 TYR A 40 9.678 -2.298 6.150 1.00 62.21 C ATOM 597 CE2 TYR A 40 11.631 -2.666 7.482 1.00 52.05 C ATOM 598 CZ TYR A 40 11.036 -2.514 6.247 1.00 43.00 C ATOM 599 OH TYR A 40 11.802 -2.578 5.106 1.00 22.15 O ATOM 0 H TYR A 40 6.848 -4.133 8.357 1.00 63.12 H new ATOM 0 HA TYR A 40 8.450 -4.209 10.809 1.00 44.12 H new ATOM 0 HB2 TYR A 40 7.935 -1.493 9.712 1.00 22.12 H new ATOM 0 HB3 TYR A 40 9.289 -2.084 10.655 1.00 22.12 H new ATOM 0 HD1 TYR A 40 7.848 -2.065 7.220 1.00 55.11 H new ATOM 0 HD2 TYR A 40 11.327 -2.723 9.591 1.00 42.11 H new ATOM 0 HE1 TYR A 40 9.215 -2.179 5.182 1.00 62.21 H new ATOM 0 HE2 TYR A 40 12.695 -2.834 7.555 1.00 52.05 H new ATOM 0 HH TYR A 40 12.738 -2.734 5.349 1.00 22.15 H new ATOM 609 N ARG A 41 6.577 -2.805 12.001 1.00 51.30 N ATOM 610 CA ARG A 41 5.366 -2.441 12.727 1.00 22.22 C ATOM 611 C ARG A 41 5.634 -1.289 13.690 1.00 2.21 C ATOM 612 O ARG A 41 6.579 -1.332 14.478 1.00 71.53 O ATOM 613 CB ARG A 41 4.825 -3.647 13.496 1.00 24.34 C ATOM 614 CG ARG A 41 5.841 -4.276 14.435 1.00 1.42 C ATOM 615 CD ARG A 41 5.649 -5.780 14.536 1.00 20.25 C ATOM 616 NE ARG A 41 6.809 -6.442 15.129 1.00 72.44 N ATOM 617 CZ ARG A 41 6.778 -7.668 15.647 1.00 61.01 C ATOM 618 NH1 ARG A 41 5.650 -8.367 15.647 1.00 10.30 N ATOM 619 NH2 ARG A 41 7.878 -8.196 16.165 1.00 32.41 N ATOM 0 H ARG A 41 7.440 -2.678 12.529 1.00 51.30 H new ATOM 0 HA ARG A 41 4.621 -2.118 12.000 1.00 22.22 H new ATOM 0 HB2 ARG A 41 3.953 -3.338 14.072 1.00 24.34 H new ATOM 0 HB3 ARG A 41 4.487 -4.399 12.784 1.00 24.34 H new ATOM 0 HG2 ARG A 41 6.849 -4.060 14.080 1.00 1.42 H new ATOM 0 HG3 ARG A 41 5.749 -3.829 15.425 1.00 1.42 H new ATOM 0 HD2 ARG A 41 4.764 -5.993 15.136 1.00 20.25 H new ATOM 0 HD3 ARG A 41 5.467 -6.190 13.543 1.00 20.25 H new ATOM 0 HE ARG A 41 7.694 -5.935 15.147 1.00 72.44 H new ATOM 0 HH11 ARG A 41 4.801 -7.965 15.249 1.00 10.30 H new ATOM 0 HH12 ARG A 41 5.632 -9.306 16.045 1.00 10.30 H new ATOM 0 HH21 ARG A 41 8.748 -7.663 16.167 1.00 32.41 H new ATOM 0 HH22 ARG A 41 7.855 -9.135 16.562 1.00 32.41 H new ATOM 633 N LYS A 42 4.796 -0.260 13.621 1.00 31.12 N ATOM 634 CA LYS A 42 4.941 0.904 14.487 1.00 53.23 C ATOM 635 C LYS A 42 3.654 1.171 15.258 1.00 65.31 C ATOM 636 O LYS A 42 2.556 0.920 14.761 1.00 2.12 O ATOM 637 CB LYS A 42 5.320 2.136 13.663 1.00 23.33 C ATOM 638 CG LYS A 42 6.124 3.164 14.442 1.00 24.24 C ATOM 639 CD LYS A 42 6.598 4.297 13.545 1.00 0.11 C ATOM 640 CE LYS A 42 5.430 5.049 12.927 1.00 64.31 C ATOM 641 NZ LYS A 42 5.505 6.511 13.197 1.00 24.20 N ATOM 0 H LYS A 42 4.009 -0.209 12.974 1.00 31.12 H new ATOM 0 HA LYS A 42 5.736 0.696 15.203 1.00 53.23 H new ATOM 0 HB2 LYS A 42 5.896 1.819 12.794 1.00 23.33 H new ATOM 0 HB3 LYS A 42 4.411 2.606 13.288 1.00 23.33 H new ATOM 0 HG2 LYS A 42 5.514 3.569 15.249 1.00 24.24 H new ATOM 0 HG3 LYS A 42 6.984 2.680 14.904 1.00 24.24 H new ATOM 0 HD2 LYS A 42 7.211 4.988 14.124 1.00 0.11 H new ATOM 0 HD3 LYS A 42 7.232 3.895 12.754 1.00 0.11 H new ATOM 0 HE2 LYS A 42 5.418 4.879 11.850 1.00 64.31 H new ATOM 0 HE3 LYS A 42 4.494 4.654 13.323 1.00 64.31 H new ATOM 0 HZ1 LYS A 42 4.691 6.987 12.759 1.00 24.20 H new ATOM 0 HZ2 LYS A 42 5.491 6.676 14.224 1.00 24.20 H new ATOM 0 HZ3 LYS A 42 6.386 6.893 12.797 1.00 24.20 H new ATOM 655 N GLN A 43 3.796 1.683 16.476 1.00 23.21 N ATOM 656 CA GLN A 43 2.643 1.985 17.317 1.00 34.02 C ATOM 657 C GLN A 43 2.242 3.450 17.181 1.00 41.23 C ATOM 658 O GLN A 43 3.036 4.349 17.458 1.00 64.00 O ATOM 659 CB GLN A 43 2.953 1.662 18.780 1.00 21.41 C ATOM 660 CG GLN A 43 1.736 1.725 19.687 1.00 53.14 C ATOM 661 CD GLN A 43 2.098 2.024 21.128 1.00 72.11 C ATOM 662 OE1 GLN A 43 1.556 3.112 21.661 1.00 41.23 O flip ATOM 663 NE2 GLN A 43 2.856 1.284 21.756 1.00 62.42 N flip ATOM 0 H GLN A 43 4.697 1.897 16.903 1.00 23.21 H new ATOM 0 HA GLN A 43 1.810 1.366 16.985 1.00 34.02 H new ATOM 0 HB2 GLN A 43 3.389 0.665 18.839 1.00 21.41 H new ATOM 0 HB3 GLN A 43 3.705 2.360 19.146 1.00 21.41 H new ATOM 0 HG2 GLN A 43 1.054 2.492 19.321 1.00 53.14 H new ATOM 0 HG3 GLN A 43 1.203 0.776 19.640 1.00 53.14 H new ATOM 0 HE21 GLN A 43 3.250 0.458 21.307 1.00 62.42 H new ATOM 0 HE22 GLN A 43 3.090 1.498 22.726 1.00 62.42 H new ATOM 672 N VAL A 44 1.006 3.682 16.752 1.00 13.14 N ATOM 673 CA VAL A 44 0.500 5.037 16.577 1.00 14.33 C ATOM 674 C VAL A 44 -0.849 5.215 17.266 1.00 62.54 C ATOM 675 O VAL A 44 -1.404 4.266 17.821 1.00 43.33 O ATOM 676 CB VAL A 44 0.354 5.392 15.084 1.00 61.41 C ATOM 677 CG1 VAL A 44 1.703 5.327 14.385 1.00 11.11 C ATOM 678 CG2 VAL A 44 -0.648 4.466 14.409 1.00 61.10 C ATOM 0 H VAL A 44 0.337 2.948 16.519 1.00 13.14 H new ATOM 0 HA VAL A 44 1.227 5.708 17.034 1.00 14.33 H new ATOM 0 HB VAL A 44 -0.021 6.413 15.008 1.00 61.41 H new ATOM 0 HG11 VAL A 44 1.580 5.581 13.332 1.00 11.11 H new ATOM 0 HG12 VAL A 44 2.389 6.035 14.851 1.00 11.11 H new ATOM 0 HG13 VAL A 44 2.109 4.319 14.470 1.00 11.11 H new ATOM 0 HG21 VAL A 44 -0.737 4.732 13.356 1.00 61.10 H new ATOM 0 HG22 VAL A 44 -0.305 3.435 14.495 1.00 61.10 H new ATOM 0 HG23 VAL A 44 -1.620 4.567 14.892 1.00 61.10 H new ATOM 688 N VAL A 45 -1.373 6.436 17.224 1.00 62.14 N ATOM 689 CA VAL A 45 -2.659 6.738 17.841 1.00 73.12 C ATOM 690 C VAL A 45 -3.686 7.147 16.791 1.00 24.23 C ATOM 691 O VAL A 45 -3.673 8.276 16.302 1.00 73.12 O ATOM 692 CB VAL A 45 -2.532 7.863 18.885 1.00 2.11 C ATOM 693 CG1 VAL A 45 -3.845 8.055 19.629 1.00 50.44 C ATOM 694 CG2 VAL A 45 -1.400 7.563 19.856 1.00 60.41 C ATOM 0 H VAL A 45 -0.926 7.232 16.769 1.00 62.14 H new ATOM 0 HA VAL A 45 -2.993 5.828 18.340 1.00 73.12 H new ATOM 0 HB VAL A 45 -2.299 8.792 18.364 1.00 2.11 H new ATOM 0 HG11 VAL A 45 -3.734 8.854 20.362 1.00 50.44 H new ATOM 0 HG12 VAL A 45 -4.630 8.319 18.920 1.00 50.44 H new ATOM 0 HG13 VAL A 45 -4.113 7.130 20.139 1.00 50.44 H new ATOM 0 HG21 VAL A 45 -1.324 8.368 20.587 1.00 60.41 H new ATOM 0 HG22 VAL A 45 -1.602 6.624 20.371 1.00 60.41 H new ATOM 0 HG23 VAL A 45 -0.462 7.482 19.307 1.00 60.41 H new ATOM 704 N ILE A 46 -4.575 6.220 16.448 1.00 1.23 N ATOM 705 CA ILE A 46 -5.609 6.482 15.455 1.00 35.15 C ATOM 706 C ILE A 46 -6.999 6.404 16.078 1.00 15.30 C ATOM 707 O ILE A 46 -7.273 5.535 16.905 1.00 24.25 O ATOM 708 CB ILE A 46 -5.521 5.487 14.279 1.00 64.33 C ATOM 709 CG1 ILE A 46 -4.109 5.490 13.691 1.00 44.45 C ATOM 710 CG2 ILE A 46 -6.549 5.829 13.209 1.00 5.05 C ATOM 711 CD1 ILE A 46 -3.937 4.545 12.522 1.00 13.15 C ATOM 0 H ILE A 46 -4.599 5.280 16.844 1.00 1.23 H new ATOM 0 HA ILE A 46 -5.442 7.491 15.078 1.00 35.15 H new ATOM 0 HB ILE A 46 -5.740 4.487 14.652 1.00 64.33 H new ATOM 0 HG12 ILE A 46 -3.861 6.501 13.369 1.00 44.45 H new ATOM 0 HG13 ILE A 46 -3.399 5.221 14.473 1.00 44.45 H new ATOM 0 HG21 ILE A 46 -6.471 5.116 12.388 1.00 5.05 H new ATOM 0 HG22 ILE A 46 -7.550 5.781 13.638 1.00 5.05 H new ATOM 0 HG23 ILE A 46 -6.363 6.835 12.834 1.00 5.05 H new ATOM 0 HD11 ILE A 46 -2.911 4.601 12.157 1.00 13.15 H new ATOM 0 HD12 ILE A 46 -4.153 3.526 12.843 1.00 13.15 H new ATOM 0 HD13 ILE A 46 -4.622 4.827 11.723 1.00 13.15 H new ATOM 723 N ASP A 47 -7.873 7.323 15.675 1.00 63.00 N ATOM 724 CA ASP A 47 -9.237 7.365 16.193 1.00 34.12 C ATOM 725 C ASP A 47 -9.253 7.701 17.683 1.00 15.03 C ATOM 726 O ASP A 47 -10.257 7.491 18.363 1.00 22.11 O ATOM 727 CB ASP A 47 -9.940 6.027 15.954 1.00 24.13 C ATOM 728 CG ASP A 47 -11.449 6.142 16.051 1.00 34.01 C ATOM 729 OD1 ASP A 47 -12.057 6.749 15.144 1.00 13.23 O ATOM 730 OD2 ASP A 47 -12.022 5.625 17.033 1.00 62.40 O ATOM 0 H ASP A 47 -7.660 8.049 14.991 1.00 63.00 H new ATOM 0 HA ASP A 47 -9.771 8.151 15.659 1.00 34.12 H new ATOM 0 HB2 ASP A 47 -9.670 5.649 14.968 1.00 24.13 H new ATOM 0 HB3 ASP A 47 -9.586 5.298 16.683 1.00 24.13 H new ATOM 735 N GLY A 48 -8.138 8.227 18.187 1.00 12.24 N ATOM 736 CA GLY A 48 -8.056 8.583 19.591 1.00 72.32 C ATOM 737 C GLY A 48 -7.525 7.455 20.458 1.00 65.52 C ATOM 738 O GLY A 48 -7.084 7.687 21.583 1.00 62.54 O ATOM 0 H GLY A 48 -7.292 8.412 17.648 1.00 12.24 H new ATOM 0 HA2 GLY A 48 -7.411 9.454 19.702 1.00 72.32 H new ATOM 0 HA3 GLY A 48 -9.045 8.872 19.946 1.00 72.32 H new ATOM 742 N GLU A 49 -7.568 6.232 19.938 1.00 1.13 N ATOM 743 CA GLU A 49 -7.088 5.071 20.681 1.00 13.21 C ATOM 744 C GLU A 49 -5.766 4.564 20.113 1.00 23.01 C ATOM 745 O GLU A 49 -5.516 4.662 18.912 1.00 32.15 O ATOM 746 CB GLU A 49 -8.134 3.953 20.651 1.00 15.42 C ATOM 747 CG GLU A 49 -8.320 3.327 19.278 1.00 55.03 C ATOM 748 CD GLU A 49 -9.583 2.494 19.184 1.00 43.23 C ATOM 749 OE1 GLU A 49 -9.824 1.675 20.096 1.00 42.24 O ATOM 750 OE2 GLU A 49 -10.330 2.659 18.197 1.00 60.45 O ATOM 0 H GLU A 49 -7.929 6.019 19.008 1.00 1.13 H new ATOM 0 HA GLU A 49 -6.921 5.377 21.714 1.00 13.21 H new ATOM 0 HB2 GLU A 49 -7.843 3.176 21.358 1.00 15.42 H new ATOM 0 HB3 GLU A 49 -9.090 4.352 20.991 1.00 15.42 H new ATOM 0 HG2 GLU A 49 -8.351 4.114 18.525 1.00 55.03 H new ATOM 0 HG3 GLU A 49 -7.458 2.701 19.048 1.00 55.03 H new ATOM 757 N THR A 50 -4.926 4.019 20.986 1.00 3.40 N ATOM 758 CA THR A 50 -3.630 3.492 20.575 1.00 72.10 C ATOM 759 C THR A 50 -3.797 2.182 19.809 1.00 3.32 C ATOM 760 O THR A 50 -4.475 1.264 20.269 1.00 25.13 O ATOM 761 CB THR A 50 -2.736 3.274 21.798 1.00 0.33 C ATOM 762 OG1 THR A 50 -2.485 4.502 22.459 1.00 54.12 O ATOM 763 CG2 THR A 50 -1.397 2.651 21.464 1.00 73.04 C ATOM 0 H THR A 50 -5.120 3.931 21.984 1.00 3.40 H new ATOM 0 HA THR A 50 -3.158 4.220 19.915 1.00 72.10 H new ATOM 0 HB THR A 50 -3.287 2.584 22.437 1.00 0.33 H new ATOM 0 HG1 THR A 50 -1.913 4.343 23.239 1.00 54.12 H new ATOM 0 HG21 THR A 50 -0.816 2.526 22.378 1.00 73.04 H new ATOM 0 HG22 THR A 50 -1.554 1.678 20.998 1.00 73.04 H new ATOM 0 HG23 THR A 50 -0.855 3.300 20.776 1.00 73.04 H new ATOM 771 N CYS A 51 -3.173 2.104 18.638 1.00 72.11 N ATOM 772 CA CYS A 51 -3.252 0.906 17.809 1.00 65.42 C ATOM 773 C CYS A 51 -1.936 0.661 17.079 1.00 14.24 C ATOM 774 O CYS A 51 -1.234 1.602 16.710 1.00 72.23 O ATOM 775 CB CYS A 51 -4.393 1.036 16.799 1.00 63.22 C ATOM 776 SG CYS A 51 -6.043 0.891 17.525 1.00 21.53 S ATOM 0 H CYS A 51 -2.608 2.855 18.242 1.00 72.11 H new ATOM 0 HA CYS A 51 -3.447 0.055 18.461 1.00 65.42 H new ATOM 0 HB2 CYS A 51 -4.312 2.001 16.298 1.00 63.22 H new ATOM 0 HB3 CYS A 51 -4.276 0.268 16.034 1.00 63.22 H new ATOM 0 HG CYS A 51 -5.958 0.988 18.819 1.00 21.53 H new ATOM 782 N LEU A 52 -1.608 -0.611 16.874 1.00 43.23 N ATOM 783 CA LEU A 52 -0.375 -0.982 16.188 1.00 71.51 C ATOM 784 C LEU A 52 -0.556 -0.916 14.674 1.00 22.43 C ATOM 785 O LEU A 52 -1.672 -1.029 14.167 1.00 35.41 O ATOM 786 CB LEU A 52 0.061 -2.389 16.607 1.00 24.43 C ATOM 787 CG LEU A 52 1.384 -2.456 17.372 1.00 53.30 C ATOM 788 CD1 LEU A 52 2.537 -2.021 16.482 1.00 50.34 C ATOM 789 CD2 LEU A 52 1.318 -1.594 18.624 1.00 75.51 C ATOM 0 H LEU A 52 -2.179 -1.402 17.173 1.00 43.23 H new ATOM 0 HA LEU A 52 0.401 -0.272 16.472 1.00 71.51 H new ATOM 0 HB2 LEU A 52 -0.722 -2.826 17.227 1.00 24.43 H new ATOM 0 HB3 LEU A 52 0.144 -3.008 15.714 1.00 24.43 H new ATOM 0 HG LEU A 52 1.557 -3.489 17.675 1.00 53.30 H new ATOM 0 HD11 LEU A 52 3.470 -2.075 17.043 1.00 50.34 H new ATOM 0 HD12 LEU A 52 2.596 -2.679 15.615 1.00 50.34 H new ATOM 0 HD13 LEU A 52 2.373 -0.996 16.149 1.00 50.34 H new ATOM 0 HD21 LEU A 52 2.267 -1.653 19.157 1.00 75.51 H new ATOM 0 HD22 LEU A 52 1.123 -0.559 18.343 1.00 75.51 H new ATOM 0 HD23 LEU A 52 0.516 -1.952 19.270 1.00 75.51 H new ATOM 801 N LEU A 53 0.549 -0.733 13.957 1.00 51.50 N ATOM 802 CA LEU A 53 0.511 -0.652 12.501 1.00 61.34 C ATOM 803 C LEU A 53 1.482 -1.646 11.872 1.00 30.43 C ATOM 804 O LEU A 53 2.595 -1.284 11.488 1.00 43.13 O ATOM 805 CB LEU A 53 0.848 0.768 12.040 1.00 73.31 C ATOM 806 CG LEU A 53 -0.269 1.795 12.233 1.00 2.42 C ATOM 807 CD1 LEU A 53 0.158 3.155 11.704 1.00 54.35 C ATOM 808 CD2 LEU A 53 -1.544 1.330 11.547 1.00 1.21 C ATOM 0 H LEU A 53 1.481 -0.638 14.361 1.00 51.50 H new ATOM 0 HA LEU A 53 -0.498 -0.904 12.176 1.00 61.34 H new ATOM 0 HB2 LEU A 53 1.731 1.109 12.580 1.00 73.31 H new ATOM 0 HB3 LEU A 53 1.113 0.737 10.983 1.00 73.31 H new ATOM 0 HG LEU A 53 -0.468 1.890 13.300 1.00 2.42 H new ATOM 0 HD11 LEU A 53 -0.650 3.872 11.850 1.00 54.35 H new ATOM 0 HD12 LEU A 53 1.044 3.492 12.241 1.00 54.35 H new ATOM 0 HD13 LEU A 53 0.386 3.077 10.641 1.00 54.35 H new ATOM 0 HD21 LEU A 53 -2.328 2.073 11.694 1.00 1.21 H new ATOM 0 HD22 LEU A 53 -1.358 1.205 10.480 1.00 1.21 H new ATOM 0 HD23 LEU A 53 -1.861 0.378 11.974 1.00 1.21 H new ATOM 820 N ASP A 54 1.053 -2.900 11.766 1.00 4.41 N ATOM 821 CA ASP A 54 1.885 -3.945 11.180 1.00 5.22 C ATOM 822 C ASP A 54 1.896 -3.835 9.658 1.00 3.13 C ATOM 823 O ASP A 54 0.960 -4.271 8.988 1.00 73.04 O ATOM 824 CB ASP A 54 1.380 -5.326 11.602 1.00 21.21 C ATOM 825 CG ASP A 54 1.887 -5.733 12.971 1.00 64.21 C ATOM 826 OD1 ASP A 54 1.329 -5.251 13.979 1.00 10.41 O ATOM 827 OD2 ASP A 54 2.843 -6.534 13.036 1.00 43.02 O ATOM 0 H ASP A 54 0.135 -3.217 12.078 1.00 4.41 H new ATOM 0 HA ASP A 54 2.904 -3.815 11.545 1.00 5.22 H new ATOM 0 HB2 ASP A 54 0.290 -5.325 11.607 1.00 21.21 H new ATOM 0 HB3 ASP A 54 1.695 -6.066 10.866 1.00 21.21 H new ATOM 832 N ILE A 55 2.957 -3.245 9.120 1.00 13.21 N ATOM 833 CA ILE A 55 3.087 -3.072 7.678 1.00 64.44 C ATOM 834 C ILE A 55 3.730 -4.291 7.026 1.00 20.45 C ATOM 835 O ILE A 55 4.925 -4.538 7.192 1.00 75.11 O ATOM 836 CB ILE A 55 3.926 -1.824 7.334 1.00 25.15 C ATOM 837 CG1 ILE A 55 3.506 -0.639 8.207 1.00 74.43 C ATOM 838 CG2 ILE A 55 3.785 -1.481 5.859 1.00 32.53 C ATOM 839 CD1 ILE A 55 2.036 -0.296 8.097 1.00 54.24 C ATOM 0 H ILE A 55 3.740 -2.878 9.661 1.00 13.21 H new ATOM 0 HA ILE A 55 2.077 -2.946 7.288 1.00 64.44 H new ATOM 0 HB ILE A 55 4.974 -2.043 7.537 1.00 25.15 H new ATOM 0 HG12 ILE A 55 3.741 -0.864 9.247 1.00 74.43 H new ATOM 0 HG13 ILE A 55 4.096 0.234 7.928 1.00 74.43 H new ATOM 0 HG21 ILE A 55 4.383 -0.598 5.632 1.00 32.53 H new ATOM 0 HG22 ILE A 55 4.132 -2.320 5.256 1.00 32.53 H new ATOM 0 HG23 ILE A 55 2.738 -1.279 5.631 1.00 32.53 H new ATOM 0 HD11 ILE A 55 1.811 0.553 8.743 1.00 54.24 H new ATOM 0 HD12 ILE A 55 1.799 -0.039 7.065 1.00 54.24 H new ATOM 0 HD13 ILE A 55 1.438 -1.154 8.404 1.00 54.24 H new ATOM 851 N LEU A 56 2.933 -5.047 6.277 1.00 33.03 N ATOM 852 CA LEU A 56 3.431 -6.236 5.594 1.00 45.45 C ATOM 853 C LEU A 56 3.878 -5.895 4.179 1.00 21.50 C ATOM 854 O LEU A 56 3.059 -5.762 3.270 1.00 13.32 O ATOM 855 CB LEU A 56 2.359 -7.327 5.557 1.00 43.03 C ATOM 856 CG LEU A 56 2.767 -8.618 4.839 1.00 34.32 C ATOM 857 CD1 LEU A 56 2.597 -8.467 3.338 1.00 53.35 C ATOM 858 CD2 LEU A 56 4.205 -8.997 5.174 1.00 34.25 C ATOM 0 H LEU A 56 1.942 -4.858 6.128 1.00 33.03 H new ATOM 0 HA LEU A 56 4.290 -6.610 6.151 1.00 45.45 H new ATOM 0 HB2 LEU A 56 2.078 -7.573 6.581 1.00 43.03 H new ATOM 0 HB3 LEU A 56 1.470 -6.925 5.070 1.00 43.03 H new ATOM 0 HG LEU A 56 2.114 -9.419 5.186 1.00 34.32 H new ATOM 0 HD11 LEU A 56 2.891 -9.393 2.844 1.00 53.35 H new ATOM 0 HD12 LEU A 56 1.554 -8.250 3.110 1.00 53.35 H new ATOM 0 HD13 LEU A 56 3.224 -7.650 2.981 1.00 53.35 H new ATOM 0 HD21 LEU A 56 4.470 -9.916 4.652 1.00 34.25 H new ATOM 0 HD22 LEU A 56 4.875 -8.196 4.861 1.00 34.25 H new ATOM 0 HD23 LEU A 56 4.300 -9.150 6.249 1.00 34.25 H new ATOM 870 N ASP A 57 5.186 -5.753 4.002 1.00 73.24 N ATOM 871 CA ASP A 57 5.752 -5.424 2.701 1.00 64.11 C ATOM 872 C ASP A 57 6.288 -6.671 2.008 1.00 30.23 C ATOM 873 O ASP A 57 7.352 -7.180 2.361 1.00 13.22 O ATOM 874 CB ASP A 57 6.870 -4.390 2.855 1.00 4.13 C ATOM 875 CG ASP A 57 6.843 -3.341 1.761 1.00 72.02 C ATOM 876 OD1 ASP A 57 6.128 -3.546 0.757 1.00 50.12 O ATOM 877 OD2 ASP A 57 7.538 -2.313 1.907 1.00 32.21 O ATOM 0 H ASP A 57 5.876 -5.861 4.746 1.00 73.24 H new ATOM 0 HA ASP A 57 4.958 -5.002 2.084 1.00 64.11 H new ATOM 0 HB2 ASP A 57 6.778 -3.902 3.825 1.00 4.13 H new ATOM 0 HB3 ASP A 57 7.835 -4.898 2.844 1.00 4.13 H new ATOM 882 N THR A 58 5.547 -7.156 1.018 1.00 61.52 N ATOM 883 CA THR A 58 5.950 -8.341 0.272 1.00 54.33 C ATOM 884 C THR A 58 7.075 -8.006 -0.701 1.00 64.02 C ATOM 885 O THR A 58 7.592 -6.889 -0.704 1.00 33.11 O ATOM 886 CB THR A 58 4.757 -8.922 -0.487 1.00 34.13 C ATOM 887 OG1 THR A 58 4.396 -8.084 -1.571 1.00 63.22 O ATOM 888 CG2 THR A 58 3.531 -9.107 0.380 1.00 11.22 C ATOM 0 H THR A 58 4.664 -6.746 0.714 1.00 61.52 H new ATOM 0 HA THR A 58 6.313 -9.085 0.981 1.00 54.33 H new ATOM 0 HB THR A 58 5.085 -9.900 -0.838 1.00 34.13 H new ATOM 0 HG1 THR A 58 3.632 -8.474 -2.045 1.00 63.22 H new ATOM 0 HG21 THR A 58 2.721 -9.522 -0.219 1.00 11.22 H new ATOM 0 HG22 THR A 58 3.763 -9.789 1.198 1.00 11.22 H new ATOM 0 HG23 THR A 58 3.224 -8.143 0.787 1.00 11.22 H new ATOM 896 N ALA A 59 7.449 -8.977 -1.526 1.00 1.21 N ATOM 897 CA ALA A 59 8.513 -8.777 -2.503 1.00 64.03 C ATOM 898 C ALA A 59 7.953 -8.314 -3.841 1.00 74.44 C ATOM 899 O ALA A 59 6.782 -8.537 -4.147 1.00 34.44 O ATOM 900 CB ALA A 59 9.309 -10.058 -2.689 1.00 51.04 C ATOM 0 H ALA A 59 7.033 -9.908 -1.538 1.00 1.21 H new ATOM 0 HA ALA A 59 9.174 -7.998 -2.122 1.00 64.03 H new ATOM 0 HB1 ALA A 59 10.099 -9.892 -3.421 1.00 51.04 H new ATOM 0 HB2 ALA A 59 9.752 -10.353 -1.738 1.00 51.04 H new ATOM 0 HB3 ALA A 59 8.648 -10.849 -3.042 1.00 51.04 H new ATOM 906 N GLY A 60 8.802 -7.675 -4.637 1.00 71.43 N ATOM 907 CA GLY A 60 8.379 -7.197 -5.938 1.00 61.02 C ATOM 908 C GLY A 60 8.897 -8.069 -7.064 1.00 55.20 C ATOM 909 O GLY A 60 8.305 -8.120 -8.143 1.00 54.32 O ATOM 0 H GLY A 60 9.776 -7.480 -4.404 1.00 71.43 H new ATOM 0 HA2 GLY A 60 7.290 -7.167 -5.976 1.00 61.02 H new ATOM 0 HA3 GLY A 60 8.731 -6.175 -6.080 1.00 61.02 H new ATOM 913 N GLN A 61 10.004 -8.759 -6.811 1.00 55.24 N ATOM 914 CA GLN A 61 10.604 -9.638 -7.807 1.00 1.12 C ATOM 915 C GLN A 61 10.222 -11.091 -7.544 1.00 61.44 C ATOM 916 O GLN A 61 9.511 -11.391 -6.585 1.00 31.21 O ATOM 917 CB GLN A 61 12.126 -9.488 -7.798 1.00 21.12 C ATOM 918 CG GLN A 61 12.604 -8.121 -8.258 1.00 35.43 C ATOM 919 CD GLN A 61 14.116 -8.006 -8.266 1.00 63.25 C ATOM 920 OE1 GLN A 61 14.811 -8.754 -7.580 1.00 42.12 O ATOM 921 NE2 GLN A 61 14.632 -7.063 -9.045 1.00 34.14 N ATOM 0 H GLN A 61 10.504 -8.726 -5.923 1.00 55.24 H new ATOM 0 HA GLN A 61 10.225 -9.352 -8.788 1.00 1.12 H new ATOM 0 HB2 GLN A 61 12.495 -9.672 -6.789 1.00 21.12 H new ATOM 0 HB3 GLN A 61 12.562 -10.252 -8.442 1.00 21.12 H new ATOM 0 HG2 GLN A 61 12.223 -7.925 -9.260 1.00 35.43 H new ATOM 0 HG3 GLN A 61 12.188 -7.355 -7.603 1.00 35.43 H new ATOM 0 HE21 GLN A 61 14.017 -6.465 -9.597 1.00 34.14 H new ATOM 0 HE22 GLN A 61 15.643 -6.937 -9.091 1.00 34.14 H new ATOM 930 N GLU A 62 10.699 -11.989 -8.400 1.00 11.11 N ATOM 931 CA GLU A 62 10.404 -13.411 -8.256 1.00 23.31 C ATOM 932 C GLU A 62 8.899 -13.658 -8.283 1.00 50.33 C ATOM 933 O GLU A 62 8.114 -12.739 -8.514 1.00 14.13 O ATOM 934 CB GLU A 62 10.996 -13.948 -6.950 1.00 51.02 C ATOM 935 CG GLU A 62 12.402 -13.445 -6.665 1.00 64.55 C ATOM 936 CD GLU A 62 13.234 -14.450 -5.892 1.00 31.31 C ATOM 937 OE1 GLU A 62 13.876 -15.307 -6.534 1.00 24.05 O ATOM 938 OE2 GLU A 62 13.243 -14.379 -4.645 1.00 51.32 O ATOM 0 H GLU A 62 11.290 -11.759 -9.199 1.00 11.11 H new ATOM 0 HA GLU A 62 10.858 -13.937 -9.096 1.00 23.31 H new ATOM 0 HB2 GLU A 62 10.344 -13.666 -6.123 1.00 51.02 H new ATOM 0 HB3 GLU A 62 11.010 -15.037 -6.988 1.00 51.02 H new ATOM 0 HG2 GLU A 62 12.900 -13.215 -7.607 1.00 64.55 H new ATOM 0 HG3 GLU A 62 12.344 -12.515 -6.099 1.00 64.55 H new ATOM 945 N GLU A 63 8.504 -14.904 -8.044 1.00 74.33 N ATOM 946 CA GLU A 63 7.093 -15.268 -8.040 1.00 51.25 C ATOM 947 C GLU A 63 6.541 -15.280 -6.617 1.00 50.13 C ATOM 948 O GLU A 63 5.886 -14.331 -6.188 1.00 61.53 O ATOM 949 CB GLU A 63 6.896 -16.637 -8.694 1.00 61.14 C ATOM 950 CG GLU A 63 7.061 -16.619 -10.205 1.00 1.34 C ATOM 951 CD GLU A 63 8.440 -16.157 -10.635 1.00 74.41 C ATOM 952 OE1 GLU A 63 9.429 -16.556 -9.986 1.00 5.41 O ATOM 953 OE2 GLU A 63 8.530 -15.396 -11.621 1.00 51.32 O ATOM 0 H GLU A 63 9.140 -15.677 -7.851 1.00 74.33 H new ATOM 0 HA GLU A 63 6.546 -14.521 -8.615 1.00 51.25 H new ATOM 0 HB2 GLU A 63 7.611 -17.340 -8.267 1.00 61.14 H new ATOM 0 HB3 GLU A 63 5.900 -17.007 -8.450 1.00 61.14 H new ATOM 0 HG2 GLU A 63 6.877 -17.619 -10.599 1.00 1.34 H new ATOM 0 HG3 GLU A 63 6.309 -15.961 -10.641 1.00 1.34 H new ATOM 960 N TYR A 64 6.810 -16.360 -5.888 1.00 73.21 N ATOM 961 CA TYR A 64 6.341 -16.493 -4.512 1.00 12.42 C ATOM 962 C TYR A 64 4.835 -16.257 -4.420 1.00 33.23 C ATOM 963 O TYR A 64 4.344 -15.686 -3.446 1.00 73.25 O ATOM 964 CB TYR A 64 7.085 -15.512 -3.603 1.00 11.34 C ATOM 965 CG TYR A 64 8.215 -16.148 -2.825 1.00 11.51 C ATOM 966 CD1 TYR A 64 8.053 -17.386 -2.214 1.00 70.35 C ATOM 967 CD2 TYR A 64 9.444 -15.512 -2.703 1.00 31.12 C ATOM 968 CE1 TYR A 64 9.083 -17.971 -1.503 1.00 50.33 C ATOM 969 CE2 TYR A 64 10.479 -16.092 -1.993 1.00 55.52 C ATOM 970 CZ TYR A 64 10.294 -17.320 -1.396 1.00 21.34 C ATOM 971 OH TYR A 64 11.322 -17.900 -0.688 1.00 34.32 O ATOM 0 H TYR A 64 7.350 -17.156 -6.227 1.00 73.21 H new ATOM 0 HA TYR A 64 6.546 -17.511 -4.181 1.00 12.42 H new ATOM 0 HB2 TYR A 64 7.484 -14.699 -4.209 1.00 11.34 H new ATOM 0 HB3 TYR A 64 6.377 -15.069 -2.903 1.00 11.34 H new ATOM 0 HD1 TYR A 64 7.106 -17.899 -2.296 1.00 70.35 H new ATOM 0 HD2 TYR A 64 9.593 -14.550 -3.170 1.00 31.12 H new ATOM 0 HE1 TYR A 64 8.941 -18.933 -1.033 1.00 50.33 H new ATOM 0 HE2 TYR A 64 11.428 -15.585 -1.907 1.00 55.52 H new ATOM 0 HH TYR A 64 12.106 -17.313 -0.710 1.00 34.32 H new ATOM 981 N SER A 65 4.108 -16.701 -5.439 1.00 73.40 N ATOM 982 CA SER A 65 2.659 -16.539 -5.472 1.00 61.04 C ATOM 983 C SER A 65 2.007 -17.211 -4.267 1.00 43.15 C ATOM 984 O SER A 65 0.923 -16.819 -3.837 1.00 24.03 O ATOM 985 CB SER A 65 2.087 -17.120 -6.767 1.00 52.11 C ATOM 986 OG SER A 65 3.004 -18.013 -7.375 1.00 35.41 O ATOM 0 H SER A 65 4.498 -17.176 -6.253 1.00 73.40 H new ATOM 0 HA SER A 65 2.438 -15.472 -5.433 1.00 61.04 H new ATOM 0 HB2 SER A 65 1.154 -17.641 -6.554 1.00 52.11 H new ATOM 0 HB3 SER A 65 1.850 -16.311 -7.458 1.00 52.11 H new ATOM 0 HG SER A 65 2.614 -18.372 -8.199 1.00 35.41 H new ATOM 992 N ALA A 66 2.677 -18.224 -3.725 1.00 63.22 N ATOM 993 CA ALA A 66 2.163 -18.949 -2.569 1.00 13.43 C ATOM 994 C ALA A 66 1.904 -18.005 -1.398 1.00 24.30 C ATOM 995 O ALA A 66 0.794 -17.946 -0.870 1.00 12.54 O ATOM 996 CB ALA A 66 3.135 -20.045 -2.161 1.00 2.21 C ATOM 0 H ALA A 66 3.577 -18.561 -4.068 1.00 63.22 H new ATOM 0 HA ALA A 66 1.214 -19.405 -2.849 1.00 13.43 H new ATOM 0 HB1 ALA A 66 2.740 -20.579 -1.297 1.00 2.21 H new ATOM 0 HB2 ALA A 66 3.266 -20.742 -2.989 1.00 2.21 H new ATOM 0 HB3 ALA A 66 4.097 -19.601 -1.904 1.00 2.21 H new ATOM 1002 N MET A 67 2.936 -17.268 -0.998 1.00 44.33 N ATOM 1003 CA MET A 67 2.817 -16.327 0.112 1.00 71.23 C ATOM 1004 C MET A 67 1.858 -15.196 -0.233 1.00 22.11 C ATOM 1005 O MET A 67 1.164 -14.672 0.638 1.00 33.21 O ATOM 1006 CB MET A 67 4.181 -15.741 0.491 1.00 61.54 C ATOM 1007 CG MET A 67 5.048 -15.359 -0.699 1.00 5.33 C ATOM 1008 SD MET A 67 6.485 -14.387 -0.216 1.00 3.51 S ATOM 1009 CE MET A 67 7.139 -15.405 1.104 1.00 71.11 C ATOM 0 H MET A 67 3.862 -17.304 -1.424 1.00 44.33 H new ATOM 0 HA MET A 67 2.423 -16.881 0.964 1.00 71.23 H new ATOM 0 HB2 MET A 67 4.025 -14.858 1.111 1.00 61.54 H new ATOM 0 HB3 MET A 67 4.719 -16.467 1.100 1.00 61.54 H new ATOM 0 HG2 MET A 67 5.379 -16.263 -1.209 1.00 5.33 H new ATOM 0 HG3 MET A 67 4.451 -14.791 -1.413 1.00 5.33 H new ATOM 0 HE1 MET A 67 7.994 -14.905 1.559 1.00 71.11 H new ATOM 0 HE2 MET A 67 6.368 -15.563 1.858 1.00 71.11 H new ATOM 0 HE3 MET A 67 7.454 -16.367 0.700 1.00 71.11 H new ATOM 1019 N ARG A 68 1.821 -14.820 -1.507 1.00 43.23 N ATOM 1020 CA ARG A 68 0.943 -13.747 -1.956 1.00 43.50 C ATOM 1021 C ARG A 68 -0.487 -13.986 -1.477 1.00 41.42 C ATOM 1022 O ARG A 68 -1.107 -13.107 -0.877 1.00 74.22 O ATOM 1023 CB ARG A 68 0.974 -13.637 -3.483 1.00 2.12 C ATOM 1024 CG ARG A 68 1.710 -12.408 -3.991 1.00 20.51 C ATOM 1025 CD ARG A 68 0.937 -11.719 -5.103 1.00 74.12 C ATOM 1026 NE ARG A 68 0.944 -12.500 -6.338 1.00 61.22 N ATOM 1027 CZ ARG A 68 1.958 -12.515 -7.201 1.00 12.11 C ATOM 1028 NH1 ARG A 68 3.050 -11.798 -6.964 1.00 74.32 N ATOM 1029 NH2 ARG A 68 1.881 -13.251 -8.301 1.00 51.11 N ATOM 0 H ARG A 68 2.387 -15.241 -2.244 1.00 43.23 H new ATOM 0 HA ARG A 68 1.301 -12.811 -1.528 1.00 43.50 H new ATOM 0 HB2 ARG A 68 1.448 -14.529 -3.893 1.00 2.12 H new ATOM 0 HB3 ARG A 68 -0.049 -13.618 -3.858 1.00 2.12 H new ATOM 0 HG2 ARG A 68 1.867 -11.710 -3.168 1.00 20.51 H new ATOM 0 HG3 ARG A 68 2.695 -12.697 -4.356 1.00 20.51 H new ATOM 0 HD2 ARG A 68 -0.092 -11.556 -4.783 1.00 74.12 H new ATOM 0 HD3 ARG A 68 1.371 -10.737 -5.292 1.00 74.12 H new ATOM 0 HE ARG A 68 0.124 -13.067 -6.552 1.00 61.22 H new ATOM 0 HH11 ARG A 68 3.115 -11.232 -6.118 1.00 74.32 H new ATOM 0 HH12 ARG A 68 3.824 -11.813 -7.628 1.00 74.32 H new ATOM 0 HH21 ARG A 68 1.045 -13.806 -8.486 1.00 51.11 H new ATOM 0 HH22 ARG A 68 2.658 -13.263 -8.962 1.00 51.11 H new ATOM 1043 N ASP A 69 -0.998 -15.186 -1.737 1.00 15.03 N ATOM 1044 CA ASP A 69 -2.349 -15.547 -1.321 1.00 24.44 C ATOM 1045 C ASP A 69 -2.444 -15.573 0.200 1.00 63.10 C ATOM 1046 O ASP A 69 -3.485 -15.259 0.776 1.00 32.02 O ATOM 1047 CB ASP A 69 -2.734 -16.913 -1.895 1.00 72.43 C ATOM 1048 CG ASP A 69 -3.562 -16.796 -3.160 1.00 64.32 C ATOM 1049 OD1 ASP A 69 -3.403 -15.790 -3.882 1.00 2.52 O ATOM 1050 OD2 ASP A 69 -4.370 -17.710 -3.428 1.00 50.24 O ATOM 0 H ASP A 69 -0.498 -15.924 -2.233 1.00 15.03 H new ATOM 0 HA ASP A 69 -3.042 -14.798 -1.703 1.00 24.44 H new ATOM 0 HB2 ASP A 69 -1.829 -17.483 -2.108 1.00 72.43 H new ATOM 0 HB3 ASP A 69 -3.295 -17.473 -1.147 1.00 72.43 H new ATOM 1055 N GLN A 70 -1.340 -15.943 0.841 1.00 75.22 N ATOM 1056 CA GLN A 70 -1.278 -16.006 2.295 1.00 32.32 C ATOM 1057 C GLN A 70 -1.368 -14.607 2.894 1.00 64.34 C ATOM 1058 O GLN A 70 -2.150 -14.363 3.812 1.00 21.11 O ATOM 1059 CB GLN A 70 0.028 -16.681 2.733 1.00 25.52 C ATOM 1060 CG GLN A 70 0.284 -16.630 4.233 1.00 72.21 C ATOM 1061 CD GLN A 70 0.362 -18.009 4.858 1.00 70.22 C ATOM 1062 OE1 GLN A 70 -0.257 -18.169 6.022 1.00 0.24 O flip ATOM 1063 NE2 GLN A 70 0.971 -18.921 4.301 1.00 44.30 N flip ATOM 0 H GLN A 70 -0.473 -16.205 0.373 1.00 75.22 H new ATOM 0 HA GLN A 70 -2.123 -16.593 2.655 1.00 32.32 H new ATOM 0 HB2 GLN A 70 0.010 -17.723 2.414 1.00 25.52 H new ATOM 0 HB3 GLN A 70 0.861 -16.204 2.217 1.00 25.52 H new ATOM 0 HG2 GLN A 70 1.216 -16.097 4.421 1.00 72.21 H new ATOM 0 HG3 GLN A 70 -0.511 -16.061 4.715 1.00 72.21 H new ATOM 0 HE21 GLN A 70 1.433 -18.754 3.407 1.00 44.30 H new ATOM 0 HE22 GLN A 70 1.014 -19.844 4.733 1.00 44.30 H new ATOM 1072 N TYR A 71 -0.558 -13.694 2.366 1.00 70.42 N ATOM 1073 CA TYR A 71 -0.533 -12.317 2.845 1.00 30.42 C ATOM 1074 C TYR A 71 -1.934 -11.718 2.883 1.00 13.10 C ATOM 1075 O TYR A 71 -2.275 -10.970 3.800 1.00 32.41 O ATOM 1076 CB TYR A 71 0.395 -11.479 1.972 1.00 20.14 C ATOM 1077 CG TYR A 71 1.833 -11.925 2.075 1.00 20.21 C ATOM 1078 CD1 TYR A 71 2.376 -12.288 3.302 1.00 63.44 C ATOM 1079 CD2 TYR A 71 2.642 -12.002 0.951 1.00 53.35 C ATOM 1080 CE1 TYR A 71 3.682 -12.712 3.407 1.00 22.52 C ATOM 1081 CE2 TYR A 71 3.952 -12.425 1.048 1.00 44.24 C ATOM 1082 CZ TYR A 71 4.468 -12.779 2.278 1.00 62.34 C ATOM 1083 OH TYR A 71 5.774 -13.199 2.376 1.00 51.43 O ATOM 0 H TYR A 71 0.092 -13.885 1.603 1.00 70.42 H new ATOM 0 HA TYR A 71 -0.151 -12.315 3.866 1.00 30.42 H new ATOM 0 HB2 TYR A 71 0.070 -11.543 0.934 1.00 20.14 H new ATOM 0 HB3 TYR A 71 0.319 -10.432 2.265 1.00 20.14 H new ATOM 0 HD1 TYR A 71 1.762 -12.237 4.189 1.00 63.44 H new ATOM 0 HD2 TYR A 71 2.241 -11.727 -0.013 1.00 53.35 H new ATOM 0 HE1 TYR A 71 4.087 -12.990 4.369 1.00 22.52 H new ATOM 0 HE2 TYR A 71 4.571 -12.479 0.165 1.00 44.24 H new ATOM 0 HH TYR A 71 6.216 -13.099 1.507 1.00 51.43 H new ATOM 1093 N MET A 72 -2.753 -12.069 1.898 1.00 14.55 N ATOM 1094 CA MET A 72 -4.123 -11.580 1.847 1.00 42.23 C ATOM 1095 C MET A 72 -4.916 -12.176 3.001 1.00 52.13 C ATOM 1096 O MET A 72 -5.631 -11.472 3.714 1.00 72.42 O ATOM 1097 CB MET A 72 -4.775 -11.946 0.512 1.00 62.14 C ATOM 1098 CG MET A 72 -3.910 -11.630 -0.696 1.00 11.42 C ATOM 1099 SD MET A 72 -4.870 -11.031 -2.100 1.00 42.44 S ATOM 1100 CE MET A 72 -3.609 -10.151 -3.017 1.00 51.14 C ATOM 0 H MET A 72 -2.493 -12.687 1.129 1.00 14.55 H new ATOM 0 HA MET A 72 -4.116 -10.494 1.936 1.00 42.23 H new ATOM 0 HB2 MET A 72 -5.009 -13.011 0.512 1.00 62.14 H new ATOM 0 HB3 MET A 72 -5.721 -11.412 0.421 1.00 62.14 H new ATOM 0 HG2 MET A 72 -3.169 -10.880 -0.421 1.00 11.42 H new ATOM 0 HG3 MET A 72 -3.363 -12.526 -0.990 1.00 11.42 H new ATOM 0 HE1 MET A 72 -4.081 -9.521 -3.771 1.00 51.14 H new ATOM 0 HE2 MET A 72 -3.030 -9.529 -2.334 1.00 51.14 H new ATOM 0 HE3 MET A 72 -2.948 -10.867 -3.505 1.00 51.14 H new ATOM 1110 N ARG A 73 -4.764 -13.483 3.185 1.00 55.11 N ATOM 1111 CA ARG A 73 -5.442 -14.195 4.259 1.00 2.52 C ATOM 1112 C ARG A 73 -4.833 -13.853 5.620 1.00 33.44 C ATOM 1113 O ARG A 73 -5.386 -14.209 6.661 1.00 20.01 O ATOM 1114 CB ARG A 73 -5.365 -15.699 4.019 1.00 51.34 C ATOM 1115 CG ARG A 73 -6.091 -16.139 2.763 1.00 71.33 C ATOM 1116 CD ARG A 73 -6.365 -17.629 2.776 1.00 32.10 C ATOM 1117 NE ARG A 73 -7.006 -18.060 4.016 1.00 34.30 N ATOM 1118 CZ ARG A 73 -7.075 -19.329 4.411 1.00 61.02 C ATOM 1119 NH1 ARG A 73 -6.549 -20.293 3.667 1.00 1.42 N ATOM 1120 NH2 ARG A 73 -7.673 -19.636 5.554 1.00 71.21 N ATOM 0 H ARG A 73 -4.173 -14.073 2.599 1.00 55.11 H new ATOM 0 HA ARG A 73 -6.486 -13.882 4.265 1.00 2.52 H new ATOM 0 HB2 ARG A 73 -4.319 -15.997 3.950 1.00 51.34 H new ATOM 0 HB3 ARG A 73 -5.789 -16.220 4.878 1.00 51.34 H new ATOM 0 HG2 ARG A 73 -7.032 -15.595 2.675 1.00 71.33 H new ATOM 0 HG3 ARG A 73 -5.493 -15.885 1.888 1.00 71.33 H new ATOM 0 HD2 ARG A 73 -7.002 -17.887 1.930 1.00 32.10 H new ATOM 0 HD3 ARG A 73 -5.428 -18.170 2.646 1.00 32.10 H new ATOM 0 HE ARG A 73 -7.425 -17.347 4.613 1.00 34.30 H new ATOM 0 HH11 ARG A 73 -6.088 -20.064 2.786 1.00 1.42 H new ATOM 0 HH12 ARG A 73 -6.605 -21.264 3.976 1.00 1.42 H new ATOM 0 HH21 ARG A 73 -8.080 -18.900 6.130 1.00 71.21 H new ATOM 0 HH22 ARG A 73 -7.726 -20.609 5.857 1.00 71.21 H new ATOM 1134 N THR A 74 -3.692 -13.161 5.609 1.00 40.12 N ATOM 1135 CA THR A 74 -3.018 -12.776 6.844 1.00 72.42 C ATOM 1136 C THR A 74 -3.336 -11.331 7.207 1.00 52.32 C ATOM 1137 O THR A 74 -3.221 -10.931 8.366 1.00 62.32 O ATOM 1138 CB THR A 74 -1.502 -12.931 6.704 1.00 4.24 C ATOM 1139 OG1 THR A 74 -0.993 -12.007 5.761 1.00 73.31 O ATOM 1140 CG2 THR A 74 -1.071 -14.316 6.272 1.00 55.53 C ATOM 0 H THR A 74 -3.218 -12.857 4.758 1.00 40.12 H new ATOM 0 HA THR A 74 -3.379 -13.434 7.634 1.00 72.42 H new ATOM 0 HB THR A 74 -1.101 -12.745 7.700 1.00 4.24 H new ATOM 0 HG1 THR A 74 -1.737 -11.583 5.284 1.00 73.31 H new ATOM 0 HG21 THR A 74 0.016 -14.351 6.194 1.00 55.53 H new ATOM 0 HG22 THR A 74 -1.406 -15.047 7.008 1.00 55.53 H new ATOM 0 HG23 THR A 74 -1.512 -14.549 5.303 1.00 55.53 H new ATOM 1148 N GLY A 75 -3.714 -10.544 6.203 1.00 31.24 N ATOM 1149 CA GLY A 75 -4.014 -9.149 6.435 1.00 14.01 C ATOM 1150 C GLY A 75 -5.496 -8.836 6.425 1.00 20.01 C ATOM 1151 O GLY A 75 -6.313 -9.647 5.987 1.00 54.41 O ATOM 0 H GLY A 75 -3.817 -10.851 5.236 1.00 31.24 H new ATOM 0 HA2 GLY A 75 -3.595 -8.851 7.396 1.00 14.01 H new ATOM 0 HA3 GLY A 75 -3.519 -8.548 5.672 1.00 14.01 H new ATOM 1155 N GLU A 76 -5.832 -7.645 6.907 1.00 63.40 N ATOM 1156 CA GLU A 76 -7.216 -7.192 6.959 1.00 50.23 C ATOM 1157 C GLU A 76 -7.447 -6.033 5.988 1.00 74.30 C ATOM 1158 O GLU A 76 -8.587 -5.670 5.707 1.00 22.12 O ATOM 1159 CB GLU A 76 -7.579 -6.760 8.381 1.00 70.24 C ATOM 1160 CG GLU A 76 -7.180 -7.771 9.444 1.00 60.53 C ATOM 1161 CD GLU A 76 -8.355 -8.224 10.290 1.00 13.44 C ATOM 1162 OE1 GLU A 76 -8.755 -7.470 11.202 1.00 72.45 O ATOM 1163 OE2 GLU A 76 -8.876 -9.331 10.039 1.00 20.24 O ATOM 0 H GLU A 76 -5.158 -6.971 7.270 1.00 63.40 H new ATOM 0 HA GLU A 76 -7.856 -8.023 6.664 1.00 50.23 H new ATOM 0 HB2 GLU A 76 -7.095 -5.808 8.597 1.00 70.24 H new ATOM 0 HB3 GLU A 76 -8.654 -6.591 8.437 1.00 70.24 H new ATOM 0 HG2 GLU A 76 -6.728 -8.638 8.963 1.00 60.53 H new ATOM 0 HG3 GLU A 76 -6.420 -7.332 10.090 1.00 60.53 H new ATOM 1170 N GLY A 77 -6.358 -5.457 5.480 1.00 54.44 N ATOM 1171 CA GLY A 77 -6.469 -4.349 4.549 1.00 54.14 C ATOM 1172 C GLY A 77 -5.262 -4.241 3.637 1.00 22.14 C ATOM 1173 O GLY A 77 -4.156 -4.629 4.013 1.00 13.34 O ATOM 0 H GLY A 77 -5.402 -5.739 5.698 1.00 54.44 H new ATOM 0 HA2 GLY A 77 -7.368 -4.473 3.945 1.00 54.14 H new ATOM 0 HA3 GLY A 77 -6.585 -3.419 5.106 1.00 54.14 H new ATOM 1177 N PHE A 78 -5.474 -3.715 2.434 1.00 10.21 N ATOM 1178 CA PHE A 78 -4.392 -3.564 1.468 1.00 63.43 C ATOM 1179 C PHE A 78 -4.258 -2.114 1.013 1.00 43.24 C ATOM 1180 O PHE A 78 -5.216 -1.342 1.072 1.00 40.34 O ATOM 1181 CB PHE A 78 -4.632 -4.469 0.259 1.00 54.51 C ATOM 1182 CG PHE A 78 -4.988 -5.880 0.631 1.00 13.52 C ATOM 1183 CD1 PHE A 78 -6.277 -6.204 1.022 1.00 73.33 C ATOM 1184 CD2 PHE A 78 -4.032 -6.882 0.591 1.00 24.22 C ATOM 1185 CE1 PHE A 78 -6.606 -7.501 1.368 1.00 22.23 C ATOM 1186 CE2 PHE A 78 -4.354 -8.180 0.935 1.00 73.02 C ATOM 1187 CZ PHE A 78 -5.643 -8.490 1.325 1.00 52.31 C ATOM 0 H PHE A 78 -6.383 -3.387 2.106 1.00 10.21 H new ATOM 0 HA PHE A 78 -3.463 -3.856 1.957 1.00 63.43 H new ATOM 0 HB2 PHE A 78 -5.434 -4.048 -0.347 1.00 54.51 H new ATOM 0 HB3 PHE A 78 -3.736 -4.480 -0.361 1.00 54.51 H new ATOM 0 HD1 PHE A 78 -7.034 -5.434 1.057 1.00 73.33 H new ATOM 0 HD2 PHE A 78 -3.023 -6.645 0.287 1.00 24.22 H new ATOM 0 HE1 PHE A 78 -7.614 -7.741 1.671 1.00 22.23 H new ATOM 0 HE2 PHE A 78 -3.599 -8.952 0.899 1.00 73.02 H new ATOM 0 HZ PHE A 78 -5.897 -9.504 1.596 1.00 52.31 H new ATOM 1197 N LEU A 79 -3.062 -1.752 0.558 1.00 32.10 N ATOM 1198 CA LEU A 79 -2.797 -0.396 0.090 1.00 64.43 C ATOM 1199 C LEU A 79 -2.226 -0.413 -1.325 1.00 70.51 C ATOM 1200 O LEU A 79 -1.142 -0.946 -1.561 1.00 54.02 O ATOM 1201 CB LEU A 79 -1.824 0.312 1.037 1.00 71.44 C ATOM 1202 CG LEU A 79 -2.100 1.804 1.252 1.00 2.44 C ATOM 1203 CD1 LEU A 79 -2.548 2.065 2.683 1.00 54.22 C ATOM 1204 CD2 LEU A 79 -0.865 2.630 0.921 1.00 50.11 C ATOM 0 H LEU A 79 -2.260 -2.380 0.504 1.00 32.10 H new ATOM 0 HA LEU A 79 -3.741 0.149 0.076 1.00 64.43 H new ATOM 0 HB2 LEU A 79 -1.851 -0.190 2.004 1.00 71.44 H new ATOM 0 HB3 LEU A 79 -0.813 0.197 0.647 1.00 71.44 H new ATOM 0 HG LEU A 79 -2.904 2.103 0.580 1.00 2.44 H new ATOM 0 HD11 LEU A 79 -2.739 3.130 2.816 1.00 54.22 H new ATOM 0 HD12 LEU A 79 -3.460 1.504 2.887 1.00 54.22 H new ATOM 0 HD13 LEU A 79 -1.766 1.748 3.373 1.00 54.22 H new ATOM 0 HD21 LEU A 79 -1.081 3.687 1.080 1.00 50.11 H new ATOM 0 HD22 LEU A 79 -0.041 2.327 1.567 1.00 50.11 H new ATOM 0 HD23 LEU A 79 -0.588 2.469 -0.121 1.00 50.11 H new ATOM 1216 N CYS A 80 -2.962 0.174 -2.264 1.00 14.52 N ATOM 1217 CA CYS A 80 -2.529 0.225 -3.655 1.00 14.42 C ATOM 1218 C CYS A 80 -1.717 1.487 -3.928 1.00 3.21 C ATOM 1219 O CYS A 80 -2.254 2.595 -3.922 1.00 71.24 O ATOM 1220 CB CYS A 80 -3.738 0.171 -4.592 1.00 11.03 C ATOM 1221 SG CYS A 80 -4.785 -1.285 -4.362 1.00 10.24 S ATOM 0 H CYS A 80 -3.861 0.621 -2.086 1.00 14.52 H new ATOM 0 HA CYS A 80 -1.894 -0.641 -3.842 1.00 14.42 H new ATOM 0 HB2 CYS A 80 -4.341 1.066 -4.442 1.00 11.03 H new ATOM 0 HB3 CYS A 80 -3.386 0.193 -5.623 1.00 11.03 H new ATOM 0 HG CYS A 80 -5.781 -1.240 -5.197 1.00 10.24 H new ATOM 1227 N VAL A 81 -0.422 1.311 -4.168 1.00 63.52 N ATOM 1228 CA VAL A 81 0.464 2.435 -4.444 1.00 3.15 C ATOM 1229 C VAL A 81 0.866 2.467 -5.915 1.00 64.42 C ATOM 1230 O VAL A 81 1.603 1.601 -6.386 1.00 33.11 O ATOM 1231 CB VAL A 81 1.735 2.376 -3.574 1.00 52.03 C ATOM 1232 CG1 VAL A 81 2.659 3.545 -3.884 1.00 3.33 C ATOM 1233 CG2 VAL A 81 1.370 2.357 -2.098 1.00 53.04 C ATOM 0 H VAL A 81 0.037 0.400 -4.177 1.00 63.52 H new ATOM 0 HA VAL A 81 -0.089 3.343 -4.202 1.00 3.15 H new ATOM 0 HB VAL A 81 2.266 1.454 -3.809 1.00 52.03 H new ATOM 0 HG11 VAL A 81 3.549 3.481 -3.258 1.00 3.33 H new ATOM 0 HG12 VAL A 81 2.951 3.510 -4.934 1.00 3.33 H new ATOM 0 HG13 VAL A 81 2.140 4.482 -3.683 1.00 3.33 H new ATOM 0 HG21 VAL A 81 2.280 2.315 -1.499 1.00 53.04 H new ATOM 0 HG22 VAL A 81 0.813 3.260 -1.849 1.00 53.04 H new ATOM 0 HG23 VAL A 81 0.756 1.482 -1.886 1.00 53.04 H new ATOM 1243 N PHE A 82 0.381 3.474 -6.634 1.00 24.00 N ATOM 1244 CA PHE A 82 0.694 3.622 -8.050 1.00 40.14 C ATOM 1245 C PHE A 82 1.462 4.919 -8.299 1.00 70.34 C ATOM 1246 O PHE A 82 1.217 5.932 -7.645 1.00 50.00 O ATOM 1247 CB PHE A 82 -0.596 3.583 -8.887 1.00 41.35 C ATOM 1248 CG PHE A 82 -1.061 4.928 -9.379 1.00 4.15 C ATOM 1249 CD1 PHE A 82 -1.689 5.817 -8.521 1.00 72.21 C ATOM 1250 CD2 PHE A 82 -0.867 5.301 -10.699 1.00 32.14 C ATOM 1251 CE1 PHE A 82 -2.115 7.052 -8.972 1.00 63.32 C ATOM 1252 CE2 PHE A 82 -1.290 6.535 -11.155 1.00 21.14 C ATOM 1253 CZ PHE A 82 -1.915 7.412 -10.290 1.00 74.33 C ATOM 0 H PHE A 82 -0.230 4.199 -6.259 1.00 24.00 H new ATOM 0 HA PHE A 82 1.329 2.790 -8.355 1.00 40.14 H new ATOM 0 HB2 PHE A 82 -0.437 2.931 -9.746 1.00 41.35 H new ATOM 0 HB3 PHE A 82 -1.389 3.135 -8.289 1.00 41.35 H new ATOM 0 HD1 PHE A 82 -1.847 5.542 -7.489 1.00 72.21 H new ATOM 0 HD2 PHE A 82 -0.379 4.619 -11.380 1.00 32.14 H new ATOM 0 HE1 PHE A 82 -2.604 7.735 -8.294 1.00 63.32 H new ATOM 0 HE2 PHE A 82 -1.132 6.813 -12.186 1.00 21.14 H new ATOM 0 HZ PHE A 82 -2.246 8.377 -10.644 1.00 74.33 H new ATOM 1263 N ALA A 83 2.389 4.880 -9.249 1.00 55.50 N ATOM 1264 CA ALA A 83 3.187 6.052 -9.583 1.00 24.11 C ATOM 1265 C ALA A 83 2.499 6.894 -10.652 1.00 53.10 C ATOM 1266 O ALA A 83 2.182 6.403 -11.735 1.00 74.23 O ATOM 1267 CB ALA A 83 4.573 5.633 -10.050 1.00 53.22 C ATOM 0 H ALA A 83 2.606 4.050 -9.801 1.00 55.50 H new ATOM 0 HA ALA A 83 3.289 6.661 -8.685 1.00 24.11 H new ATOM 0 HB1 ALA A 83 5.158 6.520 -10.296 1.00 53.22 H new ATOM 0 HB2 ALA A 83 5.072 5.078 -9.256 1.00 53.22 H new ATOM 0 HB3 ALA A 83 4.484 5.001 -10.933 1.00 53.22 H new ATOM 1273 N ILE A 84 2.271 8.166 -10.341 1.00 62.42 N ATOM 1274 CA ILE A 84 1.622 9.076 -11.275 1.00 4.54 C ATOM 1275 C ILE A 84 2.441 9.225 -12.550 1.00 72.45 C ATOM 1276 O ILE A 84 1.898 9.468 -13.627 1.00 34.35 O ATOM 1277 CB ILE A 84 1.410 10.465 -10.647 1.00 41.22 C ATOM 1278 CG1 ILE A 84 2.715 10.982 -10.037 1.00 64.10 C ATOM 1279 CG2 ILE A 84 0.321 10.399 -9.592 1.00 31.25 C ATOM 1280 CD1 ILE A 84 2.943 12.459 -10.265 1.00 73.22 C ATOM 0 H ILE A 84 2.527 8.589 -9.449 1.00 62.42 H new ATOM 0 HA ILE A 84 0.651 8.645 -11.518 1.00 4.54 H new ATOM 0 HB ILE A 84 1.099 11.158 -11.429 1.00 41.22 H new ATOM 0 HG12 ILE A 84 2.709 10.784 -8.965 1.00 64.10 H new ATOM 0 HG13 ILE A 84 3.551 10.424 -10.459 1.00 64.10 H new ATOM 0 HG21 ILE A 84 0.179 11.387 -9.154 1.00 31.25 H new ATOM 0 HG22 ILE A 84 -0.611 10.068 -10.051 1.00 31.25 H new ATOM 0 HG23 ILE A 84 0.612 9.695 -8.813 1.00 31.25 H new ATOM 0 HD11 ILE A 84 3.886 12.757 -9.806 1.00 73.22 H new ATOM 0 HD12 ILE A 84 2.981 12.660 -11.336 1.00 73.22 H new ATOM 0 HD13 ILE A 84 2.127 13.026 -9.818 1.00 73.22 H new ATOM 1292 N ASN A 85 3.753 9.073 -12.417 1.00 22.24 N ATOM 1293 CA ASN A 85 4.656 9.184 -13.555 1.00 31.31 C ATOM 1294 C ASN A 85 4.716 7.868 -14.328 1.00 52.05 C ATOM 1295 O ASN A 85 4.958 7.856 -15.535 1.00 72.22 O ATOM 1296 CB ASN A 85 6.055 9.595 -13.084 1.00 45.50 C ATOM 1297 CG ASN A 85 6.842 8.439 -12.498 1.00 10.45 C ATOM 1298 OD1 ASN A 85 6.541 7.956 -11.407 1.00 43.25 O ATOM 1299 ND2 ASN A 85 7.855 7.991 -13.227 1.00 40.34 N ATOM 0 H ASN A 85 4.216 8.872 -11.530 1.00 22.24 H new ATOM 0 HA ASN A 85 4.274 9.954 -14.225 1.00 31.31 H new ATOM 0 HB2 ASN A 85 6.607 10.015 -13.925 1.00 45.50 H new ATOM 0 HB3 ASN A 85 5.965 10.383 -12.336 1.00 45.50 H new ATOM 0 HD21 ASN A 85 8.422 7.214 -12.889 1.00 40.34 H new ATOM 0 HD22 ASN A 85 8.067 8.423 -14.126 1.00 40.34 H new ATOM 1306 N ASN A 86 4.493 6.764 -13.622 1.00 44.14 N ATOM 1307 CA ASN A 86 4.520 5.443 -14.238 1.00 74.54 C ATOM 1308 C ASN A 86 3.106 4.960 -14.546 1.00 34.13 C ATOM 1309 O ASN A 86 2.356 4.587 -13.644 1.00 34.41 O ATOM 1310 CB ASN A 86 5.226 4.443 -13.320 1.00 74.25 C ATOM 1311 CG ASN A 86 6.193 3.551 -14.073 1.00 25.54 C ATOM 1312 OD1 ASN A 86 7.038 4.030 -14.828 1.00 4.40 O ATOM 1313 ND2 ASN A 86 6.071 2.243 -13.872 1.00 54.54 N ATOM 0 H ASN A 86 4.291 6.759 -12.622 1.00 44.14 H new ATOM 0 HA ASN A 86 5.072 5.516 -15.175 1.00 74.54 H new ATOM 0 HB2 ASN A 86 5.765 4.985 -12.543 1.00 74.25 H new ATOM 0 HB3 ASN A 86 4.481 3.825 -12.819 1.00 74.25 H new ATOM 0 HD21 ASN A 86 6.693 1.593 -14.353 1.00 54.54 H new ATOM 0 HD22 ASN A 86 5.356 1.889 -13.237 1.00 54.54 H new ATOM 1320 N THR A 87 2.749 4.971 -15.826 1.00 51.43 N ATOM 1321 CA THR A 87 1.424 4.536 -16.255 1.00 74.11 C ATOM 1322 C THR A 87 1.239 3.037 -16.031 1.00 1.21 C ATOM 1323 O THR A 87 0.119 2.562 -15.843 1.00 33.41 O ATOM 1324 CB THR A 87 1.208 4.873 -17.731 1.00 33.31 C ATOM 1325 OG1 THR A 87 1.818 6.110 -18.057 1.00 74.53 O ATOM 1326 CG2 THR A 87 -0.253 4.967 -18.116 1.00 2.32 C ATOM 0 H THR A 87 3.359 5.276 -16.585 1.00 51.43 H new ATOM 0 HA THR A 87 0.685 5.066 -15.655 1.00 74.11 H new ATOM 0 HB THR A 87 1.661 4.050 -18.284 1.00 33.31 H new ATOM 0 HG1 THR A 87 1.831 6.687 -17.265 1.00 74.53 H new ATOM 0 HG21 THR A 87 -0.335 5.209 -19.176 1.00 2.32 H new ATOM 0 HG22 THR A 87 -0.742 4.012 -17.922 1.00 2.32 H new ATOM 0 HG23 THR A 87 -0.735 5.748 -17.527 1.00 2.32 H new ATOM 1334 N LYS A 88 2.343 2.297 -16.054 1.00 41.43 N ATOM 1335 CA LYS A 88 2.300 0.851 -15.856 1.00 62.21 C ATOM 1336 C LYS A 88 1.759 0.502 -14.473 1.00 24.44 C ATOM 1337 O LYS A 88 0.915 -0.382 -14.332 1.00 75.12 O ATOM 1338 CB LYS A 88 3.695 0.249 -16.036 1.00 1.11 C ATOM 1339 CG LYS A 88 4.222 0.351 -17.458 1.00 51.35 C ATOM 1340 CD LYS A 88 5.332 -0.656 -17.714 1.00 12.11 C ATOM 1341 CE LYS A 88 4.800 -2.081 -17.737 1.00 63.01 C ATOM 1342 NZ LYS A 88 5.151 -2.784 -19.002 1.00 1.01 N ATOM 0 H LYS A 88 3.278 2.674 -16.208 1.00 41.43 H new ATOM 0 HA LYS A 88 1.628 0.430 -16.604 1.00 62.21 H new ATOM 0 HB2 LYS A 88 4.389 0.753 -15.363 1.00 1.11 H new ATOM 0 HB3 LYS A 88 3.670 -0.800 -15.741 1.00 1.11 H new ATOM 0 HG2 LYS A 88 3.407 0.183 -18.162 1.00 51.35 H new ATOM 0 HG3 LYS A 88 4.595 1.359 -17.637 1.00 51.35 H new ATOM 0 HD2 LYS A 88 5.815 -0.432 -18.665 1.00 12.11 H new ATOM 0 HD3 LYS A 88 6.094 -0.564 -16.940 1.00 12.11 H new ATOM 0 HE2 LYS A 88 5.206 -2.634 -16.890 1.00 63.01 H new ATOM 0 HE3 LYS A 88 3.717 -2.066 -17.618 1.00 63.01 H new ATOM 0 HZ1 LYS A 88 4.771 -3.752 -18.978 1.00 1.01 H new ATOM 0 HZ2 LYS A 88 4.743 -2.271 -19.809 1.00 1.01 H new ATOM 0 HZ3 LYS A 88 6.185 -2.821 -19.103 1.00 1.01 H new ATOM 1356 N SER A 89 2.251 1.201 -13.453 1.00 3.23 N ATOM 1357 CA SER A 89 1.816 0.961 -12.080 1.00 11.42 C ATOM 1358 C SER A 89 0.297 1.046 -11.968 1.00 50.15 C ATOM 1359 O SER A 89 -0.336 0.210 -11.322 1.00 41.53 O ATOM 1360 CB SER A 89 2.466 1.969 -11.132 1.00 33.13 C ATOM 1361 OG SER A 89 2.007 3.284 -11.392 1.00 64.22 O ATOM 0 H SER A 89 2.950 1.937 -13.551 1.00 3.23 H new ATOM 0 HA SER A 89 2.128 -0.045 -11.798 1.00 11.42 H new ATOM 0 HB2 SER A 89 2.241 1.700 -10.100 1.00 33.13 H new ATOM 0 HB3 SER A 89 3.550 1.930 -11.243 1.00 33.13 H new ATOM 0 HG SER A 89 2.432 3.624 -12.207 1.00 64.22 H new ATOM 1367 N PHE A 90 -0.282 2.058 -12.605 1.00 61.22 N ATOM 1368 CA PHE A 90 -1.727 2.251 -12.583 1.00 62.14 C ATOM 1369 C PHE A 90 -2.443 1.039 -13.176 1.00 61.33 C ATOM 1370 O PHE A 90 -3.585 0.746 -12.823 1.00 42.43 O ATOM 1371 CB PHE A 90 -2.102 3.517 -13.361 1.00 24.30 C ATOM 1372 CG PHE A 90 -3.583 3.718 -13.517 1.00 64.20 C ATOM 1373 CD1 PHE A 90 -4.427 3.637 -12.421 1.00 75.31 C ATOM 1374 CD2 PHE A 90 -4.131 3.987 -14.762 1.00 72.20 C ATOM 1375 CE1 PHE A 90 -5.789 3.821 -12.563 1.00 1.41 C ATOM 1376 CE2 PHE A 90 -5.492 4.172 -14.910 1.00 2.12 C ATOM 1377 CZ PHE A 90 -6.322 4.088 -13.809 1.00 11.21 C ATOM 0 H PHE A 90 0.228 2.758 -13.144 1.00 61.22 H new ATOM 0 HA PHE A 90 -2.043 2.365 -11.546 1.00 62.14 H new ATOM 0 HB2 PHE A 90 -1.679 4.383 -12.852 1.00 24.30 H new ATOM 0 HB3 PHE A 90 -1.645 3.473 -14.350 1.00 24.30 H new ATOM 0 HD1 PHE A 90 -4.016 3.428 -11.445 1.00 75.31 H new ATOM 0 HD2 PHE A 90 -3.486 4.053 -15.626 1.00 72.20 H new ATOM 0 HE1 PHE A 90 -6.436 3.756 -11.701 1.00 1.41 H new ATOM 0 HE2 PHE A 90 -5.906 4.382 -15.885 1.00 2.12 H new ATOM 0 HZ PHE A 90 -7.386 4.231 -13.922 1.00 11.21 H new ATOM 1387 N GLU A 91 -1.763 0.342 -14.080 1.00 11.21 N ATOM 1388 CA GLU A 91 -2.333 -0.835 -14.726 1.00 15.11 C ATOM 1389 C GLU A 91 -2.302 -2.042 -13.793 1.00 24.42 C ATOM 1390 O GLU A 91 -3.156 -2.925 -13.878 1.00 42.51 O ATOM 1391 CB GLU A 91 -1.571 -1.150 -16.014 1.00 34.33 C ATOM 1392 CG GLU A 91 -1.396 0.055 -16.926 1.00 34.34 C ATOM 1393 CD GLU A 91 -1.767 -0.243 -18.365 1.00 42.01 C ATOM 1394 OE1 GLU A 91 -2.957 -0.517 -18.627 1.00 15.20 O ATOM 1395 OE2 GLU A 91 -0.868 -0.202 -19.231 1.00 63.04 O ATOM 0 H GLU A 91 -0.816 0.572 -14.382 1.00 11.21 H new ATOM 0 HA GLU A 91 -3.373 -0.618 -14.969 1.00 15.11 H new ATOM 0 HB2 GLU A 91 -0.589 -1.547 -15.758 1.00 34.33 H new ATOM 0 HB3 GLU A 91 -2.100 -1.933 -16.557 1.00 34.33 H new ATOM 0 HG2 GLU A 91 -2.012 0.876 -16.559 1.00 34.34 H new ATOM 0 HG3 GLU A 91 -0.360 0.390 -16.884 1.00 34.34 H new ATOM 1402 N ASP A 92 -1.314 -2.077 -12.905 1.00 31.03 N ATOM 1403 CA ASP A 92 -1.174 -3.179 -11.959 1.00 2.41 C ATOM 1404 C ASP A 92 -2.189 -3.062 -10.826 1.00 33.30 C ATOM 1405 O ASP A 92 -2.668 -4.067 -10.303 1.00 21.13 O ATOM 1406 CB ASP A 92 0.244 -3.212 -11.387 1.00 35.32 C ATOM 1407 CG ASP A 92 1.305 -3.171 -12.469 1.00 23.21 C ATOM 1408 OD1 ASP A 92 1.445 -4.172 -13.202 1.00 31.41 O ATOM 1409 OD2 ASP A 92 1.997 -2.137 -12.583 1.00 75.11 O ATOM 0 H ASP A 92 -0.598 -1.355 -12.820 1.00 31.03 H new ATOM 0 HA ASP A 92 -1.364 -4.108 -12.496 1.00 2.41 H new ATOM 0 HB2 ASP A 92 0.381 -2.365 -10.715 1.00 35.32 H new ATOM 0 HB3 ASP A 92 0.371 -4.116 -10.791 1.00 35.32 H new ATOM 1414 N ILE A 93 -2.515 -1.829 -10.451 1.00 32.41 N ATOM 1415 CA ILE A 93 -3.475 -1.588 -9.382 1.00 42.32 C ATOM 1416 C ILE A 93 -4.840 -2.173 -9.736 1.00 44.45 C ATOM 1417 O ILE A 93 -5.588 -2.605 -8.859 1.00 61.11 O ATOM 1418 CB ILE A 93 -3.624 -0.078 -9.090 1.00 62.24 C ATOM 1419 CG1 ILE A 93 -2.316 0.501 -8.557 1.00 72.13 C ATOM 1420 CG2 ILE A 93 -4.742 0.175 -8.094 1.00 14.43 C ATOM 1421 CD1 ILE A 93 -1.701 -0.308 -7.434 1.00 24.03 C ATOM 0 H ILE A 93 -2.129 -0.984 -10.871 1.00 32.41 H new ATOM 0 HA ILE A 93 -3.093 -2.081 -8.488 1.00 42.32 H new ATOM 0 HB ILE A 93 -3.874 0.418 -10.028 1.00 62.24 H new ATOM 0 HG12 ILE A 93 -1.600 0.571 -9.376 1.00 72.13 H new ATOM 0 HG13 ILE A 93 -2.496 1.516 -8.204 1.00 72.13 H new ATOM 0 HG21 ILE A 93 -4.826 1.245 -7.906 1.00 14.43 H new ATOM 0 HG22 ILE A 93 -5.682 -0.197 -8.500 1.00 14.43 H new ATOM 0 HG23 ILE A 93 -4.521 -0.342 -7.160 1.00 14.43 H new ATOM 0 HD11 ILE A 93 -0.775 0.166 -7.109 1.00 24.03 H new ATOM 0 HD12 ILE A 93 -2.397 -0.357 -6.597 1.00 24.03 H new ATOM 0 HD13 ILE A 93 -1.487 -1.317 -7.787 1.00 24.03 H new ATOM 1433 N HIS A 94 -5.155 -2.183 -11.026 1.00 22.45 N ATOM 1434 CA HIS A 94 -6.428 -2.714 -11.497 1.00 41.51 C ATOM 1435 C HIS A 94 -6.476 -4.231 -11.329 1.00 4.15 C ATOM 1436 O HIS A 94 -7.388 -4.767 -10.698 1.00 1.23 O ATOM 1437 CB HIS A 94 -6.645 -2.331 -12.967 1.00 4.24 C ATOM 1438 CG HIS A 94 -7.708 -3.132 -13.659 1.00 0.34 C ATOM 1439 ND1 HIS A 94 -9.046 -3.046 -13.338 1.00 64.24 N ATOM 1440 CD2 HIS A 94 -7.620 -4.039 -14.661 1.00 42.35 C ATOM 1441 CE1 HIS A 94 -9.736 -3.866 -14.111 1.00 1.31 C ATOM 1442 NE2 HIS A 94 -8.894 -4.479 -14.923 1.00 34.33 N ATOM 0 H HIS A 94 -4.546 -1.829 -11.764 1.00 22.45 H new ATOM 0 HA HIS A 94 -7.228 -2.280 -10.897 1.00 41.51 H new ATOM 0 HB2 HIS A 94 -6.909 -1.275 -13.021 1.00 4.24 H new ATOM 0 HB3 HIS A 94 -5.705 -2.453 -13.505 1.00 4.24 H new ATOM 0 HD2 HIS A 94 -6.717 -4.357 -15.160 1.00 42.35 H new ATOM 0 HE1 HIS A 94 -10.806 -4.010 -14.083 1.00 1.31 H new ATOM 0 HE2 HIS A 94 -9.149 -5.168 -15.631 1.00 34.33 H new ATOM 1451 N GLN A 95 -5.492 -4.918 -11.899 1.00 2.44 N ATOM 1452 CA GLN A 95 -5.425 -6.373 -11.814 1.00 24.21 C ATOM 1453 C GLN A 95 -5.171 -6.828 -10.380 1.00 62.35 C ATOM 1454 O GLN A 95 -5.574 -7.922 -9.985 1.00 13.53 O ATOM 1455 CB GLN A 95 -4.329 -6.910 -12.734 1.00 4.12 C ATOM 1456 CG GLN A 95 -2.950 -6.357 -12.424 1.00 32.42 C ATOM 1457 CD GLN A 95 -2.204 -7.191 -11.400 1.00 65.14 C ATOM 1458 OE1 GLN A 95 -2.678 -8.246 -10.978 1.00 62.50 O ATOM 1459 NE2 GLN A 95 -1.030 -6.721 -10.996 1.00 41.14 N ATOM 0 H GLN A 95 -4.730 -4.491 -12.425 1.00 2.44 H new ATOM 0 HA GLN A 95 -6.387 -6.772 -12.135 1.00 24.21 H new ATOM 0 HB2 GLN A 95 -4.301 -7.997 -12.656 1.00 4.12 H new ATOM 0 HB3 GLN A 95 -4.583 -6.671 -13.767 1.00 4.12 H new ATOM 0 HG2 GLN A 95 -2.366 -6.310 -13.343 1.00 32.42 H new ATOM 0 HG3 GLN A 95 -3.047 -5.336 -12.055 1.00 32.42 H new ATOM 0 HE21 GLN A 95 -0.676 -5.842 -11.373 1.00 41.14 H new ATOM 0 HE22 GLN A 95 -0.482 -7.239 -10.309 1.00 41.14 H new ATOM 1468 N TYR A 96 -4.499 -5.982 -9.605 1.00 23.24 N ATOM 1469 CA TYR A 96 -4.190 -6.300 -8.214 1.00 0.34 C ATOM 1470 C TYR A 96 -5.465 -6.563 -7.417 1.00 3.24 C ATOM 1471 O TYR A 96 -5.567 -7.561 -6.704 1.00 42.12 O ATOM 1472 CB TYR A 96 -3.397 -5.159 -7.572 1.00 31.32 C ATOM 1473 CG TYR A 96 -1.900 -5.355 -7.633 1.00 4.45 C ATOM 1474 CD1 TYR A 96 -1.320 -6.551 -7.229 1.00 41.34 C ATOM 1475 CD2 TYR A 96 -1.066 -4.344 -8.095 1.00 73.13 C ATOM 1476 CE1 TYR A 96 0.049 -6.734 -7.284 1.00 31.42 C ATOM 1477 CE2 TYR A 96 0.304 -4.520 -8.153 1.00 2.42 C ATOM 1478 CZ TYR A 96 0.856 -5.716 -7.746 1.00 74.21 C ATOM 1479 OH TYR A 96 2.219 -5.895 -7.803 1.00 74.33 O ATOM 0 H TYR A 96 -4.158 -5.072 -9.916 1.00 23.24 H new ATOM 0 HA TYR A 96 -3.584 -7.206 -8.201 1.00 0.34 H new ATOM 0 HB2 TYR A 96 -3.653 -4.224 -8.070 1.00 31.32 H new ATOM 0 HB3 TYR A 96 -3.700 -5.058 -6.530 1.00 31.32 H new ATOM 0 HD1 TYR A 96 -1.949 -7.351 -6.866 1.00 41.34 H new ATOM 0 HD2 TYR A 96 -1.495 -3.406 -8.414 1.00 73.13 H new ATOM 0 HE1 TYR A 96 0.484 -7.670 -6.967 1.00 31.42 H new ATOM 0 HE2 TYR A 96 0.939 -3.725 -8.515 1.00 2.42 H new ATOM 0 HH TYR A 96 2.602 -5.781 -6.908 1.00 74.33 H new ATOM 1489 N ARG A 97 -6.434 -5.662 -7.545 1.00 33.11 N ATOM 1490 CA ARG A 97 -7.702 -5.794 -6.840 1.00 25.13 C ATOM 1491 C ARG A 97 -8.364 -7.135 -7.145 1.00 23.30 C ATOM 1492 O ARG A 97 -9.074 -7.692 -6.308 1.00 61.35 O ATOM 1493 CB ARG A 97 -8.633 -4.648 -7.226 1.00 74.43 C ATOM 1494 CG ARG A 97 -9.994 -4.727 -6.562 1.00 43.44 C ATOM 1495 CD ARG A 97 -11.107 -4.672 -7.588 1.00 30.43 C ATOM 1496 NE ARG A 97 -11.253 -5.935 -8.308 1.00 43.12 N ATOM 1497 CZ ARG A 97 -11.992 -6.081 -9.406 1.00 34.40 C ATOM 1498 NH1 ARG A 97 -12.661 -5.050 -9.906 1.00 41.31 N ATOM 1499 NH2 ARG A 97 -12.064 -7.262 -10.004 1.00 42.31 N ATOM 0 H ARG A 97 -6.364 -4.831 -8.132 1.00 33.11 H new ATOM 0 HA ARG A 97 -7.504 -5.752 -5.769 1.00 25.13 H new ATOM 0 HB2 ARG A 97 -8.162 -3.702 -6.960 1.00 74.43 H new ATOM 0 HB3 ARG A 97 -8.765 -4.646 -8.308 1.00 74.43 H new ATOM 0 HG2 ARG A 97 -10.069 -5.651 -5.989 1.00 43.44 H new ATOM 0 HG3 ARG A 97 -10.106 -3.904 -5.856 1.00 43.44 H new ATOM 0 HD2 ARG A 97 -12.046 -4.428 -7.091 1.00 30.43 H new ATOM 0 HD3 ARG A 97 -10.905 -3.871 -8.299 1.00 30.43 H new ATOM 0 HE ARG A 97 -10.760 -6.752 -7.949 1.00 43.12 H new ATOM 0 HH11 ARG A 97 -12.611 -4.139 -9.449 1.00 41.31 H new ATOM 0 HH12 ARG A 97 -13.225 -5.168 -10.747 1.00 41.31 H new ATOM 0 HH21 ARG A 97 -11.553 -8.059 -9.623 1.00 42.31 H new ATOM 0 HH22 ARG A 97 -12.630 -7.374 -10.845 1.00 42.31 H new ATOM 1513 N GLU A 98 -8.124 -7.650 -8.347 1.00 43.41 N ATOM 1514 CA GLU A 98 -8.696 -8.927 -8.758 1.00 3.55 C ATOM 1515 C GLU A 98 -8.229 -10.051 -7.840 1.00 42.22 C ATOM 1516 O GLU A 98 -9.009 -10.928 -7.467 1.00 44.53 O ATOM 1517 CB GLU A 98 -8.310 -9.241 -10.205 1.00 54.31 C ATOM 1518 CG GLU A 98 -8.613 -8.110 -11.175 1.00 15.44 C ATOM 1519 CD GLU A 98 -8.336 -8.489 -12.617 1.00 53.44 C ATOM 1520 OE1 GLU A 98 -7.611 -9.481 -12.842 1.00 52.21 O ATOM 1521 OE2 GLU A 98 -8.844 -7.794 -13.521 1.00 12.24 O ATOM 0 H GLU A 98 -7.538 -7.203 -9.052 1.00 43.41 H new ATOM 0 HA GLU A 98 -9.781 -8.851 -8.688 1.00 3.55 H new ATOM 0 HB2 GLU A 98 -7.245 -9.469 -10.247 1.00 54.31 H new ATOM 0 HB3 GLU A 98 -8.840 -10.137 -10.527 1.00 54.31 H new ATOM 0 HG2 GLU A 98 -9.659 -7.820 -11.074 1.00 15.44 H new ATOM 0 HG3 GLU A 98 -8.014 -7.239 -10.910 1.00 15.44 H new ATOM 1528 N GLN A 99 -6.951 -10.018 -7.477 1.00 73.44 N ATOM 1529 CA GLN A 99 -6.376 -11.032 -6.601 1.00 64.55 C ATOM 1530 C GLN A 99 -6.904 -10.888 -5.175 1.00 14.41 C ATOM 1531 O GLN A 99 -6.914 -11.851 -4.408 1.00 64.43 O ATOM 1532 CB GLN A 99 -4.849 -10.930 -6.607 1.00 71.34 C ATOM 1533 CG GLN A 99 -4.155 -12.243 -6.926 1.00 72.13 C ATOM 1534 CD GLN A 99 -3.595 -12.922 -5.692 1.00 41.44 C ATOM 1535 OE1 GLN A 99 -4.084 -12.716 -4.581 1.00 20.34 O ATOM 1536 NE2 GLN A 99 -2.564 -13.735 -5.880 1.00 21.33 N ATOM 0 H GLN A 99 -6.293 -9.299 -7.777 1.00 73.44 H new ATOM 0 HA GLN A 99 -6.671 -12.012 -6.977 1.00 64.55 H new ATOM 0 HB2 GLN A 99 -4.546 -10.181 -7.338 1.00 71.34 H new ATOM 0 HB3 GLN A 99 -4.513 -10.578 -5.632 1.00 71.34 H new ATOM 0 HG2 GLN A 99 -4.861 -12.913 -7.416 1.00 72.13 H new ATOM 0 HG3 GLN A 99 -3.346 -12.060 -7.634 1.00 72.13 H new ATOM 0 HE21 GLN A 99 -2.191 -13.876 -6.819 1.00 21.33 H new ATOM 0 HE22 GLN A 99 -2.145 -14.219 -5.086 1.00 21.33 H new ATOM 1545 N ILE A 100 -7.340 -9.682 -4.826 1.00 44.52 N ATOM 1546 CA ILE A 100 -7.865 -9.417 -3.492 1.00 4.41 C ATOM 1547 C ILE A 100 -9.265 -10.000 -3.326 1.00 12.34 C ATOM 1548 O ILE A 100 -9.576 -10.614 -2.306 1.00 32.04 O ATOM 1549 CB ILE A 100 -7.913 -7.906 -3.193 1.00 41.34 C ATOM 1550 CG1 ILE A 100 -6.584 -7.249 -3.552 1.00 55.53 C ATOM 1551 CG2 ILE A 100 -8.262 -7.662 -1.731 1.00 21.31 C ATOM 1552 CD1 ILE A 100 -5.508 -7.492 -2.530 1.00 31.11 C ATOM 0 H ILE A 100 -7.340 -8.874 -5.448 1.00 44.52 H new ATOM 0 HA ILE A 100 -7.187 -9.897 -2.787 1.00 4.41 H new ATOM 0 HB ILE A 100 -8.692 -7.455 -3.807 1.00 41.34 H new ATOM 0 HG12 ILE A 100 -6.250 -7.625 -4.519 1.00 55.53 H new ATOM 0 HG13 ILE A 100 -6.735 -6.175 -3.663 1.00 55.53 H new ATOM 0 HG21 ILE A 100 -8.291 -6.590 -1.538 1.00 21.31 H new ATOM 0 HG22 ILE A 100 -9.237 -8.097 -1.512 1.00 21.31 H new ATOM 0 HG23 ILE A 100 -7.507 -8.125 -1.095 1.00 21.31 H new ATOM 0 HD11 ILE A 100 -4.589 -6.998 -2.845 1.00 31.11 H new ATOM 0 HD12 ILE A 100 -5.824 -7.091 -1.567 1.00 31.11 H new ATOM 0 HD13 ILE A 100 -5.331 -8.563 -2.436 1.00 31.11 H new ATOM 1564 N LYS A 101 -10.107 -9.802 -4.335 1.00 62.04 N ATOM 1565 CA LYS A 101 -11.474 -10.305 -4.300 1.00 34.23 C ATOM 1566 C LYS A 101 -11.499 -11.824 -4.157 1.00 72.25 C ATOM 1567 O LYS A 101 -12.404 -12.382 -3.536 1.00 11.22 O ATOM 1568 CB LYS A 101 -12.216 -9.885 -5.566 1.00 50.20 C ATOM 1569 CG LYS A 101 -12.023 -8.418 -5.918 1.00 14.50 C ATOM 1570 CD LYS A 101 -13.270 -7.828 -6.554 1.00 13.24 C ATOM 1571 CE LYS A 101 -13.716 -8.643 -7.756 1.00 63.54 C ATOM 1572 NZ LYS A 101 -14.607 -7.865 -8.661 1.00 32.04 N ATOM 0 H LYS A 101 -9.866 -9.296 -5.187 1.00 62.04 H new ATOM 0 HA LYS A 101 -11.972 -9.876 -3.431 1.00 34.23 H new ATOM 0 HB2 LYS A 101 -11.875 -10.499 -6.399 1.00 50.20 H new ATOM 0 HB3 LYS A 101 -13.280 -10.084 -5.438 1.00 50.20 H new ATOM 0 HG2 LYS A 101 -11.773 -7.857 -5.018 1.00 14.50 H new ATOM 0 HG3 LYS A 101 -11.181 -8.315 -6.602 1.00 14.50 H new ATOM 0 HD2 LYS A 101 -14.073 -7.792 -5.818 1.00 13.24 H new ATOM 0 HD3 LYS A 101 -13.073 -6.801 -6.861 1.00 13.24 H new ATOM 0 HE2 LYS A 101 -12.840 -8.979 -8.311 1.00 63.54 H new ATOM 0 HE3 LYS A 101 -14.238 -9.537 -7.414 1.00 63.54 H new ATOM 0 HZ1 LYS A 101 -14.414 -8.128 -9.649 1.00 32.04 H new ATOM 0 HZ2 LYS A 101 -15.600 -8.075 -8.435 1.00 32.04 H new ATOM 0 HZ3 LYS A 101 -14.430 -6.848 -8.532 1.00 32.04 H new ATOM 1586 N ARG A 102 -10.502 -12.489 -4.733 1.00 13.22 N ATOM 1587 CA ARG A 102 -10.418 -13.942 -4.666 1.00 4.12 C ATOM 1588 C ARG A 102 -10.227 -14.412 -3.227 1.00 13.44 C ATOM 1589 O ARG A 102 -11.044 -15.166 -2.699 1.00 72.24 O ATOM 1590 CB ARG A 102 -9.269 -14.445 -5.542 1.00 23.50 C ATOM 1591 CG ARG A 102 -9.676 -15.571 -6.474 1.00 31.42 C ATOM 1592 CD ARG A 102 -8.751 -15.666 -7.677 1.00 10.43 C ATOM 1593 NE ARG A 102 -8.603 -17.043 -8.142 1.00 21.34 N ATOM 1594 CZ ARG A 102 -8.216 -17.375 -9.372 1.00 13.05 C ATOM 1595 NH1 ARG A 102 -7.925 -16.433 -10.262 1.00 4.43 N ATOM 1596 NH2 ARG A 102 -8.116 -18.653 -9.713 1.00 14.21 N ATOM 0 H ARG A 102 -9.743 -12.045 -5.250 1.00 13.22 H new ATOM 0 HA ARG A 102 -11.356 -14.355 -5.038 1.00 4.12 H new ATOM 0 HB2 ARG A 102 -8.881 -13.615 -6.133 1.00 23.50 H new ATOM 0 HB3 ARG A 102 -8.456 -14.788 -4.902 1.00 23.50 H new ATOM 0 HG2 ARG A 102 -9.665 -16.516 -5.930 1.00 31.42 H new ATOM 0 HG3 ARG A 102 -10.699 -15.411 -6.813 1.00 31.42 H new ATOM 0 HD2 ARG A 102 -9.143 -15.050 -8.486 1.00 10.43 H new ATOM 0 HD3 ARG A 102 -7.772 -15.264 -7.415 1.00 10.43 H new ATOM 0 HE ARG A 102 -8.809 -17.795 -7.485 1.00 21.34 H new ATOM 0 HH11 ARG A 102 -7.997 -15.449 -10.005 1.00 4.43 H new ATOM 0 HH12 ARG A 102 -7.629 -16.694 -11.203 1.00 4.43 H new ATOM 0 HH21 ARG A 102 -8.336 -19.381 -9.033 1.00 14.21 H new ATOM 0 HH22 ARG A 102 -7.820 -18.908 -10.655 1.00 14.21 H new ATOM 1610 N VAL A 103 -9.147 -13.960 -2.595 1.00 40.22 N ATOM 1611 CA VAL A 103 -8.859 -14.334 -1.219 1.00 31.53 C ATOM 1612 C VAL A 103 -9.961 -13.850 -0.284 1.00 74.22 C ATOM 1613 O VAL A 103 -10.526 -14.628 0.485 1.00 0.13 O ATOM 1614 CB VAL A 103 -7.510 -13.752 -0.755 1.00 11.32 C ATOM 1615 CG1 VAL A 103 -7.178 -14.214 0.656 1.00 2.14 C ATOM 1616 CG2 VAL A 103 -6.404 -14.138 -1.726 1.00 71.33 C ATOM 0 H VAL A 103 -8.459 -13.335 -3.016 1.00 40.22 H new ATOM 0 HA VAL A 103 -8.807 -15.422 -1.183 1.00 31.53 H new ATOM 0 HB VAL A 103 -7.591 -12.665 -0.741 1.00 11.32 H new ATOM 0 HG11 VAL A 103 -6.221 -13.790 0.962 1.00 2.14 H new ATOM 0 HG12 VAL A 103 -7.958 -13.881 1.341 1.00 2.14 H new ATOM 0 HG13 VAL A 103 -7.117 -15.302 0.678 1.00 2.14 H new ATOM 0 HG21 VAL A 103 -5.457 -13.719 -1.384 1.00 71.33 H new ATOM 0 HG22 VAL A 103 -6.324 -15.224 -1.774 1.00 71.33 H new ATOM 0 HG23 VAL A 103 -6.637 -13.748 -2.717 1.00 71.33 H new ATOM 1626 N LYS A 104 -10.266 -12.559 -0.361 1.00 62.11 N ATOM 1627 CA LYS A 104 -11.304 -11.967 0.473 1.00 71.22 C ATOM 1628 C LYS A 104 -12.663 -12.593 0.173 1.00 11.51 C ATOM 1629 O LYS A 104 -13.546 -12.623 1.031 1.00 10.33 O ATOM 1630 CB LYS A 104 -11.364 -10.455 0.247 1.00 0.12 C ATOM 1631 CG LYS A 104 -10.030 -9.758 0.454 1.00 60.34 C ATOM 1632 CD LYS A 104 -9.613 -9.778 1.916 1.00 73.51 C ATOM 1633 CE LYS A 104 -10.034 -8.507 2.634 1.00 40.02 C ATOM 1634 NZ LYS A 104 -11.049 -8.774 3.690 1.00 24.13 N ATOM 0 H LYS A 104 -9.808 -11.903 -0.993 1.00 62.11 H new ATOM 0 HA LYS A 104 -11.056 -12.163 1.516 1.00 71.22 H new ATOM 0 HB2 LYS A 104 -11.713 -10.261 -0.767 1.00 0.12 H new ATOM 0 HB3 LYS A 104 -12.100 -10.023 0.925 1.00 0.12 H new ATOM 0 HG2 LYS A 104 -9.265 -10.246 -0.150 1.00 60.34 H new ATOM 0 HG3 LYS A 104 -10.099 -8.727 0.108 1.00 60.34 H new ATOM 0 HD2 LYS A 104 -10.059 -10.641 2.411 1.00 73.51 H new ATOM 0 HD3 LYS A 104 -8.531 -9.895 1.985 1.00 73.51 H new ATOM 0 HE2 LYS A 104 -9.159 -8.037 3.083 1.00 40.02 H new ATOM 0 HE3 LYS A 104 -10.440 -7.800 1.911 1.00 40.02 H new ATOM 0 HZ1 LYS A 104 -11.309 -7.881 4.155 1.00 24.13 H new ATOM 0 HZ2 LYS A 104 -11.895 -9.199 3.259 1.00 24.13 H new ATOM 0 HZ3 LYS A 104 -10.653 -9.429 4.394 1.00 24.13 H new ATOM 1648 N ASP A 105 -12.823 -13.091 -1.049 1.00 33.32 N ATOM 1649 CA ASP A 105 -14.074 -13.717 -1.463 1.00 51.40 C ATOM 1650 C ASP A 105 -15.223 -12.715 -1.420 1.00 13.32 C ATOM 1651 O ASP A 105 -16.277 -12.985 -0.845 1.00 31.51 O ATOM 1652 CB ASP A 105 -14.390 -14.918 -0.569 1.00 72.14 C ATOM 1653 CG ASP A 105 -15.491 -15.791 -1.140 1.00 2.24 C ATOM 1654 OD1 ASP A 105 -15.808 -15.640 -2.338 1.00 55.31 O ATOM 1655 OD2 ASP A 105 -16.037 -16.626 -0.387 1.00 4.33 O ATOM 0 H ASP A 105 -12.102 -13.073 -1.770 1.00 33.32 H new ATOM 0 HA ASP A 105 -13.957 -14.062 -2.490 1.00 51.40 H new ATOM 0 HB2 ASP A 105 -13.488 -15.516 -0.436 1.00 72.14 H new ATOM 0 HB3 ASP A 105 -14.686 -14.564 0.419 1.00 72.14 H new ATOM 1660 N SER A 106 -15.010 -11.554 -2.033 1.00 71.22 N ATOM 1661 CA SER A 106 -16.027 -10.510 -2.065 1.00 44.21 C ATOM 1662 C SER A 106 -15.530 -9.289 -2.832 1.00 61.22 C ATOM 1663 O SER A 106 -14.381 -9.245 -3.273 1.00 2.43 O ATOM 1664 CB SER A 106 -16.422 -10.110 -0.642 1.00 43.44 C ATOM 1665 OG SER A 106 -17.831 -10.050 -0.500 1.00 55.50 O ATOM 0 H SER A 106 -14.143 -11.314 -2.513 1.00 71.22 H new ATOM 0 HA SER A 106 -16.903 -10.906 -2.579 1.00 44.21 H new ATOM 0 HB2 SER A 106 -16.012 -10.829 0.068 1.00 43.44 H new ATOM 0 HB3 SER A 106 -15.988 -9.140 -0.400 1.00 43.44 H new ATOM 0 HG SER A 106 -18.057 -9.794 0.419 1.00 55.50 H new ATOM 1671 N ASP A 107 -16.403 -8.299 -2.988 1.00 63.31 N ATOM 1672 CA ASP A 107 -16.055 -7.077 -3.702 1.00 53.24 C ATOM 1673 C ASP A 107 -15.802 -5.931 -2.729 1.00 31.30 C ATOM 1674 O ASP A 107 -14.872 -5.145 -2.908 1.00 4.34 O ATOM 1675 CB ASP A 107 -17.170 -6.695 -4.678 1.00 44.32 C ATOM 1676 CG ASP A 107 -18.496 -6.466 -3.979 1.00 10.25 C ATOM 1677 OD1 ASP A 107 -19.077 -7.449 -3.471 1.00 30.32 O ATOM 1678 OD2 ASP A 107 -18.953 -5.305 -3.939 1.00 71.44 O ATOM 0 H ASP A 107 -17.357 -8.320 -2.629 1.00 63.31 H new ATOM 0 HA ASP A 107 -15.139 -7.263 -4.263 1.00 53.24 H new ATOM 0 HB2 ASP A 107 -16.885 -5.791 -5.216 1.00 44.32 H new ATOM 0 HB3 ASP A 107 -17.285 -7.484 -5.421 1.00 44.32 H new ATOM 1683 N ASP A 108 -16.636 -5.842 -1.698 1.00 32.51 N ATOM 1684 CA ASP A 108 -16.504 -4.790 -0.697 1.00 43.02 C ATOM 1685 C ASP A 108 -15.401 -5.122 0.303 1.00 41.01 C ATOM 1686 O ASP A 108 -15.672 -5.605 1.403 1.00 20.01 O ATOM 1687 CB ASP A 108 -17.830 -4.589 0.039 1.00 52.12 C ATOM 1688 CG ASP A 108 -18.922 -4.059 -0.871 1.00 62.20 C ATOM 1689 OD1 ASP A 108 -18.631 -3.158 -1.685 1.00 43.43 O ATOM 1690 OD2 ASP A 108 -20.068 -4.546 -0.768 1.00 75.23 O ATOM 0 H ASP A 108 -17.410 -6.486 -1.534 1.00 32.51 H new ATOM 0 HA ASP A 108 -16.236 -3.867 -1.211 1.00 43.02 H new ATOM 0 HB2 ASP A 108 -18.150 -5.537 0.472 1.00 52.12 H new ATOM 0 HB3 ASP A 108 -17.682 -3.895 0.866 1.00 52.12 H new ATOM 1695 N VAL A 109 -14.158 -4.856 -0.083 1.00 43.54 N ATOM 1696 CA VAL A 109 -13.016 -5.122 0.783 1.00 3.14 C ATOM 1697 C VAL A 109 -12.294 -3.827 1.149 1.00 32.44 C ATOM 1698 O VAL A 109 -12.199 -2.909 0.334 1.00 10.22 O ATOM 1699 CB VAL A 109 -12.013 -6.085 0.120 1.00 61.45 C ATOM 1700 CG1 VAL A 109 -12.624 -7.469 -0.036 1.00 45.43 C ATOM 1701 CG2 VAL A 109 -11.556 -5.540 -1.225 1.00 52.43 C ATOM 0 H VAL A 109 -13.916 -4.456 -0.990 1.00 43.54 H new ATOM 0 HA VAL A 109 -13.408 -5.589 1.687 1.00 3.14 H new ATOM 0 HB VAL A 109 -11.139 -6.170 0.766 1.00 61.45 H new ATOM 0 HG11 VAL A 109 -11.901 -8.135 -0.506 1.00 45.43 H new ATOM 0 HG12 VAL A 109 -12.894 -7.860 0.945 1.00 45.43 H new ATOM 0 HG13 VAL A 109 -13.516 -7.405 -0.659 1.00 45.43 H new ATOM 0 HG21 VAL A 109 -10.848 -6.234 -1.677 1.00 52.43 H new ATOM 0 HG22 VAL A 109 -12.418 -5.422 -1.881 1.00 52.43 H new ATOM 0 HG23 VAL A 109 -11.074 -4.573 -1.081 1.00 52.43 H new ATOM 1711 N PRO A 110 -11.776 -3.733 2.386 1.00 44.04 N ATOM 1712 CA PRO A 110 -11.063 -2.539 2.855 1.00 42.11 C ATOM 1713 C PRO A 110 -9.723 -2.346 2.153 1.00 70.22 C ATOM 1714 O PRO A 110 -8.735 -2.998 2.491 1.00 1.02 O ATOM 1715 CB PRO A 110 -10.849 -2.816 4.346 1.00 63.52 C ATOM 1716 CG PRO A 110 -10.865 -4.300 4.458 1.00 61.40 C ATOM 1717 CD PRO A 110 -11.845 -4.778 3.424 1.00 35.31 C ATOM 0 HA PRO A 110 -11.623 -1.626 2.651 1.00 42.11 H new ATOM 0 HB2 PRO A 110 -9.903 -2.402 4.694 1.00 63.52 H new ATOM 0 HB3 PRO A 110 -11.636 -2.364 4.950 1.00 63.52 H new ATOM 0 HG2 PRO A 110 -9.874 -4.716 4.279 1.00 61.40 H new ATOM 0 HG3 PRO A 110 -11.167 -4.614 5.457 1.00 61.40 H new ATOM 0 HD2 PRO A 110 -11.569 -5.756 3.030 1.00 35.31 H new ATOM 0 HD3 PRO A 110 -12.850 -4.872 3.835 1.00 35.31 H new ATOM 1725 N MET A 111 -9.697 -1.445 1.176 1.00 12.21 N ATOM 1726 CA MET A 111 -8.480 -1.162 0.429 1.00 62.44 C ATOM 1727 C MET A 111 -8.271 0.341 0.277 1.00 13.14 C ATOM 1728 O MET A 111 -9.134 1.138 0.645 1.00 73.14 O ATOM 1729 CB MET A 111 -8.536 -1.822 -0.947 1.00 21.44 C ATOM 1730 CG MET A 111 -7.366 -2.749 -1.210 1.00 32.41 C ATOM 1731 SD MET A 111 -7.492 -3.591 -2.793 1.00 34.34 S ATOM 1732 CE MET A 111 -8.908 -4.632 -2.472 1.00 71.10 C ATOM 0 H MET A 111 -10.507 -0.898 0.884 1.00 12.21 H new ATOM 0 HA MET A 111 -7.638 -1.573 0.987 1.00 62.44 H new ATOM 0 HB2 MET A 111 -9.465 -2.385 -1.036 1.00 21.44 H new ATOM 0 HB3 MET A 111 -8.558 -1.048 -1.714 1.00 21.44 H new ATOM 0 HG2 MET A 111 -6.439 -2.176 -1.181 1.00 32.41 H new ATOM 0 HG3 MET A 111 -7.308 -3.490 -0.412 1.00 32.41 H new ATOM 0 HE1 MET A 111 -8.920 -5.459 -3.182 1.00 71.10 H new ATOM 0 HE2 MET A 111 -8.848 -5.025 -1.457 1.00 71.10 H new ATOM 0 HE3 MET A 111 -9.822 -4.047 -2.581 1.00 71.10 H new ATOM 1742 N VAL A 112 -7.121 0.721 -0.268 1.00 5.40 N ATOM 1743 CA VAL A 112 -6.800 2.127 -0.470 1.00 50.55 C ATOM 1744 C VAL A 112 -5.954 2.323 -1.723 1.00 43.02 C ATOM 1745 O VAL A 112 -5.236 1.417 -2.147 1.00 41.30 O ATOM 1746 CB VAL A 112 -6.046 2.709 0.738 1.00 20.12 C ATOM 1747 CG1 VAL A 112 -5.938 4.220 0.620 1.00 62.21 C ATOM 1748 CG2 VAL A 112 -6.735 2.314 2.035 1.00 55.51 C ATOM 0 H VAL A 112 -6.396 0.074 -0.578 1.00 5.40 H new ATOM 0 HA VAL A 112 -7.747 2.654 -0.587 1.00 50.55 H new ATOM 0 HB VAL A 112 -5.037 2.297 0.750 1.00 20.12 H new ATOM 0 HG11 VAL A 112 -5.402 4.615 1.483 1.00 62.21 H new ATOM 0 HG12 VAL A 112 -5.398 4.476 -0.291 1.00 62.21 H new ATOM 0 HG13 VAL A 112 -6.937 4.654 0.584 1.00 62.21 H new ATOM 0 HG21 VAL A 112 -6.189 2.734 2.880 1.00 55.51 H new ATOM 0 HG22 VAL A 112 -7.755 2.697 2.036 1.00 55.51 H new ATOM 0 HG23 VAL A 112 -6.755 1.228 2.120 1.00 55.51 H new ATOM 1758 N LEU A 113 -6.043 3.511 -2.310 1.00 13.44 N ATOM 1759 CA LEU A 113 -5.284 3.827 -3.513 1.00 20.00 C ATOM 1760 C LEU A 113 -4.521 5.136 -3.344 1.00 32.41 C ATOM 1761 O LEU A 113 -5.119 6.208 -3.253 1.00 52.32 O ATOM 1762 CB LEU A 113 -6.219 3.920 -4.722 1.00 51.52 C ATOM 1763 CG LEU A 113 -5.534 4.230 -6.058 1.00 62.10 C ATOM 1764 CD1 LEU A 113 -4.178 3.545 -6.142 1.00 64.15 C ATOM 1765 CD2 LEU A 113 -6.419 3.803 -7.219 1.00 50.23 C ATOM 0 H LEU A 113 -6.633 4.271 -1.972 1.00 13.44 H new ATOM 0 HA LEU A 113 -4.564 3.026 -3.681 1.00 20.00 H new ATOM 0 HB2 LEU A 113 -6.756 2.977 -4.818 1.00 51.52 H new ATOM 0 HB3 LEU A 113 -6.963 4.692 -4.526 1.00 51.52 H new ATOM 0 HG LEU A 113 -5.375 5.307 -6.119 1.00 62.10 H new ATOM 0 HD11 LEU A 113 -3.711 3.779 -7.098 1.00 64.15 H new ATOM 0 HD12 LEU A 113 -3.541 3.898 -5.331 1.00 64.15 H new ATOM 0 HD13 LEU A 113 -4.309 2.466 -6.057 1.00 64.15 H new ATOM 0 HD21 LEU A 113 -5.919 4.030 -8.160 1.00 50.23 H new ATOM 0 HD22 LEU A 113 -6.608 2.731 -7.157 1.00 50.23 H new ATOM 0 HD23 LEU A 113 -7.366 4.342 -7.172 1.00 50.23 H new ATOM 1777 N VAL A 114 -3.196 5.040 -3.296 1.00 23.12 N ATOM 1778 CA VAL A 114 -2.351 6.214 -3.131 1.00 32.34 C ATOM 1779 C VAL A 114 -1.591 6.535 -4.413 1.00 20.43 C ATOM 1780 O VAL A 114 -1.343 5.655 -5.238 1.00 75.30 O ATOM 1781 CB VAL A 114 -1.340 6.016 -1.988 1.00 64.22 C ATOM 1782 CG1 VAL A 114 -0.632 7.322 -1.671 1.00 74.12 C ATOM 1783 CG2 VAL A 114 -2.031 5.461 -0.752 1.00 41.40 C ATOM 0 H VAL A 114 -2.686 4.160 -3.369 1.00 23.12 H new ATOM 0 HA VAL A 114 -3.012 7.046 -2.888 1.00 32.34 H new ATOM 0 HB VAL A 114 -0.591 5.293 -2.311 1.00 64.22 H new ATOM 0 HG11 VAL A 114 0.079 7.163 -0.860 1.00 74.12 H new ATOM 0 HG12 VAL A 114 -0.101 7.672 -2.556 1.00 74.12 H new ATOM 0 HG13 VAL A 114 -1.366 8.069 -1.369 1.00 74.12 H new ATOM 0 HG21 VAL A 114 -1.299 5.328 0.045 1.00 41.40 H new ATOM 0 HG22 VAL A 114 -2.803 6.157 -0.423 1.00 41.40 H new ATOM 0 HG23 VAL A 114 -2.486 4.500 -0.990 1.00 41.40 H new ATOM 1793 N GLY A 115 -1.221 7.802 -4.571 1.00 75.51 N ATOM 1794 CA GLY A 115 -0.488 8.220 -5.751 1.00 1.10 C ATOM 1795 C GLY A 115 0.961 8.544 -5.444 1.00 11.34 C ATOM 1796 O GLY A 115 1.332 9.711 -5.322 1.00 20.12 O ATOM 0 H GLY A 115 -1.416 8.547 -3.902 1.00 75.51 H new ATOM 0 HA2 GLY A 115 -0.530 7.430 -6.501 1.00 1.10 H new ATOM 0 HA3 GLY A 115 -0.970 9.097 -6.184 1.00 1.10 H new ATOM 1800 N ASN A 116 1.781 7.505 -5.316 1.00 24.15 N ATOM 1801 CA ASN A 116 3.199 7.677 -5.018 1.00 14.23 C ATOM 1802 C ASN A 116 3.869 8.583 -6.050 1.00 44.14 C ATOM 1803 O ASN A 116 3.389 8.723 -7.175 1.00 13.15 O ATOM 1804 CB ASN A 116 3.895 6.311 -4.973 1.00 45.32 C ATOM 1805 CG ASN A 116 5.409 6.415 -5.009 1.00 71.42 C ATOM 1806 OD1 ASN A 116 5.990 6.845 -6.005 1.00 12.42 O ATOM 1807 ND2 ASN A 116 6.056 6.018 -3.919 1.00 24.25 N ATOM 0 H ASN A 116 1.487 6.533 -5.414 1.00 24.15 H new ATOM 0 HA ASN A 116 3.290 8.154 -4.042 1.00 14.23 H new ATOM 0 HB2 ASN A 116 3.594 5.786 -4.067 1.00 45.32 H new ATOM 0 HB3 ASN A 116 3.558 5.709 -5.817 1.00 45.32 H new ATOM 0 HD21 ASN A 116 7.074 6.063 -3.886 1.00 24.25 H new ATOM 0 HD22 ASN A 116 5.534 5.668 -3.115 1.00 24.25 H new ATOM 1814 N LYS A 117 4.981 9.194 -5.654 1.00 23.34 N ATOM 1815 CA LYS A 117 5.724 10.086 -6.536 1.00 21.02 C ATOM 1816 C LYS A 117 4.882 11.299 -6.920 1.00 54.01 C ATOM 1817 O LYS A 117 4.646 11.560 -8.101 1.00 72.22 O ATOM 1818 CB LYS A 117 6.178 9.338 -7.792 1.00 65.15 C ATOM 1819 CG LYS A 117 7.568 8.734 -7.667 1.00 4.33 C ATOM 1820 CD LYS A 117 7.862 7.770 -8.805 1.00 35.31 C ATOM 1821 CE LYS A 117 9.160 7.012 -8.573 1.00 11.33 C ATOM 1822 NZ LYS A 117 8.916 5.597 -8.179 1.00 4.42 N ATOM 0 H LYS A 117 5.388 9.087 -4.725 1.00 23.34 H new ATOM 0 HA LYS A 117 6.604 10.438 -5.998 1.00 21.02 H new ATOM 0 HB2 LYS A 117 5.464 8.544 -8.011 1.00 65.15 H new ATOM 0 HB3 LYS A 117 6.163 10.023 -8.639 1.00 65.15 H new ATOM 0 HG2 LYS A 117 8.312 9.530 -7.662 1.00 4.33 H new ATOM 0 HG3 LYS A 117 7.654 8.211 -6.715 1.00 4.33 H new ATOM 0 HD2 LYS A 117 7.039 7.062 -8.905 1.00 35.31 H new ATOM 0 HD3 LYS A 117 7.924 8.321 -9.743 1.00 35.31 H new ATOM 0 HE2 LYS A 117 9.762 7.037 -9.481 1.00 11.33 H new ATOM 0 HE3 LYS A 117 9.737 7.511 -7.794 1.00 11.33 H new ATOM 0 HZ1 LYS A 117 9.826 5.116 -8.031 1.00 4.42 H new ATOM 0 HZ2 LYS A 117 8.364 5.572 -7.298 1.00 4.42 H new ATOM 0 HZ3 LYS A 117 8.388 5.113 -8.933 1.00 4.42 H new ATOM 1836 N CYS A 118 4.433 12.039 -5.912 1.00 62.31 N ATOM 1837 CA CYS A 118 3.618 13.228 -6.136 1.00 2.03 C ATOM 1838 C CYS A 118 4.488 14.479 -6.236 1.00 11.53 C ATOM 1839 O CYS A 118 4.077 15.487 -6.811 1.00 4.31 O ATOM 1840 CB CYS A 118 2.598 13.391 -5.008 1.00 52.11 C ATOM 1841 SG CYS A 118 1.165 14.402 -5.449 1.00 2.15 S ATOM 0 H CYS A 118 4.620 11.836 -4.930 1.00 62.31 H new ATOM 0 HA CYS A 118 3.090 13.101 -7.081 1.00 2.03 H new ATOM 0 HB2 CYS A 118 2.252 12.404 -4.700 1.00 52.11 H new ATOM 0 HB3 CYS A 118 3.094 13.838 -4.146 1.00 52.11 H new ATOM 0 HG CYS A 118 0.238 13.644 -5.955 1.00 2.15 H new ATOM 1847 N ASP A 119 5.692 14.409 -5.674 1.00 22.42 N ATOM 1848 CA ASP A 119 6.617 15.537 -5.703 1.00 73.31 C ATOM 1849 C ASP A 119 7.295 15.652 -7.065 1.00 20.11 C ATOM 1850 O ASP A 119 7.730 16.733 -7.464 1.00 43.45 O ATOM 1851 CB ASP A 119 7.672 15.386 -4.605 1.00 11.43 C ATOM 1852 CG ASP A 119 8.635 16.556 -4.561 1.00 23.02 C ATOM 1853 OD1 ASP A 119 8.164 17.711 -4.494 1.00 74.41 O ATOM 1854 OD2 ASP A 119 9.861 16.317 -4.593 1.00 65.21 O ATOM 0 H ASP A 119 6.049 13.583 -5.193 1.00 22.42 H new ATOM 0 HA ASP A 119 6.045 16.448 -5.525 1.00 73.31 H new ATOM 0 HB2 ASP A 119 7.176 15.291 -3.639 1.00 11.43 H new ATOM 0 HB3 ASP A 119 8.232 14.465 -4.767 1.00 11.43 H new ATOM 1859 N LEU A 120 7.383 14.531 -7.776 1.00 34.03 N ATOM 1860 CA LEU A 120 8.010 14.506 -9.095 1.00 73.22 C ATOM 1861 C LEU A 120 7.431 15.593 -9.998 1.00 14.32 C ATOM 1862 O LEU A 120 6.396 16.182 -9.690 1.00 73.35 O ATOM 1863 CB LEU A 120 7.823 13.134 -9.745 1.00 72.32 C ATOM 1864 CG LEU A 120 8.771 12.046 -9.240 1.00 34.34 C ATOM 1865 CD1 LEU A 120 8.552 10.750 -10.004 1.00 24.03 C ATOM 1866 CD2 LEU A 120 10.218 12.501 -9.363 1.00 72.41 C ATOM 0 H LEU A 120 7.028 13.628 -7.461 1.00 34.03 H new ATOM 0 HA LEU A 120 9.075 14.698 -8.965 1.00 73.22 H new ATOM 0 HB2 LEU A 120 6.797 12.807 -9.579 1.00 72.32 H new ATOM 0 HB3 LEU A 120 7.954 13.238 -10.822 1.00 72.32 H new ATOM 0 HG LEU A 120 8.556 11.864 -8.187 1.00 34.34 H new ATOM 0 HD11 LEU A 120 9.236 9.988 -9.631 1.00 24.03 H new ATOM 0 HD12 LEU A 120 7.524 10.415 -9.865 1.00 24.03 H new ATOM 0 HD13 LEU A 120 8.739 10.917 -11.065 1.00 24.03 H new ATOM 0 HD21 LEU A 120 10.879 11.714 -8.999 1.00 72.41 H new ATOM 0 HD22 LEU A 120 10.446 12.712 -10.408 1.00 72.41 H new ATOM 0 HD23 LEU A 120 10.367 13.403 -8.770 1.00 72.41 H new ATOM 1878 N ALA A 121 8.109 15.854 -11.112 1.00 1.14 N ATOM 1879 CA ALA A 121 7.662 16.872 -12.055 1.00 52.52 C ATOM 1880 C ALA A 121 7.423 16.279 -13.440 1.00 72.30 C ATOM 1881 O ALA A 121 7.534 16.974 -14.450 1.00 3.30 O ATOM 1882 CB ALA A 121 8.680 18.000 -12.132 1.00 23.25 C ATOM 0 H ALA A 121 8.968 15.375 -11.383 1.00 1.14 H new ATOM 0 HA ALA A 121 6.714 17.272 -11.694 1.00 52.52 H new ATOM 0 HB1 ALA A 121 8.335 18.754 -12.839 1.00 23.25 H new ATOM 0 HB2 ALA A 121 8.797 18.453 -11.147 1.00 23.25 H new ATOM 0 HB3 ALA A 121 9.639 17.603 -12.464 1.00 23.25 H new ATOM 1888 N ALA A 122 7.097 14.991 -13.482 1.00 31.42 N ATOM 1889 CA ALA A 122 6.846 14.309 -14.745 1.00 55.04 C ATOM 1890 C ALA A 122 5.759 13.250 -14.593 1.00 30.54 C ATOM 1891 O ALA A 122 6.044 12.053 -14.580 1.00 25.22 O ATOM 1892 CB ALA A 122 8.129 13.678 -15.261 1.00 54.14 C ATOM 0 H ALA A 122 7.001 14.400 -12.656 1.00 31.42 H new ATOM 0 HA ALA A 122 6.497 15.047 -15.467 1.00 55.04 H new ATOM 0 HB1 ALA A 122 7.931 13.171 -16.205 1.00 54.14 H new ATOM 0 HB2 ALA A 122 8.879 14.454 -15.416 1.00 54.14 H new ATOM 0 HB3 ALA A 122 8.498 12.957 -14.532 1.00 54.14 H new ATOM 1898 N ARG A 123 4.512 13.696 -14.478 1.00 72.33 N ATOM 1899 CA ARG A 123 3.388 12.783 -14.327 1.00 51.21 C ATOM 1900 C ARG A 123 2.813 12.399 -15.686 1.00 2.23 C ATOM 1901 O ARG A 123 2.691 13.238 -16.578 1.00 63.02 O ATOM 1902 CB ARG A 123 2.303 13.428 -13.469 1.00 11.24 C ATOM 1903 CG ARG A 123 1.851 14.781 -13.991 1.00 64.24 C ATOM 1904 CD ARG A 123 0.337 14.882 -14.041 1.00 42.30 C ATOM 1905 NE ARG A 123 -0.247 13.907 -14.959 1.00 63.12 N ATOM 1906 CZ ARG A 123 -0.301 14.071 -16.279 1.00 22.01 C ATOM 1907 NH1 ARG A 123 0.193 15.168 -16.840 1.00 41.11 N ATOM 1908 NH2 ARG A 123 -0.847 13.133 -17.041 1.00 51.02 N ATOM 0 H ARG A 123 4.256 14.683 -14.487 1.00 72.33 H new ATOM 0 HA ARG A 123 3.746 11.878 -13.836 1.00 51.21 H new ATOM 0 HB2 ARG A 123 1.443 12.760 -13.419 1.00 11.24 H new ATOM 0 HB3 ARG A 123 2.675 13.545 -12.451 1.00 11.24 H new ATOM 0 HG2 ARG A 123 2.248 15.570 -13.352 1.00 64.24 H new ATOM 0 HG3 ARG A 123 2.260 14.942 -14.988 1.00 64.24 H new ATOM 0 HD2 ARG A 123 -0.070 14.728 -13.042 1.00 42.30 H new ATOM 0 HD3 ARG A 123 0.051 15.887 -14.350 1.00 42.30 H new ATOM 0 HE ARG A 123 -0.636 13.050 -14.565 1.00 63.12 H new ATOM 0 HH11 ARG A 123 0.617 15.891 -16.259 1.00 41.11 H new ATOM 0 HH12 ARG A 123 0.149 15.288 -17.852 1.00 41.11 H new ATOM 0 HH21 ARG A 123 -1.225 12.287 -16.616 1.00 51.02 H new ATOM 0 HH22 ARG A 123 -0.889 13.258 -18.052 1.00 51.02 H new ATOM 1922 N THR A 124 2.455 11.129 -15.834 1.00 44.45 N ATOM 1923 CA THR A 124 1.887 10.637 -17.082 1.00 25.34 C ATOM 1924 C THR A 124 0.411 10.297 -16.905 1.00 1.42 C ATOM 1925 O THR A 124 -0.358 10.298 -17.867 1.00 34.53 O ATOM 1926 CB THR A 124 2.654 9.404 -17.562 1.00 42.11 C ATOM 1927 OG1 THR A 124 2.352 8.281 -16.754 1.00 21.32 O ATOM 1928 CG2 THR A 124 4.155 9.591 -17.544 1.00 1.03 C ATOM 0 H THR A 124 2.548 10.422 -15.105 1.00 44.45 H new ATOM 0 HA THR A 124 1.974 11.424 -17.832 1.00 25.34 H new ATOM 0 HB THR A 124 2.335 9.247 -18.592 1.00 42.11 H new ATOM 0 HG1 THR A 124 3.162 7.986 -16.288 1.00 21.32 H new ATOM 0 HG21 THR A 124 4.639 8.680 -17.896 1.00 1.03 H new ATOM 0 HG22 THR A 124 4.426 10.421 -18.196 1.00 1.03 H new ATOM 0 HG23 THR A 124 4.483 9.807 -16.527 1.00 1.03 H new ATOM 1936 N VAL A 125 0.023 10.001 -15.668 1.00 2.10 N ATOM 1937 CA VAL A 125 -1.347 9.655 -15.355 1.00 53.42 C ATOM 1938 C VAL A 125 -2.006 10.737 -14.508 1.00 70.52 C ATOM 1939 O VAL A 125 -1.743 10.848 -13.311 1.00 5.21 O ATOM 1940 CB VAL A 125 -1.403 8.322 -14.596 1.00 33.42 C ATOM 1941 CG1 VAL A 125 -2.837 7.865 -14.443 1.00 15.25 C ATOM 1942 CG2 VAL A 125 -0.565 7.269 -15.305 1.00 62.04 C ATOM 0 H VAL A 125 0.650 9.996 -14.864 1.00 2.10 H new ATOM 0 HA VAL A 125 -1.887 9.564 -16.298 1.00 53.42 H new ATOM 0 HB VAL A 125 -0.985 8.468 -13.600 1.00 33.42 H new ATOM 0 HG11 VAL A 125 -2.862 6.919 -13.903 1.00 15.25 H new ATOM 0 HG12 VAL A 125 -3.400 8.615 -13.887 1.00 15.25 H new ATOM 0 HG13 VAL A 125 -3.284 7.732 -15.428 1.00 15.25 H new ATOM 0 HG21 VAL A 125 -0.616 6.331 -14.753 1.00 62.04 H new ATOM 0 HG22 VAL A 125 -0.948 7.118 -16.314 1.00 62.04 H new ATOM 0 HG23 VAL A 125 0.471 7.603 -15.357 1.00 62.04 H new ATOM 1952 N GLU A 126 -2.864 11.534 -15.136 1.00 40.11 N ATOM 1953 CA GLU A 126 -3.561 12.608 -14.438 1.00 41.05 C ATOM 1954 C GLU A 126 -4.314 12.071 -13.224 1.00 52.41 C ATOM 1955 O GLU A 126 -4.574 10.872 -13.123 1.00 23.24 O ATOM 1956 CB GLU A 126 -4.533 13.313 -15.384 1.00 3.23 C ATOM 1957 CG GLU A 126 -5.326 12.358 -16.259 1.00 55.32 C ATOM 1958 CD GLU A 126 -6.549 13.009 -16.874 1.00 44.21 C ATOM 1959 OE1 GLU A 126 -6.433 14.156 -17.355 1.00 44.23 O ATOM 1960 OE2 GLU A 126 -7.623 12.371 -16.876 1.00 53.23 O ATOM 0 H GLU A 126 -3.093 11.456 -16.127 1.00 40.11 H new ATOM 0 HA GLU A 126 -2.816 13.325 -14.093 1.00 41.05 H new ATOM 0 HB2 GLU A 126 -5.226 13.916 -14.797 1.00 3.23 H new ATOM 0 HB3 GLU A 126 -3.975 13.999 -16.021 1.00 3.23 H new ATOM 0 HG2 GLU A 126 -4.682 11.980 -17.053 1.00 55.32 H new ATOM 0 HG3 GLU A 126 -5.637 11.499 -15.664 1.00 55.32 H new ATOM 1967 N SER A 127 -4.659 12.966 -12.307 1.00 61.10 N ATOM 1968 CA SER A 127 -5.381 12.584 -11.098 1.00 71.13 C ATOM 1969 C SER A 127 -6.754 12.014 -11.437 1.00 52.53 C ATOM 1970 O SER A 127 -7.237 11.095 -10.775 1.00 24.11 O ATOM 1971 CB SER A 127 -5.532 13.788 -10.167 1.00 72.14 C ATOM 1972 OG SER A 127 -6.610 14.614 -10.571 1.00 43.11 O ATOM 0 H SER A 127 -4.451 13.962 -12.377 1.00 61.10 H new ATOM 0 HA SER A 127 -4.803 11.811 -10.592 1.00 71.13 H new ATOM 0 HB2 SER A 127 -5.697 13.444 -9.146 1.00 72.14 H new ATOM 0 HB3 SER A 127 -4.608 14.367 -10.163 1.00 72.14 H new ATOM 0 HG SER A 127 -6.686 15.375 -9.959 1.00 43.11 H new ATOM 1978 N ARG A 128 -7.378 12.565 -12.473 1.00 64.21 N ATOM 1979 CA ARG A 128 -8.697 12.112 -12.903 1.00 22.31 C ATOM 1980 C ARG A 128 -8.674 10.627 -13.260 1.00 73.30 C ATOM 1981 O ARG A 128 -9.528 9.859 -12.818 1.00 2.52 O ATOM 1982 CB ARG A 128 -9.172 12.937 -14.104 1.00 32.03 C ATOM 1983 CG ARG A 128 -10.442 12.408 -14.752 1.00 23.31 C ATOM 1984 CD ARG A 128 -11.584 12.318 -13.753 1.00 14.23 C ATOM 1985 NE ARG A 128 -12.887 12.461 -14.399 1.00 24.12 N ATOM 1986 CZ ARG A 128 -14.031 12.038 -13.865 1.00 11.33 C ATOM 1987 NH1 ARG A 128 -14.040 11.449 -12.676 1.00 42.14 N ATOM 1988 NH2 ARG A 128 -15.170 12.206 -14.523 1.00 13.34 N ATOM 0 H ARG A 128 -6.992 13.326 -13.031 1.00 64.21 H new ATOM 0 HA ARG A 128 -9.393 12.253 -12.076 1.00 22.31 H new ATOM 0 HB2 ARG A 128 -9.341 13.965 -13.782 1.00 32.03 H new ATOM 0 HB3 ARG A 128 -8.379 12.963 -14.851 1.00 32.03 H new ATOM 0 HG2 ARG A 128 -10.730 13.061 -15.576 1.00 23.31 H new ATOM 0 HG3 ARG A 128 -10.251 11.423 -15.177 1.00 23.31 H new ATOM 0 HD2 ARG A 128 -11.539 11.360 -13.236 1.00 14.23 H new ATOM 0 HD3 ARG A 128 -11.467 13.094 -12.997 1.00 14.23 H new ATOM 0 HE ARG A 128 -12.922 12.912 -15.313 1.00 24.12 H new ATOM 0 HH11 ARG A 128 -13.167 11.318 -12.165 1.00 42.14 H new ATOM 0 HH12 ARG A 128 -14.920 11.127 -12.273 1.00 42.14 H new ATOM 0 HH21 ARG A 128 -15.169 12.659 -15.437 1.00 13.34 H new ATOM 0 HH22 ARG A 128 -16.047 11.882 -14.115 1.00 13.34 H new ATOM 2002 N GLN A 129 -7.693 10.233 -14.064 1.00 51.24 N ATOM 2003 CA GLN A 129 -7.560 8.842 -14.484 1.00 43.43 C ATOM 2004 C GLN A 129 -7.409 7.918 -13.280 1.00 35.13 C ATOM 2005 O GLN A 129 -7.987 6.832 -13.243 1.00 31.30 O ATOM 2006 CB GLN A 129 -6.358 8.683 -15.417 1.00 35.11 C ATOM 2007 CG GLN A 129 -6.471 7.494 -16.357 1.00 62.32 C ATOM 2008 CD GLN A 129 -5.472 7.555 -17.496 1.00 22.23 C ATOM 2009 OE1 GLN A 129 -4.425 6.909 -17.454 1.00 53.14 O ATOM 2010 NE2 GLN A 129 -5.793 8.333 -18.524 1.00 32.51 N ATOM 0 H GLN A 129 -6.978 10.857 -14.438 1.00 51.24 H new ATOM 0 HA GLN A 129 -8.468 8.563 -15.019 1.00 43.43 H new ATOM 0 HB2 GLN A 129 -6.244 9.592 -16.007 1.00 35.11 H new ATOM 0 HB3 GLN A 129 -5.454 8.577 -14.817 1.00 35.11 H new ATOM 0 HG2 GLN A 129 -6.318 6.574 -15.793 1.00 62.32 H new ATOM 0 HG3 GLN A 129 -7.481 7.453 -16.766 1.00 62.32 H new ATOM 0 HE21 GLN A 129 -6.672 8.851 -18.517 1.00 32.51 H new ATOM 0 HE22 GLN A 129 -5.161 8.412 -19.320 1.00 32.51 H new ATOM 2019 N ALA A 130 -6.629 8.356 -12.297 1.00 14.25 N ATOM 2020 CA ALA A 130 -6.402 7.566 -11.093 1.00 4.14 C ATOM 2021 C ALA A 130 -7.670 7.473 -10.250 1.00 31.13 C ATOM 2022 O ALA A 130 -7.993 6.413 -9.713 1.00 72.01 O ATOM 2023 CB ALA A 130 -5.267 8.164 -10.276 1.00 21.01 C ATOM 0 H ALA A 130 -6.144 9.253 -12.311 1.00 14.25 H new ATOM 0 HA ALA A 130 -6.124 6.557 -11.398 1.00 4.14 H new ATOM 0 HB1 ALA A 130 -5.108 7.564 -9.380 1.00 21.01 H new ATOM 0 HB2 ALA A 130 -4.355 8.173 -10.873 1.00 21.01 H new ATOM 0 HB3 ALA A 130 -5.523 9.184 -9.989 1.00 21.01 H new ATOM 2029 N GLN A 131 -8.384 8.588 -10.139 1.00 3.34 N ATOM 2030 CA GLN A 131 -9.617 8.631 -9.360 1.00 52.11 C ATOM 2031 C GLN A 131 -10.737 7.873 -10.066 1.00 1.42 C ATOM 2032 O GLN A 131 -11.635 7.332 -9.422 1.00 22.12 O ATOM 2033 CB GLN A 131 -10.041 10.081 -9.118 1.00 64.13 C ATOM 2034 CG GLN A 131 -9.455 10.682 -7.851 1.00 74.42 C ATOM 2035 CD GLN A 131 -10.517 11.241 -6.923 1.00 63.32 C ATOM 2036 OE1 GLN A 131 -10.774 12.444 -6.908 1.00 62.15 O ATOM 2037 NE2 GLN A 131 -11.140 10.366 -6.143 1.00 23.31 N ATOM 0 H GLN A 131 -8.131 9.473 -10.578 1.00 3.34 H new ATOM 0 HA GLN A 131 -9.427 8.149 -8.401 1.00 52.11 H new ATOM 0 HB2 GLN A 131 -9.738 10.687 -9.972 1.00 64.13 H new ATOM 0 HB3 GLN A 131 -11.129 10.129 -9.064 1.00 64.13 H new ATOM 0 HG2 GLN A 131 -8.882 9.920 -7.323 1.00 74.42 H new ATOM 0 HG3 GLN A 131 -8.758 11.476 -8.119 1.00 74.42 H new ATOM 0 HE21 GLN A 131 -10.895 9.377 -6.189 1.00 23.31 H new ATOM 0 HE22 GLN A 131 -11.864 10.683 -5.498 1.00 23.31 H new ATOM 2046 N ASP A 132 -10.678 7.837 -11.394 1.00 21.32 N ATOM 2047 CA ASP A 132 -11.689 7.145 -12.186 1.00 62.33 C ATOM 2048 C ASP A 132 -11.775 5.673 -11.795 1.00 2.15 C ATOM 2049 O ASP A 132 -12.856 5.085 -11.788 1.00 24.15 O ATOM 2050 CB ASP A 132 -11.372 7.270 -13.677 1.00 41.30 C ATOM 2051 CG ASP A 132 -12.517 6.802 -14.553 1.00 74.22 C ATOM 2052 OD1 ASP A 132 -13.648 7.299 -14.369 1.00 70.31 O ATOM 2053 OD2 ASP A 132 -12.283 5.938 -15.424 1.00 11.34 O ATOM 0 H ASP A 132 -9.941 8.279 -11.944 1.00 21.32 H new ATOM 0 HA ASP A 132 -12.653 7.612 -11.985 1.00 62.33 H new ATOM 0 HB2 ASP A 132 -11.141 8.309 -13.911 1.00 41.30 H new ATOM 0 HB3 ASP A 132 -10.481 6.686 -13.906 1.00 41.30 H new ATOM 2058 N LEU A 133 -10.629 5.084 -11.471 1.00 12.21 N ATOM 2059 CA LEU A 133 -10.574 3.681 -11.078 1.00 54.25 C ATOM 2060 C LEU A 133 -10.961 3.512 -9.613 1.00 63.53 C ATOM 2061 O LEU A 133 -11.814 2.690 -9.276 1.00 13.33 O ATOM 2062 CB LEU A 133 -9.171 3.118 -11.317 1.00 73.45 C ATOM 2063 CG LEU A 133 -8.959 1.680 -10.840 1.00 23.11 C ATOM 2064 CD1 LEU A 133 -9.556 0.695 -11.833 1.00 51.22 C ATOM 2065 CD2 LEU A 133 -7.478 1.402 -10.634 1.00 50.13 C ATOM 0 H LEU A 133 -9.725 5.557 -11.473 1.00 12.21 H new ATOM 0 HA LEU A 133 -11.288 3.129 -11.689 1.00 54.25 H new ATOM 0 HB2 LEU A 133 -8.954 3.166 -12.384 1.00 73.45 H new ATOM 0 HB3 LEU A 133 -8.448 3.761 -10.815 1.00 73.45 H new ATOM 0 HG LEU A 133 -9.469 1.554 -9.885 1.00 23.11 H new ATOM 0 HD11 LEU A 133 -9.396 -0.323 -11.477 1.00 51.22 H new ATOM 0 HD12 LEU A 133 -10.626 0.881 -11.931 1.00 51.22 H new ATOM 0 HD13 LEU A 133 -9.075 0.820 -12.803 1.00 51.22 H new ATOM 0 HD21 LEU A 133 -7.344 0.375 -10.295 1.00 50.13 H new ATOM 0 HD22 LEU A 133 -6.947 1.545 -11.575 1.00 50.13 H new ATOM 0 HD23 LEU A 133 -7.080 2.086 -9.885 1.00 50.13 H new ATOM 2077 N ALA A 134 -10.327 4.293 -8.745 1.00 74.20 N ATOM 2078 CA ALA A 134 -10.603 4.228 -7.315 1.00 72.23 C ATOM 2079 C ALA A 134 -12.074 4.507 -7.024 1.00 13.12 C ATOM 2080 O ALA A 134 -12.702 3.812 -6.226 1.00 40.05 O ATOM 2081 CB ALA A 134 -9.719 5.211 -6.563 1.00 71.14 C ATOM 0 H ALA A 134 -9.618 4.978 -9.007 1.00 74.20 H new ATOM 0 HA ALA A 134 -10.379 3.218 -6.973 1.00 72.23 H new ATOM 0 HB1 ALA A 134 -9.935 5.152 -5.496 1.00 71.14 H new ATOM 0 HB2 ALA A 134 -8.671 4.964 -6.735 1.00 71.14 H new ATOM 0 HB3 ALA A 134 -9.916 6.223 -6.918 1.00 71.14 H new ATOM 2087 N ARG A 135 -12.618 5.529 -7.678 1.00 4.30 N ATOM 2088 CA ARG A 135 -14.016 5.901 -7.490 1.00 51.32 C ATOM 2089 C ARG A 135 -14.938 4.722 -7.791 1.00 34.34 C ATOM 2090 O ARG A 135 -15.909 4.482 -7.074 1.00 24.22 O ATOM 2091 CB ARG A 135 -14.376 7.086 -8.387 1.00 42.44 C ATOM 2092 CG ARG A 135 -15.818 7.545 -8.240 1.00 31.01 C ATOM 2093 CD ARG A 135 -15.970 9.024 -8.557 1.00 72.10 C ATOM 2094 NE ARG A 135 -17.152 9.289 -9.374 1.00 41.13 N ATOM 2095 CZ ARG A 135 -17.554 10.509 -9.722 1.00 72.01 C ATOM 2096 NH1 ARG A 135 -16.873 11.578 -9.328 1.00 10.24 N ATOM 2097 NH2 ARG A 135 -18.640 10.661 -10.468 1.00 4.05 N ATOM 0 H ARG A 135 -12.112 6.114 -8.343 1.00 4.30 H new ATOM 0 HA ARG A 135 -14.152 6.189 -6.448 1.00 51.32 H new ATOM 0 HB2 ARG A 135 -13.713 7.920 -8.157 1.00 42.44 H new ATOM 0 HB3 ARG A 135 -14.195 6.812 -9.426 1.00 42.44 H new ATOM 0 HG2 ARG A 135 -16.455 6.962 -8.905 1.00 31.01 H new ATOM 0 HG3 ARG A 135 -16.159 7.353 -7.223 1.00 31.01 H new ATOM 0 HD2 ARG A 135 -16.037 9.589 -7.627 1.00 72.10 H new ATOM 0 HD3 ARG A 135 -15.081 9.376 -9.080 1.00 72.10 H new ATOM 0 HE ARG A 135 -17.701 8.492 -9.697 1.00 41.13 H new ATOM 0 HH11 ARG A 135 -16.036 11.467 -8.755 1.00 10.24 H new ATOM 0 HH12 ARG A 135 -17.186 12.510 -9.598 1.00 10.24 H new ATOM 0 HH21 ARG A 135 -19.167 9.843 -10.775 1.00 4.05 H new ATOM 0 HH22 ARG A 135 -18.949 11.596 -10.735 1.00 4.05 H new ATOM 2111 N SER A 136 -14.624 3.989 -8.854 1.00 42.42 N ATOM 2112 CA SER A 136 -15.423 2.834 -9.246 1.00 51.34 C ATOM 2113 C SER A 136 -15.155 1.653 -8.321 1.00 74.14 C ATOM 2114 O SER A 136 -16.050 0.857 -8.036 1.00 22.13 O ATOM 2115 CB SER A 136 -15.118 2.444 -10.694 1.00 0.22 C ATOM 2116 OG SER A 136 -15.808 1.262 -11.060 1.00 31.25 O ATOM 0 H SER A 136 -13.823 4.174 -9.458 1.00 42.42 H new ATOM 0 HA SER A 136 -16.476 3.105 -9.166 1.00 51.34 H new ATOM 0 HB2 SER A 136 -15.404 3.257 -11.361 1.00 0.22 H new ATOM 0 HB3 SER A 136 -14.045 2.295 -10.815 1.00 0.22 H new ATOM 0 HG SER A 136 -15.598 1.035 -11.990 1.00 31.25 H new ATOM 2122 N TYR A 137 -13.915 1.547 -7.853 1.00 51.34 N ATOM 2123 CA TYR A 137 -13.525 0.465 -6.957 1.00 43.22 C ATOM 2124 C TYR A 137 -14.179 0.625 -5.588 1.00 63.14 C ATOM 2125 O TYR A 137 -14.362 -0.350 -4.860 1.00 11.23 O ATOM 2126 CB TYR A 137 -12.002 0.427 -6.808 1.00 23.11 C ATOM 2127 CG TYR A 137 -11.310 -0.423 -7.852 1.00 33.41 C ATOM 2128 CD1 TYR A 137 -11.875 -0.618 -9.107 1.00 71.13 C ATOM 2129 CD2 TYR A 137 -10.090 -1.030 -7.581 1.00 52.12 C ATOM 2130 CE1 TYR A 137 -11.244 -1.394 -10.060 1.00 42.13 C ATOM 2131 CE2 TYR A 137 -9.453 -1.806 -8.529 1.00 21.33 C ATOM 2132 CZ TYR A 137 -10.034 -1.985 -9.767 1.00 61.15 C ATOM 2133 OH TYR A 137 -9.403 -2.759 -10.715 1.00 31.43 O ATOM 0 H TYR A 137 -13.163 2.198 -8.080 1.00 51.34 H new ATOM 0 HA TYR A 137 -13.866 -0.475 -7.391 1.00 43.22 H new ATOM 0 HB2 TYR A 137 -11.615 1.444 -6.865 1.00 23.11 H new ATOM 0 HB3 TYR A 137 -11.752 0.046 -5.818 1.00 23.11 H new ATOM 0 HD1 TYR A 137 -12.822 -0.155 -9.341 1.00 71.13 H new ATOM 0 HD2 TYR A 137 -9.632 -0.893 -6.613 1.00 52.12 H new ATOM 0 HE1 TYR A 137 -11.697 -1.537 -11.030 1.00 42.13 H new ATOM 0 HE2 TYR A 137 -8.505 -2.270 -8.302 1.00 21.33 H new ATOM 0 HH TYR A 137 -9.625 -2.426 -11.610 1.00 31.43 H new ATOM 2143 N GLY A 138 -14.529 1.861 -5.243 1.00 43.54 N ATOM 2144 CA GLY A 138 -15.158 2.123 -3.962 1.00 72.02 C ATOM 2145 C GLY A 138 -14.153 2.452 -2.874 1.00 42.50 C ATOM 2146 O GLY A 138 -14.495 2.470 -1.692 1.00 33.44 O ATOM 0 H GLY A 138 -14.388 2.685 -5.828 1.00 43.54 H new ATOM 0 HA2 GLY A 138 -15.857 2.952 -4.068 1.00 72.02 H new ATOM 0 HA3 GLY A 138 -15.740 1.251 -3.662 1.00 72.02 H new ATOM 2150 N ILE A 139 -12.910 2.712 -3.271 1.00 30.30 N ATOM 2151 CA ILE A 139 -11.858 3.040 -2.317 1.00 4.24 C ATOM 2152 C ILE A 139 -11.405 4.490 -2.465 1.00 34.05 C ATOM 2153 O ILE A 139 -11.482 5.065 -3.550 1.00 15.02 O ATOM 2154 CB ILE A 139 -10.645 2.117 -2.478 1.00 44.23 C ATOM 2155 CG1 ILE A 139 -10.268 1.990 -3.948 1.00 21.33 C ATOM 2156 CG2 ILE A 139 -10.939 0.749 -1.880 1.00 55.32 C ATOM 2157 CD1 ILE A 139 -9.044 1.143 -4.161 1.00 52.55 C ATOM 0 H ILE A 139 -12.608 2.702 -4.245 1.00 30.30 H new ATOM 0 HA ILE A 139 -12.283 2.898 -1.323 1.00 4.24 H new ATOM 0 HB ILE A 139 -9.801 2.552 -1.943 1.00 44.23 H new ATOM 0 HG12 ILE A 139 -11.104 1.558 -4.497 1.00 21.33 H new ATOM 0 HG13 ILE A 139 -10.094 2.983 -4.362 1.00 21.33 H new ATOM 0 HG21 ILE A 139 -10.069 0.104 -2.002 1.00 55.32 H new ATOM 0 HG22 ILE A 139 -11.165 0.857 -0.819 1.00 55.32 H new ATOM 0 HG23 ILE A 139 -11.794 0.305 -2.390 1.00 55.32 H new ATOM 0 HD11 ILE A 139 -8.821 1.087 -5.227 1.00 52.55 H new ATOM 0 HD12 ILE A 139 -8.198 1.587 -3.637 1.00 52.55 H new ATOM 0 HD13 ILE A 139 -9.224 0.140 -3.775 1.00 52.55 H new ATOM 2169 N PRO A 140 -10.922 5.102 -1.369 1.00 53.31 N ATOM 2170 CA PRO A 140 -10.455 6.492 -1.383 1.00 32.54 C ATOM 2171 C PRO A 140 -9.163 6.662 -2.174 1.00 61.25 C ATOM 2172 O PRO A 140 -8.432 5.698 -2.404 1.00 34.43 O ATOM 2173 CB PRO A 140 -10.215 6.804 0.097 1.00 5.10 C ATOM 2174 CG PRO A 140 -9.961 5.479 0.728 1.00 33.31 C ATOM 2175 CD PRO A 140 -10.796 4.488 -0.034 1.00 52.20 C ATOM 0 HA PRO A 140 -11.174 7.156 -1.863 1.00 32.54 H new ATOM 0 HB2 PRO A 140 -9.365 7.474 0.227 1.00 5.10 H new ATOM 0 HB3 PRO A 140 -11.080 7.296 0.543 1.00 5.10 H new ATOM 0 HG2 PRO A 140 -8.904 5.219 0.677 1.00 33.31 H new ATOM 0 HG3 PRO A 140 -10.235 5.491 1.783 1.00 33.31 H new ATOM 0 HD2 PRO A 140 -10.314 3.512 -0.085 1.00 52.20 H new ATOM 0 HD3 PRO A 140 -11.769 4.339 0.433 1.00 52.20 H new ATOM 2183 N TYR A 141 -8.884 7.895 -2.583 1.00 61.31 N ATOM 2184 CA TYR A 141 -7.677 8.194 -3.345 1.00 11.22 C ATOM 2185 C TYR A 141 -6.865 9.291 -2.663 1.00 61.11 C ATOM 2186 O TYR A 141 -7.341 10.413 -2.489 1.00 33.50 O ATOM 2187 CB TYR A 141 -8.035 8.617 -4.772 1.00 5.25 C ATOM 2188 CG TYR A 141 -6.847 9.101 -5.574 1.00 44.50 C ATOM 2189 CD1 TYR A 141 -5.813 8.236 -5.908 1.00 10.55 C ATOM 2190 CD2 TYR A 141 -6.758 10.423 -5.991 1.00 71.11 C ATOM 2191 CE1 TYR A 141 -4.724 8.675 -6.635 1.00 61.33 C ATOM 2192 CE2 TYR A 141 -5.671 10.869 -6.718 1.00 34.35 C ATOM 2193 CZ TYR A 141 -4.657 9.992 -7.038 1.00 72.20 C ATOM 2194 OH TYR A 141 -3.574 10.433 -7.762 1.00 64.31 O ATOM 0 H TYR A 141 -9.478 8.704 -2.399 1.00 61.31 H new ATOM 0 HA TYR A 141 -7.071 7.289 -3.388 1.00 11.22 H new ATOM 0 HB2 TYR A 141 -8.493 7.773 -5.289 1.00 5.25 H new ATOM 0 HB3 TYR A 141 -8.783 9.409 -4.731 1.00 5.25 H new ATOM 0 HD1 TYR A 141 -5.861 7.204 -5.594 1.00 10.55 H new ATOM 0 HD2 TYR A 141 -7.551 11.113 -5.743 1.00 71.11 H new ATOM 0 HE1 TYR A 141 -3.928 7.990 -6.887 1.00 61.33 H new ATOM 0 HE2 TYR A 141 -5.616 11.900 -7.034 1.00 34.35 H new ATOM 0 HH TYR A 141 -3.683 11.385 -7.967 1.00 64.31 H new ATOM 2204 N ILE A 142 -5.638 8.958 -2.279 1.00 2.12 N ATOM 2205 CA ILE A 142 -4.760 9.908 -1.618 1.00 71.02 C ATOM 2206 C ILE A 142 -3.462 10.089 -2.399 1.00 10.12 C ATOM 2207 O ILE A 142 -3.097 9.246 -3.218 1.00 52.25 O ATOM 2208 CB ILE A 142 -4.429 9.446 -0.189 1.00 74.21 C ATOM 2209 CG1 ILE A 142 -5.704 9.019 0.543 1.00 13.00 C ATOM 2210 CG2 ILE A 142 -3.720 10.553 0.567 1.00 4.54 C ATOM 2211 CD1 ILE A 142 -5.895 7.519 0.597 1.00 22.22 C ATOM 0 H ILE A 142 -5.230 8.033 -2.416 1.00 2.12 H new ATOM 0 HA ILE A 142 -5.287 10.861 -1.575 1.00 71.02 H new ATOM 0 HB ILE A 142 -3.763 8.584 -0.243 1.00 74.21 H new ATOM 0 HG12 ILE A 142 -5.678 9.411 1.560 1.00 13.00 H new ATOM 0 HG13 ILE A 142 -6.565 9.469 0.049 1.00 13.00 H new ATOM 0 HG21 ILE A 142 -3.491 10.215 1.577 1.00 4.54 H new ATOM 0 HG22 ILE A 142 -2.795 10.811 0.052 1.00 4.54 H new ATOM 0 HG23 ILE A 142 -4.364 11.431 0.616 1.00 4.54 H new ATOM 0 HD11 ILE A 142 -6.818 7.289 1.130 1.00 22.22 H new ATOM 0 HD12 ILE A 142 -5.953 7.123 -0.417 1.00 22.22 H new ATOM 0 HD13 ILE A 142 -5.052 7.063 1.117 1.00 22.22 H new ATOM 2223 N GLU A 143 -2.767 11.193 -2.142 1.00 11.15 N ATOM 2224 CA GLU A 143 -1.509 11.481 -2.824 1.00 32.01 C ATOM 2225 C GLU A 143 -0.364 11.603 -1.824 1.00 5.42 C ATOM 2226 O GLU A 143 -0.489 12.277 -0.801 1.00 61.43 O ATOM 2227 CB GLU A 143 -1.628 12.770 -3.639 1.00 64.24 C ATOM 2228 CG GLU A 143 -2.792 12.766 -4.617 1.00 60.10 C ATOM 2229 CD GLU A 143 -2.677 13.857 -5.663 1.00 5.42 C ATOM 2230 OE1 GLU A 143 -1.759 13.777 -6.506 1.00 21.15 O ATOM 2231 OE2 GLU A 143 -3.506 14.791 -5.640 1.00 1.04 O ATOM 0 H GLU A 143 -3.053 11.902 -1.467 1.00 11.15 H new ATOM 0 HA GLU A 143 -1.293 10.652 -3.498 1.00 32.01 H new ATOM 0 HB2 GLU A 143 -1.741 13.612 -2.957 1.00 64.24 H new ATOM 0 HB3 GLU A 143 -0.701 12.928 -4.191 1.00 64.24 H new ATOM 0 HG2 GLU A 143 -2.842 11.796 -5.112 1.00 60.10 H new ATOM 0 HG3 GLU A 143 -3.725 12.892 -4.067 1.00 60.10 H new ATOM 2238 N THR A 144 0.751 10.944 -2.124 1.00 42.44 N ATOM 2239 CA THR A 144 1.916 10.979 -1.248 1.00 62.42 C ATOM 2240 C THR A 144 3.211 10.939 -2.054 1.00 45.32 C ATOM 2241 O THR A 144 3.195 10.725 -3.266 1.00 51.11 O ATOM 2242 CB THR A 144 1.875 9.805 -0.269 1.00 35.21 C ATOM 2243 OG1 THR A 144 2.110 8.582 -0.943 1.00 51.44 O ATOM 2244 CG2 THR A 144 0.555 9.682 0.460 1.00 2.43 C ATOM 0 H THR A 144 0.872 10.380 -2.966 1.00 42.44 H new ATOM 0 HA THR A 144 1.890 11.914 -0.689 1.00 62.42 H new ATOM 0 HB THR A 144 2.658 10.009 0.462 1.00 35.21 H new ATOM 0 HG1 THR A 144 2.082 7.843 -0.300 1.00 51.44 H new ATOM 0 HG21 THR A 144 0.592 8.830 1.139 1.00 2.43 H new ATOM 0 HG22 THR A 144 0.368 10.592 1.030 1.00 2.43 H new ATOM 0 HG23 THR A 144 -0.248 9.535 -0.263 1.00 2.43 H new ATOM 2252 N SER A 145 4.331 11.145 -1.369 1.00 43.01 N ATOM 2253 CA SER A 145 5.639 11.132 -2.015 1.00 1.43 C ATOM 2254 C SER A 145 6.713 10.639 -1.049 1.00 21.44 C ATOM 2255 O SER A 145 6.971 11.263 -0.020 1.00 74.31 O ATOM 2256 CB SER A 145 5.991 12.532 -2.530 1.00 12.51 C ATOM 2257 OG SER A 145 7.391 12.755 -2.508 1.00 73.13 O ATOM 0 H SER A 145 4.359 11.323 -0.365 1.00 43.01 H new ATOM 0 HA SER A 145 5.597 10.446 -2.861 1.00 1.43 H new ATOM 0 HB2 SER A 145 5.618 12.651 -3.547 1.00 12.51 H new ATOM 0 HB3 SER A 145 5.492 13.283 -1.917 1.00 12.51 H new ATOM 0 HG SER A 145 7.574 13.653 -2.160 1.00 73.13 H new ATOM 2263 N ALA A 146 7.333 9.514 -1.389 1.00 74.33 N ATOM 2264 CA ALA A 146 8.378 8.933 -0.554 1.00 22.55 C ATOM 2265 C ALA A 146 9.607 9.837 -0.487 1.00 24.32 C ATOM 2266 O ALA A 146 10.395 9.757 0.454 1.00 53.35 O ATOM 2267 CB ALA A 146 8.762 7.557 -1.075 1.00 50.43 C ATOM 0 H ALA A 146 7.130 8.986 -2.238 1.00 74.33 H new ATOM 0 HA ALA A 146 7.983 8.834 0.457 1.00 22.55 H new ATOM 0 HB1 ALA A 146 9.543 7.134 -0.443 1.00 50.43 H new ATOM 0 HB2 ALA A 146 7.889 6.905 -1.058 1.00 50.43 H new ATOM 0 HB3 ALA A 146 9.130 7.645 -2.097 1.00 50.43 H new ATOM 2273 N LYS A 147 9.768 10.692 -1.493 1.00 61.51 N ATOM 2274 CA LYS A 147 10.907 11.603 -1.545 1.00 41.14 C ATOM 2275 C LYS A 147 10.777 12.709 -0.502 1.00 35.31 C ATOM 2276 O LYS A 147 11.568 12.786 0.438 1.00 21.55 O ATOM 2277 CB LYS A 147 11.029 12.218 -2.940 1.00 13.42 C ATOM 2278 CG LYS A 147 12.466 12.381 -3.408 1.00 64.52 C ATOM 2279 CD LYS A 147 13.190 11.044 -3.469 1.00 5.14 C ATOM 2280 CE LYS A 147 14.484 11.072 -2.672 1.00 73.05 C ATOM 2281 NZ LYS A 147 15.440 10.026 -3.129 1.00 15.22 N ATOM 0 H LYS A 147 9.126 10.773 -2.281 1.00 61.51 H new ATOM 0 HA LYS A 147 11.806 11.028 -1.324 1.00 41.14 H new ATOM 0 HB2 LYS A 147 10.492 11.592 -3.653 1.00 13.42 H new ATOM 0 HB3 LYS A 147 10.542 13.193 -2.942 1.00 13.42 H new ATOM 0 HG2 LYS A 147 12.478 12.847 -4.393 1.00 64.52 H new ATOM 0 HG3 LYS A 147 12.996 13.052 -2.732 1.00 64.52 H new ATOM 0 HD2 LYS A 147 12.540 10.260 -3.081 1.00 5.14 H new ATOM 0 HD3 LYS A 147 13.407 10.794 -4.508 1.00 5.14 H new ATOM 0 HE2 LYS A 147 14.948 12.054 -2.767 1.00 73.05 H new ATOM 0 HE3 LYS A 147 14.263 10.925 -1.615 1.00 73.05 H new ATOM 0 HZ1 LYS A 147 16.008 9.698 -2.322 1.00 15.22 H new ATOM 0 HZ2 LYS A 147 14.912 9.224 -3.529 1.00 15.22 H new ATOM 0 HZ3 LYS A 147 16.069 10.424 -3.856 1.00 15.22 H new ATOM 2295 N THR A 148 9.779 13.568 -0.679 1.00 2.44 N ATOM 2296 CA THR A 148 9.550 14.676 0.243 1.00 74.22 C ATOM 2297 C THR A 148 8.798 14.221 1.492 1.00 65.43 C ATOM 2298 O THR A 148 8.734 14.947 2.484 1.00 14.34 O ATOM 2299 CB THR A 148 8.768 15.790 -0.455 1.00 40.54 C ATOM 2300 OG1 THR A 148 7.572 15.284 -1.021 1.00 74.30 O ATOM 2301 CG2 THR A 148 9.549 16.466 -1.562 1.00 51.43 C ATOM 0 H THR A 148 9.115 13.519 -1.452 1.00 2.44 H new ATOM 0 HA THR A 148 10.524 15.054 0.554 1.00 74.22 H new ATOM 0 HB THR A 148 8.558 16.526 0.321 1.00 40.54 H new ATOM 0 HG1 THR A 148 7.085 16.012 -1.461 1.00 74.30 H new ATOM 0 HG21 THR A 148 8.937 17.246 -2.015 1.00 51.43 H new ATOM 0 HG22 THR A 148 10.455 16.910 -1.149 1.00 51.43 H new ATOM 0 HG23 THR A 148 9.818 15.730 -2.319 1.00 51.43 H new ATOM 2309 N ARG A 149 8.225 13.021 1.441 1.00 11.42 N ATOM 2310 CA ARG A 149 7.478 12.487 2.575 1.00 51.30 C ATOM 2311 C ARG A 149 6.268 13.364 2.882 1.00 33.03 C ATOM 2312 O ARG A 149 6.119 13.873 3.993 1.00 31.33 O ATOM 2313 CB ARG A 149 8.380 12.386 3.808 1.00 12.35 C ATOM 2314 CG ARG A 149 7.734 11.665 4.980 1.00 35.01 C ATOM 2315 CD ARG A 149 8.510 11.884 6.269 1.00 71.51 C ATOM 2316 NE ARG A 149 7.632 12.223 7.387 1.00 0.22 N ATOM 2317 CZ ARG A 149 7.161 13.447 7.617 1.00 31.12 C ATOM 2318 NH1 ARG A 149 7.477 14.451 6.809 1.00 33.33 N ATOM 2319 NH2 ARG A 149 6.370 13.666 8.658 1.00 54.21 N ATOM 0 H ARG A 149 8.264 12.403 0.630 1.00 11.42 H new ATOM 0 HA ARG A 149 7.127 11.489 2.313 1.00 51.30 H new ATOM 0 HB2 ARG A 149 9.298 11.866 3.534 1.00 12.35 H new ATOM 0 HB3 ARG A 149 8.664 13.390 4.123 1.00 12.35 H new ATOM 0 HG2 ARG A 149 6.711 12.019 5.106 1.00 35.01 H new ATOM 0 HG3 ARG A 149 7.678 10.598 4.765 1.00 35.01 H new ATOM 0 HD2 ARG A 149 9.073 10.982 6.511 1.00 71.51 H new ATOM 0 HD3 ARG A 149 9.236 12.684 6.123 1.00 71.51 H new ATOM 0 HE ARG A 149 7.364 11.477 8.029 1.00 0.22 H new ATOM 0 HH11 ARG A 149 8.084 14.288 6.006 1.00 33.33 H new ATOM 0 HH12 ARG A 149 7.113 15.386 6.991 1.00 33.33 H new ATOM 0 HH21 ARG A 149 6.123 12.897 9.281 1.00 54.21 H new ATOM 0 HH22 ARG A 149 6.008 14.603 8.836 1.00 54.21 H new ATOM 2333 N GLN A 150 5.407 13.540 1.885 1.00 10.22 N ATOM 2334 CA GLN A 150 4.211 14.359 2.042 1.00 70.34 C ATOM 2335 C GLN A 150 2.957 13.490 2.081 1.00 4.33 C ATOM 2336 O GLN A 150 2.757 12.633 1.221 1.00 14.03 O ATOM 2337 CB GLN A 150 4.111 15.373 0.899 1.00 40.05 C ATOM 2338 CG GLN A 150 2.851 16.223 0.941 1.00 3.12 C ATOM 2339 CD GLN A 150 3.127 17.690 0.682 1.00 52.51 C ATOM 2340 OE1 GLN A 150 3.122 18.507 1.603 1.00 12.15 O ATOM 2341 NE2 GLN A 150 3.370 18.032 -0.578 1.00 13.12 N ATOM 0 H GLN A 150 5.516 13.126 0.959 1.00 10.22 H new ATOM 0 HA GLN A 150 4.287 14.895 2.988 1.00 70.34 H new ATOM 0 HB2 GLN A 150 4.981 16.028 0.930 1.00 40.05 H new ATOM 0 HB3 GLN A 150 4.147 14.840 -0.051 1.00 40.05 H new ATOM 0 HG2 GLN A 150 2.144 15.854 0.198 1.00 3.12 H new ATOM 0 HG3 GLN A 150 2.376 16.113 1.916 1.00 3.12 H new ATOM 0 HE21 GLN A 150 3.364 17.321 -1.310 1.00 13.12 H new ATOM 0 HE22 GLN A 150 3.563 19.005 -0.814 1.00 13.12 H new ATOM 2350 N GLY A 151 2.117 13.720 3.085 1.00 41.45 N ATOM 2351 CA GLY A 151 0.891 12.955 3.218 1.00 41.40 C ATOM 2352 C GLY A 151 1.138 11.462 3.326 1.00 1.21 C ATOM 2353 O GLY A 151 0.244 10.660 3.057 1.00 64.31 O ATOM 0 H GLY A 151 2.264 14.423 3.809 1.00 41.45 H new ATOM 0 HA2 GLY A 151 0.351 13.294 4.102 1.00 41.40 H new ATOM 0 HA3 GLY A 151 0.251 13.151 2.358 1.00 41.40 H new ATOM 2357 N VAL A 152 2.351 11.086 3.723 1.00 0.34 N ATOM 2358 CA VAL A 152 2.703 9.678 3.865 1.00 53.32 C ATOM 2359 C VAL A 152 1.765 8.975 4.841 1.00 64.34 C ATOM 2360 O VAL A 152 1.088 8.011 4.483 1.00 13.41 O ATOM 2361 CB VAL A 152 4.155 9.508 4.352 1.00 30.20 C ATOM 2362 CG1 VAL A 152 4.556 8.041 4.338 1.00 12.05 C ATOM 2363 CG2 VAL A 152 5.103 10.336 3.497 1.00 43.31 C ATOM 0 H VAL A 152 3.104 11.735 3.951 1.00 0.34 H new ATOM 0 HA VAL A 152 2.604 9.225 2.879 1.00 53.32 H new ATOM 0 HB VAL A 152 4.219 9.867 5.379 1.00 30.20 H new ATOM 0 HG11 VAL A 152 5.584 7.942 4.685 1.00 12.05 H new ATOM 0 HG12 VAL A 152 3.895 7.477 4.996 1.00 12.05 H new ATOM 0 HG13 VAL A 152 4.476 7.652 3.323 1.00 12.05 H new ATOM 0 HG21 VAL A 152 6.124 10.204 3.854 1.00 43.31 H new ATOM 0 HG22 VAL A 152 5.037 10.009 2.459 1.00 43.31 H new ATOM 0 HG23 VAL A 152 4.828 11.389 3.564 1.00 43.31 H new ATOM 2373 N GLU A 153 1.726 9.467 6.075 1.00 10.20 N ATOM 2374 CA GLU A 153 0.866 8.889 7.101 1.00 53.02 C ATOM 2375 C GLU A 153 -0.602 9.021 6.713 1.00 64.42 C ATOM 2376 O GLU A 153 -1.427 8.178 7.065 1.00 1.12 O ATOM 2377 CB GLU A 153 1.113 9.573 8.446 1.00 25.52 C ATOM 2378 CG GLU A 153 2.560 9.505 8.905 1.00 52.34 C ATOM 2379 CD GLU A 153 3.358 10.729 8.504 1.00 35.25 C ATOM 2380 OE1 GLU A 153 2.799 11.845 8.550 1.00 12.50 O ATOM 2381 OE2 GLU A 153 4.544 10.572 8.144 1.00 34.41 O ATOM 0 H GLU A 153 2.280 10.264 6.389 1.00 10.20 H new ATOM 0 HA GLU A 153 1.107 7.830 7.190 1.00 53.02 H new ATOM 0 HB2 GLU A 153 0.812 10.618 8.374 1.00 25.52 H new ATOM 0 HB3 GLU A 153 0.478 9.110 9.202 1.00 25.52 H new ATOM 0 HG2 GLU A 153 2.588 9.397 9.989 1.00 52.34 H new ATOM 0 HG3 GLU A 153 3.029 8.616 8.484 1.00 52.34 H new ATOM 2388 N ASP A 154 -0.921 10.087 5.985 1.00 73.34 N ATOM 2389 CA ASP A 154 -2.289 10.336 5.545 1.00 71.41 C ATOM 2390 C ASP A 154 -2.847 9.135 4.786 1.00 4.12 C ATOM 2391 O ASP A 154 -3.908 8.612 5.125 1.00 51.43 O ATOM 2392 CB ASP A 154 -2.342 11.584 4.661 1.00 43.55 C ATOM 2393 CG ASP A 154 -3.452 12.534 5.067 1.00 31.43 C ATOM 2394 OD1 ASP A 154 -4.626 12.244 4.755 1.00 54.14 O ATOM 2395 OD2 ASP A 154 -3.147 13.568 5.698 1.00 32.22 O ATOM 0 H ASP A 154 -0.248 10.794 5.687 1.00 73.34 H new ATOM 0 HA ASP A 154 -2.904 10.499 6.430 1.00 71.41 H new ATOM 0 HB2 ASP A 154 -1.385 12.104 4.714 1.00 43.55 H new ATOM 0 HB3 ASP A 154 -2.485 11.285 3.623 1.00 43.55 H new ATOM 2400 N ALA A 155 -2.122 8.702 3.759 1.00 10.51 N ATOM 2401 CA ALA A 155 -2.543 7.562 2.953 1.00 60.41 C ATOM 2402 C ALA A 155 -2.651 6.301 3.804 1.00 53.44 C ATOM 2403 O ALA A 155 -3.647 5.581 3.741 1.00 71.22 O ATOM 2404 CB ALA A 155 -1.574 7.343 1.802 1.00 41.24 C ATOM 0 H ALA A 155 -1.241 9.123 3.466 1.00 10.51 H new ATOM 0 HA ALA A 155 -3.530 7.780 2.545 1.00 60.41 H new ATOM 0 HB1 ALA A 155 -1.901 6.489 1.209 1.00 41.24 H new ATOM 0 HB2 ALA A 155 -1.549 8.233 1.173 1.00 41.24 H new ATOM 0 HB3 ALA A 155 -0.577 7.150 2.198 1.00 41.24 H new ATOM 2410 N PHE A 156 -1.618 6.041 4.599 1.00 13.04 N ATOM 2411 CA PHE A 156 -1.596 4.867 5.465 1.00 5.51 C ATOM 2412 C PHE A 156 -2.792 4.868 6.411 1.00 53.24 C ATOM 2413 O PHE A 156 -3.523 3.882 6.506 1.00 5.31 O ATOM 2414 CB PHE A 156 -0.297 4.828 6.272 1.00 1.54 C ATOM 2415 CG PHE A 156 0.843 4.176 5.545 1.00 3.03 C ATOM 2416 CD1 PHE A 156 0.883 2.800 5.385 1.00 22.41 C ATOM 2417 CD2 PHE A 156 1.875 4.938 5.021 1.00 3.11 C ATOM 2418 CE1 PHE A 156 1.932 2.197 4.717 1.00 64.13 C ATOM 2419 CE2 PHE A 156 2.926 4.341 4.352 1.00 52.14 C ATOM 2420 CZ PHE A 156 2.955 2.968 4.199 1.00 20.22 C ATOM 0 H PHE A 156 -0.785 6.627 4.662 1.00 13.04 H new ATOM 0 HA PHE A 156 -1.653 3.980 4.834 1.00 5.51 H new ATOM 0 HB2 PHE A 156 -0.013 5.846 6.537 1.00 1.54 H new ATOM 0 HB3 PHE A 156 -0.475 4.294 7.205 1.00 1.54 H new ATOM 0 HD1 PHE A 156 0.086 2.192 5.787 1.00 22.41 H new ATOM 0 HD2 PHE A 156 1.857 6.012 5.137 1.00 3.11 H new ATOM 0 HE1 PHE A 156 1.952 1.124 4.600 1.00 64.13 H new ATOM 0 HE2 PHE A 156 3.724 4.947 3.949 1.00 52.14 H new ATOM 0 HZ PHE A 156 3.775 2.499 3.676 1.00 20.22 H new ATOM 2430 N TYR A 157 -2.983 5.982 7.109 1.00 52.42 N ATOM 2431 CA TYR A 157 -4.089 6.118 8.050 1.00 44.41 C ATOM 2432 C TYR A 157 -5.431 5.892 7.358 1.00 12.34 C ATOM 2433 O TYR A 157 -6.410 5.503 7.995 1.00 65.41 O ATOM 2434 CB TYR A 157 -4.064 7.503 8.699 1.00 32.52 C ATOM 2435 CG TYR A 157 -3.195 7.581 9.936 1.00 14.30 C ATOM 2436 CD1 TYR A 157 -2.007 6.865 10.022 1.00 0.41 C ATOM 2437 CD2 TYR A 157 -3.564 8.372 11.017 1.00 70.23 C ATOM 2438 CE1 TYR A 157 -1.212 6.935 11.150 1.00 3.33 C ATOM 2439 CE2 TYR A 157 -2.774 8.447 12.148 1.00 72.22 C ATOM 2440 CZ TYR A 157 -1.599 7.727 12.210 1.00 51.23 C ATOM 2441 OH TYR A 157 -0.810 7.800 13.335 1.00 35.04 O ATOM 0 H TYR A 157 -2.385 6.806 7.041 1.00 52.42 H new ATOM 0 HA TYR A 157 -3.970 5.358 8.822 1.00 44.41 H new ATOM 0 HB2 TYR A 157 -3.707 8.230 7.969 1.00 32.52 H new ATOM 0 HB3 TYR A 157 -5.082 7.789 8.963 1.00 32.52 H new ATOM 0 HD1 TYR A 157 -1.700 6.244 9.194 1.00 0.41 H new ATOM 0 HD2 TYR A 157 -4.483 8.937 10.972 1.00 70.23 H new ATOM 0 HE1 TYR A 157 -0.292 6.372 11.201 1.00 3.33 H new ATOM 0 HE2 TYR A 157 -3.075 9.067 12.980 1.00 72.22 H new ATOM 0 HH TYR A 157 -1.225 8.402 13.987 1.00 35.04 H new ATOM 2451 N THR A 158 -5.471 6.140 6.052 1.00 10.30 N ATOM 2452 CA THR A 158 -6.692 5.966 5.276 1.00 23.23 C ATOM 2453 C THR A 158 -7.223 4.540 5.395 1.00 43.11 C ATOM 2454 O THR A 158 -8.402 4.329 5.681 1.00 65.50 O ATOM 2455 CB THR A 158 -6.436 6.304 3.808 1.00 5.13 C ATOM 2456 OG1 THR A 158 -5.543 7.398 3.694 1.00 43.42 O ATOM 2457 CG2 THR A 158 -7.694 6.658 3.048 1.00 11.15 C ATOM 0 H THR A 158 -4.670 6.463 5.509 1.00 10.30 H new ATOM 0 HA THR A 158 -7.444 6.645 5.677 1.00 23.23 H new ATOM 0 HB THR A 158 -6.011 5.400 3.373 1.00 5.13 H new ATOM 0 HG1 THR A 158 -5.423 7.815 4.573 1.00 43.42 H new ATOM 0 HG21 THR A 158 -7.441 6.887 2.013 1.00 11.15 H new ATOM 0 HG22 THR A 158 -8.385 5.815 3.075 1.00 11.15 H new ATOM 0 HG23 THR A 158 -8.164 7.527 3.508 1.00 11.15 H new ATOM 2465 N LEU A 159 -6.348 3.564 5.172 1.00 62.41 N ATOM 2466 CA LEU A 159 -6.735 2.159 5.253 1.00 41.35 C ATOM 2467 C LEU A 159 -7.276 1.819 6.639 1.00 64.12 C ATOM 2468 O LEU A 159 -8.181 0.995 6.776 1.00 44.42 O ATOM 2469 CB LEU A 159 -5.545 1.257 4.916 1.00 54.33 C ATOM 2470 CG LEU A 159 -5.801 -0.246 5.072 1.00 51.34 C ATOM 2471 CD1 LEU A 159 -7.089 -0.649 4.370 1.00 65.52 C ATOM 2472 CD2 LEU A 159 -4.625 -1.048 4.531 1.00 62.04 C ATOM 0 H LEU A 159 -5.368 3.719 4.934 1.00 62.41 H new ATOM 0 HA LEU A 159 -7.527 1.986 4.525 1.00 41.35 H new ATOM 0 HB2 LEU A 159 -5.241 1.453 3.888 1.00 54.33 H new ATOM 0 HB3 LEU A 159 -4.707 1.535 5.555 1.00 54.33 H new ATOM 0 HG LEU A 159 -5.908 -0.465 6.134 1.00 51.34 H new ATOM 0 HD11 LEU A 159 -7.251 -1.720 4.494 1.00 65.52 H new ATOM 0 HD12 LEU A 159 -7.926 -0.103 4.804 1.00 65.52 H new ATOM 0 HD13 LEU A 159 -7.014 -0.414 3.308 1.00 65.52 H new ATOM 0 HD21 LEU A 159 -4.825 -2.113 4.650 1.00 62.04 H new ATOM 0 HD22 LEU A 159 -4.486 -0.821 3.474 1.00 62.04 H new ATOM 0 HD23 LEU A 159 -3.721 -0.785 5.081 1.00 62.04 H new ATOM 2484 N VAL A 160 -6.720 2.457 7.664 1.00 13.34 N ATOM 2485 CA VAL A 160 -7.151 2.221 9.036 1.00 43.32 C ATOM 2486 C VAL A 160 -8.648 2.476 9.191 1.00 35.21 C ATOM 2487 O VAL A 160 -9.378 1.642 9.727 1.00 43.15 O ATOM 2488 CB VAL A 160 -6.380 3.117 10.025 1.00 41.40 C ATOM 2489 CG1 VAL A 160 -6.799 2.825 11.458 1.00 11.42 C ATOM 2490 CG2 VAL A 160 -4.880 2.932 9.852 1.00 5.43 C ATOM 0 H VAL A 160 -5.970 3.142 7.570 1.00 13.34 H new ATOM 0 HA VAL A 160 -6.939 1.176 9.263 1.00 43.32 H new ATOM 0 HB VAL A 160 -6.624 4.157 9.808 1.00 41.40 H new ATOM 0 HG11 VAL A 160 -6.242 3.469 12.138 1.00 11.42 H new ATOM 0 HG12 VAL A 160 -7.866 3.015 11.571 1.00 11.42 H new ATOM 0 HG13 VAL A 160 -6.589 1.781 11.693 1.00 11.42 H new ATOM 0 HG21 VAL A 160 -4.351 3.572 10.558 1.00 5.43 H new ATOM 0 HG22 VAL A 160 -4.618 1.891 10.039 1.00 5.43 H new ATOM 0 HG23 VAL A 160 -4.595 3.201 8.835 1.00 5.43 H new ATOM 2500 N ARG A 161 -9.099 3.632 8.715 1.00 42.42 N ATOM 2501 CA ARG A 161 -10.508 3.996 8.797 1.00 74.34 C ATOM 2502 C ARG A 161 -11.360 3.069 7.936 1.00 35.52 C ATOM 2503 O ARG A 161 -12.533 2.836 8.230 1.00 31.13 O ATOM 2504 CB ARG A 161 -10.709 5.447 8.356 1.00 72.23 C ATOM 2505 CG ARG A 161 -10.110 6.464 9.314 1.00 61.13 C ATOM 2506 CD ARG A 161 -10.155 7.869 8.733 1.00 45.42 C ATOM 2507 NE ARG A 161 -9.695 8.873 9.690 1.00 42.22 N ATOM 2508 CZ ARG A 161 -9.317 10.103 9.348 1.00 63.04 C ATOM 2509 NH1 ARG A 161 -9.340 10.483 8.077 1.00 41.01 N ATOM 2510 NH2 ARG A 161 -8.914 10.955 10.281 1.00 22.25 N ATOM 0 H ARG A 161 -8.508 4.333 8.268 1.00 42.42 H new ATOM 0 HA ARG A 161 -10.824 3.892 9.835 1.00 74.34 H new ATOM 0 HB2 ARG A 161 -10.264 5.583 7.370 1.00 72.23 H new ATOM 0 HB3 ARG A 161 -11.777 5.642 8.253 1.00 72.23 H new ATOM 0 HG2 ARG A 161 -10.655 6.442 10.258 1.00 61.13 H new ATOM 0 HG3 ARG A 161 -9.078 6.193 9.535 1.00 61.13 H new ATOM 0 HD2 ARG A 161 -9.535 7.911 7.838 1.00 45.42 H new ATOM 0 HD3 ARG A 161 -11.175 8.102 8.426 1.00 45.42 H new ATOM 0 HE ARG A 161 -9.662 8.617 10.677 1.00 42.22 H new ATOM 0 HH11 ARG A 161 -9.649 9.831 7.355 1.00 41.01 H new ATOM 0 HH12 ARG A 161 -9.049 11.427 7.822 1.00 41.01 H new ATOM 0 HH21 ARG A 161 -8.894 10.668 11.260 1.00 22.25 H new ATOM 0 HH22 ARG A 161 -8.624 11.898 10.020 1.00 22.25 H new ATOM 2524 N GLU A 162 -10.764 2.544 6.870 1.00 31.23 N ATOM 2525 CA GLU A 162 -11.468 1.644 5.964 1.00 23.32 C ATOM 2526 C GLU A 162 -11.703 0.285 6.614 1.00 62.01 C ATOM 2527 O GLU A 162 -12.823 -0.226 6.620 1.00 33.33 O ATOM 2528 CB GLU A 162 -10.677 1.471 4.666 1.00 33.54 C ATOM 2529 CG GLU A 162 -10.930 2.571 3.648 1.00 41.14 C ATOM 2530 CD GLU A 162 -12.387 2.663 3.239 1.00 43.42 C ATOM 2531 OE1 GLU A 162 -12.954 1.629 2.827 1.00 71.34 O ATOM 2532 OE2 GLU A 162 -12.961 3.768 3.331 1.00 62.43 O ATOM 0 H GLU A 162 -9.794 2.727 6.612 1.00 31.23 H new ATOM 0 HA GLU A 162 -12.437 2.088 5.736 1.00 23.32 H new ATOM 0 HB2 GLU A 162 -9.613 1.442 4.900 1.00 33.54 H new ATOM 0 HB3 GLU A 162 -10.932 0.509 4.220 1.00 33.54 H new ATOM 0 HG2 GLU A 162 -10.612 3.527 4.065 1.00 41.14 H new ATOM 0 HG3 GLU A 162 -10.319 2.390 2.764 1.00 41.14 H new ATOM 2539 N ILE A 163 -10.640 -0.298 7.160 1.00 42.43 N ATOM 2540 CA ILE A 163 -10.729 -1.594 7.809 1.00 74.25 C ATOM 2541 C ILE A 163 -11.703 -1.557 8.984 1.00 20.35 C ATOM 2542 O ILE A 163 -12.420 -2.524 9.240 1.00 0.40 O ATOM 2543 CB ILE A 163 -9.350 -2.050 8.302 1.00 31.12 C ATOM 2544 CG1 ILE A 163 -8.379 -2.123 7.128 1.00 1.22 C ATOM 2545 CG2 ILE A 163 -9.448 -3.398 8.993 1.00 64.11 C ATOM 2546 CD1 ILE A 163 -6.941 -2.218 7.558 1.00 61.45 C ATOM 0 H ILE A 163 -9.706 0.111 7.164 1.00 42.43 H new ATOM 0 HA ILE A 163 -11.099 -2.305 7.070 1.00 74.25 H new ATOM 0 HB ILE A 163 -8.978 -1.324 9.025 1.00 31.12 H new ATOM 0 HG12 ILE A 163 -8.626 -2.988 6.513 1.00 1.22 H new ATOM 0 HG13 ILE A 163 -8.508 -1.240 6.502 1.00 1.22 H new ATOM 0 HG21 ILE A 163 -8.459 -3.704 9.335 1.00 64.11 H new ATOM 0 HG22 ILE A 163 -10.120 -3.321 9.848 1.00 64.11 H new ATOM 0 HG23 ILE A 163 -9.835 -4.138 8.293 1.00 64.11 H new ATOM 0 HD11 ILE A 163 -6.300 -2.267 6.677 1.00 61.45 H new ATOM 0 HD12 ILE A 163 -6.679 -1.340 8.149 1.00 61.45 H new ATOM 0 HD13 ILE A 163 -6.800 -3.116 8.160 1.00 61.45 H new ATOM 2558 N ARG A 164 -11.720 -0.433 9.694 1.00 74.41 N ATOM 2559 CA ARG A 164 -12.602 -0.266 10.843 1.00 23.43 C ATOM 2560 C ARG A 164 -14.069 -0.272 10.417 1.00 30.24 C ATOM 2561 O ARG A 164 -14.957 -0.539 11.226 1.00 44.31 O ATOM 2562 CB ARG A 164 -12.277 1.038 11.575 1.00 5.13 C ATOM 2563 CG ARG A 164 -11.333 0.854 12.753 1.00 44.44 C ATOM 2564 CD ARG A 164 -11.055 2.174 13.455 1.00 0.24 C ATOM 2565 NE ARG A 164 -12.281 2.921 13.723 1.00 41.13 N ATOM 2566 CZ ARG A 164 -13.142 2.611 14.690 1.00 41.24 C ATOM 2567 NH1 ARG A 164 -12.915 1.571 15.482 1.00 74.33 N ATOM 2568 NH2 ARG A 164 -14.233 3.344 14.866 1.00 51.00 N ATOM 0 H ARG A 164 -11.132 0.376 9.493 1.00 74.41 H new ATOM 0 HA ARG A 164 -12.438 -1.107 11.517 1.00 23.43 H new ATOM 0 HB2 ARG A 164 -11.832 1.740 10.870 1.00 5.13 H new ATOM 0 HB3 ARG A 164 -13.205 1.487 11.930 1.00 5.13 H new ATOM 0 HG2 ARG A 164 -11.767 0.148 13.461 1.00 44.44 H new ATOM 0 HG3 ARG A 164 -10.395 0.421 12.405 1.00 44.44 H new ATOM 0 HD2 ARG A 164 -10.535 1.983 14.394 1.00 0.24 H new ATOM 0 HD3 ARG A 164 -10.389 2.779 12.839 1.00 0.24 H new ATOM 0 HE ARG A 164 -12.490 3.728 13.135 1.00 41.13 H new ATOM 0 HH11 ARG A 164 -12.077 1.004 15.352 1.00 74.33 H new ATOM 0 HH12 ARG A 164 -13.578 1.338 16.221 1.00 74.33 H new ATOM 0 HH21 ARG A 164 -14.412 4.145 14.261 1.00 51.00 H new ATOM 0 HH22 ARG A 164 -14.893 3.107 15.607 1.00 51.00 H new ATOM 2582 N GLN A 165 -14.318 0.024 9.143 1.00 15.33 N ATOM 2583 CA GLN A 165 -15.678 0.051 8.617 1.00 54.34 C ATOM 2584 C GLN A 165 -16.036 -1.272 7.949 1.00 61.34 C ATOM 2585 O GLN A 165 -16.886 -1.320 7.060 1.00 55.45 O ATOM 2586 CB GLN A 165 -15.834 1.195 7.618 1.00 54.53 C ATOM 2587 CG GLN A 165 -15.935 2.560 8.276 1.00 43.00 C ATOM 2588 CD GLN A 165 -16.641 3.579 7.402 1.00 51.52 C ATOM 2589 OE1 GLN A 165 -17.701 4.091 7.759 1.00 42.15 O ATOM 2590 NE2 GLN A 165 -16.054 3.877 6.248 1.00 13.44 N ATOM 0 H GLN A 165 -13.596 0.248 8.458 1.00 15.33 H new ATOM 0 HA GLN A 165 -16.359 0.208 9.454 1.00 54.34 H new ATOM 0 HB2 GLN A 165 -14.984 1.191 6.936 1.00 54.53 H new ATOM 0 HB3 GLN A 165 -16.726 1.023 7.016 1.00 54.53 H new ATOM 0 HG2 GLN A 165 -16.470 2.465 9.221 1.00 43.00 H new ATOM 0 HG3 GLN A 165 -14.934 2.921 8.511 1.00 43.00 H new ATOM 0 HE21 GLN A 165 -15.175 3.428 5.992 1.00 13.44 H new ATOM 0 HE22 GLN A 165 -16.483 4.555 5.618 1.00 13.44 H new ATOM 2599 N HIS A 166 -15.383 -2.342 8.384 1.00 0.02 N ATOM 2600 CA HIS A 166 -15.631 -3.667 7.831 1.00 35.10 C ATOM 2601 C HIS A 166 -15.162 -4.755 8.792 1.00 0.11 C ATOM 2602 O HIS A 166 -15.138 -4.494 10.014 1.00 15.21 O ATOM 2603 CB HIS A 166 -14.925 -3.820 6.482 1.00 64.01 C ATOM 2604 CG HIS A 166 -15.779 -4.453 5.428 1.00 13.10 C ATOM 2605 ND1 HIS A 166 -16.611 -3.730 4.598 1.00 43.53 N ATOM 2606 CD2 HIS A 166 -15.930 -5.751 5.071 1.00 22.30 C ATOM 2607 CE1 HIS A 166 -17.236 -4.556 3.777 1.00 44.45 C ATOM 2608 NE2 HIS A 166 -16.839 -5.786 4.043 1.00 33.40 N ATOM 2609 OXT HIS A 166 -14.825 -5.859 8.316 1.00 64.34 O ATOM 0 H HIS A 166 -14.677 -2.318 9.119 1.00 0.02 H new ATOM 0 HA HIS A 166 -16.706 -3.777 7.685 1.00 35.10 H new ATOM 0 HB2 HIS A 166 -14.604 -2.838 6.136 1.00 64.01 H new ATOM 0 HB3 HIS A 166 -14.025 -4.420 6.618 1.00 64.01 H new ATOM 0 HD2 HIS A 166 -15.429 -6.600 5.513 1.00 22.30 H new ATOM 0 HE1 HIS A 166 -17.950 -4.273 3.018 1.00 44.45 H new ATOM 0 HE2 HIS A 166 -17.157 -6.628 3.562 1.00 33.40 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 11.615 -0.197 -6.280 1.00 14.15 P HETATM 2620 O1G GNP A 201 12.850 -0.832 -5.465 1.00 10.53 O HETATM 2621 O2G GNP A 201 10.338 -1.112 -5.927 1.00 74.43 O HETATM 2622 O3G GNP A 201 11.873 -0.110 -7.735 1.00 32.10 O HETATM 2623 N3B GNP A 201 11.333 1.249 -5.603 1.00 12.20 N HETATM 2624 PB GNP A 201 11.696 1.184 -4.024 1.00 21.32 P HETATM 2625 O1B GNP A 201 11.245 2.454 -3.413 1.00 21.02 O HETATM 2626 O2B GNP A 201 11.178 -0.087 -3.471 1.00 31.04 O HETATM 2627 O3A GNP A 201 13.305 1.142 -4.033 1.00 70.23 O HETATM 2628 PA GNP A 201 14.151 2.351 -3.389 1.00 12.33 P HETATM 2629 O1A GNP A 201 15.530 1.878 -3.136 1.00 62.25 O HETATM 2630 O2A GNP A 201 13.368 2.881 -2.250 1.00 0.35 O HETATM 2631 O5' GNP A 201 14.175 3.446 -4.569 1.00 12.32 O HETATM 2632 C5' GNP A 201 14.862 3.164 -5.791 1.00 32.12 C HETATM 2633 C4' GNP A 201 15.016 4.429 -6.638 1.00 1.34 C HETATM 2634 O4' GNP A 201 13.717 5.008 -6.856 1.00 42.32 O HETATM 2635 C3' GNP A 201 15.788 5.469 -5.824 1.00 22.51 C HETATM 2636 O3' GNP A 201 16.246 6.529 -6.668 1.00 42.33 O HETATM 2637 C2' GNP A 201 14.659 5.952 -4.917 1.00 15.11 C HETATM 2638 O2' GNP A 201 15.012 7.206 -4.327 1.00 24.04 O HETATM 2639 C1' GNP A 201 13.610 6.165 -6.007 1.00 43.34 C HETATM 2640 N9 GNP A 201 12.253 6.295 -5.431 1.00 15.23 N HETATM 2641 C8 GNP A 201 11.547 5.316 -4.870 1.00 13.31 C HETATM 2642 N7 GNP A 201 10.372 5.794 -4.467 1.00 61.33 N HETATM 2643 C5 GNP A 201 10.326 7.087 -4.774 1.00 50.03 C HETATM 2644 C6 GNP A 201 9.362 8.071 -4.593 1.00 64.13 C HETATM 2645 O6 GNP A 201 8.291 7.808 -4.049 1.00 4.04 O HETATM 2646 N1 GNP A 201 9.634 9.368 -5.042 1.00 11.30 N HETATM 2647 C2 GNP A 201 10.864 9.636 -5.657 1.00 73.04 C HETATM 2648 N2 GNP A 201 11.134 10.865 -6.088 1.00 70.13 N HETATM 2649 N3 GNP A 201 11.769 8.659 -5.814 1.00 1.13 N HETATM 2650 C4 GNP A 201 11.528 7.410 -5.391 1.00 71.01 C HETATM 0 HO3' GNP A 201 16.005 7.391 -6.270 1.00 42.33 H new HETATM 0 HO2' GNP A 201 14.630 7.263 -3.426 1.00 24.04 H new HETATM 0 HNB3 GNP A 201 10.982 2.071 -6.094 1.00 12.20 H new HETATM 0 HN22 GNP A 201 12.029 11.063 -6.536 1.00 70.13 H new HETATM 0 HN21 GNP A 201 10.446 11.609 -5.970 1.00 70.13 H new HETATM 0 H5'2 GNP A 201 14.314 2.409 -6.355 1.00 32.12 H new HETATM 0 H5'1 GNP A 201 15.845 2.747 -5.572 1.00 32.12 H new HETATM 0 HN1 GNP A 201 8.944 10.110 -4.923 1.00 11.30 H new HETATM 0 H8 GNP A 201 11.879 4.284 -4.758 1.00 13.31 H new HETATM 0 H4' GNP A 201 15.515 4.173 -7.573 1.00 1.34 H new HETATM 0 H3' GNP A 201 16.680 5.104 -5.314 1.00 22.51 H new HETATM 0 H2' GNP A 201 14.381 5.303 -4.087 1.00 15.11 H new HETATM 0 H1' GNP A 201 13.778 7.089 -6.561 1.00 43.34 H new HETATM 2664 MG MG A 202 9.501 -1.567 -4.068 1.00 64.02 MG HETATM 2665 C13 KOB A 203 2.648 -14.337 7.320 1.00 71.34 C HETATM 2666 C12 KOB A 203 2.321 -12.996 7.479 1.00 5.34 C HETATM 2667 C11 KOB A 203 3.261 -12.013 7.189 1.00 75.23 C HETATM 2668 F11 KOB A 203 2.945 -10.713 7.351 1.00 31.35 F HETATM 2669 C10 KOB A 203 4.528 -12.368 6.739 1.00 30.34 C HETATM 2670 C9 KOB A 203 4.852 -13.711 6.583 1.00 24.22 C HETATM 2671 C8 KOB A 203 3.915 -14.697 6.873 1.00 12.34 C HETATM 2672 N8 KOB A 203 4.256 -15.975 6.730 1.00 42.42 N HETATM 2673 C7 KOB A 203 3.408 -16.963 7.006 1.00 64.24 C HETATM 2674 S7 KOB A 203 1.790 -16.635 7.586 1.00 3.32 S HETATM 2675 N7 KOB A 203 3.796 -18.225 6.846 1.00 43.40 N HETATM 2676 N6 KOB A 203 4.931 -18.481 6.447 1.00 11.32 N HETATM 2677 C6 KOB A 203 5.209 -18.429 5.147 1.00 72.02 C HETATM 2678 C5 KOB A 203 4.210 -18.101 4.237 1.00 20.10 C HETATM 2679 C4 KOB A 203 4.494 -18.090 2.876 1.00 20.34 C HETATM 2680 C3 KOB A 203 5.773 -18.400 2.427 1.00 33.34 C HETATM 2681 N3 KOB A 203 6.031 -18.434 1.123 1.00 40.24 N HETATM 2682 O3B KOB A 203 7.341 -18.740 0.665 1.00 63.52 O HETATM 2683 O3A KOB A 203 5.000 -18.160 0.185 1.00 73.43 O HETATM 2684 C2 KOB A 203 6.774 -18.716 3.339 1.00 71.31 C HETATM 2685 C1 KOB A 203 6.491 -18.731 4.700 1.00 10.33 C HETATM 2686 N1 KOB A 203 7.451 -19.030 5.570 1.00 42.04 N HETATM 2687 O1B KOB A 203 7.175 -19.043 6.963 1.00 52.10 O HETATM 2688 O1A KOB A 203 8.758 -19.337 5.103 1.00 74.23 O HETATM 0 HE2 KOB A 203 1.328 -12.715 7.831 1.00 5.34 H new HETATM 0 HE1 KOB A 203 5.264 -11.597 6.510 1.00 30.34 H new HETATM 0 HD2 KOB A 203 1.911 -15.108 7.546 1.00 71.34 H new HETATM 0 HD1 KOB A 203 5.845 -13.992 6.232 1.00 24.22 H new HETATM 0 HAD KOB A 203 5.193 -16.204 6.400 1.00 42.42 H new HETATM 0 HAC KOB A 203 3.149 -18.985 7.055 1.00 43.40 H new HETATM 0 HAB KOB A 203 5.660 -18.734 7.114 1.00 11.32 H new HETATM 0 H5 KOB A 203 3.209 -17.854 4.589 1.00 20.10 H new HETATM 0 H4 KOB A 203 3.712 -17.838 2.159 1.00 20.34 H new HETATM 0 H2 KOB A 203 7.779 -18.951 2.987 1.00 71.31 H new HETATM 2699 O HOH A 301 11.076 -3.173 -3.692 1.00 12.14 O HETATM 2702 O HOH A 302 8.139 0.179 -4.456 1.00 62.14 O HETATM 2705 O HOH A 303 8.184 -3.215 -4.767 1.00 43.42 O