USER MOD reduce.3.24.130724 H: found=0, std=0, add=1297, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1289 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 HIS : no HD1:sc= -0.0107 X(o=0.84,f=0.84) USER MOD Set 1.2: A 137 TYR OH : rot -14:sc= 0.854 USER MOD Set 2.1: A 85 ASN : amide:sc= 0.858 K(o=1.7,f=-5.4!) USER MOD Set 2.2: A 117 LYS NZ :NH3+ -168:sc= 0.883 (180deg=0) USER MOD Set 3.1: A 16 LYS NZ :NH3+ -179:sc= 1.51 (180deg=0.913) USER MOD Set 3.2: A 58 THR OG1 : rot 180:sc= 0.535 USER MOD Single : A 1 MET CE :methyl 164:sc= -0.0507 (180deg=-0.364) USER MOD Single : A 1 MET N :NH3+ -112:sc= -0.0167 (180deg=-0.0425) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 130:sc= 0.411 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 60:sc= 0.812 USER MOD Single : A 20 THR OG1 : rot 76:sc= 0.0784 USER MOD Single : A 22 GLN : amide:sc= -1.18 K(o=-1.2,f=-3!) USER MOD Single : A 25 GLN : amide:sc= -0.0951 X(o=-0.095,f=-0.26) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 TYR OH : rot -51:sc= 0.9 USER MOD Single : A 35 SER OG : rot 150:sc= 0.503 USER MOD Single : A 39 SER OG : rot 148:sc= 1.25 USER MOD Single : A 40 TYR OH : rot 98:sc= 0.0206 USER MOD Single : A 42 LYS NZ :NH3+ -165:sc= 0.844 (180deg=0.696) USER MOD Single : A 43 GLN : amide:sc= -0.124 K(o=-0.12,f=-0.95) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0563 USER MOD Single : A 51 CYS SG : rot -24:sc= 0.324 USER MOD Single : A 61 GLN : amide:sc= -0.0379 X(o=-0.038,f=-0.045) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -130:sc= 0.445 USER MOD Single : A 67 MET CE :methyl -149:sc= -0.206 (180deg=-0.31) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 166:sc=-0.00419 (180deg=-0.213) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.0712 USER MOD Single : A 86 ASN : amide:sc= -0.0338 K(o=-0.034,f=-10!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -84:sc= 1.16 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.118 F(o=-2.3!,f=-0.12) USER MOD Single : A 96 TYR OH : rot 7:sc= 0.833 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -165:sc= 1.32 (180deg=1.15) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -168:sc= -0.0446 (180deg=-0.461) USER MOD Single : A 116 ASN : amide:sc= -1.88! C(o=-1.9!,f=-9.2!) USER MOD Single : A 118 CYS SG : rot 84:sc= -1.32 USER MOD Single : A 124 THR OG1 : rot -75:sc= 0.966 USER MOD Single : A 127 SER OG : rot -129:sc= 0.0309 USER MOD Single : A 129 GLN :FLIP amide:sc= -0.364 F(o=-3.5!,f=-0.36) USER MOD Single : A 131 GLN :FLIP amide:sc= -0.103 F(o=-2.5!,f=-0.1) USER MOD Single : A 136 SER OG : rot -32:sc= 1.22 USER MOD Single : A 141 TYR OH : rot 30:sc= 0 USER MOD Single : A 144 THR OG1 : rot -120:sc= 0.401 USER MOD Single : A 145 SER OG : rot -163:sc= 0.612 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot -18:sc= 0.728 USER MOD Single : A 150 GLN : amide:sc= 0.793 K(o=0.79,f=-0.05) USER MOD Single : A 157 TYR OH : rot 127:sc= 0.914 USER MOD Single : A 158 THR OG1 : rot 66:sc= 0.719 USER MOD Single : A 165 GLN :FLIP amide:sc= -0.108 F(o=-2!,f=-0.11) USER MOD Single : A 166 HIS : no HE2:sc= 0.419 K(o=0.42,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.468 18.568 -12.786 1.00 0.00 N ATOM 2 CA MET A 1 -8.570 17.181 -13.227 1.00 0.00 C ATOM 3 C MET A 1 -7.318 16.397 -12.849 1.00 0.00 C ATOM 4 O MET A 1 -6.723 15.714 -13.684 1.00 0.00 O ATOM 5 CB MET A 1 -8.799 17.120 -14.736 1.00 0.00 C ATOM 6 CG MET A 1 -10.170 17.604 -15.185 1.00 0.00 C ATOM 7 SD MET A 1 -10.375 17.548 -16.976 1.00 0.00 S ATOM 8 CE MET A 1 -10.371 15.780 -17.261 1.00 0.00 C ATOM 0 H1 MET A 1 -9.157 18.742 -12.026 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.508 18.750 -12.431 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.667 19.202 -13.586 1.00 0.00 H new ATOM 0 HA MET A 1 -9.422 16.725 -12.724 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.035 17.720 -15.231 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.663 16.091 -15.070 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.939 16.990 -14.716 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.322 18.626 -14.838 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.766 15.571 -18.255 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.351 15.402 -17.189 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.993 15.289 -16.513 1.00 0.00 H new ATOM 18 N THR A 2 -6.920 16.498 -11.584 1.00 0.00 N ATOM 19 CA THR A 2 -5.740 15.797 -11.095 1.00 0.00 C ATOM 20 C THR A 2 -6.123 14.498 -10.395 1.00 0.00 C ATOM 21 O THR A 2 -6.796 14.513 -9.365 1.00 0.00 O ATOM 22 CB THR A 2 -4.925 16.671 -10.124 1.00 0.00 C ATOM 23 OG1 THR A 2 -4.484 17.857 -10.799 1.00 0.00 O ATOM 24 CG2 THR A 2 -3.715 15.908 -9.607 1.00 0.00 C ATOM 0 H THR A 2 -7.399 17.059 -10.880 1.00 0.00 H new ATOM 0 HA THR A 2 -5.126 15.570 -11.966 1.00 0.00 H new ATOM 0 HB THR A 2 -5.561 16.939 -9.280 1.00 0.00 H new ATOM 0 HG1 THR A 2 -3.967 18.413 -10.179 1.00 0.00 H new ATOM 0 HG21 THR A 2 -3.151 16.541 -8.922 1.00 0.00 H new ATOM 0 HG22 THR A 2 -4.047 15.012 -9.083 1.00 0.00 H new ATOM 0 HG23 THR A 2 -3.079 15.623 -10.445 1.00 0.00 H new ATOM 32 N GLU A 3 -5.690 13.376 -10.962 1.00 0.00 N ATOM 33 CA GLU A 3 -6.045 12.066 -10.429 1.00 0.00 C ATOM 34 C GLU A 3 -4.804 11.200 -10.239 1.00 0.00 C ATOM 35 O GLU A 3 -3.924 11.158 -11.100 1.00 0.00 O ATOM 36 CB GLU A 3 -7.042 11.363 -11.353 1.00 0.00 C ATOM 37 CG GLU A 3 -7.469 9.980 -10.882 1.00 0.00 C ATOM 38 CD GLU A 3 -8.501 9.384 -11.799 1.00 0.00 C ATOM 39 OE1 GLU A 3 -8.841 10.017 -12.769 1.00 0.00 O ATOM 40 OE2 GLU A 3 -8.867 8.251 -11.592 1.00 0.00 O ATOM 0 H GLU A 3 -5.094 13.348 -11.789 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.512 12.214 -9.456 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -7.929 11.989 -11.454 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.599 11.275 -12.345 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -6.599 9.325 -10.836 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -7.872 10.046 -9.872 1.00 0.00 H new ATOM 47 N TYR A 4 -4.738 10.511 -9.105 1.00 0.00 N ATOM 48 CA TYR A 4 -3.618 9.623 -8.814 1.00 0.00 C ATOM 49 C TYR A 4 -4.091 8.179 -8.677 1.00 0.00 C ATOM 50 O TYR A 4 -4.927 7.864 -7.830 1.00 0.00 O ATOM 51 CB TYR A 4 -2.900 10.067 -7.538 1.00 0.00 C ATOM 52 CG TYR A 4 -2.259 11.433 -7.639 1.00 0.00 C ATOM 53 CD1 TYR A 4 -1.003 11.590 -8.206 1.00 0.00 C ATOM 54 CD2 TYR A 4 -2.910 12.563 -7.164 1.00 0.00 C ATOM 55 CE1 TYR A 4 -0.413 12.835 -8.301 1.00 0.00 C ATOM 56 CE2 TYR A 4 -2.330 13.813 -7.254 1.00 0.00 C ATOM 57 CZ TYR A 4 -1.080 13.945 -7.823 1.00 0.00 C ATOM 58 OH TYR A 4 -0.496 15.188 -7.914 1.00 0.00 O ATOM 0 H TYR A 4 -5.447 10.550 -8.372 1.00 0.00 H new ATOM 0 HA TYR A 4 -2.918 9.678 -9.647 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -3.614 10.071 -6.714 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.132 9.334 -7.291 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -0.477 10.724 -8.580 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.888 12.463 -6.716 1.00 0.00 H new ATOM 0 HE1 TYR A 4 0.565 12.940 -8.747 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -2.852 14.682 -6.881 1.00 0.00 H new ATOM 0 HH TYR A 4 -1.131 15.820 -8.311 1.00 0.00 H new ATOM 68 N LYS A 5 -3.548 7.304 -9.517 1.00 0.00 N ATOM 69 CA LYS A 5 -4.021 5.927 -9.599 1.00 0.00 C ATOM 70 C LYS A 5 -3.065 4.980 -8.880 1.00 0.00 C ATOM 71 O LYS A 5 -1.988 4.666 -9.387 1.00 0.00 O ATOM 72 CB LYS A 5 -4.187 5.503 -11.059 1.00 0.00 C ATOM 73 CG LYS A 5 -5.225 6.304 -11.834 1.00 0.00 C ATOM 74 CD LYS A 5 -5.131 6.034 -13.328 1.00 0.00 C ATOM 75 CE LYS A 5 -6.219 6.772 -14.094 1.00 0.00 C ATOM 76 NZ LYS A 5 -6.187 6.457 -15.548 1.00 0.00 N ATOM 0 H LYS A 5 -2.780 7.524 -10.151 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.992 5.874 -9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.225 5.595 -11.563 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.463 4.449 -11.089 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -6.223 6.049 -11.479 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -5.081 7.368 -11.645 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.152 6.343 -13.694 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.217 4.963 -13.512 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -7.194 6.505 -13.686 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -6.097 7.846 -13.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.944 6.980 -16.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -5.266 6.735 -15.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -6.329 5.436 -15.685 1.00 0.00 H new ATOM 90 N LEU A 6 -3.467 4.526 -7.697 1.00 0.00 N ATOM 91 CA LEU A 6 -2.626 3.654 -6.886 1.00 0.00 C ATOM 92 C LEU A 6 -3.265 2.280 -6.720 1.00 0.00 C ATOM 93 O LEU A 6 -4.446 2.168 -6.388 1.00 0.00 O ATOM 94 CB LEU A 6 -2.365 4.293 -5.517 1.00 0.00 C ATOM 95 CG LEU A 6 -1.661 5.656 -5.555 1.00 0.00 C ATOM 96 CD1 LEU A 6 -1.501 6.200 -4.142 1.00 0.00 C ATOM 97 CD2 LEU A 6 -0.308 5.511 -6.234 1.00 0.00 C ATOM 0 H LEU A 6 -4.371 4.748 -7.279 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.674 3.523 -7.400 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -3.318 4.409 -5.000 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -1.761 3.607 -4.923 1.00 0.00 H new ATOM 0 HG LEU A 6 -2.265 6.362 -6.125 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -1.000 7.168 -4.179 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -2.483 6.317 -3.684 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.905 5.506 -3.550 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.191 6.480 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU A 6 0.305 4.802 -5.677 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -0.449 5.147 -7.252 1.00 0.00 H new ATOM 109 N VAL A 7 -2.478 1.235 -6.953 1.00 0.00 N ATOM 110 CA VAL A 7 -2.990 -0.130 -6.923 1.00 0.00 C ATOM 111 C VAL A 7 -2.736 -0.783 -5.568 1.00 0.00 C ATOM 112 O VAL A 7 -1.643 -0.676 -5.011 1.00 0.00 O ATOM 113 CB VAL A 7 -2.356 -0.996 -8.028 1.00 0.00 C ATOM 114 CG1 VAL A 7 -2.863 -2.428 -7.939 1.00 0.00 C ATOM 115 CG2 VAL A 7 -2.653 -0.412 -9.400 1.00 0.00 C ATOM 0 H VAL A 7 -1.483 1.307 -7.165 1.00 0.00 H new ATOM 0 HA VAL A 7 -4.064 -0.067 -7.097 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.276 -1.002 -7.883 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.405 -3.026 -8.727 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -2.601 -2.847 -6.967 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -3.946 -2.439 -8.059 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -2.197 -1.037 -10.168 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.731 -0.376 -9.554 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.244 0.596 -9.463 1.00 0.00 H new ATOM 125 N VAL A 8 -3.753 -1.458 -5.043 1.00 0.00 N ATOM 126 CA VAL A 8 -3.643 -2.123 -3.750 1.00 0.00 C ATOM 127 C VAL A 8 -3.139 -3.553 -3.909 1.00 0.00 C ATOM 128 O VAL A 8 -3.746 -4.362 -4.610 1.00 0.00 O ATOM 129 CB VAL A 8 -4.993 -2.144 -3.008 1.00 0.00 C ATOM 130 CG1 VAL A 8 -4.844 -2.813 -1.650 1.00 0.00 C ATOM 131 CG2 VAL A 8 -5.534 -0.731 -2.848 1.00 0.00 C ATOM 0 H VAL A 8 -4.663 -1.559 -5.493 1.00 0.00 H new ATOM 0 HA VAL A 8 -2.926 -1.551 -3.162 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.703 -2.721 -3.601 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -5.807 -2.819 -1.140 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -4.499 -3.838 -1.785 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -4.119 -2.262 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.488 -0.764 -2.322 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -4.825 -0.132 -2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -5.677 -0.283 -3.831 1.00 0.00 H new ATOM 141 N VAL A 9 -2.025 -3.858 -3.252 1.00 0.00 N ATOM 142 CA VAL A 9 -1.552 -5.233 -3.147 1.00 0.00 C ATOM 143 C VAL A 9 -1.117 -5.557 -1.721 1.00 0.00 C ATOM 144 O VAL A 9 -0.921 -4.659 -0.902 1.00 0.00 O ATOM 145 CB VAL A 9 -0.377 -5.502 -4.106 1.00 0.00 C ATOM 146 CG1 VAL A 9 -0.814 -5.306 -5.550 1.00 0.00 C ATOM 147 CG2 VAL A 9 0.798 -4.593 -3.778 1.00 0.00 C ATOM 0 H VAL A 9 -1.433 -3.171 -2.784 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.388 -5.875 -3.424 1.00 0.00 H new ATOM 0 HB VAL A 9 -0.058 -6.536 -3.979 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.028 -5.500 -6.214 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.625 -5.996 -5.781 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -1.158 -4.281 -5.690 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.619 -4.797 -4.466 1.00 0.00 H new ATOM 0 HG22 VAL A 9 0.491 -3.552 -3.878 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.127 -4.778 -2.755 1.00 0.00 H new ATOM 157 N GLY A 10 -0.965 -6.845 -1.433 1.00 0.00 N ATOM 158 CA GLY A 10 -0.511 -7.263 -0.119 1.00 0.00 C ATOM 159 C GLY A 10 -0.929 -8.681 0.215 1.00 0.00 C ATOM 160 O GLY A 10 -1.257 -9.465 -0.675 1.00 0.00 O ATOM 0 H GLY A 10 -1.148 -7.607 -2.086 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.575 -7.187 -0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.911 -6.583 0.633 1.00 0.00 H new ATOM 164 N ALA A 11 -0.918 -9.012 1.502 1.00 0.00 N ATOM 165 CA ALA A 11 -1.251 -10.359 1.947 1.00 0.00 C ATOM 166 C ALA A 11 -2.648 -10.760 1.485 1.00 0.00 C ATOM 167 O ALA A 11 -3.601 -9.994 1.619 1.00 0.00 O ATOM 168 CB ALA A 11 -1.147 -10.455 3.462 1.00 0.00 C ATOM 0 H ALA A 11 -0.682 -8.365 2.255 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.536 -11.050 1.500 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -1.398 -11.467 3.781 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.129 -10.219 3.772 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.839 -9.748 3.920 1.00 0.00 H new ATOM 174 N GLY A 12 -2.762 -11.968 0.938 1.00 0.00 N ATOM 175 CA GLY A 12 -4.032 -12.423 0.404 1.00 0.00 C ATOM 176 C GLY A 12 -4.926 -13.028 1.468 1.00 0.00 C ATOM 177 O GLY A 12 -4.773 -14.194 1.828 1.00 0.00 O ATOM 0 H GLY A 12 -1.998 -12.638 0.856 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -4.547 -11.584 -0.065 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.850 -13.162 -0.377 1.00 0.00 H new ATOM 181 N GLY A 13 -5.863 -12.231 1.975 1.00 0.00 N ATOM 182 CA GLY A 13 -6.898 -12.762 2.842 1.00 0.00 C ATOM 183 C GLY A 13 -7.082 -11.935 4.099 1.00 0.00 C ATOM 184 O GLY A 13 -8.081 -12.079 4.804 1.00 0.00 O ATOM 0 H GLY A 13 -5.923 -11.228 1.800 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.840 -12.802 2.296 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -6.646 -13.786 3.118 1.00 0.00 H new ATOM 188 N VAL A 14 -6.117 -11.065 4.380 1.00 0.00 N ATOM 189 CA VAL A 14 -6.160 -10.238 5.580 1.00 0.00 C ATOM 190 C VAL A 14 -7.314 -9.244 5.521 1.00 0.00 C ATOM 191 O VAL A 14 -8.272 -9.341 6.287 1.00 0.00 O ATOM 192 CB VAL A 14 -4.842 -9.468 5.785 1.00 0.00 C ATOM 193 CG1 VAL A 14 -4.969 -8.493 6.945 1.00 0.00 C ATOM 194 CG2 VAL A 14 -3.693 -10.435 6.027 1.00 0.00 C ATOM 0 H VAL A 14 -5.296 -10.915 3.793 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.308 -10.914 6.422 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.631 -8.900 4.879 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.028 -7.958 7.075 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -5.766 -7.780 6.735 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -5.204 -9.041 7.857 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.769 -9.874 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.899 -11.029 6.918 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.587 -11.096 5.167 1.00 0.00 H new ATOM 204 N GLY A 15 -7.218 -8.287 4.603 1.00 0.00 N ATOM 205 CA GLY A 15 -8.332 -7.394 4.342 1.00 0.00 C ATOM 206 C GLY A 15 -7.921 -6.169 3.548 1.00 0.00 C ATOM 207 O GLY A 15 -7.950 -5.050 4.061 1.00 0.00 O ATOM 0 H GLY A 15 -6.388 -8.114 4.035 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.106 -7.934 3.796 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.770 -7.079 5.289 1.00 0.00 H new ATOM 211 N LYS A 16 -7.533 -6.381 2.295 1.00 0.00 N ATOM 212 CA LYS A 16 -7.162 -5.280 1.414 1.00 0.00 C ATOM 213 C LYS A 16 -8.369 -4.400 1.104 1.00 0.00 C ATOM 214 O LYS A 16 -8.242 -3.184 0.965 1.00 0.00 O ATOM 215 CB LYS A 16 -6.550 -5.813 0.117 1.00 0.00 C ATOM 216 CG LYS A 16 -7.554 -6.443 -0.839 1.00 0.00 C ATOM 217 CD LYS A 16 -6.857 -7.071 -2.037 1.00 0.00 C ATOM 218 CE LYS A 16 -5.998 -6.055 -2.774 1.00 0.00 C ATOM 219 NZ LYS A 16 -5.370 -6.636 -3.992 1.00 0.00 N ATOM 0 H LYS A 16 -7.467 -7.305 1.867 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.418 -4.673 1.929 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.043 -4.995 -0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.789 -6.553 0.366 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.133 -7.202 -0.313 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -8.258 -5.685 -1.181 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.235 -7.902 -1.704 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.601 -7.483 -2.718 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.610 -5.198 -3.055 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.220 -5.685 -2.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.780 -5.916 -4.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.779 -7.448 -3.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.112 -6.950 -4.649 1.00 0.00 H new ATOM 233 N SER A 17 -9.538 -5.022 0.998 1.00 0.00 N ATOM 234 CA SER A 17 -10.768 -4.295 0.708 1.00 0.00 C ATOM 235 C SER A 17 -11.169 -3.414 1.886 1.00 0.00 C ATOM 236 O SER A 17 -11.584 -2.269 1.707 1.00 0.00 O ATOM 237 CB SER A 17 -11.882 -5.266 0.367 1.00 0.00 C ATOM 238 OG SER A 17 -13.097 -4.609 0.128 1.00 0.00 O ATOM 0 H SER A 17 -9.660 -6.029 1.109 1.00 0.00 H new ATOM 0 HA SER A 17 -10.591 -3.649 -0.152 1.00 0.00 H new ATOM 0 HB2 SER A 17 -11.603 -5.843 -0.514 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.008 -5.975 1.185 1.00 0.00 H new ATOM 0 HG SER A 17 -12.991 -3.988 -0.623 1.00 0.00 H new ATOM 244 N ALA A 18 -11.042 -3.956 3.093 1.00 0.00 N ATOM 245 CA ALA A 18 -11.435 -3.237 4.299 1.00 0.00 C ATOM 246 C ALA A 18 -10.616 -1.962 4.468 1.00 0.00 C ATOM 247 O ALA A 18 -11.139 -0.928 4.887 1.00 0.00 O ATOM 248 CB ALA A 18 -11.280 -4.133 5.520 1.00 0.00 C ATOM 0 H ALA A 18 -10.670 -4.891 3.262 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.483 -2.954 4.200 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.577 -3.584 6.414 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -11.913 -5.013 5.408 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -10.239 -4.444 5.614 1.00 0.00 H new ATOM 254 N LEU A 19 -9.331 -2.041 4.142 1.00 0.00 N ATOM 255 CA LEU A 19 -8.443 -0.889 4.247 1.00 0.00 C ATOM 256 C LEU A 19 -8.817 0.182 3.228 1.00 0.00 C ATOM 257 O LEU A 19 -8.663 1.377 3.481 1.00 0.00 O ATOM 258 CB LEU A 19 -6.984 -1.323 4.056 1.00 0.00 C ATOM 259 CG LEU A 19 -6.424 -2.234 5.156 1.00 0.00 C ATOM 260 CD1 LEU A 19 -4.996 -2.641 4.821 1.00 0.00 C ATOM 261 CD2 LEU A 19 -6.479 -1.509 6.493 1.00 0.00 C ATOM 0 H LEU A 19 -8.881 -2.891 3.803 1.00 0.00 H new ATOM 0 HA LEU A 19 -8.555 -0.462 5.244 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.898 -1.839 3.100 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.361 -0.430 3.994 1.00 0.00 H new ATOM 0 HG LEU A 19 -7.029 -3.138 5.222 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.608 -3.287 5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.984 -3.177 3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.373 -1.750 4.743 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.081 -2.156 7.275 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.883 -0.598 6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.513 -1.253 6.726 1.00 0.00 H new ATOM 273 N THR A 20 -9.313 -0.254 2.074 1.00 0.00 N ATOM 274 CA THR A 20 -9.837 0.664 1.071 1.00 0.00 C ATOM 275 C THR A 20 -11.142 1.302 1.538 1.00 0.00 C ATOM 276 O THR A 20 -11.384 2.486 1.301 1.00 0.00 O ATOM 277 CB THR A 20 -10.076 -0.046 -0.274 1.00 0.00 C ATOM 278 OG1 THR A 20 -8.832 -0.545 -0.781 1.00 0.00 O ATOM 279 CG2 THR A 20 -10.681 0.917 -1.285 1.00 0.00 C ATOM 0 H THR A 20 -9.363 -1.238 1.811 1.00 0.00 H new ATOM 0 HA THR A 20 -9.085 1.441 0.932 1.00 0.00 H new ATOM 0 HB THR A 20 -10.769 -0.872 -0.114 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.574 -1.348 -0.282 1.00 0.00 H new ATOM 0 HG21 THR A 20 -10.843 0.398 -2.230 1.00 0.00 H new ATOM 0 HG22 THR A 20 -11.633 1.290 -0.908 1.00 0.00 H new ATOM 0 HG23 THR A 20 -10.001 1.754 -1.443 1.00 0.00 H new ATOM 287 N ILE A 21 -11.976 0.510 2.202 1.00 0.00 N ATOM 288 CA ILE A 21 -13.268 0.990 2.678 1.00 0.00 C ATOM 289 C ILE A 21 -13.096 2.091 3.718 1.00 0.00 C ATOM 290 O ILE A 21 -13.794 3.104 3.685 1.00 0.00 O ATOM 291 CB ILE A 21 -14.106 -0.151 3.283 1.00 0.00 C ATOM 292 CG1 ILE A 21 -14.542 -1.130 2.190 1.00 0.00 C ATOM 293 CG2 ILE A 21 -15.316 0.409 4.015 1.00 0.00 C ATOM 294 CD1 ILE A 21 -15.112 -2.425 2.723 1.00 0.00 C ATOM 0 H ILE A 21 -11.781 -0.467 2.423 1.00 0.00 H new ATOM 0 HA ILE A 21 -13.794 1.392 1.812 1.00 0.00 H new ATOM 0 HB ILE A 21 -13.490 -0.691 4.002 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -15.289 -0.647 1.560 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.686 -1.355 1.554 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -15.898 -0.411 4.437 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -14.983 1.068 4.817 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -15.935 0.972 3.317 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -15.398 -3.067 1.890 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.361 -2.931 3.329 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -15.989 -2.212 3.335 1.00 0.00 H new ATOM 306 N GLN A 22 -12.160 1.885 4.640 1.00 0.00 N ATOM 307 CA GLN A 22 -11.980 2.799 5.762 1.00 0.00 C ATOM 308 C GLN A 22 -11.444 4.145 5.288 1.00 0.00 C ATOM 309 O GLN A 22 -11.601 5.162 5.966 1.00 0.00 O ATOM 310 CB GLN A 22 -11.026 2.197 6.798 1.00 0.00 C ATOM 311 CG GLN A 22 -9.590 2.066 6.319 1.00 0.00 C ATOM 312 CD GLN A 22 -8.770 3.309 6.606 1.00 0.00 C ATOM 313 OE1 GLN A 22 -9.114 4.110 7.479 1.00 0.00 O ATOM 314 NE2 GLN A 22 -7.679 3.480 5.867 1.00 0.00 N ATOM 0 H GLN A 22 -11.516 1.094 4.632 1.00 0.00 H new ATOM 0 HA GLN A 22 -12.955 2.956 6.224 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -11.043 2.817 7.695 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -11.393 1.211 7.084 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -9.125 1.207 6.803 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -9.584 1.869 5.247 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -7.432 2.792 5.156 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -7.089 4.299 6.011 1.00 0.00 H new ATOM 323 N LEU A 23 -10.811 4.146 4.120 1.00 0.00 N ATOM 324 CA LEU A 23 -10.366 5.385 3.492 1.00 0.00 C ATOM 325 C LEU A 23 -11.557 6.235 3.060 1.00 0.00 C ATOM 326 O LEU A 23 -11.595 7.440 3.313 1.00 0.00 O ATOM 327 CB LEU A 23 -9.462 5.078 2.291 1.00 0.00 C ATOM 328 CG LEU A 23 -8.084 4.504 2.642 1.00 0.00 C ATOM 329 CD1 LEU A 23 -7.391 4.005 1.381 1.00 0.00 C ATOM 330 CD2 LEU A 23 -7.247 5.573 3.329 1.00 0.00 C ATOM 0 H LEU A 23 -10.594 3.303 3.589 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.793 5.953 4.225 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.977 4.372 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.321 5.995 1.719 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.204 3.661 3.323 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.413 3.599 1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.996 3.226 0.917 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -7.267 4.832 0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.268 5.164 3.578 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.125 6.425 2.660 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.748 5.897 4.241 1.00 0.00 H new ATOM 342 N ILE A 24 -12.525 5.600 2.411 1.00 0.00 N ATOM 343 CA ILE A 24 -13.651 6.318 1.825 1.00 0.00 C ATOM 344 C ILE A 24 -14.761 6.527 2.849 1.00 0.00 C ATOM 345 O ILE A 24 -15.604 7.411 2.693 1.00 0.00 O ATOM 346 CB ILE A 24 -14.224 5.574 0.605 1.00 0.00 C ATOM 347 CG1 ILE A 24 -14.774 4.208 1.022 1.00 0.00 C ATOM 348 CG2 ILE A 24 -13.159 5.417 -0.470 1.00 0.00 C ATOM 349 CD1 ILE A 24 -15.520 3.488 -0.078 1.00 0.00 C ATOM 0 H ILE A 24 -12.553 4.589 2.277 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.272 7.287 1.500 1.00 0.00 H new ATOM 0 HB ILE A 24 -15.043 6.163 0.193 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -13.948 3.581 1.358 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -15.441 4.340 1.874 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -13.581 4.889 -1.325 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -12.813 6.401 -0.786 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -12.320 4.848 -0.070 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -15.879 2.528 0.294 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -16.368 4.093 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -14.852 3.323 -0.923 1.00 0.00 H new ATOM 361 N GLN A 25 -14.754 5.710 3.897 1.00 0.00 N ATOM 362 CA GLN A 25 -15.796 5.766 4.916 1.00 0.00 C ATOM 363 C GLN A 25 -15.265 6.387 6.203 1.00 0.00 C ATOM 364 O GLN A 25 -16.033 6.871 7.033 1.00 0.00 O ATOM 365 CB GLN A 25 -16.343 4.366 5.203 1.00 0.00 C ATOM 366 CG GLN A 25 -17.023 3.707 4.015 1.00 0.00 C ATOM 367 CD GLN A 25 -18.224 4.494 3.526 1.00 0.00 C ATOM 368 OE1 GLN A 25 -19.037 4.971 4.322 1.00 0.00 O ATOM 369 NE2 GLN A 25 -18.345 4.630 2.210 1.00 0.00 N ATOM 0 H GLN A 25 -14.039 5.002 4.063 1.00 0.00 H new ATOM 0 HA GLN A 25 -16.603 6.391 4.535 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -15.524 3.730 5.537 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -17.055 4.428 6.026 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -16.305 3.602 3.201 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -17.340 2.702 4.293 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -17.649 4.219 1.589 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -19.134 5.146 1.821 1.00 0.00 H new ATOM 378 N ASN A 26 -13.946 6.370 6.362 1.00 0.00 N ATOM 379 CA ASN A 26 -13.319 6.822 7.599 1.00 0.00 C ATOM 380 C ASN A 26 -13.702 5.918 8.766 1.00 0.00 C ATOM 381 O ASN A 26 -13.861 6.379 9.896 1.00 0.00 O ATOM 382 CB ASN A 26 -13.677 8.264 7.910 1.00 0.00 C ATOM 383 CG ASN A 26 -13.049 9.259 6.973 1.00 0.00 C ATOM 384 OD1 ASN A 26 -11.990 9.008 6.388 1.00 0.00 O ATOM 385 ND2 ASN A 26 -13.654 10.417 6.892 1.00 0.00 N ATOM 0 H ASN A 26 -13.290 6.048 5.650 1.00 0.00 H new ATOM 0 HA ASN A 26 -12.240 6.766 7.455 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.761 8.376 7.872 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -13.368 8.494 8.930 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -13.252 11.164 6.325 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -14.527 10.572 7.396 1.00 0.00 H new ATOM 392 N HIS A 27 -13.849 4.627 8.484 1.00 0.00 N ATOM 393 CA HIS A 27 -14.213 3.657 9.510 1.00 0.00 C ATOM 394 C HIS A 27 -13.776 2.251 9.109 1.00 0.00 C ATOM 395 O HIS A 27 -13.890 1.863 7.947 1.00 0.00 O ATOM 396 CB HIS A 27 -15.722 3.684 9.771 1.00 0.00 C ATOM 397 CG HIS A 27 -16.158 2.773 10.876 1.00 0.00 C ATOM 398 ND1 HIS A 27 -15.893 3.034 12.204 1.00 0.00 N ATOM 399 CD2 HIS A 27 -16.840 1.604 10.850 1.00 0.00 C ATOM 400 CE1 HIS A 27 -16.394 2.063 12.948 1.00 0.00 C ATOM 401 NE2 HIS A 27 -16.973 1.184 12.151 1.00 0.00 N ATOM 0 H HIS A 27 -13.722 4.229 7.554 1.00 0.00 H new ATOM 0 HA HIS A 27 -13.695 3.932 10.429 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -16.022 4.704 10.013 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -16.245 3.407 8.856 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -17.210 1.097 9.971 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -16.339 2.000 14.025 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -17.443 0.331 12.453 1.00 0.00 H new ATOM 408 N PHE A 28 -13.273 1.494 10.079 1.00 0.00 N ATOM 409 CA PHE A 28 -12.744 0.162 9.812 1.00 0.00 C ATOM 410 C PHE A 28 -13.838 -0.894 9.937 1.00 0.00 C ATOM 411 O PHE A 28 -14.528 -0.971 10.953 1.00 0.00 O ATOM 412 CB PHE A 28 -11.589 -0.156 10.764 1.00 0.00 C ATOM 413 CG PHE A 28 -10.330 0.607 10.465 1.00 0.00 C ATOM 414 CD1 PHE A 28 -9.383 0.096 9.591 1.00 0.00 C ATOM 415 CD2 PHE A 28 -10.091 1.837 11.058 1.00 0.00 C ATOM 416 CE1 PHE A 28 -8.224 0.795 9.316 1.00 0.00 C ATOM 417 CE2 PHE A 28 -8.932 2.540 10.785 1.00 0.00 C ATOM 418 CZ PHE A 28 -7.999 2.019 9.914 1.00 0.00 C ATOM 0 H PHE A 28 -13.221 1.780 11.057 1.00 0.00 H new ATOM 0 HA PHE A 28 -12.369 0.146 8.789 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -11.901 0.062 11.785 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -11.375 -1.224 10.717 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -9.554 -0.860 9.119 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -10.818 2.251 11.741 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -7.494 0.385 8.634 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -8.758 3.497 11.254 1.00 0.00 H new ATOM 0 HZ PHE A 28 -7.094 2.567 9.700 1.00 0.00 H new ATOM 428 N VAL A 29 -13.990 -1.706 8.896 1.00 0.00 N ATOM 429 CA VAL A 29 -15.042 -2.716 8.862 1.00 0.00 C ATOM 430 C VAL A 29 -14.462 -4.106 8.624 1.00 0.00 C ATOM 431 O VAL A 29 -13.303 -4.247 8.231 1.00 0.00 O ATOM 432 CB VAL A 29 -16.084 -2.410 7.770 1.00 0.00 C ATOM 433 CG1 VAL A 29 -16.750 -1.067 8.031 1.00 0.00 C ATOM 434 CG2 VAL A 29 -15.434 -2.422 6.395 1.00 0.00 C ATOM 0 H VAL A 29 -13.399 -1.685 8.065 1.00 0.00 H new ATOM 0 HA VAL A 29 -15.533 -2.692 9.835 1.00 0.00 H new ATOM 0 HB VAL A 29 -16.849 -3.186 7.797 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -17.483 -0.867 7.250 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -17.249 -1.090 9.000 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -15.995 -0.280 8.031 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -16.185 -2.204 5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -14.649 -1.666 6.357 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -15.001 -3.404 6.206 1.00 0.00 H new ATOM 444 N ASP A 30 -15.274 -5.129 8.863 1.00 0.00 N ATOM 445 CA ASP A 30 -14.876 -6.503 8.580 1.00 0.00 C ATOM 446 C ASP A 30 -15.405 -6.954 7.222 1.00 0.00 C ATOM 447 O ASP A 30 -14.803 -7.799 6.561 1.00 0.00 O ATOM 448 CB ASP A 30 -15.374 -7.444 9.679 1.00 0.00 C ATOM 449 CG ASP A 30 -14.771 -7.182 11.053 1.00 0.00 C ATOM 450 OD1 ASP A 30 -13.567 -7.156 11.157 1.00 0.00 O ATOM 451 OD2 ASP A 30 -15.509 -6.854 11.950 1.00 0.00 O ATOM 0 H ASP A 30 -16.212 -5.033 9.252 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.787 -6.539 8.554 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -16.458 -7.359 9.749 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -15.153 -8.471 9.389 1.00 0.00 H new ATOM 456 N GLU A 31 -16.535 -6.384 6.814 1.00 0.00 N ATOM 457 CA GLU A 31 -17.146 -6.731 5.536 1.00 0.00 C ATOM 458 C GLU A 31 -16.228 -6.360 4.375 1.00 0.00 C ATOM 459 O GLU A 31 -15.627 -5.286 4.363 1.00 0.00 O ATOM 460 CB GLU A 31 -18.500 -6.035 5.383 1.00 0.00 C ATOM 461 CG GLU A 31 -19.251 -6.394 4.109 1.00 0.00 C ATOM 462 CD GLU A 31 -20.593 -5.718 4.056 1.00 0.00 C ATOM 463 OE1 GLU A 31 -20.917 -5.011 4.979 1.00 0.00 O ATOM 464 OE2 GLU A 31 -21.246 -5.817 3.044 1.00 0.00 O ATOM 0 H GLU A 31 -17.045 -5.681 7.349 1.00 0.00 H new ATOM 0 HA GLU A 31 -17.302 -7.810 5.518 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -19.123 -6.287 6.241 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -18.345 -4.956 5.407 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -18.660 -6.101 3.241 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -19.384 -7.475 4.055 1.00 0.00 H new ATOM 471 N TYR A 32 -16.124 -7.258 3.401 1.00 0.00 N ATOM 472 CA TYR A 32 -15.288 -7.021 2.231 1.00 0.00 C ATOM 473 C TYR A 32 -16.143 -6.792 0.988 1.00 0.00 C ATOM 474 O TYR A 32 -17.243 -7.331 0.869 1.00 0.00 O ATOM 475 CB TYR A 32 -14.335 -8.198 2.006 1.00 0.00 C ATOM 476 CG TYR A 32 -13.470 -8.523 3.204 1.00 0.00 C ATOM 477 CD1 TYR A 32 -12.451 -7.670 3.598 1.00 0.00 C ATOM 478 CD2 TYR A 32 -13.674 -9.684 3.935 1.00 0.00 C ATOM 479 CE1 TYR A 32 -11.657 -7.962 4.690 1.00 0.00 C ATOM 480 CE2 TYR A 32 -12.888 -9.986 5.030 1.00 0.00 C ATOM 481 CZ TYR A 32 -11.879 -9.122 5.404 1.00 0.00 C ATOM 482 OH TYR A 32 -11.091 -9.418 6.493 1.00 0.00 O ATOM 0 H TYR A 32 -16.608 -8.156 3.399 1.00 0.00 H new ATOM 0 HA TYR A 32 -14.699 -6.122 2.414 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -14.918 -9.080 1.741 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -13.691 -7.974 1.155 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.275 -6.761 3.042 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -14.461 -10.364 3.643 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -10.867 -7.286 4.983 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -13.062 -10.893 5.590 1.00 0.00 H new ATOM 0 HH TYR A 32 -10.146 -9.343 6.243 1.00 0.00 H new ATOM 492 N ASP A 33 -15.628 -5.988 0.064 1.00 0.00 N ATOM 493 CA ASP A 33 -16.355 -5.662 -1.158 1.00 0.00 C ATOM 494 C ASP A 33 -16.164 -6.750 -2.209 1.00 0.00 C ATOM 495 O ASP A 33 -15.079 -7.311 -2.370 1.00 0.00 O ATOM 496 CB ASP A 33 -15.901 -4.308 -1.709 1.00 0.00 C ATOM 497 CG ASP A 33 -16.283 -3.116 -0.843 1.00 0.00 C ATOM 498 OD1 ASP A 33 -17.414 -3.049 -0.423 1.00 0.00 O ATOM 499 OD2 ASP A 33 -15.407 -2.368 -0.478 1.00 0.00 O ATOM 0 H ASP A 33 -14.710 -5.550 0.138 1.00 0.00 H new ATOM 0 HA ASP A 33 -17.416 -5.602 -0.914 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -14.818 -4.323 -1.828 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -16.329 -4.172 -2.702 1.00 0.00 H new ATOM 504 N PRO A 34 -17.243 -7.058 -2.944 1.00 0.00 N ATOM 505 CA PRO A 34 -17.188 -7.981 -4.083 1.00 0.00 C ATOM 506 C PRO A 34 -16.391 -7.411 -5.252 1.00 0.00 C ATOM 507 O PRO A 34 -16.165 -6.204 -5.332 1.00 0.00 O ATOM 508 CB PRO A 34 -18.659 -8.200 -4.451 1.00 0.00 C ATOM 509 CG PRO A 34 -19.340 -6.944 -4.028 1.00 0.00 C ATOM 510 CD PRO A 34 -18.625 -6.505 -2.778 1.00 0.00 C ATOM 0 HA PRO A 34 -16.675 -8.910 -3.834 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -18.779 -8.376 -5.520 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -19.072 -9.068 -3.937 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.277 -6.182 -4.805 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -20.399 -7.117 -3.835 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.613 -5.419 -2.685 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.108 -6.897 -1.883 1.00 0.00 H new ATOM 518 N SER A 35 -15.968 -8.288 -6.156 1.00 0.00 N ATOM 519 CA SER A 35 -15.231 -7.867 -7.342 1.00 0.00 C ATOM 520 C SER A 35 -15.961 -6.738 -8.063 1.00 0.00 C ATOM 521 O SER A 35 -15.335 -5.830 -8.610 1.00 0.00 O ATOM 522 CB SER A 35 -15.022 -9.045 -8.274 1.00 0.00 C ATOM 523 OG SER A 35 -14.134 -9.988 -7.741 1.00 0.00 O ATOM 0 H SER A 35 -16.123 -9.294 -6.090 1.00 0.00 H new ATOM 0 HA SER A 35 -14.257 -7.492 -7.027 1.00 0.00 H new ATOM 0 HB2 SER A 35 -15.981 -9.523 -8.474 1.00 0.00 H new ATOM 0 HB3 SER A 35 -14.639 -8.687 -9.230 1.00 0.00 H new ATOM 0 HG SER A 35 -14.368 -10.881 -8.070 1.00 0.00 H new ATOM 529 N ILE A 36 -17.288 -6.801 -8.059 1.00 0.00 N ATOM 530 CA ILE A 36 -18.105 -5.757 -8.665 1.00 0.00 C ATOM 531 C ILE A 36 -18.124 -4.503 -7.798 1.00 0.00 C ATOM 532 O ILE A 36 -18.467 -4.558 -6.617 1.00 0.00 O ATOM 533 CB ILE A 36 -19.550 -6.233 -8.897 1.00 0.00 C ATOM 534 CG1 ILE A 36 -19.575 -7.401 -9.886 1.00 0.00 C ATOM 535 CG2 ILE A 36 -20.413 -5.087 -9.401 1.00 0.00 C ATOM 536 CD1 ILE A 36 -20.920 -8.082 -9.994 1.00 0.00 C ATOM 0 H ILE A 36 -17.821 -7.565 -7.642 1.00 0.00 H new ATOM 0 HA ILE A 36 -17.653 -5.522 -9.629 1.00 0.00 H new ATOM 0 HB ILE A 36 -19.958 -6.578 -7.947 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -19.283 -7.037 -10.871 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -18.829 -8.136 -9.584 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -21.432 -5.441 -9.560 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -20.419 -4.284 -8.664 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -20.008 -4.713 -10.341 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.858 -8.898 -10.713 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.207 -8.478 -9.020 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -21.667 -7.361 -10.327 1.00 0.00 H new ATOM 548 N GLU A 37 -17.756 -3.372 -8.393 1.00 0.00 N ATOM 549 CA GLU A 37 -17.629 -2.125 -7.650 1.00 0.00 C ATOM 550 C GLU A 37 -16.646 -2.278 -6.493 1.00 0.00 C ATOM 551 O GLU A 37 -16.965 -1.962 -5.347 1.00 0.00 O ATOM 552 CB GLU A 37 -18.994 -1.670 -7.127 1.00 0.00 C ATOM 553 CG GLU A 37 -20.005 -1.337 -8.215 1.00 0.00 C ATOM 554 CD GLU A 37 -21.328 -0.934 -7.626 1.00 0.00 C ATOM 555 OE1 GLU A 37 -21.424 -0.859 -6.425 1.00 0.00 O ATOM 556 OE2 GLU A 37 -22.211 -0.593 -8.378 1.00 0.00 O ATOM 0 H GLU A 37 -17.541 -3.295 -9.387 1.00 0.00 H new ATOM 0 HA GLU A 37 -17.243 -1.365 -8.330 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -19.406 -2.455 -6.493 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -18.854 -0.792 -6.497 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -19.620 -0.529 -8.837 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -20.142 -2.202 -8.864 1.00 0.00 H new ATOM 563 N ASP A 38 -15.450 -2.765 -6.801 1.00 0.00 N ATOM 564 CA ASP A 38 -14.429 -2.989 -5.784 1.00 0.00 C ATOM 565 C ASP A 38 -13.560 -1.748 -5.604 1.00 0.00 C ATOM 566 O ASP A 38 -13.306 -1.313 -4.481 1.00 0.00 O ATOM 567 CB ASP A 38 -13.560 -4.194 -6.148 1.00 0.00 C ATOM 568 CG ASP A 38 -12.991 -4.156 -7.561 1.00 0.00 C ATOM 569 OD1 ASP A 38 -13.371 -3.287 -8.309 1.00 0.00 O ATOM 570 OD2 ASP A 38 -12.073 -4.892 -7.830 1.00 0.00 O ATOM 0 H ASP A 38 -15.163 -3.013 -7.748 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.934 -3.196 -4.841 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -12.735 -4.259 -5.439 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -14.152 -5.102 -6.032 1.00 0.00 H new ATOM 575 N SER A 39 -13.105 -1.184 -6.719 1.00 0.00 N ATOM 576 CA SER A 39 -12.236 -0.013 -6.683 1.00 0.00 C ATOM 577 C SER A 39 -13.039 1.250 -6.391 1.00 0.00 C ATOM 578 O SER A 39 -14.199 1.367 -6.786 1.00 0.00 O ATOM 579 CB SER A 39 -11.488 0.124 -7.995 1.00 0.00 C ATOM 580 OG SER A 39 -10.681 -0.990 -8.259 1.00 0.00 O ATOM 0 H SER A 39 -13.324 -1.519 -7.657 1.00 0.00 H new ATOM 0 HA SER A 39 -11.512 -0.146 -5.879 1.00 0.00 H new ATOM 0 HB2 SER A 39 -12.203 0.254 -8.808 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.869 1.021 -7.967 1.00 0.00 H new ATOM 0 HG SER A 39 -10.627 -1.133 -9.227 1.00 0.00 H new ATOM 586 N TYR A 40 -12.413 2.194 -5.695 1.00 0.00 N ATOM 587 CA TYR A 40 -13.098 3.407 -5.266 1.00 0.00 C ATOM 588 C TYR A 40 -12.250 4.642 -5.559 1.00 0.00 C ATOM 589 O TYR A 40 -11.025 4.561 -5.648 1.00 0.00 O ATOM 590 CB TYR A 40 -13.430 3.337 -3.774 1.00 0.00 C ATOM 591 CG TYR A 40 -14.478 2.302 -3.428 1.00 0.00 C ATOM 592 CD1 TYR A 40 -15.828 2.572 -3.601 1.00 0.00 C ATOM 593 CD2 TYR A 40 -14.116 1.060 -2.928 1.00 0.00 C ATOM 594 CE1 TYR A 40 -16.789 1.631 -3.286 1.00 0.00 C ATOM 595 CE2 TYR A 40 -15.068 0.111 -2.611 1.00 0.00 C ATOM 596 CZ TYR A 40 -16.406 0.401 -2.792 1.00 0.00 C ATOM 597 OH TYR A 40 -17.359 -0.539 -2.476 1.00 0.00 O ATOM 0 H TYR A 40 -11.433 2.142 -5.417 1.00 0.00 H new ATOM 0 HA TYR A 40 -14.028 3.486 -5.828 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -12.518 3.117 -3.219 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -13.776 4.316 -3.442 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -16.132 3.533 -3.988 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.070 0.831 -2.784 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -17.836 1.857 -3.426 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.768 -0.852 -2.224 1.00 0.00 H new ATOM 0 HH TYR A 40 -17.454 -1.171 -3.219 1.00 0.00 H new ATOM 607 N ARG A 41 -12.912 5.785 -5.705 1.00 0.00 N ATOM 608 CA ARG A 41 -12.218 7.063 -5.799 1.00 0.00 C ATOM 609 C ARG A 41 -12.634 7.992 -4.661 1.00 0.00 C ATOM 610 O ARG A 41 -13.792 8.001 -4.244 1.00 0.00 O ATOM 611 CB ARG A 41 -12.406 7.721 -7.158 1.00 0.00 C ATOM 612 CG ARG A 41 -11.763 6.982 -8.321 1.00 0.00 C ATOM 613 CD ARG A 41 -12.125 7.514 -9.660 1.00 0.00 C ATOM 614 NE ARG A 41 -11.454 6.859 -10.770 1.00 0.00 N ATOM 615 CZ ARG A 41 -11.803 6.997 -12.064 1.00 0.00 C ATOM 616 NH1 ARG A 41 -12.834 7.734 -12.413 1.00 0.00 N ATOM 617 NH2 ARG A 41 -11.093 6.353 -12.974 1.00 0.00 N ATOM 0 H ARG A 41 -13.928 5.852 -5.761 1.00 0.00 H new ATOM 0 HA ARG A 41 -11.151 6.863 -5.697 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -13.474 7.818 -7.354 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -11.996 8.730 -7.117 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.680 7.023 -8.208 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -12.049 5.931 -8.271 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -13.202 7.419 -9.796 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -11.893 8.579 -9.689 1.00 0.00 H new ATOM 0 HE ARG A 41 -10.663 6.252 -10.554 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -13.384 8.212 -11.699 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -13.084 7.828 -13.397 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -10.305 5.771 -12.688 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -11.333 6.438 -13.962 1.00 0.00 H new ATOM 631 N LYS A 42 -11.680 8.774 -4.165 1.00 0.00 N ATOM 632 CA LYS A 42 -11.923 9.641 -3.019 1.00 0.00 C ATOM 633 C LYS A 42 -11.190 10.970 -3.177 1.00 0.00 C ATOM 634 O LYS A 42 -9.994 10.997 -3.463 1.00 0.00 O ATOM 635 CB LYS A 42 -11.493 8.952 -1.723 1.00 0.00 C ATOM 636 CG LYS A 42 -11.819 9.733 -0.457 1.00 0.00 C ATOM 637 CD LYS A 42 -13.291 9.609 -0.093 1.00 0.00 C ATOM 638 CE LYS A 42 -13.595 10.297 1.229 1.00 0.00 C ATOM 639 NZ LYS A 42 -15.004 10.082 1.658 1.00 0.00 N ATOM 0 H LYS A 42 -10.732 8.824 -4.539 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.993 9.842 -2.970 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -11.975 7.976 -1.667 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.418 8.775 -1.759 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -11.207 9.366 0.367 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.565 10.783 -0.600 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -13.901 10.048 -0.882 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -13.564 8.556 -0.028 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -12.920 9.920 1.998 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -13.404 11.366 1.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -15.245 10.758 2.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -15.639 10.225 0.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -15.114 9.112 2.017 1.00 0.00 H new ATOM 653 N GLN A 43 -11.915 12.067 -2.988 1.00 0.00 N ATOM 654 CA GLN A 43 -11.325 13.398 -3.078 1.00 0.00 C ATOM 655 C GLN A 43 -10.575 13.749 -1.798 1.00 0.00 C ATOM 656 O GLN A 43 -11.150 13.749 -0.709 1.00 0.00 O ATOM 657 CB GLN A 43 -12.405 14.448 -3.351 1.00 0.00 C ATOM 658 CG GLN A 43 -11.872 15.859 -3.524 1.00 0.00 C ATOM 659 CD GLN A 43 -12.961 16.848 -3.894 1.00 0.00 C ATOM 660 OE1 GLN A 43 -14.134 16.484 -4.019 1.00 0.00 O ATOM 661 NE2 GLN A 43 -12.579 18.107 -4.076 1.00 0.00 N ATOM 0 H GLN A 43 -12.912 12.061 -2.772 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.617 13.394 -3.907 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -12.951 14.165 -4.251 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -13.120 14.440 -2.528 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -11.393 16.179 -2.599 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -11.104 15.862 -4.298 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -11.598 18.364 -3.962 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -13.266 18.817 -4.329 1.00 0.00 H new ATOM 670 N VAL A 44 -9.287 14.049 -1.936 1.00 0.00 N ATOM 671 CA VAL A 44 -8.426 14.272 -0.780 1.00 0.00 C ATOM 672 C VAL A 44 -7.452 15.417 -1.033 1.00 0.00 C ATOM 673 O VAL A 44 -7.191 15.783 -2.179 1.00 0.00 O ATOM 674 CB VAL A 44 -7.630 13.005 -0.416 1.00 0.00 C ATOM 675 CG1 VAL A 44 -8.570 11.892 0.021 1.00 0.00 C ATOM 676 CG2 VAL A 44 -6.781 12.551 -1.594 1.00 0.00 C ATOM 0 H VAL A 44 -8.817 14.143 -2.836 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.079 14.531 0.054 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.967 13.243 0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.990 11.005 0.274 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.137 12.216 0.894 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.257 11.656 -0.791 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.226 11.655 -1.318 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.427 12.331 -2.444 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -6.082 13.342 -1.865 1.00 0.00 H new ATOM 686 N VAL A 45 -6.916 15.979 0.046 1.00 0.00 N ATOM 687 CA VAL A 45 -5.860 16.978 -0.059 1.00 0.00 C ATOM 688 C VAL A 45 -4.497 16.373 0.260 1.00 0.00 C ATOM 689 O VAL A 45 -4.254 15.917 1.378 1.00 0.00 O ATOM 690 CB VAL A 45 -6.115 18.171 0.882 1.00 0.00 C ATOM 691 CG1 VAL A 45 -4.980 19.179 0.783 1.00 0.00 C ATOM 692 CG2 VAL A 45 -7.444 18.833 0.555 1.00 0.00 C ATOM 0 H VAL A 45 -7.196 15.759 1.002 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.864 17.334 -1.089 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.158 17.799 1.906 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.176 20.015 1.454 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -4.042 18.700 1.065 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.907 19.545 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.608 19.673 1.230 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.428 19.191 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.250 18.109 0.675 1.00 0.00 H new ATOM 702 N ILE A 46 -3.611 16.371 -0.731 1.00 0.00 N ATOM 703 CA ILE A 46 -2.290 15.776 -0.572 1.00 0.00 C ATOM 704 C ILE A 46 -1.195 16.742 -1.013 1.00 0.00 C ATOM 705 O ILE A 46 -1.255 17.308 -2.105 1.00 0.00 O ATOM 706 CB ILE A 46 -2.161 14.467 -1.372 1.00 0.00 C ATOM 707 CG1 ILE A 46 -3.211 13.453 -0.910 1.00 0.00 C ATOM 708 CG2 ILE A 46 -0.761 13.891 -1.228 1.00 0.00 C ATOM 709 CD1 ILE A 46 -3.280 12.211 -1.768 1.00 0.00 C ATOM 0 H ILE A 46 -3.784 16.775 -1.652 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.169 15.555 0.488 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.335 14.686 -2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.993 13.162 0.118 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.189 13.934 -0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.688 12.966 -1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -0.032 14.609 -1.604 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.559 13.685 -0.177 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -4.046 11.541 -1.378 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.529 12.490 -2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.315 11.705 -1.754 1.00 0.00 H new ATOM 721 N ASP A 47 -0.194 16.923 -0.158 1.00 0.00 N ATOM 722 CA ASP A 47 0.858 17.901 -0.410 1.00 0.00 C ATOM 723 C ASP A 47 0.303 19.321 -0.361 1.00 0.00 C ATOM 724 O ASP A 47 0.893 20.248 -0.916 1.00 0.00 O ATOM 725 CB ASP A 47 1.523 17.639 -1.763 1.00 0.00 C ATOM 726 CG ASP A 47 2.905 18.259 -1.915 1.00 0.00 C ATOM 727 OD1 ASP A 47 3.687 18.150 -1.000 1.00 0.00 O ATOM 728 OD2 ASP A 47 3.223 18.697 -2.995 1.00 0.00 O ATOM 0 H ASP A 47 -0.089 16.406 0.715 1.00 0.00 H new ATOM 0 HA ASP A 47 1.609 17.798 0.374 1.00 0.00 H new ATOM 0 HB2 ASP A 47 1.603 16.562 -1.912 1.00 0.00 H new ATOM 0 HB3 ASP A 47 0.877 18.023 -2.552 1.00 0.00 H new ATOM 733 N GLY A 48 -0.835 19.484 0.307 1.00 0.00 N ATOM 734 CA GLY A 48 -1.462 20.790 0.397 1.00 0.00 C ATOM 735 C GLY A 48 -2.331 21.099 -0.806 1.00 0.00 C ATOM 736 O GLY A 48 -3.003 22.129 -0.845 1.00 0.00 O ATOM 0 H GLY A 48 -1.334 18.735 0.787 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -2.069 20.837 1.301 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -0.691 21.554 0.490 1.00 0.00 H new ATOM 740 N GLU A 49 -2.316 20.207 -1.791 1.00 0.00 N ATOM 741 CA GLU A 49 -3.077 20.411 -3.018 1.00 0.00 C ATOM 742 C GLU A 49 -4.256 19.445 -3.096 1.00 0.00 C ATOM 743 O GLU A 49 -4.098 18.238 -2.910 1.00 0.00 O ATOM 744 CB GLU A 49 -2.174 20.245 -4.243 1.00 0.00 C ATOM 745 CG GLU A 49 -2.848 20.566 -5.569 1.00 0.00 C ATOM 746 CD GLU A 49 -1.867 20.514 -6.707 1.00 0.00 C ATOM 747 OE1 GLU A 49 -0.909 21.248 -6.675 1.00 0.00 O ATOM 748 OE2 GLU A 49 -2.014 19.662 -7.552 1.00 0.00 O ATOM 0 H GLU A 49 -1.785 19.336 -1.763 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.469 21.428 -3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.303 20.889 -4.127 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.809 19.218 -4.274 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -3.656 19.857 -5.750 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.299 21.557 -5.520 1.00 0.00 H new ATOM 755 N THR A 50 -5.439 19.986 -3.371 1.00 0.00 N ATOM 756 CA THR A 50 -6.634 19.168 -3.526 1.00 0.00 C ATOM 757 C THR A 50 -6.578 18.349 -4.811 1.00 0.00 C ATOM 758 O THR A 50 -6.322 18.887 -5.890 1.00 0.00 O ATOM 759 CB THR A 50 -7.911 20.029 -3.532 1.00 0.00 C ATOM 760 OG1 THR A 50 -7.990 20.779 -2.312 1.00 0.00 O ATOM 761 CG2 THR A 50 -9.146 19.151 -3.664 1.00 0.00 C ATOM 0 H THR A 50 -5.594 20.987 -3.491 1.00 0.00 H new ATOM 0 HA THR A 50 -6.666 18.493 -2.670 1.00 0.00 H new ATOM 0 HB THR A 50 -7.869 20.709 -4.383 1.00 0.00 H new ATOM 0 HG1 THR A 50 -8.802 21.328 -2.317 1.00 0.00 H new ATOM 0 HG21 THR A 50 -10.039 19.777 -3.666 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.095 18.589 -4.596 1.00 0.00 H new ATOM 0 HG23 THR A 50 -9.191 18.458 -2.824 1.00 0.00 H new ATOM 769 N CYS A 51 -6.819 17.049 -4.690 1.00 0.00 N ATOM 770 CA CYS A 51 -6.717 16.143 -5.828 1.00 0.00 C ATOM 771 C CYS A 51 -7.650 14.948 -5.658 1.00 0.00 C ATOM 772 O CYS A 51 -8.282 14.784 -4.613 1.00 0.00 O ATOM 773 CB CYS A 51 -5.255 15.698 -5.777 1.00 0.00 C ATOM 774 SG CYS A 51 -4.816 14.734 -4.311 1.00 0.00 S ATOM 0 H CYS A 51 -7.087 16.598 -3.815 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.998 16.606 -6.774 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -5.038 15.105 -6.665 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.618 16.581 -5.820 1.00 0.00 H new ATOM 0 HG CYS A 51 -5.643 15.010 -3.347 1.00 0.00 H new ATOM 780 N LEU A 52 -7.735 14.118 -6.691 1.00 0.00 N ATOM 781 CA LEU A 52 -8.544 12.907 -6.636 1.00 0.00 C ATOM 782 C LEU A 52 -7.668 11.672 -6.457 1.00 0.00 C ATOM 783 O LEU A 52 -6.768 11.414 -7.258 1.00 0.00 O ATOM 784 CB LEU A 52 -9.397 12.779 -7.904 1.00 0.00 C ATOM 785 CG LEU A 52 -10.315 11.551 -7.953 1.00 0.00 C ATOM 786 CD1 LEU A 52 -11.379 11.650 -6.868 1.00 0.00 C ATOM 787 CD2 LEU A 52 -10.956 11.449 -9.329 1.00 0.00 C ATOM 0 H LEU A 52 -7.253 14.262 -7.578 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.206 12.979 -5.773 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.010 13.675 -8.002 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.733 12.751 -8.768 1.00 0.00 H new ATOM 0 HG LEU A 52 -9.727 10.651 -7.773 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.025 10.773 -6.911 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.899 11.699 -5.891 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.975 12.549 -7.024 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -11.608 10.576 -9.363 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -11.542 12.347 -9.525 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -10.178 11.350 -10.086 1.00 0.00 H new ATOM 799 N LEU A 53 -7.935 10.909 -5.403 1.00 0.00 N ATOM 800 CA LEU A 53 -7.174 9.697 -5.122 1.00 0.00 C ATOM 801 C LEU A 53 -7.951 8.454 -5.544 1.00 0.00 C ATOM 802 O LEU A 53 -9.018 8.164 -5.005 1.00 0.00 O ATOM 803 CB LEU A 53 -6.820 9.627 -3.631 1.00 0.00 C ATOM 804 CG LEU A 53 -6.056 8.368 -3.201 1.00 0.00 C ATOM 805 CD1 LEU A 53 -4.714 8.301 -3.916 1.00 0.00 C ATOM 806 CD2 LEU A 53 -5.863 8.381 -1.692 1.00 0.00 C ATOM 0 H LEU A 53 -8.674 11.108 -4.728 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.251 9.731 -5.701 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -6.222 10.501 -3.374 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.741 9.690 -3.052 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.631 7.483 -3.474 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.180 7.404 -3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -4.877 8.270 -4.993 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.123 9.181 -3.664 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.320 7.486 -1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -5.294 9.266 -1.406 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.836 8.400 -1.201 1.00 0.00 H new ATOM 818 N ASP A 54 -7.408 7.725 -6.512 1.00 0.00 N ATOM 819 CA ASP A 54 -8.059 6.523 -7.021 1.00 0.00 C ATOM 820 C ASP A 54 -7.409 5.268 -6.447 1.00 0.00 C ATOM 821 O ASP A 54 -6.236 4.993 -6.703 1.00 0.00 O ATOM 822 CB ASP A 54 -8.011 6.491 -8.551 1.00 0.00 C ATOM 823 CG ASP A 54 -8.753 5.320 -9.180 1.00 0.00 C ATOM 824 OD1 ASP A 54 -9.182 4.455 -8.453 1.00 0.00 O ATOM 825 OD2 ASP A 54 -9.022 5.375 -10.356 1.00 0.00 O ATOM 0 H ASP A 54 -6.519 7.945 -6.960 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.102 6.546 -6.705 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -8.432 7.420 -8.935 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.969 6.458 -8.869 1.00 0.00 H new ATOM 830 N ILE A 55 -8.178 4.513 -5.670 1.00 0.00 N ATOM 831 CA ILE A 55 -7.671 3.300 -5.043 1.00 0.00 C ATOM 832 C ILE A 55 -8.160 2.055 -5.775 1.00 0.00 C ATOM 833 O ILE A 55 -9.357 1.766 -5.800 1.00 0.00 O ATOM 834 CB ILE A 55 -8.088 3.212 -3.563 1.00 0.00 C ATOM 835 CG1 ILE A 55 -7.639 4.466 -2.807 1.00 0.00 C ATOM 836 CG2 ILE A 55 -7.508 1.962 -2.920 1.00 0.00 C ATOM 837 CD1 ILE A 55 -6.145 4.693 -2.834 1.00 0.00 C ATOM 0 H ILE A 55 -9.154 4.720 -5.460 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.584 3.347 -5.101 1.00 0.00 H new ATOM 0 HB ILE A 55 -9.175 3.150 -3.512 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -8.137 5.335 -3.236 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.967 4.391 -1.770 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.813 1.916 -1.874 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -7.875 1.080 -3.444 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.420 1.993 -2.980 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.905 5.599 -2.278 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -5.639 3.842 -2.377 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -5.812 4.802 -3.866 1.00 0.00 H new ATOM 849 N LEU A 56 -7.227 1.320 -6.369 1.00 0.00 N ATOM 850 CA LEU A 56 -7.573 0.206 -7.245 1.00 0.00 C ATOM 851 C LEU A 56 -7.567 -1.113 -6.477 1.00 0.00 C ATOM 852 O LEU A 56 -6.524 -1.559 -6.001 1.00 0.00 O ATOM 853 CB LEU A 56 -6.602 0.139 -8.431 1.00 0.00 C ATOM 854 CG LEU A 56 -6.918 1.097 -9.587 1.00 0.00 C ATOM 855 CD1 LEU A 56 -8.390 0.997 -9.961 1.00 0.00 C ATOM 856 CD2 LEU A 56 -6.561 2.519 -9.181 1.00 0.00 C ATOM 0 H LEU A 56 -6.225 1.475 -6.260 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.581 0.372 -7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -5.596 0.351 -8.069 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.594 -0.880 -8.817 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.325 0.822 -10.459 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.604 1.681 -10.782 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.619 -0.023 -10.269 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.003 1.262 -9.099 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.786 3.199 -10.003 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.143 2.804 -8.304 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.498 2.574 -8.945 1.00 0.00 H new ATOM 868 N ASP A 57 -8.738 -1.730 -6.361 1.00 0.00 N ATOM 869 CA ASP A 57 -8.845 -3.066 -5.786 1.00 0.00 C ATOM 870 C ASP A 57 -8.896 -4.126 -6.881 1.00 0.00 C ATOM 871 O ASP A 57 -9.498 -3.918 -7.935 1.00 0.00 O ATOM 872 CB ASP A 57 -10.082 -3.169 -4.892 1.00 0.00 C ATOM 873 CG ASP A 57 -9.996 -2.363 -3.603 1.00 0.00 C ATOM 874 OD1 ASP A 57 -8.929 -1.890 -3.292 1.00 0.00 O ATOM 875 OD2 ASP A 57 -11.021 -2.095 -3.024 1.00 0.00 O ATOM 0 H ASP A 57 -9.627 -1.326 -6.658 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.958 -3.243 -5.177 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.952 -2.836 -5.457 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -10.247 -4.217 -4.641 1.00 0.00 H new ATOM 880 N THR A 58 -8.260 -5.265 -6.626 1.00 0.00 N ATOM 881 CA THR A 58 -8.213 -6.349 -7.599 1.00 0.00 C ATOM 882 C THR A 58 -9.539 -7.100 -7.650 1.00 0.00 C ATOM 883 O THR A 58 -10.269 -7.158 -6.661 1.00 0.00 O ATOM 884 CB THR A 58 -7.082 -7.345 -7.282 1.00 0.00 C ATOM 885 OG1 THR A 58 -7.264 -7.874 -5.962 1.00 0.00 O ATOM 886 CG2 THR A 58 -5.727 -6.659 -7.367 1.00 0.00 C ATOM 0 H THR A 58 -7.770 -5.461 -5.753 1.00 0.00 H new ATOM 0 HA THR A 58 -8.019 -5.892 -8.570 1.00 0.00 H new ATOM 0 HB THR A 58 -7.115 -8.153 -8.013 1.00 0.00 H new ATOM 0 HG1 THR A 58 -6.545 -8.509 -5.762 1.00 0.00 H new ATOM 0 HG21 THR A 58 -4.940 -7.378 -7.140 1.00 0.00 H new ATOM 0 HG22 THR A 58 -5.580 -6.266 -8.373 1.00 0.00 H new ATOM 0 HG23 THR A 58 -5.688 -5.840 -6.649 1.00 0.00 H new ATOM 894 N ALA A 59 -9.844 -7.673 -8.810 1.00 0.00 N ATOM 895 CA ALA A 59 -11.143 -8.296 -9.036 1.00 0.00 C ATOM 896 C ALA A 59 -11.000 -9.591 -9.828 1.00 0.00 C ATOM 897 O ALA A 59 -10.166 -9.692 -10.726 1.00 0.00 O ATOM 898 CB ALA A 59 -12.071 -7.332 -9.759 1.00 0.00 C ATOM 0 H ALA A 59 -9.210 -7.719 -9.607 1.00 0.00 H new ATOM 0 HA ALA A 59 -11.576 -8.541 -8.066 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.037 -7.810 -9.921 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -12.207 -6.435 -9.154 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -11.635 -7.059 -10.720 1.00 0.00 H new ATOM 904 N GLY A 60 -11.820 -10.581 -9.487 1.00 0.00 N ATOM 905 CA GLY A 60 -11.818 -11.832 -10.223 1.00 0.00 C ATOM 906 C GLY A 60 -10.615 -12.693 -9.899 1.00 0.00 C ATOM 907 O GLY A 60 -10.472 -13.173 -8.775 1.00 0.00 O ATOM 0 H GLY A 60 -12.485 -10.539 -8.715 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -12.729 -12.385 -9.995 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -11.832 -11.621 -11.292 1.00 0.00 H new ATOM 911 N GLN A 61 -9.747 -12.890 -10.887 1.00 0.00 N ATOM 912 CA GLN A 61 -8.581 -13.751 -10.718 1.00 0.00 C ATOM 913 C GLN A 61 -7.342 -12.929 -10.380 1.00 0.00 C ATOM 914 O GLN A 61 -7.305 -11.721 -10.614 1.00 0.00 O ATOM 915 CB GLN A 61 -8.330 -14.571 -11.986 1.00 0.00 C ATOM 916 CG GLN A 61 -9.502 -15.441 -12.408 1.00 0.00 C ATOM 917 CD GLN A 61 -9.845 -16.492 -11.369 1.00 0.00 C ATOM 918 OE1 GLN A 61 -8.984 -17.267 -10.942 1.00 0.00 O ATOM 919 NE2 GLN A 61 -11.107 -16.528 -10.959 1.00 0.00 N ATOM 0 H GLN A 61 -9.829 -12.466 -11.811 1.00 0.00 H new ATOM 0 HA GLN A 61 -8.784 -14.431 -9.890 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.084 -13.891 -12.802 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -7.459 -15.207 -11.827 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -10.374 -14.811 -12.585 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -9.266 -15.931 -13.353 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.786 -15.868 -11.339 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -11.398 -17.216 -10.264 1.00 0.00 H new ATOM 928 N GLU A 62 -6.331 -13.592 -9.828 1.00 0.00 N ATOM 929 CA GLU A 62 -5.083 -12.925 -9.474 1.00 0.00 C ATOM 930 C GLU A 62 -4.302 -12.534 -10.725 1.00 0.00 C ATOM 931 O GLU A 62 -3.764 -11.430 -10.813 1.00 0.00 O ATOM 932 CB GLU A 62 -4.229 -13.824 -8.577 1.00 0.00 C ATOM 933 CG GLU A 62 -2.942 -13.178 -8.083 1.00 0.00 C ATOM 934 CD GLU A 62 -3.228 -11.967 -7.239 1.00 0.00 C ATOM 935 OE1 GLU A 62 -4.059 -12.056 -6.368 1.00 0.00 O ATOM 936 OE2 GLU A 62 -2.538 -10.986 -7.390 1.00 0.00 O ATOM 0 H GLU A 62 -6.351 -14.590 -9.616 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.330 -12.016 -8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.823 -14.127 -7.715 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.978 -14.732 -9.126 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.369 -13.901 -7.503 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.325 -12.893 -8.935 1.00 0.00 H new ATOM 943 N GLU A 63 -4.244 -13.447 -11.690 1.00 0.00 N ATOM 944 CA GLU A 63 -3.444 -13.239 -12.891 1.00 0.00 C ATOM 945 C GLU A 63 -4.259 -12.537 -13.973 1.00 0.00 C ATOM 946 O GLU A 63 -3.703 -11.967 -14.912 1.00 0.00 O ATOM 947 CB GLU A 63 -2.906 -14.572 -13.416 1.00 0.00 C ATOM 948 CG GLU A 63 -1.925 -15.266 -12.481 1.00 0.00 C ATOM 949 CD GLU A 63 -0.708 -14.418 -12.239 1.00 0.00 C ATOM 950 OE1 GLU A 63 -0.080 -14.027 -13.193 1.00 0.00 O ATOM 951 OE2 GLU A 63 -0.469 -14.066 -11.107 1.00 0.00 O ATOM 0 H GLU A 63 -4.741 -14.337 -11.663 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.601 -12.601 -12.628 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.746 -15.241 -13.603 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.416 -14.400 -14.374 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.415 -15.482 -11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -1.625 -16.222 -12.910 1.00 0.00 H new ATOM 958 N TYR A 64 -5.579 -12.584 -13.835 1.00 0.00 N ATOM 959 CA TYR A 64 -6.473 -12.010 -14.833 1.00 0.00 C ATOM 960 C TYR A 64 -7.386 -10.961 -14.207 1.00 0.00 C ATOM 961 O TYR A 64 -8.528 -11.248 -13.848 1.00 0.00 O ATOM 962 CB TYR A 64 -7.308 -13.106 -15.499 1.00 0.00 C ATOM 963 CG TYR A 64 -6.486 -14.236 -16.079 1.00 0.00 C ATOM 964 CD1 TYR A 64 -5.856 -14.099 -17.307 1.00 0.00 C ATOM 965 CD2 TYR A 64 -6.343 -15.436 -15.398 1.00 0.00 C ATOM 966 CE1 TYR A 64 -5.104 -15.126 -17.842 1.00 0.00 C ATOM 967 CE2 TYR A 64 -5.593 -16.471 -15.923 1.00 0.00 C ATOM 968 CZ TYR A 64 -4.975 -16.311 -17.147 1.00 0.00 C ATOM 969 OH TYR A 64 -4.228 -17.339 -17.676 1.00 0.00 O ATOM 0 H TYR A 64 -6.054 -13.014 -13.041 1.00 0.00 H new ATOM 0 HA TYR A 64 -5.861 -11.524 -15.593 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -8.004 -13.515 -14.766 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -7.907 -12.661 -16.293 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -5.955 -13.173 -17.854 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -6.826 -15.564 -14.441 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -4.619 -15.002 -18.799 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.491 -17.399 -15.380 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.238 -18.101 -17.060 1.00 0.00 H new ATOM 979 N SER A 65 -6.874 -9.740 -14.079 1.00 0.00 N ATOM 980 CA SER A 65 -7.642 -8.646 -13.496 1.00 0.00 C ATOM 981 C SER A 65 -7.158 -7.301 -14.027 1.00 0.00 C ATOM 982 O SER A 65 -5.994 -6.936 -13.858 1.00 0.00 O ATOM 983 CB SER A 65 -7.545 -8.686 -11.983 1.00 0.00 C ATOM 984 OG SER A 65 -8.259 -7.641 -11.382 1.00 0.00 O ATOM 0 H SER A 65 -5.931 -9.484 -14.371 1.00 0.00 H new ATOM 0 HA SER A 65 -8.686 -8.767 -13.783 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.926 -9.641 -11.621 1.00 0.00 H new ATOM 0 HB3 SER A 65 -6.498 -8.627 -11.685 1.00 0.00 H new ATOM 0 HG SER A 65 -7.686 -7.185 -10.731 1.00 0.00 H new ATOM 990 N ALA A 66 -8.060 -6.566 -14.669 1.00 0.00 N ATOM 991 CA ALA A 66 -7.709 -5.292 -15.285 1.00 0.00 C ATOM 992 C ALA A 66 -7.230 -4.290 -14.240 1.00 0.00 C ATOM 993 O ALA A 66 -6.397 -3.432 -14.527 1.00 0.00 O ATOM 994 CB ALA A 66 -8.898 -4.731 -16.051 1.00 0.00 C ATOM 0 H ALA A 66 -9.039 -6.831 -14.776 1.00 0.00 H new ATOM 0 HA ALA A 66 -6.891 -5.468 -15.983 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.622 -3.780 -16.506 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.193 -5.434 -16.830 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -9.732 -4.577 -15.366 1.00 0.00 H new ATOM 1000 N MET A 67 -7.763 -4.406 -13.028 1.00 0.00 N ATOM 1001 CA MET A 67 -7.469 -3.448 -11.970 1.00 0.00 C ATOM 1002 C MET A 67 -5.996 -3.507 -11.577 1.00 0.00 C ATOM 1003 O MET A 67 -5.391 -2.488 -11.242 1.00 0.00 O ATOM 1004 CB MET A 67 -8.354 -3.713 -10.755 1.00 0.00 C ATOM 1005 CG MET A 67 -9.842 -3.506 -11.002 1.00 0.00 C ATOM 1006 SD MET A 67 -10.239 -1.812 -11.477 1.00 0.00 S ATOM 1007 CE MET A 67 -10.352 -1.976 -13.256 1.00 0.00 C ATOM 0 H MET A 67 -8.400 -5.154 -12.755 1.00 0.00 H new ATOM 0 HA MET A 67 -7.681 -2.447 -12.347 1.00 0.00 H new ATOM 0 HB2 MET A 67 -8.193 -4.738 -10.420 1.00 0.00 H new ATOM 0 HB3 MET A 67 -8.039 -3.059 -9.942 1.00 0.00 H new ATOM 0 HG2 MET A 67 -10.174 -4.186 -11.786 1.00 0.00 H new ATOM 0 HG3 MET A 67 -10.396 -3.765 -10.100 1.00 0.00 H new ATOM 0 HE1 MET A 67 -10.046 -1.042 -13.728 1.00 0.00 H new ATOM 0 HE2 MET A 67 -9.699 -2.782 -13.589 1.00 0.00 H new ATOM 0 HE3 MET A 67 -11.381 -2.203 -13.536 1.00 0.00 H new ATOM 1017 N ARG A 68 -5.425 -4.707 -11.617 1.00 0.00 N ATOM 1018 CA ARG A 68 -3.994 -4.879 -11.404 1.00 0.00 C ATOM 1019 C ARG A 68 -3.232 -4.783 -12.722 1.00 0.00 C ATOM 1020 O ARG A 68 -2.240 -4.061 -12.827 1.00 0.00 O ATOM 1021 CB ARG A 68 -3.673 -6.169 -10.665 1.00 0.00 C ATOM 1022 CG ARG A 68 -2.201 -6.375 -10.346 1.00 0.00 C ATOM 1023 CD ARG A 68 -1.902 -7.637 -9.622 1.00 0.00 C ATOM 1024 NE ARG A 68 -2.045 -8.841 -10.425 1.00 0.00 N ATOM 1025 CZ ARG A 68 -1.125 -9.291 -11.301 1.00 0.00 C ATOM 1026 NH1 ARG A 68 -0.014 -8.623 -11.518 1.00 0.00 N ATOM 1027 NH2 ARG A 68 -1.381 -10.410 -11.955 1.00 0.00 N ATOM 0 H ARG A 68 -5.932 -5.574 -11.795 1.00 0.00 H new ATOM 0 HA ARG A 68 -3.662 -4.063 -10.763 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -4.238 -6.187 -9.733 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -4.021 -7.010 -11.264 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.634 -6.361 -11.277 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -1.850 -5.535 -9.747 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.882 -7.589 -9.240 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.563 -7.711 -8.758 1.00 0.00 H new ATOM 0 HE ARG A 68 -2.902 -9.383 -10.318 1.00 0.00 H new ATOM 0 HH11 ARG A 68 0.162 -7.750 -11.020 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.672 -8.977 -12.184 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -2.256 -10.908 -11.790 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -0.704 -10.776 -12.625 1.00 0.00 H new ATOM 1041 N ASP A 69 -3.702 -5.515 -13.726 1.00 0.00 N ATOM 1042 CA ASP A 69 -2.918 -5.751 -14.933 1.00 0.00 C ATOM 1043 C ASP A 69 -2.684 -4.449 -15.693 1.00 0.00 C ATOM 1044 O ASP A 69 -1.567 -4.165 -16.126 1.00 0.00 O ATOM 1045 CB ASP A 69 -3.616 -6.771 -15.836 1.00 0.00 C ATOM 1046 CG ASP A 69 -3.604 -8.197 -15.301 1.00 0.00 C ATOM 1047 OD1 ASP A 69 -2.788 -8.488 -14.459 1.00 0.00 O ATOM 1048 OD2 ASP A 69 -4.505 -8.936 -15.618 1.00 0.00 O ATOM 0 H ASP A 69 -4.622 -5.955 -13.728 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.950 -6.153 -14.633 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.650 -6.460 -15.983 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.137 -6.759 -16.815 1.00 0.00 H new ATOM 1053 N GLN A 70 -3.743 -3.663 -15.849 1.00 0.00 N ATOM 1054 CA GLN A 70 -3.663 -2.414 -16.598 1.00 0.00 C ATOM 1055 C GLN A 70 -2.879 -1.363 -15.818 1.00 0.00 C ATOM 1056 O GLN A 70 -1.975 -0.724 -16.356 1.00 0.00 O ATOM 1057 CB GLN A 70 -5.065 -1.887 -16.915 1.00 0.00 C ATOM 1058 CG GLN A 70 -5.078 -0.591 -17.707 1.00 0.00 C ATOM 1059 CD GLN A 70 -6.484 -0.075 -17.950 1.00 0.00 C ATOM 1060 OE1 GLN A 70 -7.168 -0.509 -18.881 1.00 0.00 O ATOM 1061 NE2 GLN A 70 -6.923 0.860 -17.114 1.00 0.00 N ATOM 0 H GLN A 70 -4.666 -3.868 -15.467 1.00 0.00 H new ATOM 0 HA GLN A 70 -3.141 -2.616 -17.533 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -5.609 -2.648 -17.475 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -5.604 -1.734 -15.980 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -4.504 0.165 -17.171 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -4.581 -0.749 -18.664 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -6.324 1.190 -16.358 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -7.859 1.248 -17.229 1.00 0.00 H new ATOM 1070 N TYR A 71 -3.232 -1.189 -14.549 1.00 0.00 N ATOM 1071 CA TYR A 71 -2.720 -0.076 -13.760 1.00 0.00 C ATOM 1072 C TYR A 71 -1.276 -0.324 -13.337 1.00 0.00 C ATOM 1073 O TYR A 71 -0.454 0.591 -13.323 1.00 0.00 O ATOM 1074 CB TYR A 71 -3.597 0.156 -12.527 1.00 0.00 C ATOM 1075 CG TYR A 71 -4.972 0.699 -12.847 1.00 0.00 C ATOM 1076 CD1 TYR A 71 -6.001 -0.148 -13.234 1.00 0.00 C ATOM 1077 CD2 TYR A 71 -5.238 2.057 -12.758 1.00 0.00 C ATOM 1078 CE1 TYR A 71 -7.258 0.343 -13.527 1.00 0.00 C ATOM 1079 CE2 TYR A 71 -6.492 2.559 -13.049 1.00 0.00 C ATOM 1080 CZ TYR A 71 -7.500 1.698 -13.433 1.00 0.00 C ATOM 1081 OH TYR A 71 -8.751 2.193 -13.722 1.00 0.00 O ATOM 0 H TYR A 71 -3.871 -1.805 -14.045 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.746 0.817 -14.384 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.705 -0.785 -11.988 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.089 0.851 -11.858 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -5.816 -1.209 -13.307 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -4.452 2.733 -12.456 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -8.047 -0.330 -13.828 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -6.682 3.620 -12.976 1.00 0.00 H new ATOM 0 HH TYR A 71 -8.753 3.166 -13.605 1.00 0.00 H new ATOM 1091 N MET A 72 -0.974 -1.573 -12.993 1.00 0.00 N ATOM 1092 CA MET A 72 0.383 -1.956 -12.624 1.00 0.00 C ATOM 1093 C MET A 72 1.332 -1.804 -13.810 1.00 0.00 C ATOM 1094 O MET A 72 2.508 -1.483 -13.637 1.00 0.00 O ATOM 1095 CB MET A 72 0.405 -3.393 -12.107 1.00 0.00 C ATOM 1096 CG MET A 72 1.725 -3.815 -11.476 1.00 0.00 C ATOM 1097 SD MET A 72 2.093 -2.908 -9.962 1.00 0.00 S ATOM 1098 CE MET A 72 0.911 -3.638 -8.833 1.00 0.00 C ATOM 0 H MET A 72 -1.651 -2.335 -12.962 1.00 0.00 H new ATOM 0 HA MET A 72 0.722 -1.291 -11.829 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.390 -3.514 -11.371 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.180 -4.067 -12.933 1.00 0.00 H new ATOM 0 HG2 MET A 72 1.694 -4.882 -11.257 1.00 0.00 H new ATOM 0 HG3 MET A 72 2.532 -3.660 -12.193 1.00 0.00 H new ATOM 0 HE1 MET A 72 1.172 -3.370 -7.809 1.00 0.00 H new ATOM 0 HE2 MET A 72 -0.088 -3.267 -9.062 1.00 0.00 H new ATOM 0 HE3 MET A 72 0.928 -4.723 -8.940 1.00 0.00 H new ATOM 1108 N ARG A 73 0.814 -2.036 -15.011 1.00 0.00 N ATOM 1109 CA ARG A 73 1.598 -1.863 -16.228 1.00 0.00 C ATOM 1110 C ARG A 73 2.014 -0.405 -16.404 1.00 0.00 C ATOM 1111 O ARG A 73 3.083 -0.114 -16.940 1.00 0.00 O ATOM 1112 CB ARG A 73 0.875 -2.392 -17.458 1.00 0.00 C ATOM 1113 CG ARG A 73 1.670 -2.310 -18.751 1.00 0.00 C ATOM 1114 CD ARG A 73 1.017 -2.964 -19.914 1.00 0.00 C ATOM 1115 NE ARG A 73 1.740 -2.825 -21.168 1.00 0.00 N ATOM 1116 CZ ARG A 73 1.286 -3.250 -22.364 1.00 0.00 C ATOM 1117 NH1 ARG A 73 0.133 -3.873 -22.468 1.00 0.00 N ATOM 1118 NH2 ARG A 73 2.043 -3.045 -23.427 1.00 0.00 N ATOM 0 H ARG A 73 -0.146 -2.344 -15.168 1.00 0.00 H new ATOM 0 HA ARG A 73 2.503 -2.461 -16.119 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.602 -3.432 -17.282 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.054 -1.835 -17.583 1.00 0.00 H new ATOM 0 HG2 ARG A 73 1.845 -1.261 -18.990 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.646 -2.768 -18.593 1.00 0.00 H new ATOM 0 HD2 ARG A 73 0.893 -4.025 -19.696 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.018 -2.545 -20.037 1.00 0.00 H new ATOM 0 HE ARG A 73 2.655 -2.374 -21.141 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.433 -4.041 -21.636 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.196 -4.188 -23.381 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.944 -2.577 -23.329 1.00 0.00 H new ATOM 0 HH22 ARG A 73 1.727 -3.355 -24.346 1.00 0.00 H new ATOM 1132 N THR A 74 1.160 0.508 -15.950 1.00 0.00 N ATOM 1133 CA THR A 74 1.478 1.930 -15.974 1.00 0.00 C ATOM 1134 C THR A 74 2.561 2.269 -14.958 1.00 0.00 C ATOM 1135 O THR A 74 3.464 3.058 -15.238 1.00 0.00 O ATOM 1136 CB THR A 74 0.234 2.792 -15.690 1.00 0.00 C ATOM 1137 OG1 THR A 74 -0.746 2.574 -16.714 1.00 0.00 O ATOM 1138 CG2 THR A 74 0.604 4.267 -15.654 1.00 0.00 C ATOM 0 H THR A 74 0.243 0.287 -15.561 1.00 0.00 H new ATOM 0 HA THR A 74 1.842 2.153 -16.977 1.00 0.00 H new ATOM 0 HB THR A 74 -0.174 2.506 -14.720 1.00 0.00 H new ATOM 0 HG1 THR A 74 -1.538 3.122 -16.531 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.287 4.861 -15.452 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.340 4.438 -14.868 1.00 0.00 H new ATOM 0 HG23 THR A 74 1.025 4.560 -16.616 1.00 0.00 H new ATOM 1146 N GLY A 75 2.467 1.667 -13.776 1.00 0.00 N ATOM 1147 CA GLY A 75 3.521 1.806 -12.787 1.00 0.00 C ATOM 1148 C GLY A 75 3.465 3.138 -12.065 1.00 0.00 C ATOM 1149 O GLY A 75 4.483 3.627 -11.574 1.00 0.00 O ATOM 0 H GLY A 75 1.681 1.086 -13.486 1.00 0.00 H new ATOM 0 HA2 GLY A 75 3.442 0.998 -12.060 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.490 1.701 -13.275 1.00 0.00 H new ATOM 1153 N GLU A 76 2.275 3.726 -12.002 1.00 0.00 N ATOM 1154 CA GLU A 76 2.095 5.015 -11.345 1.00 0.00 C ATOM 1155 C GLU A 76 2.317 4.894 -9.840 1.00 0.00 C ATOM 1156 O GLU A 76 2.859 5.799 -9.206 1.00 0.00 O ATOM 1157 CB GLU A 76 0.699 5.573 -11.630 1.00 0.00 C ATOM 1158 CG GLU A 76 0.555 7.067 -11.377 1.00 0.00 C ATOM 1159 CD GLU A 76 -0.714 7.603 -11.979 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -0.979 7.308 -13.120 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -1.475 8.215 -11.266 1.00 0.00 O ATOM 0 H GLU A 76 1.422 3.331 -12.397 1.00 0.00 H new ATOM 0 HA GLU A 76 2.837 5.705 -11.748 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.444 5.367 -12.669 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -0.025 5.041 -11.012 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.560 7.258 -10.304 1.00 0.00 H new ATOM 0 HG3 GLU A 76 1.411 7.594 -11.799 1.00 0.00 H new ATOM 1168 N GLY A 77 1.892 3.768 -9.273 1.00 0.00 N ATOM 1169 CA GLY A 77 2.172 3.489 -7.877 1.00 0.00 C ATOM 1170 C GLY A 77 1.293 2.387 -7.318 1.00 0.00 C ATOM 1171 O GLY A 77 0.204 2.131 -7.834 1.00 0.00 O ATOM 0 H GLY A 77 1.359 3.045 -9.756 1.00 0.00 H new ATOM 0 HA2 GLY A 77 3.219 3.204 -7.769 1.00 0.00 H new ATOM 0 HA3 GLY A 77 2.027 4.397 -7.292 1.00 0.00 H new ATOM 1175 N PHE A 78 1.766 1.732 -6.263 1.00 0.00 N ATOM 1176 CA PHE A 78 0.986 0.700 -5.592 1.00 0.00 C ATOM 1177 C PHE A 78 1.434 0.536 -4.142 1.00 0.00 C ATOM 1178 O PHE A 78 2.598 0.761 -3.812 1.00 0.00 O ATOM 1179 CB PHE A 78 1.106 -0.631 -6.337 1.00 0.00 C ATOM 1180 CG PHE A 78 2.503 -1.181 -6.373 1.00 0.00 C ATOM 1181 CD1 PHE A 78 3.381 -0.820 -7.384 1.00 0.00 C ATOM 1182 CD2 PHE A 78 2.943 -2.062 -5.396 1.00 0.00 C ATOM 1183 CE1 PHE A 78 4.666 -1.326 -7.419 1.00 0.00 C ATOM 1184 CE2 PHE A 78 4.228 -2.569 -5.428 1.00 0.00 C ATOM 1185 CZ PHE A 78 5.089 -2.201 -6.440 1.00 0.00 C ATOM 0 H PHE A 78 2.686 1.898 -5.855 1.00 0.00 H new ATOM 0 HA PHE A 78 -0.059 1.010 -5.595 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.450 -1.362 -5.864 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.751 -0.498 -7.359 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.056 -0.135 -8.153 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.273 -2.355 -4.601 1.00 0.00 H new ATOM 0 HE1 PHE A 78 5.339 -1.037 -8.212 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.558 -3.253 -4.660 1.00 0.00 H new ATOM 0 HZ PHE A 78 6.093 -2.597 -6.466 1.00 0.00 H new ATOM 1195 N LEU A 79 0.501 0.143 -3.281 1.00 0.00 N ATOM 1196 CA LEU A 79 0.783 0.008 -1.856 1.00 0.00 C ATOM 1197 C LEU A 79 0.807 -1.460 -1.442 1.00 0.00 C ATOM 1198 O LEU A 79 -0.075 -2.234 -1.815 1.00 0.00 O ATOM 1199 CB LEU A 79 -0.256 0.781 -1.034 1.00 0.00 C ATOM 1200 CG LEU A 79 0.030 0.860 0.471 1.00 0.00 C ATOM 1201 CD1 LEU A 79 1.292 1.675 0.720 1.00 0.00 C ATOM 1202 CD2 LEU A 79 -1.162 1.481 1.184 1.00 0.00 C ATOM 0 H LEU A 79 -0.457 -0.088 -3.545 1.00 0.00 H new ATOM 0 HA LEU A 79 1.769 0.430 -1.661 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.326 1.795 -1.428 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.230 0.314 -1.179 1.00 0.00 H new ATOM 0 HG LEU A 79 0.189 -0.144 0.864 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.487 1.726 1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.136 1.201 0.220 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.157 2.683 0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.958 1.537 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.336 2.484 0.795 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.047 0.868 1.015 1.00 0.00 H new ATOM 1214 N CYS A 80 1.819 -1.834 -0.668 1.00 0.00 N ATOM 1215 CA CYS A 80 1.917 -3.189 -0.140 1.00 0.00 C ATOM 1216 C CYS A 80 1.524 -3.230 1.332 1.00 0.00 C ATOM 1217 O CYS A 80 2.188 -2.635 2.180 1.00 0.00 O ATOM 1218 CB CYS A 80 3.401 -3.514 -0.312 1.00 0.00 C ATOM 1219 SG CYS A 80 3.972 -3.523 -2.028 1.00 0.00 S ATOM 0 H CYS A 80 2.583 -1.218 -0.392 1.00 0.00 H new ATOM 0 HA CYS A 80 1.256 -3.895 -0.643 1.00 0.00 H new ATOM 0 HB2 CYS A 80 3.987 -2.786 0.249 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.600 -4.491 0.129 1.00 0.00 H new ATOM 0 HG CYS A 80 5.240 -3.806 -2.062 1.00 0.00 H new ATOM 1225 N VAL A 81 0.437 -3.935 1.631 1.00 0.00 N ATOM 1226 CA VAL A 81 -0.053 -4.043 2.999 1.00 0.00 C ATOM 1227 C VAL A 81 -0.022 -5.489 3.482 1.00 0.00 C ATOM 1228 O VAL A 81 -0.306 -6.415 2.722 1.00 0.00 O ATOM 1229 CB VAL A 81 -1.488 -3.499 3.131 1.00 0.00 C ATOM 1230 CG1 VAL A 81 -1.537 -2.029 2.741 1.00 0.00 C ATOM 1231 CG2 VAL A 81 -2.446 -4.308 2.271 1.00 0.00 C ATOM 0 H VAL A 81 -0.121 -4.440 0.943 1.00 0.00 H new ATOM 0 HA VAL A 81 0.611 -3.441 3.619 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.797 -3.592 4.172 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.558 -1.660 2.840 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.880 -1.457 3.396 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.209 -1.916 1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.455 -3.909 2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.139 -4.246 1.227 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.432 -5.350 2.592 1.00 0.00 H new ATOM 1241 N PHE A 82 0.325 -5.675 4.752 1.00 0.00 N ATOM 1242 CA PHE A 82 0.350 -7.005 5.349 1.00 0.00 C ATOM 1243 C PHE A 82 -0.092 -6.955 6.809 1.00 0.00 C ATOM 1244 O PHE A 82 -0.160 -5.884 7.411 1.00 0.00 O ATOM 1245 CB PHE A 82 1.749 -7.614 5.241 1.00 0.00 C ATOM 1246 CG PHE A 82 2.767 -6.955 6.127 1.00 0.00 C ATOM 1247 CD1 PHE A 82 3.464 -5.836 5.695 1.00 0.00 C ATOM 1248 CD2 PHE A 82 3.030 -7.452 7.395 1.00 0.00 C ATOM 1249 CE1 PHE A 82 4.401 -5.229 6.508 1.00 0.00 C ATOM 1250 CE2 PHE A 82 3.967 -6.846 8.211 1.00 0.00 C ATOM 1251 CZ PHE A 82 4.652 -5.735 7.768 1.00 0.00 C ATOM 0 H PHE A 82 0.592 -4.922 5.386 1.00 0.00 H new ATOM 0 HA PHE A 82 -0.350 -7.635 4.800 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.694 -8.673 5.492 1.00 0.00 H new ATOM 0 HB3 PHE A 82 2.085 -7.548 4.206 1.00 0.00 H new ATOM 0 HD1 PHE A 82 3.272 -5.435 4.711 1.00 0.00 H new ATOM 0 HD2 PHE A 82 2.497 -8.322 7.749 1.00 0.00 H new ATOM 0 HE1 PHE A 82 4.937 -4.359 6.158 1.00 0.00 H new ATOM 0 HE2 PHE A 82 4.162 -7.243 9.196 1.00 0.00 H new ATOM 0 HZ PHE A 82 5.384 -5.261 8.405 1.00 0.00 H new ATOM 1261 N ALA A 83 -0.393 -8.121 7.371 1.00 0.00 N ATOM 1262 CA ALA A 83 -0.779 -8.217 8.773 1.00 0.00 C ATOM 1263 C ALA A 83 0.437 -8.460 9.661 1.00 0.00 C ATOM 1264 O ALA A 83 1.244 -9.351 9.394 1.00 0.00 O ATOM 1265 CB ALA A 83 -1.805 -9.325 8.963 1.00 0.00 C ATOM 0 H ALA A 83 -0.377 -9.013 6.876 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.227 -7.268 9.068 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.084 -9.386 10.015 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.690 -9.108 8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.377 -10.276 8.646 1.00 0.00 H new ATOM 1271 N ILE A 84 0.561 -7.663 10.717 1.00 0.00 N ATOM 1272 CA ILE A 84 1.729 -7.723 11.586 1.00 0.00 C ATOM 1273 C ILE A 84 1.696 -8.970 12.465 1.00 0.00 C ATOM 1274 O ILE A 84 2.724 -9.404 12.982 1.00 0.00 O ATOM 1275 CB ILE A 84 1.831 -6.475 12.481 1.00 0.00 C ATOM 1276 CG1 ILE A 84 3.265 -6.295 12.984 1.00 0.00 C ATOM 1277 CG2 ILE A 84 0.863 -6.578 13.649 1.00 0.00 C ATOM 1278 CD1 ILE A 84 4.265 -6.002 11.889 1.00 0.00 C ATOM 0 H ILE A 84 -0.133 -6.968 10.991 1.00 0.00 H new ATOM 0 HA ILE A 84 2.604 -7.763 10.937 1.00 0.00 H new ATOM 0 HB ILE A 84 1.562 -5.600 11.889 1.00 0.00 H new ATOM 0 HG12 ILE A 84 3.286 -5.481 13.709 1.00 0.00 H new ATOM 0 HG13 ILE A 84 3.571 -7.199 13.510 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.948 -5.687 14.272 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -0.156 -6.660 13.271 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.102 -7.460 14.243 1.00 0.00 H new ATOM 0 HD11 ILE A 84 5.258 -5.887 12.324 1.00 0.00 H new ATOM 0 HD12 ILE A 84 4.275 -6.826 11.175 1.00 0.00 H new ATOM 0 HD13 ILE A 84 3.985 -5.081 11.377 1.00 0.00 H new ATOM 1290 N ASN A 85 0.507 -9.541 12.627 1.00 0.00 N ATOM 1291 CA ASN A 85 0.340 -10.738 13.443 1.00 0.00 C ATOM 1292 C ASN A 85 0.421 -11.997 12.585 1.00 0.00 C ATOM 1293 O ASN A 85 0.567 -13.104 13.102 1.00 0.00 O ATOM 1294 CB ASN A 85 -0.968 -10.709 14.213 1.00 0.00 C ATOM 1295 CG ASN A 85 -2.187 -10.799 13.338 1.00 0.00 C ATOM 1296 OD1 ASN A 85 -2.411 -9.955 12.462 1.00 0.00 O ATOM 1297 ND2 ASN A 85 -3.017 -11.769 13.624 1.00 0.00 N ATOM 0 H ASN A 85 -0.354 -9.195 12.204 1.00 0.00 H new ATOM 0 HA ASN A 85 1.156 -10.755 14.166 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -0.980 -11.536 14.923 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -1.016 -9.789 14.795 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.897 -11.854 13.115 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.785 -12.440 14.356 1.00 0.00 H new ATOM 1304 N ASN A 86 0.327 -11.819 11.272 1.00 0.00 N ATOM 1305 CA ASN A 86 0.447 -12.933 10.338 1.00 0.00 C ATOM 1306 C ASN A 86 1.883 -13.076 9.843 1.00 0.00 C ATOM 1307 O ASN A 86 2.420 -12.178 9.193 1.00 0.00 O ATOM 1308 CB ASN A 86 -0.503 -12.781 9.164 1.00 0.00 C ATOM 1309 CG ASN A 86 -0.547 -13.982 8.261 1.00 0.00 C ATOM 1310 OD1 ASN A 86 0.347 -14.836 8.287 1.00 0.00 O ATOM 1311 ND2 ASN A 86 -1.538 -14.011 7.407 1.00 0.00 N ATOM 0 H ASN A 86 0.168 -10.914 10.830 1.00 0.00 H new ATOM 0 HA ASN A 86 0.173 -13.840 10.877 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -1.506 -12.586 9.543 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.208 -11.909 8.580 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.598 -14.763 6.721 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.251 -13.281 7.428 1.00 0.00 H new ATOM 1318 N THR A 87 2.500 -14.212 10.153 1.00 0.00 N ATOM 1319 CA THR A 87 3.869 -14.478 9.729 1.00 0.00 C ATOM 1320 C THR A 87 3.960 -14.599 8.212 1.00 0.00 C ATOM 1321 O THR A 87 4.910 -14.114 7.596 1.00 0.00 O ATOM 1322 CB THR A 87 4.420 -15.765 10.371 1.00 0.00 C ATOM 1323 OG1 THR A 87 4.445 -15.617 11.797 1.00 0.00 O ATOM 1324 CG2 THR A 87 5.827 -16.051 9.870 1.00 0.00 C ATOM 0 H THR A 87 2.073 -14.963 10.696 1.00 0.00 H new ATOM 0 HA THR A 87 4.471 -13.632 10.061 1.00 0.00 H new ATOM 0 HB THR A 87 3.772 -16.597 10.096 1.00 0.00 H new ATOM 0 HG1 THR A 87 4.794 -16.437 12.205 1.00 0.00 H new ATOM 0 HG21 THR A 87 6.200 -16.964 10.334 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.809 -16.176 8.787 1.00 0.00 H new ATOM 0 HG23 THR A 87 6.482 -15.219 10.129 1.00 0.00 H new ATOM 1332 N LYS A 88 2.967 -15.248 7.613 1.00 0.00 N ATOM 1333 CA LYS A 88 3.019 -15.588 6.196 1.00 0.00 C ATOM 1334 C LYS A 88 2.797 -14.352 5.331 1.00 0.00 C ATOM 1335 O LYS A 88 3.160 -14.333 4.154 1.00 0.00 O ATOM 1336 CB LYS A 88 1.979 -16.660 5.863 1.00 0.00 C ATOM 1337 CG LYS A 88 2.262 -18.024 6.479 1.00 0.00 C ATOM 1338 CD LYS A 88 1.181 -19.030 6.116 1.00 0.00 C ATOM 1339 CE LYS A 88 1.482 -20.403 6.699 1.00 0.00 C ATOM 1340 NZ LYS A 88 0.434 -21.399 6.348 1.00 0.00 N ATOM 0 H LYS A 88 2.116 -15.549 8.087 1.00 0.00 H new ATOM 0 HA LYS A 88 4.012 -15.984 5.981 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.001 -16.318 6.202 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.921 -16.769 4.780 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.230 -18.387 6.134 1.00 0.00 H new ATOM 0 HG3 LYS A 88 2.325 -17.930 7.563 1.00 0.00 H new ATOM 0 HD2 LYS A 88 0.217 -18.680 6.485 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.100 -19.103 5.032 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.448 -20.749 6.332 1.00 0.00 H new ATOM 0 HE3 LYS A 88 1.561 -20.327 7.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.677 -22.320 6.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.484 -21.083 6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.375 -21.491 5.314 1.00 0.00 H new ATOM 1354 N SER A 89 2.201 -13.321 5.922 1.00 0.00 N ATOM 1355 CA SER A 89 1.797 -12.139 5.169 1.00 0.00 C ATOM 1356 C SER A 89 3.007 -11.456 4.540 1.00 0.00 C ATOM 1357 O SER A 89 2.890 -10.779 3.517 1.00 0.00 O ATOM 1358 CB SER A 89 1.052 -11.174 6.071 1.00 0.00 C ATOM 1359 OG SER A 89 1.884 -10.624 7.055 1.00 0.00 O ATOM 0 H SER A 89 1.987 -13.280 6.919 1.00 0.00 H new ATOM 0 HA SER A 89 1.131 -12.454 4.366 1.00 0.00 H new ATOM 0 HB2 SER A 89 0.624 -10.372 5.469 1.00 0.00 H new ATOM 0 HB3 SER A 89 0.221 -11.693 6.548 1.00 0.00 H new ATOM 0 HG SER A 89 1.943 -11.240 7.815 1.00 0.00 H new ATOM 1365 N PHE A 90 4.170 -11.638 5.158 1.00 0.00 N ATOM 1366 CA PHE A 90 5.413 -11.092 4.624 1.00 0.00 C ATOM 1367 C PHE A 90 5.732 -11.700 3.261 1.00 0.00 C ATOM 1368 O PHE A 90 6.218 -11.014 2.364 1.00 0.00 O ATOM 1369 CB PHE A 90 6.568 -11.338 5.596 1.00 0.00 C ATOM 1370 CG PHE A 90 6.623 -10.357 6.732 1.00 0.00 C ATOM 1371 CD1 PHE A 90 7.178 -9.099 6.555 1.00 0.00 C ATOM 1372 CD2 PHE A 90 6.119 -10.690 7.981 1.00 0.00 C ATOM 1373 CE1 PHE A 90 7.231 -8.195 7.599 1.00 0.00 C ATOM 1374 CE2 PHE A 90 6.170 -9.788 9.027 1.00 0.00 C ATOM 1375 CZ PHE A 90 6.725 -8.541 8.836 1.00 0.00 C ATOM 0 H PHE A 90 4.278 -12.159 6.028 1.00 0.00 H new ATOM 0 HA PHE A 90 5.284 -10.017 4.499 1.00 0.00 H new ATOM 0 HB2 PHE A 90 6.480 -12.346 6.002 1.00 0.00 H new ATOM 0 HB3 PHE A 90 7.508 -11.296 5.046 1.00 0.00 H new ATOM 0 HD1 PHE A 90 7.574 -8.822 5.589 1.00 0.00 H new ATOM 0 HD2 PHE A 90 5.682 -11.665 8.138 1.00 0.00 H new ATOM 0 HE1 PHE A 90 7.668 -7.219 7.447 1.00 0.00 H new ATOM 0 HE2 PHE A 90 5.775 -10.060 9.994 1.00 0.00 H new ATOM 0 HZ PHE A 90 6.764 -7.836 9.653 1.00 0.00 H new ATOM 1385 N GLU A 91 5.455 -12.992 3.116 1.00 0.00 N ATOM 1386 CA GLU A 91 5.867 -13.732 1.929 1.00 0.00 C ATOM 1387 C GLU A 91 5.151 -13.210 0.687 1.00 0.00 C ATOM 1388 O GLU A 91 5.745 -13.105 -0.386 1.00 0.00 O ATOM 1389 CB GLU A 91 5.595 -15.228 2.107 1.00 0.00 C ATOM 1390 CG GLU A 91 6.498 -15.915 3.121 1.00 0.00 C ATOM 1391 CD GLU A 91 6.111 -17.356 3.310 1.00 0.00 C ATOM 1392 OE1 GLU A 91 5.129 -17.767 2.740 1.00 0.00 O ATOM 1393 OE2 GLU A 91 6.858 -18.074 3.932 1.00 0.00 O ATOM 0 H GLU A 91 4.948 -13.547 3.805 1.00 0.00 H new ATOM 0 HA GLU A 91 6.939 -13.585 1.795 1.00 0.00 H new ATOM 0 HB2 GLU A 91 4.557 -15.362 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 91 5.710 -15.723 1.143 1.00 0.00 H new ATOM 0 HG2 GLU A 91 7.534 -15.855 2.788 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.440 -15.392 4.076 1.00 0.00 H new ATOM 1400 N ASP A 92 3.871 -12.886 0.841 1.00 0.00 N ATOM 1401 CA ASP A 92 3.053 -12.451 -0.284 1.00 0.00 C ATOM 1402 C ASP A 92 3.638 -11.200 -0.932 1.00 0.00 C ATOM 1403 O ASP A 92 3.758 -11.121 -2.155 1.00 0.00 O ATOM 1404 CB ASP A 92 1.614 -12.188 0.167 1.00 0.00 C ATOM 1405 CG ASP A 92 0.796 -13.446 0.426 1.00 0.00 C ATOM 1406 OD1 ASP A 92 1.266 -14.512 0.108 1.00 0.00 O ATOM 1407 OD2 ASP A 92 -0.217 -13.348 1.077 1.00 0.00 O ATOM 0 H ASP A 92 3.379 -12.917 1.734 1.00 0.00 H new ATOM 0 HA ASP A 92 3.048 -13.251 -1.024 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.635 -11.589 1.078 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.111 -11.592 -0.594 1.00 0.00 H new ATOM 1412 N ILE A 93 4.001 -10.225 -0.104 1.00 0.00 N ATOM 1413 CA ILE A 93 4.558 -8.972 -0.597 1.00 0.00 C ATOM 1414 C ILE A 93 5.953 -9.181 -1.177 1.00 0.00 C ATOM 1415 O ILE A 93 6.318 -8.567 -2.179 1.00 0.00 O ATOM 1416 CB ILE A 93 4.626 -7.909 0.514 1.00 0.00 C ATOM 1417 CG1 ILE A 93 3.217 -7.459 0.910 1.00 0.00 C ATOM 1418 CG2 ILE A 93 5.461 -6.721 0.063 1.00 0.00 C ATOM 1419 CD1 ILE A 93 3.185 -6.536 2.107 1.00 0.00 C ATOM 0 H ILE A 93 3.919 -10.280 0.911 1.00 0.00 H new ATOM 0 HA ILE A 93 3.891 -8.618 -1.383 1.00 0.00 H new ATOM 0 HB ILE A 93 5.104 -8.351 1.388 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.755 -6.954 0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.612 -8.339 1.126 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.499 -5.979 0.861 1.00 0.00 H new ATOM 0 HG22 ILE A 93 6.472 -7.055 -0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 93 5.012 -6.277 -0.825 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.153 -6.261 2.327 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.617 -7.044 2.970 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.762 -5.637 1.889 1.00 0.00 H new ATOM 1431 N HIS A 94 6.727 -10.054 -0.541 1.00 0.00 N ATOM 1432 CA HIS A 94 8.056 -10.399 -1.034 1.00 0.00 C ATOM 1433 C HIS A 94 7.986 -10.909 -2.471 1.00 0.00 C ATOM 1434 O HIS A 94 8.839 -10.582 -3.295 1.00 0.00 O ATOM 1435 CB HIS A 94 8.714 -11.450 -0.134 1.00 0.00 C ATOM 1436 CG HIS A 94 9.071 -10.938 1.227 1.00 0.00 C ATOM 1437 ND1 HIS A 94 9.594 -11.748 2.213 1.00 0.00 N ATOM 1438 CD2 HIS A 94 8.981 -9.699 1.766 1.00 0.00 C ATOM 1439 CE1 HIS A 94 9.811 -11.028 3.300 1.00 0.00 C ATOM 1440 NE2 HIS A 94 9.446 -9.783 3.055 1.00 0.00 N ATOM 0 H HIS A 94 6.457 -10.536 0.317 1.00 0.00 H new ATOM 0 HA HIS A 94 8.665 -9.495 -1.015 1.00 0.00 H new ATOM 0 HB2 HIS A 94 8.038 -12.299 -0.028 1.00 0.00 H new ATOM 0 HB3 HIS A 94 9.616 -11.820 -0.622 1.00 0.00 H new ATOM 0 HD2 HIS A 94 8.612 -8.811 1.274 1.00 0.00 H new ATOM 0 HE1 HIS A 94 10.218 -11.396 4.230 1.00 0.00 H new ATOM 0 HE2 HIS A 94 9.501 -9.009 3.717 1.00 0.00 H new ATOM 1447 N GLN A 95 6.966 -11.710 -2.760 1.00 0.00 N ATOM 1448 CA GLN A 95 6.722 -12.173 -4.121 1.00 0.00 C ATOM 1449 C GLN A 95 6.349 -11.010 -5.034 1.00 0.00 C ATOM 1450 O GLN A 95 6.859 -10.893 -6.148 1.00 0.00 O ATOM 1451 CB GLN A 95 5.610 -13.225 -4.140 1.00 0.00 C ATOM 1452 CG GLN A 95 5.999 -14.554 -3.516 1.00 0.00 C ATOM 1453 CD GLN A 95 4.797 -15.435 -3.234 1.00 0.00 C ATOM 1454 OE1 GLN A 95 3.604 -14.867 -3.366 1.00 0.00 O flip ATOM 1455 NE2 GLN A 95 4.938 -16.616 -2.904 1.00 0.00 N flip ATOM 0 H GLN A 95 6.296 -12.052 -2.071 1.00 0.00 H new ATOM 0 HA GLN A 95 7.643 -12.624 -4.490 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.742 -12.829 -3.613 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.305 -13.397 -5.172 1.00 0.00 H new ATOM 0 HG2 GLN A 95 6.682 -15.079 -4.183 1.00 0.00 H new ATOM 0 HG3 GLN A 95 6.538 -14.372 -2.587 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.874 -17.012 -2.814 1.00 0.00 H new ATOM 0 HE22 GLN A 95 4.119 -17.196 -2.721 1.00 0.00 H new ATOM 1464 N TYR A 96 5.455 -10.152 -4.555 1.00 0.00 N ATOM 1465 CA TYR A 96 4.997 -9.009 -5.336 1.00 0.00 C ATOM 1466 C TYR A 96 6.165 -8.101 -5.709 1.00 0.00 C ATOM 1467 O TYR A 96 6.322 -7.717 -6.868 1.00 0.00 O ATOM 1468 CB TYR A 96 3.941 -8.218 -4.560 1.00 0.00 C ATOM 1469 CG TYR A 96 2.548 -8.799 -4.656 1.00 0.00 C ATOM 1470 CD1 TYR A 96 1.921 -8.945 -5.884 1.00 0.00 C ATOM 1471 CD2 TYR A 96 1.862 -9.197 -3.517 1.00 0.00 C ATOM 1472 CE1 TYR A 96 0.649 -9.474 -5.978 1.00 0.00 C ATOM 1473 CE2 TYR A 96 0.590 -9.728 -3.599 1.00 0.00 C ATOM 1474 CZ TYR A 96 -0.014 -9.865 -4.832 1.00 0.00 C ATOM 1475 OH TYR A 96 -1.282 -10.392 -4.920 1.00 0.00 O ATOM 0 H TYR A 96 5.033 -10.226 -3.629 1.00 0.00 H new ATOM 0 HA TYR A 96 4.548 -9.387 -6.255 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.234 -8.172 -3.511 1.00 0.00 H new ATOM 0 HB3 TYR A 96 3.923 -7.193 -4.931 1.00 0.00 H new ATOM 0 HD1 TYR A 96 2.436 -8.640 -6.783 1.00 0.00 H new ATOM 0 HD2 TYR A 96 2.331 -9.090 -2.550 1.00 0.00 H new ATOM 0 HE1 TYR A 96 0.175 -9.581 -6.943 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.071 -10.034 -2.703 1.00 0.00 H new ATOM 0 HH TYR A 96 -1.519 -10.518 -5.862 1.00 0.00 H new ATOM 1485 N ARG A 97 6.982 -7.762 -4.718 1.00 0.00 N ATOM 1486 CA ARG A 97 8.047 -6.784 -4.906 1.00 0.00 C ATOM 1487 C ARG A 97 9.123 -7.324 -5.842 1.00 0.00 C ATOM 1488 O ARG A 97 9.577 -6.626 -6.748 1.00 0.00 O ATOM 1489 CB ARG A 97 8.637 -6.316 -3.584 1.00 0.00 C ATOM 1490 CG ARG A 97 9.474 -5.049 -3.670 1.00 0.00 C ATOM 1491 CD ARG A 97 10.901 -5.279 -4.012 1.00 0.00 C ATOM 1492 NE ARG A 97 11.714 -4.074 -4.048 1.00 0.00 N ATOM 1493 CZ ARG A 97 11.755 -3.209 -5.080 1.00 0.00 C ATOM 1494 NH1 ARG A 97 11.063 -3.429 -6.175 1.00 0.00 N ATOM 1495 NH2 ARG A 97 12.530 -2.144 -4.971 1.00 0.00 N ATOM 0 H ARG A 97 6.927 -8.150 -3.776 1.00 0.00 H new ATOM 0 HA ARG A 97 7.603 -5.906 -5.376 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.823 -6.149 -2.878 1.00 0.00 H new ATOM 0 HB3 ARG A 97 9.255 -7.115 -3.175 1.00 0.00 H new ATOM 0 HG2 ARG A 97 9.036 -4.388 -4.418 1.00 0.00 H new ATOM 0 HG3 ARG A 97 9.421 -4.528 -2.714 1.00 0.00 H new ATOM 0 HD2 ARG A 97 11.329 -5.969 -3.285 1.00 0.00 H new ATOM 0 HD3 ARG A 97 10.954 -5.767 -4.985 1.00 0.00 H new ATOM 0 HE ARG A 97 12.294 -3.869 -3.234 1.00 0.00 H new ATOM 0 HH11 ARG A 97 10.484 -4.265 -6.253 1.00 0.00 H new ATOM 0 HH12 ARG A 97 11.105 -2.764 -6.947 1.00 0.00 H new ATOM 0 HH21 ARG A 97 13.076 -1.995 -4.122 1.00 0.00 H new ATOM 0 HH22 ARG A 97 12.582 -1.471 -5.736 1.00 0.00 H new ATOM 1509 N GLU A 98 9.526 -8.569 -5.616 1.00 0.00 N ATOM 1510 CA GLU A 98 10.603 -9.176 -6.390 1.00 0.00 C ATOM 1511 C GLU A 98 10.167 -9.414 -7.834 1.00 0.00 C ATOM 1512 O GLU A 98 10.948 -9.229 -8.766 1.00 0.00 O ATOM 1513 CB GLU A 98 11.050 -10.491 -5.749 1.00 0.00 C ATOM 1514 CG GLU A 98 11.799 -10.327 -4.434 1.00 0.00 C ATOM 1515 CD GLU A 98 12.044 -11.656 -3.775 1.00 0.00 C ATOM 1516 OE1 GLU A 98 11.612 -12.650 -4.308 1.00 0.00 O ATOM 1517 OE2 GLU A 98 12.758 -11.691 -2.801 1.00 0.00 O ATOM 0 H GLU A 98 9.124 -9.178 -4.903 1.00 0.00 H new ATOM 0 HA GLU A 98 11.446 -8.485 -6.395 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.172 -11.114 -5.578 1.00 0.00 H new ATOM 0 HB3 GLU A 98 11.688 -11.025 -6.453 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.751 -9.828 -4.615 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.225 -9.687 -3.764 1.00 0.00 H new ATOM 1524 N GLN A 99 8.916 -9.827 -8.008 1.00 0.00 N ATOM 1525 CA GLN A 99 8.366 -10.057 -9.338 1.00 0.00 C ATOM 1526 C GLN A 99 8.196 -8.743 -10.093 1.00 0.00 C ATOM 1527 O GLN A 99 8.600 -8.624 -11.250 1.00 0.00 O ATOM 1528 CB GLN A 99 7.019 -10.779 -9.246 1.00 0.00 C ATOM 1529 CG GLN A 99 6.355 -11.033 -10.588 1.00 0.00 C ATOM 1530 CD GLN A 99 4.965 -11.623 -10.444 1.00 0.00 C ATOM 1531 OE1 GLN A 99 4.795 -12.844 -10.402 1.00 0.00 O ATOM 1532 NE2 GLN A 99 3.961 -10.756 -10.372 1.00 0.00 N ATOM 0 H GLN A 99 8.264 -10.009 -7.245 1.00 0.00 H new ATOM 0 HA GLN A 99 9.069 -10.685 -9.885 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.165 -11.733 -8.739 1.00 0.00 H new ATOM 0 HB3 GLN A 99 6.345 -10.188 -8.626 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.293 -10.097 -11.143 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.975 -11.711 -11.175 1.00 0.00 H new ATOM 0 HE21 GLN A 99 4.149 -9.754 -10.411 1.00 0.00 H new ATOM 0 HE22 GLN A 99 3.003 -11.092 -10.278 1.00 0.00 H new ATOM 1541 N ILE A 100 7.598 -7.759 -9.430 1.00 0.00 N ATOM 1542 CA ILE A 100 7.421 -6.438 -10.021 1.00 0.00 C ATOM 1543 C ILE A 100 8.767 -5.777 -10.300 1.00 0.00 C ATOM 1544 O ILE A 100 8.937 -5.093 -11.309 1.00 0.00 O ATOM 1545 CB ILE A 100 6.587 -5.519 -9.110 1.00 0.00 C ATOM 1546 CG1 ILE A 100 5.135 -6.001 -9.051 1.00 0.00 C ATOM 1547 CG2 ILE A 100 6.654 -4.081 -9.600 1.00 0.00 C ATOM 1548 CD1 ILE A 100 4.312 -5.330 -7.975 1.00 0.00 C ATOM 0 H ILE A 100 7.228 -7.851 -8.484 1.00 0.00 H new ATOM 0 HA ILE A 100 6.888 -6.581 -10.961 1.00 0.00 H new ATOM 0 HB ILE A 100 7.004 -5.558 -8.104 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.664 -5.825 -10.018 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.126 -7.078 -8.883 1.00 0.00 H new ATOM 0 HG21 ILE A 100 6.059 -3.445 -8.945 1.00 0.00 H new ATOM 0 HG22 ILE A 100 7.690 -3.742 -9.592 1.00 0.00 H new ATOM 0 HG23 ILE A 100 6.261 -4.024 -10.615 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.296 -5.724 -7.996 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.758 -5.527 -7.000 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.288 -4.255 -8.152 1.00 0.00 H new ATOM 1560 N LYS A 101 9.722 -5.987 -9.400 1.00 0.00 N ATOM 1561 CA LYS A 101 11.062 -5.438 -9.564 1.00 0.00 C ATOM 1562 C LYS A 101 11.637 -5.804 -10.928 1.00 0.00 C ATOM 1563 O LYS A 101 12.248 -4.970 -11.599 1.00 0.00 O ATOM 1564 CB LYS A 101 11.985 -5.935 -8.451 1.00 0.00 C ATOM 1565 CG LYS A 101 13.419 -5.431 -8.551 1.00 0.00 C ATOM 1566 CD LYS A 101 14.275 -5.967 -7.413 1.00 0.00 C ATOM 1567 CE LYS A 101 15.721 -5.512 -7.544 1.00 0.00 C ATOM 1568 NZ LYS A 101 16.577 -6.057 -6.456 1.00 0.00 N ATOM 0 H LYS A 101 9.592 -6.534 -8.549 1.00 0.00 H new ATOM 0 HA LYS A 101 10.991 -4.352 -9.502 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.572 -5.630 -7.490 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.994 -7.025 -8.463 1.00 0.00 H new ATOM 0 HG2 LYS A 101 13.848 -5.735 -9.506 1.00 0.00 H new ATOM 0 HG3 LYS A 101 13.426 -4.341 -8.532 1.00 0.00 H new ATOM 0 HD2 LYS A 101 13.870 -5.627 -6.460 1.00 0.00 H new ATOM 0 HD3 LYS A 101 14.234 -7.056 -7.407 1.00 0.00 H new ATOM 0 HE2 LYS A 101 16.115 -5.830 -8.509 1.00 0.00 H new ATOM 0 HE3 LYS A 101 15.762 -4.423 -7.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 17.554 -5.723 -6.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 16.217 -5.733 -5.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 16.560 -7.096 -6.488 1.00 0.00 H new ATOM 1582 N ARG A 102 11.436 -7.053 -11.335 1.00 0.00 N ATOM 1583 CA ARG A 102 11.956 -7.535 -12.609 1.00 0.00 C ATOM 1584 C ARG A 102 11.299 -6.805 -13.776 1.00 0.00 C ATOM 1585 O ARG A 102 11.948 -6.498 -14.775 1.00 0.00 O ATOM 1586 CB ARG A 102 11.827 -9.044 -12.749 1.00 0.00 C ATOM 1587 CG ARG A 102 12.751 -9.851 -11.851 1.00 0.00 C ATOM 1588 CD ARG A 102 12.562 -11.322 -11.941 1.00 0.00 C ATOM 1589 NE ARG A 102 13.456 -12.097 -11.096 1.00 0.00 N ATOM 1590 CZ ARG A 102 13.435 -13.440 -10.989 1.00 0.00 C ATOM 1591 NH1 ARG A 102 12.545 -14.157 -11.639 1.00 0.00 N ATOM 1592 NH2 ARG A 102 14.318 -14.017 -10.192 1.00 0.00 N ATOM 0 H ARG A 102 10.917 -7.750 -10.801 1.00 0.00 H new ATOM 0 HA ARG A 102 13.023 -7.311 -12.629 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.797 -9.328 -12.534 1.00 0.00 H new ATOM 0 HB3 ARG A 102 12.023 -9.316 -13.786 1.00 0.00 H new ATOM 0 HG2 ARG A 102 13.784 -9.613 -12.105 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.597 -9.539 -10.818 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.532 -11.560 -11.674 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.702 -11.631 -12.977 1.00 0.00 H new ATOM 0 HE ARG A 102 14.148 -11.588 -10.545 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.857 -13.697 -12.235 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.543 -15.173 -11.547 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.991 -13.447 -9.679 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.327 -15.032 -10.090 1.00 0.00 H new ATOM 1606 N VAL A 103 10.005 -6.531 -13.642 1.00 0.00 N ATOM 1607 CA VAL A 103 9.284 -5.742 -14.634 1.00 0.00 C ATOM 1608 C VAL A 103 9.744 -4.289 -14.621 1.00 0.00 C ATOM 1609 O VAL A 103 9.814 -3.638 -15.665 1.00 0.00 O ATOM 1610 CB VAL A 103 7.762 -5.791 -14.399 1.00 0.00 C ATOM 1611 CG1 VAL A 103 7.048 -4.820 -15.326 1.00 0.00 C ATOM 1612 CG2 VAL A 103 7.237 -7.204 -14.603 1.00 0.00 C ATOM 0 H VAL A 103 9.435 -6.844 -12.856 1.00 0.00 H new ATOM 0 HA VAL A 103 9.505 -6.182 -15.606 1.00 0.00 H new ATOM 0 HB VAL A 103 7.563 -5.494 -13.369 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.974 -4.868 -15.146 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.403 -3.807 -15.135 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.255 -5.088 -16.362 1.00 0.00 H new ATOM 0 HG21 VAL A 103 6.160 -7.220 -14.433 1.00 0.00 H new ATOM 0 HG22 VAL A 103 7.448 -7.527 -15.622 1.00 0.00 H new ATOM 0 HG23 VAL A 103 7.726 -7.879 -13.900 1.00 0.00 H new ATOM 1622 N LYS A 104 10.057 -3.784 -13.433 1.00 0.00 N ATOM 1623 CA LYS A 104 10.321 -2.361 -13.251 1.00 0.00 C ATOM 1624 C LYS A 104 11.820 -2.078 -13.278 1.00 0.00 C ATOM 1625 O LYS A 104 12.264 -1.001 -12.879 1.00 0.00 O ATOM 1626 CB LYS A 104 9.712 -1.867 -11.938 1.00 0.00 C ATOM 1627 CG LYS A 104 8.200 -2.018 -11.849 1.00 0.00 C ATOM 1628 CD LYS A 104 7.501 -1.253 -12.964 1.00 0.00 C ATOM 1629 CE LYS A 104 5.991 -1.432 -12.897 1.00 0.00 C ATOM 1630 NZ LYS A 104 5.319 -0.953 -14.135 1.00 0.00 N ATOM 0 H LYS A 104 10.134 -4.339 -12.581 1.00 0.00 H new ATOM 0 HA LYS A 104 9.856 -1.822 -14.077 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.168 -2.413 -11.112 1.00 0.00 H new ATOM 0 HB3 LYS A 104 9.968 -0.816 -11.806 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.934 -3.073 -11.907 1.00 0.00 H new ATOM 0 HG3 LYS A 104 7.852 -1.654 -10.882 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.747 -0.194 -12.891 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.868 -1.599 -13.930 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.757 -2.485 -12.741 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.599 -0.888 -12.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.299 -0.853 -13.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 5.715 -0.032 -14.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 5.473 -1.639 -14.901 1.00 0.00 H new ATOM 1644 N ASP A 105 12.592 -3.049 -13.750 1.00 0.00 N ATOM 1645 CA ASP A 105 14.028 -2.865 -13.927 1.00 0.00 C ATOM 1646 C ASP A 105 14.325 -1.541 -14.624 1.00 0.00 C ATOM 1647 O ASP A 105 15.330 -0.891 -14.340 1.00 0.00 O ATOM 1648 CB ASP A 105 14.626 -4.027 -14.724 1.00 0.00 C ATOM 1649 CG ASP A 105 14.819 -5.307 -13.921 1.00 0.00 C ATOM 1650 OD1 ASP A 105 14.738 -5.247 -12.717 1.00 0.00 O ATOM 1651 OD2 ASP A 105 14.890 -6.354 -14.518 1.00 0.00 O ATOM 0 H ASP A 105 12.249 -3.972 -14.017 1.00 0.00 H new ATOM 0 HA ASP A 105 14.489 -2.845 -12.939 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.978 -4.240 -15.574 1.00 0.00 H new ATOM 0 HB3 ASP A 105 15.590 -3.717 -15.128 1.00 0.00 H new ATOM 1656 N SER A 106 13.445 -1.151 -15.541 1.00 0.00 N ATOM 1657 CA SER A 106 13.513 0.172 -16.151 1.00 0.00 C ATOM 1658 C SER A 106 12.166 0.882 -16.063 1.00 0.00 C ATOM 1659 O SER A 106 11.441 0.988 -17.053 1.00 0.00 O ATOM 1660 CB SER A 106 13.960 0.059 -17.596 1.00 0.00 C ATOM 1661 OG SER A 106 15.244 -0.492 -17.708 1.00 0.00 O ATOM 0 H SER A 106 12.677 -1.732 -15.878 1.00 0.00 H new ATOM 0 HA SER A 106 14.244 0.766 -15.602 1.00 0.00 H new ATOM 0 HB2 SER A 106 13.251 -0.559 -18.147 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.948 1.047 -18.057 1.00 0.00 H new ATOM 0 HG SER A 106 15.494 -0.549 -18.654 1.00 0.00 H new ATOM 1667 N ASP A 107 11.837 1.365 -14.870 1.00 0.00 N ATOM 1668 CA ASP A 107 10.598 2.106 -14.661 1.00 0.00 C ATOM 1669 C ASP A 107 10.630 2.853 -13.332 1.00 0.00 C ATOM 1670 O ASP A 107 11.359 2.476 -12.413 1.00 0.00 O ATOM 1671 CB ASP A 107 9.393 1.164 -14.709 1.00 0.00 C ATOM 1672 CG ASP A 107 8.064 1.856 -14.980 1.00 0.00 C ATOM 1673 OD1 ASP A 107 8.062 3.054 -15.140 1.00 0.00 O ATOM 1674 OD2 ASP A 107 7.090 1.171 -15.182 1.00 0.00 O ATOM 0 H ASP A 107 12.410 1.257 -14.033 1.00 0.00 H new ATOM 0 HA ASP A 107 10.502 2.836 -15.464 1.00 0.00 H new ATOM 0 HB2 ASP A 107 9.563 0.415 -15.483 1.00 0.00 H new ATOM 0 HB3 ASP A 107 9.325 0.632 -13.760 1.00 0.00 H new ATOM 1679 N ASP A 108 9.838 3.915 -13.237 1.00 0.00 N ATOM 1680 CA ASP A 108 9.794 4.731 -12.029 1.00 0.00 C ATOM 1681 C ASP A 108 8.460 4.561 -11.306 1.00 0.00 C ATOM 1682 O ASP A 108 7.455 5.161 -11.688 1.00 0.00 O ATOM 1683 CB ASP A 108 10.028 6.206 -12.366 1.00 0.00 C ATOM 1684 CG ASP A 108 10.047 7.133 -11.158 1.00 0.00 C ATOM 1685 OD1 ASP A 108 9.712 6.686 -10.086 1.00 0.00 O ATOM 1686 OD2 ASP A 108 10.542 8.227 -11.282 1.00 0.00 O ATOM 0 H ASP A 108 9.217 4.231 -13.982 1.00 0.00 H new ATOM 0 HA ASP A 108 10.591 4.394 -11.366 1.00 0.00 H new ATOM 0 HB2 ASP A 108 10.977 6.299 -12.895 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.248 6.538 -13.051 1.00 0.00 H new ATOM 1691 N VAL A 109 8.460 3.740 -10.261 1.00 0.00 N ATOM 1692 CA VAL A 109 7.243 3.465 -9.506 1.00 0.00 C ATOM 1693 C VAL A 109 7.507 3.502 -8.006 1.00 0.00 C ATOM 1694 O VAL A 109 8.416 2.848 -7.494 1.00 0.00 O ATOM 1695 CB VAL A 109 6.643 2.096 -9.879 1.00 0.00 C ATOM 1696 CG1 VAL A 109 7.652 0.986 -9.626 1.00 0.00 C ATOM 1697 CG2 VAL A 109 5.366 1.842 -9.094 1.00 0.00 C ATOM 0 H VAL A 109 9.288 3.254 -9.918 1.00 0.00 H new ATOM 0 HA VAL A 109 6.528 4.246 -9.766 1.00 0.00 H new ATOM 0 HB VAL A 109 6.399 2.105 -10.941 1.00 0.00 H new ATOM 0 HG11 VAL A 109 7.212 0.026 -9.895 1.00 0.00 H new ATOM 0 HG12 VAL A 109 8.542 1.159 -10.231 1.00 0.00 H new ATOM 0 HG13 VAL A 109 7.926 0.977 -8.571 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.956 0.871 -9.370 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.587 1.852 -8.027 1.00 0.00 H new ATOM 0 HG23 VAL A 109 4.638 2.621 -9.321 1.00 0.00 H new ATOM 1707 N PRO A 110 6.693 4.283 -7.280 1.00 0.00 N ATOM 1708 CA PRO A 110 6.810 4.414 -5.825 1.00 0.00 C ATOM 1709 C PRO A 110 6.236 3.209 -5.087 1.00 0.00 C ATOM 1710 O PRO A 110 5.197 2.673 -5.470 1.00 0.00 O ATOM 1711 CB PRO A 110 6.037 5.697 -5.507 1.00 0.00 C ATOM 1712 CG PRO A 110 4.982 5.766 -6.558 1.00 0.00 C ATOM 1713 CD PRO A 110 5.618 5.198 -7.799 1.00 0.00 C ATOM 0 HA PRO A 110 7.849 4.459 -5.499 1.00 0.00 H new ATOM 0 HB2 PRO A 110 5.601 5.661 -4.509 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.688 6.571 -5.539 1.00 0.00 H new ATOM 0 HG2 PRO A 110 4.102 5.192 -6.269 1.00 0.00 H new ATOM 0 HG3 PRO A 110 4.654 6.793 -6.719 1.00 0.00 H new ATOM 0 HD2 PRO A 110 4.892 4.656 -8.405 1.00 0.00 H new ATOM 0 HD3 PRO A 110 6.035 5.985 -8.428 1.00 0.00 H new ATOM 1721 N MET A 111 6.921 2.790 -4.027 1.00 0.00 N ATOM 1722 CA MET A 111 6.482 1.643 -3.240 1.00 0.00 C ATOM 1723 C MET A 111 6.531 1.958 -1.748 1.00 0.00 C ATOM 1724 O MET A 111 7.431 2.656 -1.279 1.00 0.00 O ATOM 1725 CB MET A 111 7.345 0.423 -3.555 1.00 0.00 C ATOM 1726 CG MET A 111 7.383 0.041 -5.028 1.00 0.00 C ATOM 1727 SD MET A 111 8.378 -1.431 -5.339 1.00 0.00 S ATOM 1728 CE MET A 111 8.575 -1.337 -7.116 1.00 0.00 C ATOM 0 H MET A 111 7.781 3.227 -3.694 1.00 0.00 H new ATOM 0 HA MET A 111 5.449 1.420 -3.507 1.00 0.00 H new ATOM 0 HB2 MET A 111 8.363 0.616 -3.216 1.00 0.00 H new ATOM 0 HB3 MET A 111 6.974 -0.427 -2.982 1.00 0.00 H new ATOM 0 HG2 MET A 111 6.366 -0.131 -5.381 1.00 0.00 H new ATOM 0 HG3 MET A 111 7.784 0.874 -5.605 1.00 0.00 H new ATOM 0 HE1 MET A 111 8.980 -2.278 -7.487 1.00 0.00 H new ATOM 0 HE2 MET A 111 7.607 -1.150 -7.580 1.00 0.00 H new ATOM 0 HE3 MET A 111 9.259 -0.525 -7.364 1.00 0.00 H new ATOM 1738 N VAL A 112 5.557 1.441 -1.006 1.00 0.00 N ATOM 1739 CA VAL A 112 5.561 1.553 0.448 1.00 0.00 C ATOM 1740 C VAL A 112 5.112 0.251 1.101 1.00 0.00 C ATOM 1741 O VAL A 112 4.135 -0.366 0.674 1.00 0.00 O ATOM 1742 CB VAL A 112 4.651 2.699 0.929 1.00 0.00 C ATOM 1743 CG1 VAL A 112 4.588 2.727 2.449 1.00 0.00 C ATOM 1744 CG2 VAL A 112 5.147 4.034 0.393 1.00 0.00 C ATOM 0 H VAL A 112 4.755 0.940 -1.388 1.00 0.00 H new ATOM 0 HA VAL A 112 6.587 1.769 0.744 1.00 0.00 H new ATOM 0 HB VAL A 112 3.646 2.525 0.545 1.00 0.00 H new ATOM 0 HG11 VAL A 112 3.941 3.543 2.771 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.188 1.781 2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 112 5.590 2.878 2.852 1.00 0.00 H new ATOM 0 HG21 VAL A 112 4.492 4.832 0.743 1.00 0.00 H new ATOM 0 HG22 VAL A 112 6.161 4.215 0.749 1.00 0.00 H new ATOM 0 HG23 VAL A 112 5.143 4.013 -0.697 1.00 0.00 H new ATOM 1754 N LEU A 113 5.830 -0.161 2.140 1.00 0.00 N ATOM 1755 CA LEU A 113 5.466 -1.355 2.895 1.00 0.00 C ATOM 1756 C LEU A 113 4.745 -0.983 4.188 1.00 0.00 C ATOM 1757 O LEU A 113 5.284 -0.260 5.025 1.00 0.00 O ATOM 1758 CB LEU A 113 6.714 -2.193 3.200 1.00 0.00 C ATOM 1759 CG LEU A 113 6.464 -3.460 4.027 1.00 0.00 C ATOM 1760 CD1 LEU A 113 5.656 -4.463 3.214 1.00 0.00 C ATOM 1761 CD2 LEU A 113 7.795 -4.060 4.454 1.00 0.00 C ATOM 0 H LEU A 113 6.667 0.314 2.479 1.00 0.00 H new ATOM 0 HA LEU A 113 4.785 -1.950 2.286 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.179 -2.480 2.257 1.00 0.00 H new ATOM 0 HB3 LEU A 113 7.431 -1.567 3.731 1.00 0.00 H new ATOM 0 HG LEU A 113 5.892 -3.205 4.919 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.484 -5.359 3.810 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.699 -4.021 2.938 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.207 -4.728 2.311 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.616 -4.960 5.042 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.380 -4.314 3.570 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.344 -3.336 5.057 1.00 0.00 H new ATOM 1773 N VAL A 114 3.524 -1.484 4.343 1.00 0.00 N ATOM 1774 CA VAL A 114 2.680 -1.105 5.470 1.00 0.00 C ATOM 1775 C VAL A 114 2.318 -2.319 6.319 1.00 0.00 C ATOM 1776 O VAL A 114 1.832 -3.326 5.806 1.00 0.00 O ATOM 1777 CB VAL A 114 1.386 -0.414 4.999 1.00 0.00 C ATOM 1778 CG1 VAL A 114 0.505 -0.065 6.189 1.00 0.00 C ATOM 1779 CG2 VAL A 114 1.712 0.835 4.195 1.00 0.00 C ATOM 0 H VAL A 114 3.097 -2.153 3.703 1.00 0.00 H new ATOM 0 HA VAL A 114 3.256 -0.403 6.073 1.00 0.00 H new ATOM 0 HB VAL A 114 0.840 -1.105 4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.405 0.422 5.838 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.244 -0.976 6.728 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.044 0.609 6.855 1.00 0.00 H new ATOM 0 HG21 VAL A 114 0.787 1.311 3.870 1.00 0.00 H new ATOM 0 HG22 VAL A 114 2.279 1.529 4.815 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.305 0.561 3.322 1.00 0.00 H new ATOM 1789 N GLY A 115 2.559 -2.216 7.623 1.00 0.00 N ATOM 1790 CA GLY A 115 2.146 -3.264 8.538 1.00 0.00 C ATOM 1791 C GLY A 115 1.086 -2.795 9.515 1.00 0.00 C ATOM 1792 O GLY A 115 1.187 -1.705 10.074 1.00 0.00 O ATOM 0 H GLY A 115 3.032 -1.426 8.061 1.00 0.00 H new ATOM 0 HA2 GLY A 115 1.762 -4.110 7.968 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.014 -3.621 9.092 1.00 0.00 H new ATOM 1796 N ASN A 116 0.065 -3.622 9.721 1.00 0.00 N ATOM 1797 CA ASN A 116 -1.127 -3.198 10.444 1.00 0.00 C ATOM 1798 C ASN A 116 -1.008 -3.522 11.930 1.00 0.00 C ATOM 1799 O ASN A 116 -0.006 -4.082 12.375 1.00 0.00 O ATOM 1800 CB ASN A 116 -2.381 -3.828 9.867 1.00 0.00 C ATOM 1801 CG ASN A 116 -2.508 -5.298 10.155 1.00 0.00 C ATOM 1802 OD1 ASN A 116 -1.691 -5.883 10.874 1.00 0.00 O ATOM 1803 ND2 ASN A 116 -3.481 -5.914 9.531 1.00 0.00 N ATOM 0 H ASN A 116 0.040 -4.589 9.397 1.00 0.00 H new ATOM 0 HA ASN A 116 -1.209 -2.117 10.329 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -3.253 -3.312 10.268 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -2.389 -3.677 8.788 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.590 -6.924 9.627 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.130 -5.384 8.949 1.00 0.00 H new ATOM 1810 N LYS A 117 -2.035 -3.167 12.692 1.00 0.00 N ATOM 1811 CA LYS A 117 -2.138 -3.586 14.085 1.00 0.00 C ATOM 1812 C LYS A 117 -0.845 -3.288 14.838 1.00 0.00 C ATOM 1813 O LYS A 117 -0.394 -4.090 15.657 1.00 0.00 O ATOM 1814 CB LYS A 117 -2.470 -5.076 14.175 1.00 0.00 C ATOM 1815 CG LYS A 117 -3.807 -5.461 13.556 1.00 0.00 C ATOM 1816 CD LYS A 117 -4.084 -6.949 13.717 1.00 0.00 C ATOM 1817 CE LYS A 117 -5.081 -7.442 12.679 1.00 0.00 C ATOM 1818 NZ LYS A 117 -5.143 -8.928 12.628 1.00 0.00 N ATOM 0 H LYS A 117 -2.810 -2.589 12.368 1.00 0.00 H new ATOM 0 HA LYS A 117 -2.945 -3.020 14.549 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -1.679 -5.642 13.683 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -2.470 -5.373 15.224 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -4.606 -4.887 14.026 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.808 -5.201 12.497 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -3.152 -7.507 13.623 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -4.472 -7.143 14.717 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.070 -7.045 12.909 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.803 -7.057 11.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -5.672 -9.225 11.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -4.178 -9.314 12.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.622 -9.285 13.479 1.00 0.00 H new ATOM 1832 N CYS A 118 -0.256 -2.131 14.558 1.00 0.00 N ATOM 1833 CA CYS A 118 0.962 -1.708 15.241 1.00 0.00 C ATOM 1834 C CYS A 118 0.656 -1.250 16.663 1.00 0.00 C ATOM 1835 O CYS A 118 1.563 -0.941 17.436 1.00 0.00 O ATOM 1836 CB CYS A 118 1.441 -0.534 14.387 1.00 0.00 C ATOM 1837 SG CYS A 118 2.020 -0.994 12.737 1.00 0.00 S ATOM 0 H CYS A 118 -0.602 -1.469 13.863 1.00 0.00 H new ATOM 0 HA CYS A 118 1.700 -2.504 15.337 1.00 0.00 H new ATOM 0 HB2 CYS A 118 0.625 0.182 14.286 1.00 0.00 H new ATOM 0 HB3 CYS A 118 2.249 -0.024 14.913 1.00 0.00 H new ATOM 0 HG CYS A 118 1.004 -1.087 11.931 1.00 0.00 H new ATOM 1843 N ASP A 119 -0.628 -1.209 17.003 1.00 0.00 N ATOM 1844 CA ASP A 119 -1.048 -0.954 18.376 1.00 0.00 C ATOM 1845 C ASP A 119 -1.267 -2.261 19.130 1.00 0.00 C ATOM 1846 O ASP A 119 -1.470 -2.263 20.344 1.00 0.00 O ATOM 1847 CB ASP A 119 -2.325 -0.110 18.400 1.00 0.00 C ATOM 1848 CG ASP A 119 -2.169 1.284 17.808 1.00 0.00 C ATOM 1849 OD1 ASP A 119 -1.151 1.894 18.034 1.00 0.00 O ATOM 1850 OD2 ASP A 119 -2.994 1.664 17.011 1.00 0.00 O ATOM 0 H ASP A 119 -1.396 -1.349 16.346 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.252 -0.399 18.874 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -3.106 -0.639 17.853 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -2.665 -0.017 19.431 1.00 0.00 H new ATOM 1855 N LEU A 120 -1.223 -3.372 18.403 1.00 0.00 N ATOM 1856 CA LEU A 120 -1.491 -4.681 18.988 1.00 0.00 C ATOM 1857 C LEU A 120 -0.204 -5.329 19.486 1.00 0.00 C ATOM 1858 O LEU A 120 0.739 -5.529 18.720 1.00 0.00 O ATOM 1859 CB LEU A 120 -2.187 -5.589 17.965 1.00 0.00 C ATOM 1860 CG LEU A 120 -2.488 -7.012 18.453 1.00 0.00 C ATOM 1861 CD1 LEU A 120 -3.489 -6.970 19.599 1.00 0.00 C ATOM 1862 CD2 LEU A 120 -3.025 -7.842 17.297 1.00 0.00 C ATOM 0 H LEU A 120 -1.004 -3.392 17.407 1.00 0.00 H new ATOM 0 HA LEU A 120 -2.153 -4.543 19.843 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.124 -5.119 17.664 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.562 -5.652 17.074 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.571 -7.473 18.819 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.696 -7.985 19.938 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -3.075 -6.389 20.423 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -4.414 -6.506 19.257 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.239 -8.853 17.644 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.940 -7.388 16.917 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -2.281 -7.881 16.501 1.00 0.00 H new ATOM 1874 N ALA A 121 -0.173 -5.657 20.773 1.00 0.00 N ATOM 1875 CA ALA A 121 0.992 -6.301 21.369 1.00 0.00 C ATOM 1876 C ALA A 121 1.215 -7.688 20.779 1.00 0.00 C ATOM 1877 O ALA A 121 2.353 -8.106 20.564 1.00 0.00 O ATOM 1878 CB ALA A 121 0.832 -6.387 22.880 1.00 0.00 C ATOM 0 H ALA A 121 -0.940 -5.488 21.423 1.00 0.00 H new ATOM 0 HA ALA A 121 1.868 -5.694 21.141 1.00 0.00 H new ATOM 0 HB1 ALA A 121 1.709 -6.870 23.312 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.730 -5.383 23.293 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.058 -6.970 23.119 1.00 0.00 H new ATOM 1884 N ALA A 122 0.123 -8.398 20.519 1.00 0.00 N ATOM 1885 CA ALA A 122 0.200 -9.737 19.947 1.00 0.00 C ATOM 1886 C ALA A 122 0.548 -9.682 18.464 1.00 0.00 C ATOM 1887 O ALA A 122 -0.334 -9.553 17.614 1.00 0.00 O ATOM 1888 CB ALA A 122 -1.113 -10.477 20.155 1.00 0.00 C ATOM 0 H ALA A 122 -0.826 -8.069 20.695 1.00 0.00 H new ATOM 0 HA ALA A 122 0.995 -10.278 20.460 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -1.041 -11.475 19.723 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -1.320 -10.558 21.222 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.920 -9.929 19.669 1.00 0.00 H new ATOM 1894 N ARG A 123 1.838 -9.779 18.159 1.00 0.00 N ATOM 1895 CA ARG A 123 2.314 -9.628 16.789 1.00 0.00 C ATOM 1896 C ARG A 123 3.608 -10.406 16.574 1.00 0.00 C ATOM 1897 O ARG A 123 4.190 -10.938 17.520 1.00 0.00 O ATOM 1898 CB ARG A 123 2.466 -8.167 16.390 1.00 0.00 C ATOM 1899 CG ARG A 123 3.514 -7.395 17.176 1.00 0.00 C ATOM 1900 CD ARG A 123 3.581 -5.948 16.850 1.00 0.00 C ATOM 1901 NE ARG A 123 4.650 -5.227 17.522 1.00 0.00 N ATOM 1902 CZ ARG A 123 4.535 -4.634 18.726 1.00 0.00 C ATOM 1903 NH1 ARG A 123 3.393 -4.640 19.377 1.00 0.00 N ATOM 1904 NH2 ARG A 123 5.596 -4.025 19.226 1.00 0.00 N ATOM 0 H ARG A 123 2.573 -9.962 18.843 1.00 0.00 H new ATOM 0 HA ARG A 123 1.553 -10.051 16.133 1.00 0.00 H new ATOM 0 HB2 ARG A 123 2.719 -8.119 15.331 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.503 -7.670 16.511 1.00 0.00 H new ATOM 0 HG2 ARG A 123 3.307 -7.506 18.240 1.00 0.00 H new ATOM 0 HG3 ARG A 123 4.491 -7.842 16.992 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.706 -5.837 15.773 1.00 0.00 H new ATOM 0 HD3 ARG A 123 2.629 -5.486 17.110 1.00 0.00 H new ATOM 0 HE ARG A 123 5.551 -5.166 17.048 1.00 0.00 H new ATOM 0 HH11 ARG A 123 2.577 -5.098 18.971 1.00 0.00 H new ATOM 0 HH12 ARG A 123 3.323 -4.186 20.288 1.00 0.00 H new ATOM 0 HH21 ARG A 123 6.471 -4.013 18.702 1.00 0.00 H new ATOM 0 HH22 ARG A 123 5.540 -3.567 20.136 1.00 0.00 H new ATOM 1918 N THR A 124 4.053 -10.469 15.323 1.00 0.00 N ATOM 1919 CA THR A 124 5.307 -11.134 14.991 1.00 0.00 C ATOM 1920 C THR A 124 6.504 -10.322 15.473 1.00 0.00 C ATOM 1921 O THR A 124 6.345 -9.296 16.134 1.00 0.00 O ATOM 1922 CB THR A 124 5.437 -11.371 13.475 1.00 0.00 C ATOM 1923 OG1 THR A 124 5.449 -10.111 12.791 1.00 0.00 O ATOM 1924 CG2 THR A 124 4.274 -12.209 12.965 1.00 0.00 C ATOM 0 H THR A 124 3.564 -10.068 14.523 1.00 0.00 H new ATOM 0 HA THR A 124 5.296 -12.098 15.500 1.00 0.00 H new ATOM 0 HB THR A 124 6.368 -11.905 13.284 1.00 0.00 H new ATOM 0 HG1 THR A 124 4.543 -9.737 12.778 1.00 0.00 H new ATOM 0 HG21 THR A 124 4.382 -12.367 11.892 1.00 0.00 H new ATOM 0 HG22 THR A 124 4.269 -13.173 13.475 1.00 0.00 H new ATOM 0 HG23 THR A 124 3.337 -11.689 13.163 1.00 0.00 H new ATOM 1932 N VAL A 125 7.703 -10.787 15.137 1.00 0.00 N ATOM 1933 CA VAL A 125 8.928 -10.124 15.567 1.00 0.00 C ATOM 1934 C VAL A 125 8.836 -8.616 15.365 1.00 0.00 C ATOM 1935 O VAL A 125 8.212 -8.145 14.415 1.00 0.00 O ATOM 1936 CB VAL A 125 10.156 -10.661 14.808 1.00 0.00 C ATOM 1937 CG1 VAL A 125 11.375 -9.793 15.087 1.00 0.00 C ATOM 1938 CG2 VAL A 125 10.433 -12.105 15.196 1.00 0.00 C ATOM 0 H VAL A 125 7.852 -11.620 14.568 1.00 0.00 H new ATOM 0 HA VAL A 125 9.047 -10.339 16.629 1.00 0.00 H new ATOM 0 HB VAL A 125 9.943 -10.626 13.740 1.00 0.00 H new ATOM 0 HG11 VAL A 125 12.234 -10.186 14.543 1.00 0.00 H new ATOM 0 HG12 VAL A 125 11.176 -8.772 14.762 1.00 0.00 H new ATOM 0 HG13 VAL A 125 11.589 -9.799 16.156 1.00 0.00 H new ATOM 0 HG21 VAL A 125 11.304 -12.468 14.650 1.00 0.00 H new ATOM 0 HG22 VAL A 125 10.626 -12.163 16.267 1.00 0.00 H new ATOM 0 HG23 VAL A 125 9.568 -12.720 14.949 1.00 0.00 H new ATOM 1948 N GLU A 126 9.461 -7.865 16.267 1.00 0.00 N ATOM 1949 CA GLU A 126 9.285 -6.417 16.308 1.00 0.00 C ATOM 1950 C GLU A 126 9.334 -5.824 14.904 1.00 0.00 C ATOM 1951 O GLU A 126 10.018 -6.343 14.022 1.00 0.00 O ATOM 1952 CB GLU A 126 10.354 -5.771 17.193 1.00 0.00 C ATOM 1953 CG GLU A 126 10.167 -4.277 17.415 1.00 0.00 C ATOM 1954 CD GLU A 126 8.845 -3.982 18.066 1.00 0.00 C ATOM 1955 OE1 GLU A 126 7.841 -4.085 17.402 1.00 0.00 O ATOM 1956 OE2 GLU A 126 8.826 -3.765 19.254 1.00 0.00 O ATOM 0 H GLU A 126 10.093 -8.234 16.978 1.00 0.00 H new ATOM 0 HA GLU A 126 8.304 -6.208 16.735 1.00 0.00 H new ATOM 0 HB2 GLU A 126 10.359 -6.272 18.161 1.00 0.00 H new ATOM 0 HB3 GLU A 126 11.332 -5.939 16.742 1.00 0.00 H new ATOM 0 HG2 GLU A 126 10.975 -3.896 18.040 1.00 0.00 H new ATOM 0 HG3 GLU A 126 10.229 -3.755 16.460 1.00 0.00 H new ATOM 1963 N SER A 127 8.604 -4.731 14.704 1.00 0.00 N ATOM 1964 CA SER A 127 8.463 -4.136 13.380 1.00 0.00 C ATOM 1965 C SER A 127 9.805 -3.613 12.875 1.00 0.00 C ATOM 1966 O SER A 127 9.941 -3.252 11.706 1.00 0.00 O ATOM 1967 CB SER A 127 7.436 -3.021 13.412 1.00 0.00 C ATOM 1968 OG SER A 127 7.865 -1.933 14.183 1.00 0.00 O ATOM 0 H SER A 127 8.101 -4.239 15.443 1.00 0.00 H new ATOM 0 HA SER A 127 8.119 -4.908 12.691 1.00 0.00 H new ATOM 0 HB2 SER A 127 7.233 -2.686 12.395 1.00 0.00 H new ATOM 0 HB3 SER A 127 6.498 -3.404 13.815 1.00 0.00 H new ATOM 0 HG SER A 127 7.167 -1.693 14.828 1.00 0.00 H new ATOM 1974 N ARG A 128 10.791 -3.575 13.764 1.00 0.00 N ATOM 1975 CA ARG A 128 12.149 -3.202 13.385 1.00 0.00 C ATOM 1976 C ARG A 128 12.691 -4.143 12.313 1.00 0.00 C ATOM 1977 O ARG A 128 13.457 -3.732 11.444 1.00 0.00 O ATOM 1978 CB ARG A 128 13.081 -3.123 14.584 1.00 0.00 C ATOM 1979 CG ARG A 128 12.822 -1.952 15.519 1.00 0.00 C ATOM 1980 CD ARG A 128 13.690 -1.927 16.724 1.00 0.00 C ATOM 1981 NE ARG A 128 13.440 -0.812 17.624 1.00 0.00 N ATOM 1982 CZ ARG A 128 14.050 -0.637 18.812 1.00 0.00 C ATOM 1983 NH1 ARG A 128 14.917 -1.515 19.265 1.00 0.00 N ATOM 1984 NH2 ARG A 128 13.737 0.432 19.523 1.00 0.00 N ATOM 0 H ARG A 128 10.675 -3.798 14.753 1.00 0.00 H new ATOM 0 HA ARG A 128 12.104 -2.198 12.962 1.00 0.00 H new ATOM 0 HB2 ARG A 128 12.997 -4.049 15.153 1.00 0.00 H new ATOM 0 HB3 ARG A 128 14.108 -3.062 14.224 1.00 0.00 H new ATOM 0 HG2 ARG A 128 12.962 -1.023 14.966 1.00 0.00 H new ATOM 0 HG3 ARG A 128 11.780 -1.980 15.837 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.554 -2.859 17.273 1.00 0.00 H new ATOM 0 HD3 ARG A 128 14.732 -1.894 16.405 1.00 0.00 H new ATOM 0 HE ARG A 128 12.755 -0.114 17.335 1.00 0.00 H new ATOM 0 HH11 ARG A 128 15.137 -2.345 18.715 1.00 0.00 H new ATOM 0 HH12 ARG A 128 15.370 -1.366 20.167 1.00 0.00 H new ATOM 0 HH21 ARG A 128 13.050 1.097 19.168 1.00 0.00 H new ATOM 0 HH22 ARG A 128 14.182 0.592 20.427 1.00 0.00 H new ATOM 1998 N GLN A 129 12.288 -5.408 12.385 1.00 0.00 N ATOM 1999 CA GLN A 129 12.653 -6.384 11.366 1.00 0.00 C ATOM 2000 C GLN A 129 11.938 -6.093 10.051 1.00 0.00 C ATOM 2001 O GLN A 129 12.494 -6.301 8.972 1.00 0.00 O ATOM 2002 CB GLN A 129 12.316 -7.799 11.841 1.00 0.00 C ATOM 2003 CG GLN A 129 12.916 -8.892 10.972 1.00 0.00 C ATOM 2004 CD GLN A 129 12.172 -10.207 11.091 1.00 0.00 C ATOM 2005 OE1 GLN A 129 10.930 -10.145 11.559 1.00 0.00 O flip ATOM 2006 NE2 GLN A 129 12.705 -11.268 10.765 1.00 0.00 N flip ATOM 0 H GLN A 129 11.709 -5.780 13.138 1.00 0.00 H new ATOM 0 HA GLN A 129 13.727 -6.311 11.198 1.00 0.00 H new ATOM 0 HB2 GLN A 129 12.671 -7.924 12.864 1.00 0.00 H new ATOM 0 HB3 GLN A 129 11.233 -7.917 11.863 1.00 0.00 H new ATOM 0 HG2 GLN A 129 12.909 -8.568 9.931 1.00 0.00 H new ATOM 0 HG3 GLN A 129 13.959 -9.042 11.252 1.00 0.00 H new ATOM 0 HE21 GLN A 129 13.661 -11.270 10.410 1.00 0.00 H new ATOM 0 HE22 GLN A 129 12.190 -12.144 10.850 1.00 0.00 H new ATOM 2015 N ALA A 130 10.704 -5.610 10.149 1.00 0.00 N ATOM 2016 CA ALA A 130 9.940 -5.223 8.969 1.00 0.00 C ATOM 2017 C ALA A 130 10.580 -4.030 8.268 1.00 0.00 C ATOM 2018 O ALA A 130 10.555 -3.933 7.042 1.00 0.00 O ATOM 2019 CB ALA A 130 8.503 -4.903 9.353 1.00 0.00 C ATOM 0 H ALA A 130 10.212 -5.477 11.033 1.00 0.00 H new ATOM 0 HA ALA A 130 9.941 -6.063 8.274 1.00 0.00 H new ATOM 0 HB1 ALA A 130 7.944 -4.616 8.463 1.00 0.00 H new ATOM 0 HB2 ALA A 130 8.042 -5.782 9.803 1.00 0.00 H new ATOM 0 HB3 ALA A 130 8.492 -4.081 10.069 1.00 0.00 H new ATOM 2025 N GLN A 131 11.153 -3.125 9.055 1.00 0.00 N ATOM 2026 CA GLN A 131 11.942 -2.027 8.507 1.00 0.00 C ATOM 2027 C GLN A 131 13.183 -2.551 7.793 1.00 0.00 C ATOM 2028 O GLN A 131 13.500 -2.123 6.684 1.00 0.00 O ATOM 2029 CB GLN A 131 12.353 -1.055 9.616 1.00 0.00 C ATOM 2030 CG GLN A 131 11.202 -0.252 10.198 1.00 0.00 C ATOM 2031 CD GLN A 131 11.572 0.429 11.502 1.00 0.00 C ATOM 2032 OE1 GLN A 131 12.763 0.129 12.008 1.00 0.00 O flip ATOM 2033 NE2 GLN A 131 10.797 1.219 12.048 1.00 0.00 N flip ATOM 0 H GLN A 131 11.086 -3.130 10.073 1.00 0.00 H new ATOM 0 HA GLN A 131 11.322 -1.498 7.783 1.00 0.00 H new ATOM 0 HB2 GLN A 131 12.831 -1.617 10.418 1.00 0.00 H new ATOM 0 HB3 GLN A 131 13.099 -0.366 9.221 1.00 0.00 H new ATOM 0 HG2 GLN A 131 10.886 0.500 9.475 1.00 0.00 H new ATOM 0 HG3 GLN A 131 10.350 -0.912 10.365 1.00 0.00 H new ATOM 0 HE21 GLN A 131 9.891 1.420 11.624 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.062 1.671 12.923 1.00 0.00 H new ATOM 2042 N ASP A 132 13.882 -3.479 8.438 1.00 0.00 N ATOM 2043 CA ASP A 132 15.061 -4.097 7.844 1.00 0.00 C ATOM 2044 C ASP A 132 14.697 -4.850 6.569 1.00 0.00 C ATOM 2045 O ASP A 132 15.440 -4.823 5.585 1.00 0.00 O ATOM 2046 CB ASP A 132 15.732 -5.044 8.843 1.00 0.00 C ATOM 2047 CG ASP A 132 16.471 -4.343 9.975 1.00 0.00 C ATOM 2048 OD1 ASP A 132 16.676 -3.156 9.880 1.00 0.00 O ATOM 2049 OD2 ASP A 132 16.686 -4.962 10.990 1.00 0.00 O ATOM 0 H ASP A 132 13.652 -3.819 9.372 1.00 0.00 H new ATOM 0 HA ASP A 132 15.763 -3.304 7.586 1.00 0.00 H new ATOM 0 HB2 ASP A 132 14.973 -5.698 9.271 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.435 -5.681 8.306 1.00 0.00 H new ATOM 2054 N LEU A 133 13.551 -5.522 6.591 1.00 0.00 N ATOM 2055 CA LEU A 133 13.054 -6.224 5.413 1.00 0.00 C ATOM 2056 C LEU A 133 12.707 -5.244 4.299 1.00 0.00 C ATOM 2057 O LEU A 133 12.999 -5.489 3.129 1.00 0.00 O ATOM 2058 CB LEU A 133 11.830 -7.074 5.778 1.00 0.00 C ATOM 2059 CG LEU A 133 12.129 -8.322 6.619 1.00 0.00 C ATOM 2060 CD1 LEU A 133 10.829 -8.943 7.112 1.00 0.00 C ATOM 2061 CD2 LEU A 133 12.921 -9.319 5.786 1.00 0.00 C ATOM 0 H LEU A 133 12.949 -5.595 7.411 1.00 0.00 H new ATOM 0 HA LEU A 133 13.844 -6.882 5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 133 11.123 -6.449 6.323 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.336 -7.385 4.858 1.00 0.00 H new ATOM 0 HG LEU A 133 12.724 -8.041 7.488 1.00 0.00 H new ATOM 0 HD11 LEU A 133 11.052 -9.828 7.708 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.289 -8.220 7.724 1.00 0.00 H new ATOM 0 HD13 LEU A 133 10.214 -9.226 6.258 1.00 0.00 H new ATOM 0 HD21 LEU A 133 13.133 -10.205 6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 133 12.340 -9.604 4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 133 13.859 -8.863 5.467 1.00 0.00 H new ATOM 2073 N ALA A 134 12.085 -4.129 4.671 1.00 0.00 N ATOM 2074 CA ALA A 134 11.781 -3.069 3.717 1.00 0.00 C ATOM 2075 C ALA A 134 13.058 -2.463 3.144 1.00 0.00 C ATOM 2076 O ALA A 134 13.133 -2.160 1.953 1.00 0.00 O ATOM 2077 CB ALA A 134 10.934 -1.992 4.378 1.00 0.00 C ATOM 0 H ALA A 134 11.782 -3.937 5.626 1.00 0.00 H new ATOM 0 HA ALA A 134 11.216 -3.506 2.893 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.714 -1.207 3.655 1.00 0.00 H new ATOM 0 HB2 ALA A 134 10.001 -2.430 4.733 1.00 0.00 H new ATOM 0 HB3 ALA A 134 11.479 -1.567 5.221 1.00 0.00 H new ATOM 2083 N ARG A 135 14.061 -2.289 3.999 1.00 0.00 N ATOM 2084 CA ARG A 135 15.325 -1.693 3.583 1.00 0.00 C ATOM 2085 C ARG A 135 16.053 -2.598 2.595 1.00 0.00 C ATOM 2086 O ARG A 135 16.701 -2.121 1.664 1.00 0.00 O ATOM 2087 CB ARG A 135 16.208 -1.331 4.768 1.00 0.00 C ATOM 2088 CG ARG A 135 15.756 -0.111 5.555 1.00 0.00 C ATOM 2089 CD ARG A 135 16.538 0.146 6.790 1.00 0.00 C ATOM 2090 NE ARG A 135 16.108 1.312 7.545 1.00 0.00 N ATOM 2091 CZ ARG A 135 16.608 1.676 8.742 1.00 0.00 C ATOM 2092 NH1 ARG A 135 17.526 0.951 9.341 1.00 0.00 N ATOM 2093 NH2 ARG A 135 16.132 2.770 9.311 1.00 0.00 N ATOM 0 H ARG A 135 14.023 -2.552 4.984 1.00 0.00 H new ATOM 0 HA ARG A 135 15.091 -0.758 3.074 1.00 0.00 H new ATOM 0 HB2 ARG A 135 16.252 -2.185 5.444 1.00 0.00 H new ATOM 0 HB3 ARG A 135 17.222 -1.157 4.407 1.00 0.00 H new ATOM 0 HG2 ARG A 135 15.819 0.766 4.911 1.00 0.00 H new ATOM 0 HG3 ARG A 135 14.707 -0.235 5.823 1.00 0.00 H new ATOM 0 HD2 ARG A 135 16.475 -0.731 7.434 1.00 0.00 H new ATOM 0 HD3 ARG A 135 17.587 0.270 6.521 1.00 0.00 H new ATOM 0 HE ARG A 135 15.376 1.896 7.140 1.00 0.00 H new ATOM 0 HH11 ARG A 135 17.871 0.098 8.900 1.00 0.00 H new ATOM 0 HH12 ARG A 135 17.894 1.241 10.247 1.00 0.00 H new ATOM 0 HH21 ARG A 135 15.406 3.313 8.844 1.00 0.00 H new ATOM 0 HH22 ARG A 135 16.491 3.071 10.217 1.00 0.00 H new ATOM 2107 N SER A 136 15.944 -3.906 2.806 1.00 0.00 N ATOM 2108 CA SER A 136 16.576 -4.878 1.922 1.00 0.00 C ATOM 2109 C SER A 136 15.960 -4.824 0.527 1.00 0.00 C ATOM 2110 O SER A 136 16.594 -5.200 -0.459 1.00 0.00 O ATOM 2111 CB SER A 136 16.452 -6.273 2.504 1.00 0.00 C ATOM 2112 OG SER A 136 15.131 -6.741 2.472 1.00 0.00 O ATOM 0 H SER A 136 15.424 -4.317 3.581 1.00 0.00 H new ATOM 0 HA SER A 136 17.633 -4.627 1.835 1.00 0.00 H new ATOM 0 HB2 SER A 136 17.092 -6.957 1.946 1.00 0.00 H new ATOM 0 HB3 SER A 136 16.810 -6.269 3.533 1.00 0.00 H new ATOM 0 HG SER A 136 14.514 -5.987 2.580 1.00 0.00 H new ATOM 2118 N TYR A 137 14.719 -4.355 0.453 1.00 0.00 N ATOM 2119 CA TYR A 137 14.019 -4.243 -0.821 1.00 0.00 C ATOM 2120 C TYR A 137 13.983 -2.793 -1.297 1.00 0.00 C ATOM 2121 O TYR A 137 13.357 -2.475 -2.306 1.00 0.00 O ATOM 2122 CB TYR A 137 12.597 -4.795 -0.701 1.00 0.00 C ATOM 2123 CG TYR A 137 12.532 -6.301 -0.581 1.00 0.00 C ATOM 2124 CD1 TYR A 137 12.974 -7.116 -1.613 1.00 0.00 C ATOM 2125 CD2 TYR A 137 12.027 -6.904 0.561 1.00 0.00 C ATOM 2126 CE1 TYR A 137 12.917 -8.492 -1.509 1.00 0.00 C ATOM 2127 CE2 TYR A 137 11.965 -8.280 0.676 1.00 0.00 C ATOM 2128 CZ TYR A 137 12.412 -9.071 -0.363 1.00 0.00 C ATOM 2129 OH TYR A 137 12.352 -10.441 -0.255 1.00 0.00 O ATOM 0 H TYR A 137 14.177 -4.046 1.260 1.00 0.00 H new ATOM 0 HA TYR A 137 14.563 -4.833 -1.558 1.00 0.00 H new ATOM 0 HB2 TYR A 137 12.117 -4.350 0.171 1.00 0.00 H new ATOM 0 HB3 TYR A 137 12.023 -4.485 -1.574 1.00 0.00 H new ATOM 0 HD1 TYR A 137 13.369 -6.667 -2.512 1.00 0.00 H new ATOM 0 HD2 TYR A 137 11.676 -6.287 1.375 1.00 0.00 H new ATOM 0 HE1 TYR A 137 13.266 -9.112 -2.321 1.00 0.00 H new ATOM 0 HE2 TYR A 137 11.569 -8.733 1.573 1.00 0.00 H new ATOM 0 HH TYR A 137 12.493 -10.845 -1.137 1.00 0.00 H new ATOM 2139 N GLY A 138 14.661 -1.919 -0.560 1.00 0.00 N ATOM 2140 CA GLY A 138 14.866 -0.559 -1.024 1.00 0.00 C ATOM 2141 C GLY A 138 13.608 0.281 -0.930 1.00 0.00 C ATOM 2142 O GLY A 138 13.428 1.230 -1.694 1.00 0.00 O ATOM 0 H GLY A 138 15.072 -2.128 0.350 1.00 0.00 H new ATOM 0 HA2 GLY A 138 15.656 -0.092 -0.435 1.00 0.00 H new ATOM 0 HA3 GLY A 138 15.209 -0.579 -2.058 1.00 0.00 H new ATOM 2146 N ILE A 139 12.733 -0.068 0.007 1.00 0.00 N ATOM 2147 CA ILE A 139 11.461 0.625 0.161 1.00 0.00 C ATOM 2148 C ILE A 139 11.252 1.078 1.602 1.00 0.00 C ATOM 2149 O ILE A 139 11.786 0.496 2.545 1.00 0.00 O ATOM 2150 CB ILE A 139 10.278 -0.263 -0.266 1.00 0.00 C ATOM 2151 CG1 ILE A 139 10.227 -1.531 0.590 1.00 0.00 C ATOM 2152 CG2 ILE A 139 10.384 -0.617 -1.742 1.00 0.00 C ATOM 2153 CD1 ILE A 139 9.009 -2.391 0.336 1.00 0.00 C ATOM 0 H ILE A 139 12.882 -0.827 0.671 1.00 0.00 H new ATOM 0 HA ILE A 139 11.498 1.499 -0.489 1.00 0.00 H new ATOM 0 HB ILE A 139 9.353 0.293 -0.113 1.00 0.00 H new ATOM 0 HG12 ILE A 139 11.123 -2.122 0.401 1.00 0.00 H new ATOM 0 HG13 ILE A 139 10.248 -1.249 1.643 1.00 0.00 H new ATOM 0 HG21 ILE A 139 9.540 -1.245 -2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 139 10.374 0.296 -2.337 1.00 0.00 H new ATOM 0 HG23 ILE A 139 11.314 -1.156 -1.921 1.00 0.00 H new ATOM 0 HD11 ILE A 139 9.044 -3.270 0.979 1.00 0.00 H new ATOM 0 HD12 ILE A 139 8.107 -1.818 0.553 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.997 -2.705 -0.708 1.00 0.00 H new ATOM 2165 N PRO A 140 10.454 2.142 1.778 1.00 0.00 N ATOM 2166 CA PRO A 140 10.107 2.660 3.105 1.00 0.00 C ATOM 2167 C PRO A 140 9.084 1.784 3.819 1.00 0.00 C ATOM 2168 O PRO A 140 8.309 1.070 3.182 1.00 0.00 O ATOM 2169 CB PRO A 140 9.555 4.061 2.821 1.00 0.00 C ATOM 2170 CG PRO A 140 8.950 3.954 1.462 1.00 0.00 C ATOM 2171 CD PRO A 140 9.834 2.997 0.707 1.00 0.00 C ATOM 0 HA PRO A 140 10.965 2.675 3.777 1.00 0.00 H new ATOM 0 HB2 PRO A 140 8.813 4.354 3.564 1.00 0.00 H new ATOM 0 HB3 PRO A 140 10.345 4.812 2.846 1.00 0.00 H new ATOM 0 HG2 PRO A 140 7.926 3.585 1.515 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.913 4.926 0.970 1.00 0.00 H new ATOM 0 HD2 PRO A 140 9.260 2.397 0.001 1.00 0.00 H new ATOM 0 HD3 PRO A 140 10.593 3.526 0.131 1.00 0.00 H new ATOM 2179 N TYR A 141 9.086 1.842 5.146 1.00 0.00 N ATOM 2180 CA TYR A 141 8.120 1.098 5.946 1.00 0.00 C ATOM 2181 C TYR A 141 7.240 2.045 6.757 1.00 0.00 C ATOM 2182 O TYR A 141 7.737 2.938 7.443 1.00 0.00 O ATOM 2183 CB TYR A 141 8.836 0.116 6.876 1.00 0.00 C ATOM 2184 CG TYR A 141 7.909 -0.631 7.809 1.00 0.00 C ATOM 2185 CD1 TYR A 141 7.041 -1.600 7.327 1.00 0.00 C ATOM 2186 CD2 TYR A 141 7.907 -0.367 9.171 1.00 0.00 C ATOM 2187 CE1 TYR A 141 6.192 -2.285 8.175 1.00 0.00 C ATOM 2188 CE2 TYR A 141 7.063 -1.046 10.028 1.00 0.00 C ATOM 2189 CZ TYR A 141 6.207 -2.004 9.526 1.00 0.00 C ATOM 2190 OH TYR A 141 5.365 -2.684 10.376 1.00 0.00 O ATOM 0 H TYR A 141 9.746 2.397 5.691 1.00 0.00 H new ATOM 0 HA TYR A 141 7.482 0.534 5.265 1.00 0.00 H new ATOM 0 HB2 TYR A 141 9.387 -0.605 6.272 1.00 0.00 H new ATOM 0 HB3 TYR A 141 9.570 0.662 7.469 1.00 0.00 H new ATOM 0 HD1 TYR A 141 7.029 -1.823 6.270 1.00 0.00 H new ATOM 0 HD2 TYR A 141 8.576 0.382 9.568 1.00 0.00 H new ATOM 0 HE1 TYR A 141 5.521 -3.035 7.783 1.00 0.00 H new ATOM 0 HE2 TYR A 141 7.073 -0.828 11.086 1.00 0.00 H new ATOM 0 HH TYR A 141 5.198 -3.582 10.021 1.00 0.00 H new ATOM 2200 N ILE A 142 5.930 1.842 6.672 1.00 0.00 N ATOM 2201 CA ILE A 142 4.981 2.646 7.433 1.00 0.00 C ATOM 2202 C ILE A 142 4.182 1.782 8.402 1.00 0.00 C ATOM 2203 O ILE A 142 3.758 0.679 8.060 1.00 0.00 O ATOM 2204 CB ILE A 142 4.008 3.400 6.508 1.00 0.00 C ATOM 2205 CG1 ILE A 142 4.780 4.311 5.550 1.00 0.00 C ATOM 2206 CG2 ILE A 142 3.012 4.205 7.327 1.00 0.00 C ATOM 2207 CD1 ILE A 142 5.543 5.418 6.242 1.00 0.00 C ATOM 0 H ILE A 142 5.501 1.128 6.084 1.00 0.00 H new ATOM 0 HA ILE A 142 5.566 3.373 7.996 1.00 0.00 H new ATOM 0 HB ILE A 142 3.455 2.670 5.917 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.479 3.706 4.973 1.00 0.00 H new ATOM 0 HG13 ILE A 142 4.080 4.753 4.841 1.00 0.00 H new ATOM 0 HG21 ILE A 142 2.332 4.732 6.658 1.00 0.00 H new ATOM 0 HG22 ILE A 142 2.442 3.533 7.969 1.00 0.00 H new ATOM 0 HG23 ILE A 142 3.547 4.928 7.943 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.064 6.021 5.498 1.00 0.00 H new ATOM 0 HD12 ILE A 142 4.847 6.048 6.797 1.00 0.00 H new ATOM 0 HD13 ILE A 142 6.268 4.985 6.931 1.00 0.00 H new ATOM 2219 N GLU A 143 3.979 2.293 9.613 1.00 0.00 N ATOM 2220 CA GLU A 143 3.203 1.581 10.621 1.00 0.00 C ATOM 2221 C GLU A 143 1.763 2.088 10.658 1.00 0.00 C ATOM 2222 O GLU A 143 1.518 3.294 10.710 1.00 0.00 O ATOM 2223 CB GLU A 143 3.851 1.728 12.000 1.00 0.00 C ATOM 2224 CG GLU A 143 5.173 0.990 12.154 1.00 0.00 C ATOM 2225 CD GLU A 143 5.696 1.095 13.560 1.00 0.00 C ATOM 2226 OE1 GLU A 143 5.853 2.194 14.035 1.00 0.00 O ATOM 2227 OE2 GLU A 143 5.832 0.078 14.199 1.00 0.00 O ATOM 0 H GLU A 143 4.341 3.196 9.919 1.00 0.00 H new ATOM 0 HA GLU A 143 3.188 0.525 10.352 1.00 0.00 H new ATOM 0 HB2 GLU A 143 4.014 2.787 12.201 1.00 0.00 H new ATOM 0 HB3 GLU A 143 3.155 1.364 12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 143 5.039 -0.059 11.891 1.00 0.00 H new ATOM 0 HG3 GLU A 143 5.905 1.402 11.460 1.00 0.00 H new ATOM 2234 N THR A 144 0.814 1.158 10.630 1.00 0.00 N ATOM 2235 CA THR A 144 -0.600 1.508 10.680 1.00 0.00 C ATOM 2236 C THR A 144 -1.353 0.611 11.656 1.00 0.00 C ATOM 2237 O THR A 144 -0.820 -0.392 12.131 1.00 0.00 O ATOM 2238 CB THR A 144 -1.257 1.405 9.291 1.00 0.00 C ATOM 2239 OG1 THR A 144 -2.508 2.107 9.298 1.00 0.00 O ATOM 2240 CG2 THR A 144 -1.499 -0.050 8.921 1.00 0.00 C ATOM 0 H THR A 144 0.999 0.157 10.573 1.00 0.00 H new ATOM 0 HA THR A 144 -0.657 2.541 11.022 1.00 0.00 H new ATOM 0 HB THR A 144 -0.587 1.849 8.555 1.00 0.00 H new ATOM 0 HG1 THR A 144 -3.234 1.485 9.082 1.00 0.00 H new ATOM 0 HG21 THR A 144 -1.964 -0.103 7.936 1.00 0.00 H new ATOM 0 HG22 THR A 144 -0.549 -0.584 8.903 1.00 0.00 H new ATOM 0 HG23 THR A 144 -2.158 -0.508 9.658 1.00 0.00 H new ATOM 2248 N SER A 145 -2.597 0.978 11.949 1.00 0.00 N ATOM 2249 CA SER A 145 -3.431 0.194 12.852 1.00 0.00 C ATOM 2250 C SER A 145 -4.906 0.541 12.669 1.00 0.00 C ATOM 2251 O SER A 145 -5.260 1.700 12.457 1.00 0.00 O ATOM 2252 CB SER A 145 -3.006 0.423 14.290 1.00 0.00 C ATOM 2253 OG SER A 145 -3.841 -0.241 15.198 1.00 0.00 O ATOM 0 H SER A 145 -3.049 1.812 11.574 1.00 0.00 H new ATOM 0 HA SER A 145 -3.299 -0.861 12.612 1.00 0.00 H new ATOM 0 HB2 SER A 145 -1.980 0.080 14.424 1.00 0.00 H new ATOM 0 HB3 SER A 145 -3.015 1.492 14.504 1.00 0.00 H new ATOM 0 HG SER A 145 -3.713 0.134 16.094 1.00 0.00 H new ATOM 2259 N ALA A 146 -5.761 -0.474 12.752 1.00 0.00 N ATOM 2260 CA ALA A 146 -7.200 -0.256 12.817 1.00 0.00 C ATOM 2261 C ALA A 146 -7.583 0.507 14.080 1.00 0.00 C ATOM 2262 O ALA A 146 -8.623 1.166 14.130 1.00 0.00 O ATOM 2263 CB ALA A 146 -7.938 -1.585 12.758 1.00 0.00 C ATOM 0 H ALA A 146 -5.481 -1.455 12.776 1.00 0.00 H new ATOM 0 HA ALA A 146 -7.490 0.347 11.957 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -9.012 -1.407 12.808 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -7.697 -2.094 11.825 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -7.634 -2.208 13.600 1.00 0.00 H new ATOM 2269 N LYS A 147 -6.738 0.414 15.102 1.00 0.00 N ATOM 2270 CA LYS A 147 -7.070 0.939 16.421 1.00 0.00 C ATOM 2271 C LYS A 147 -6.927 2.457 16.454 1.00 0.00 C ATOM 2272 O LYS A 147 -7.916 3.184 16.558 1.00 0.00 O ATOM 2273 CB LYS A 147 -6.184 0.301 17.492 1.00 0.00 C ATOM 2274 CG LYS A 147 -6.545 0.687 18.920 1.00 0.00 C ATOM 2275 CD LYS A 147 -5.697 -0.072 19.930 1.00 0.00 C ATOM 2276 CE LYS A 147 -6.076 0.294 21.357 1.00 0.00 C ATOM 2277 NZ LYS A 147 -5.254 -0.442 22.356 1.00 0.00 N ATOM 0 H LYS A 147 -5.817 -0.021 15.041 1.00 0.00 H new ATOM 0 HA LYS A 147 -8.109 0.687 16.632 1.00 0.00 H new ATOM 0 HB2 LYS A 147 -6.243 -0.783 17.396 1.00 0.00 H new ATOM 0 HB3 LYS A 147 -5.148 0.582 17.304 1.00 0.00 H new ATOM 0 HG2 LYS A 147 -6.403 1.759 19.056 1.00 0.00 H new ATOM 0 HG3 LYS A 147 -7.600 0.480 19.099 1.00 0.00 H new ATOM 0 HD2 LYS A 147 -5.824 -1.144 19.782 1.00 0.00 H new ATOM 0 HD3 LYS A 147 -4.643 0.150 19.763 1.00 0.00 H new ATOM 0 HE2 LYS A 147 -5.949 1.367 21.502 1.00 0.00 H new ATOM 0 HE3 LYS A 147 -7.131 0.072 21.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 -5.543 -0.165 23.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 -5.394 -1.465 22.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 -4.250 -0.211 22.217 1.00 0.00 H new ATOM 2291 N THR A 148 -5.688 2.932 16.364 1.00 0.00 N ATOM 2292 CA THR A 148 -5.414 4.364 16.386 1.00 0.00 C ATOM 2293 C THR A 148 -4.357 4.737 15.354 1.00 0.00 C ATOM 2294 O THR A 148 -4.506 5.719 14.627 1.00 0.00 O ATOM 2295 CB THR A 148 -4.946 4.828 17.778 1.00 0.00 C ATOM 2296 OG1 THR A 148 -3.831 4.032 18.200 1.00 0.00 O ATOM 2297 CG2 THR A 148 -6.072 4.694 18.792 1.00 0.00 C ATOM 0 H THR A 148 -4.858 2.345 16.275 1.00 0.00 H new ATOM 0 HA THR A 148 -6.349 4.868 16.142 1.00 0.00 H new ATOM 0 HB THR A 148 -4.651 5.875 17.715 1.00 0.00 H new ATOM 0 HG1 THR A 148 -3.797 3.209 17.669 1.00 0.00 H new ATOM 0 HG21 THR A 148 -5.723 5.026 19.770 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.917 5.308 18.481 1.00 0.00 H new ATOM 0 HG23 THR A 148 -6.384 3.651 18.854 1.00 0.00 H new ATOM 2305 N ARG A 149 -3.289 3.948 15.295 1.00 0.00 N ATOM 2306 CA ARG A 149 -2.126 4.296 14.488 1.00 0.00 C ATOM 2307 C ARG A 149 -2.516 4.486 13.025 1.00 0.00 C ATOM 2308 O ARG A 149 -3.024 3.566 12.384 1.00 0.00 O ATOM 2309 CB ARG A 149 -0.998 3.286 14.640 1.00 0.00 C ATOM 2310 CG ARG A 149 0.313 3.688 13.984 1.00 0.00 C ATOM 2311 CD ARG A 149 0.997 4.835 14.635 1.00 0.00 C ATOM 2312 NE ARG A 149 2.211 5.273 13.964 1.00 0.00 N ATOM 2313 CZ ARG A 149 3.406 4.661 14.069 1.00 0.00 C ATOM 2314 NH1 ARG A 149 3.563 3.610 14.844 1.00 0.00 N ATOM 2315 NH2 ARG A 149 4.425 5.160 13.391 1.00 0.00 N ATOM 0 H ARG A 149 -3.205 3.064 15.796 1.00 0.00 H new ATOM 0 HA ARG A 149 -1.745 5.247 14.861 1.00 0.00 H new ATOM 0 HB2 ARG A 149 -0.820 3.119 15.702 1.00 0.00 H new ATOM 0 HB3 ARG A 149 -1.322 2.335 14.218 1.00 0.00 H new ATOM 0 HG2 ARG A 149 0.985 2.830 13.987 1.00 0.00 H new ATOM 0 HG3 ARG A 149 0.122 3.939 12.941 1.00 0.00 H new ATOM 0 HD2 ARG A 149 0.303 5.674 14.687 1.00 0.00 H new ATOM 0 HD3 ARG A 149 1.243 4.561 15.661 1.00 0.00 H new ATOM 0 HE ARG A 149 2.153 6.102 13.372 1.00 0.00 H new ATOM 0 HH11 ARG A 149 2.773 3.247 15.377 1.00 0.00 H new ATOM 0 HH12 ARG A 149 4.475 3.158 14.912 1.00 0.00 H new ATOM 0 HH21 ARG A 149 4.294 5.987 12.808 1.00 0.00 H new ATOM 0 HH22 ARG A 149 5.342 4.718 13.451 1.00 0.00 H new ATOM 2329 N GLN A 150 -2.275 5.685 12.504 1.00 0.00 N ATOM 2330 CA GLN A 150 -2.578 5.988 11.111 1.00 0.00 C ATOM 2331 C GLN A 150 -1.382 5.684 10.215 1.00 0.00 C ATOM 2332 O GLN A 150 -0.327 6.303 10.340 1.00 0.00 O ATOM 2333 CB GLN A 150 -2.983 7.456 10.956 1.00 0.00 C ATOM 2334 CG GLN A 150 -4.202 7.854 11.770 1.00 0.00 C ATOM 2335 CD GLN A 150 -5.454 7.113 11.340 1.00 0.00 C ATOM 2336 OE1 GLN A 150 -5.912 7.249 10.202 1.00 0.00 O ATOM 2337 NE2 GLN A 150 -6.017 6.327 12.250 1.00 0.00 N ATOM 0 H GLN A 150 -1.871 6.462 13.026 1.00 0.00 H new ATOM 0 HA GLN A 150 -3.412 5.356 10.805 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -2.143 8.086 11.249 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -3.181 7.658 9.903 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -4.011 7.657 12.825 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -4.367 8.927 11.671 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -5.604 6.245 13.179 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -6.863 5.805 12.020 1.00 0.00 H new ATOM 2346 N GLY A 151 -1.554 4.725 9.310 1.00 0.00 N ATOM 2347 CA GLY A 151 -0.492 4.377 8.385 1.00 0.00 C ATOM 2348 C GLY A 151 -0.967 4.328 6.947 1.00 0.00 C ATOM 2349 O GLY A 151 -0.410 4.998 6.077 1.00 0.00 O ATOM 0 H GLY A 151 -2.411 4.183 9.201 1.00 0.00 H new ATOM 0 HA2 GLY A 151 0.315 5.105 8.473 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.078 3.407 8.661 1.00 0.00 H new ATOM 2353 N VAL A 152 -2.001 3.530 6.694 1.00 0.00 N ATOM 2354 CA VAL A 152 -2.447 3.266 5.332 1.00 0.00 C ATOM 2355 C VAL A 152 -2.744 4.566 4.591 1.00 0.00 C ATOM 2356 O VAL A 152 -2.279 4.773 3.470 1.00 0.00 O ATOM 2357 CB VAL A 152 -3.703 2.375 5.311 1.00 0.00 C ATOM 2358 CG1 VAL A 152 -4.277 2.296 3.905 1.00 0.00 C ATOM 2359 CG2 VAL A 152 -3.377 0.983 5.831 1.00 0.00 C ATOM 0 H VAL A 152 -2.545 3.056 7.415 1.00 0.00 H new ATOM 0 HA VAL A 152 -1.634 2.741 4.830 1.00 0.00 H new ATOM 0 HB VAL A 152 -4.452 2.821 5.965 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -5.164 1.662 3.909 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -4.547 3.296 3.566 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.532 1.873 3.231 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -4.276 0.367 5.809 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -2.611 0.530 5.202 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -3.010 1.054 6.855 1.00 0.00 H new ATOM 2369 N GLU A 153 -3.523 5.437 5.224 1.00 0.00 N ATOM 2370 CA GLU A 153 -3.923 6.694 4.603 1.00 0.00 C ATOM 2371 C GLU A 153 -2.704 7.556 4.286 1.00 0.00 C ATOM 2372 O GLU A 153 -2.586 8.101 3.188 1.00 0.00 O ATOM 2373 CB GLU A 153 -4.888 7.459 5.512 1.00 0.00 C ATOM 2374 CG GLU A 153 -5.397 8.769 4.928 1.00 0.00 C ATOM 2375 CD GLU A 153 -6.386 9.429 5.847 1.00 0.00 C ATOM 2376 OE1 GLU A 153 -6.648 8.888 6.894 1.00 0.00 O ATOM 2377 OE2 GLU A 153 -6.794 10.529 5.557 1.00 0.00 O ATOM 0 H GLU A 153 -3.889 5.296 6.165 1.00 0.00 H new ATOM 0 HA GLU A 153 -4.433 6.461 3.668 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -5.742 6.819 5.736 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -4.389 7.667 6.458 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -4.557 9.441 4.751 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -5.865 8.581 3.961 1.00 0.00 H new ATOM 2384 N ASP A 154 -1.802 7.674 5.253 1.00 0.00 N ATOM 2385 CA ASP A 154 -0.586 8.458 5.073 1.00 0.00 C ATOM 2386 C ASP A 154 0.318 7.824 4.020 1.00 0.00 C ATOM 2387 O ASP A 154 1.002 8.523 3.273 1.00 0.00 O ATOM 2388 CB ASP A 154 0.165 8.599 6.399 1.00 0.00 C ATOM 2389 CG ASP A 154 -0.490 9.546 7.396 1.00 0.00 C ATOM 2390 OD1 ASP A 154 -1.372 10.272 7.004 1.00 0.00 O ATOM 2391 OD2 ASP A 154 -0.216 9.427 8.566 1.00 0.00 O ATOM 0 H ASP A 154 -1.890 7.237 6.170 1.00 0.00 H new ATOM 0 HA ASP A 154 -0.873 9.451 4.727 1.00 0.00 H new ATOM 0 HB2 ASP A 154 0.256 7.614 6.858 1.00 0.00 H new ATOM 0 HB3 ASP A 154 1.177 8.950 6.194 1.00 0.00 H new ATOM 2396 N ALA A 155 0.318 6.496 3.969 1.00 0.00 N ATOM 2397 CA ALA A 155 1.144 5.768 3.014 1.00 0.00 C ATOM 2398 C ALA A 155 0.693 6.036 1.582 1.00 0.00 C ATOM 2399 O ALA A 155 1.517 6.206 0.683 1.00 0.00 O ATOM 2400 CB ALA A 155 1.104 4.276 3.312 1.00 0.00 C ATOM 0 H ALA A 155 -0.245 5.902 4.578 1.00 0.00 H new ATOM 0 HA ALA A 155 2.170 6.120 3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 155 1.725 3.744 2.591 1.00 0.00 H new ATOM 0 HB2 ALA A 155 1.481 4.096 4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 155 0.077 3.918 3.240 1.00 0.00 H new ATOM 2406 N PHE A 156 -0.619 6.072 1.377 1.00 0.00 N ATOM 2407 CA PHE A 156 -1.180 6.405 0.072 1.00 0.00 C ATOM 2408 C PHE A 156 -0.850 7.846 -0.309 1.00 0.00 C ATOM 2409 O PHE A 156 -0.567 8.143 -1.469 1.00 0.00 O ATOM 2410 CB PHE A 156 -2.694 6.190 0.069 1.00 0.00 C ATOM 2411 CG PHE A 156 -3.104 4.773 -0.218 1.00 0.00 C ATOM 2412 CD1 PHE A 156 -2.732 4.154 -1.401 1.00 0.00 C ATOM 2413 CD2 PHE A 156 -3.864 4.057 0.695 1.00 0.00 C ATOM 2414 CE1 PHE A 156 -3.109 2.852 -1.668 1.00 0.00 C ATOM 2415 CE2 PHE A 156 -4.242 2.754 0.432 1.00 0.00 C ATOM 2416 CZ PHE A 156 -3.865 2.152 -0.749 1.00 0.00 C ATOM 0 H PHE A 156 -1.314 5.875 2.097 1.00 0.00 H new ATOM 0 HA PHE A 156 -0.732 5.743 -0.668 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -3.096 6.486 1.038 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -3.144 6.847 -0.676 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -2.140 4.696 -2.123 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -4.164 4.523 1.622 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -2.813 2.382 -2.594 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.833 2.207 1.152 1.00 0.00 H new ATOM 0 HZ PHE A 156 -4.161 1.134 -0.955 1.00 0.00 H new ATOM 2426 N TYR A 157 -0.890 8.735 0.676 1.00 0.00 N ATOM 2427 CA TYR A 157 -0.490 10.122 0.470 1.00 0.00 C ATOM 2428 C TYR A 157 0.991 10.214 0.113 1.00 0.00 C ATOM 2429 O TYR A 157 1.389 11.013 -0.736 1.00 0.00 O ATOM 2430 CB TYR A 157 -0.783 10.957 1.719 1.00 0.00 C ATOM 2431 CG TYR A 157 -2.257 11.090 2.035 1.00 0.00 C ATOM 2432 CD1 TYR A 157 -3.217 10.526 1.208 1.00 0.00 C ATOM 2433 CD2 TYR A 157 -2.683 11.779 3.161 1.00 0.00 C ATOM 2434 CE1 TYR A 157 -4.564 10.645 1.491 1.00 0.00 C ATOM 2435 CE2 TYR A 157 -4.027 11.904 3.455 1.00 0.00 C ATOM 2436 CZ TYR A 157 -4.965 11.335 2.617 1.00 0.00 C ATOM 2437 OH TYR A 157 -6.304 11.456 2.906 1.00 0.00 O ATOM 0 H TYR A 157 -1.195 8.521 1.625 1.00 0.00 H new ATOM 0 HA TYR A 157 -1.071 10.520 -0.362 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -0.278 10.506 2.573 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -0.358 11.952 1.587 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -2.906 9.984 0.327 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -1.952 12.225 3.819 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -5.298 10.201 0.835 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -4.342 12.444 4.336 1.00 0.00 H new ATOM 0 HH TYR A 157 -6.470 11.151 3.823 1.00 0.00 H new ATOM 2447 N THR A 158 1.803 9.390 0.766 1.00 0.00 N ATOM 2448 CA THR A 158 3.233 9.343 0.484 1.00 0.00 C ATOM 2449 C THR A 158 3.496 8.896 -0.949 1.00 0.00 C ATOM 2450 O THR A 158 4.359 9.448 -1.634 1.00 0.00 O ATOM 2451 CB THR A 158 3.968 8.396 1.451 1.00 0.00 C ATOM 2452 OG1 THR A 158 3.840 8.884 2.793 1.00 0.00 O ATOM 2453 CG2 THR A 158 5.442 8.303 1.088 1.00 0.00 C ATOM 0 H THR A 158 1.495 8.745 1.494 1.00 0.00 H new ATOM 0 HA THR A 158 3.615 10.355 0.622 1.00 0.00 H new ATOM 0 HB THR A 158 3.522 7.405 1.374 1.00 0.00 H new ATOM 0 HG1 THR A 158 2.902 8.830 3.073 1.00 0.00 H new ATOM 0 HG21 THR A 158 5.946 7.630 1.782 1.00 0.00 H new ATOM 0 HG22 THR A 158 5.543 7.920 0.073 1.00 0.00 H new ATOM 0 HG23 THR A 158 5.895 9.293 1.149 1.00 0.00 H new ATOM 2461 N LEU A 159 2.749 7.892 -1.398 1.00 0.00 N ATOM 2462 CA LEU A 159 2.850 7.420 -2.774 1.00 0.00 C ATOM 2463 C LEU A 159 2.514 8.535 -3.759 1.00 0.00 C ATOM 2464 O LEU A 159 3.188 8.705 -4.775 1.00 0.00 O ATOM 2465 CB LEU A 159 1.924 6.217 -2.993 1.00 0.00 C ATOM 2466 CG LEU A 159 2.373 4.916 -2.314 1.00 0.00 C ATOM 2467 CD1 LEU A 159 1.273 3.868 -2.415 1.00 0.00 C ATOM 2468 CD2 LEU A 159 3.654 4.418 -2.966 1.00 0.00 C ATOM 0 H LEU A 159 2.067 7.390 -0.829 1.00 0.00 H new ATOM 0 HA LEU A 159 3.879 7.108 -2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.929 6.473 -2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.835 6.037 -4.064 1.00 0.00 H new ATOM 0 HG LEU A 159 2.568 5.105 -1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 159 1.601 2.948 -1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 159 0.373 4.237 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 159 1.056 3.668 -3.464 1.00 0.00 H new ATOM 0 HD21 LEU A 159 3.972 3.494 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 159 3.475 4.231 -4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 159 4.434 5.171 -2.858 1.00 0.00 H new ATOM 2480 N VAL A 160 1.468 9.295 -3.450 1.00 0.00 N ATOM 2481 CA VAL A 160 1.067 10.420 -4.286 1.00 0.00 C ATOM 2482 C VAL A 160 2.140 11.503 -4.304 1.00 0.00 C ATOM 2483 O VAL A 160 2.465 12.050 -5.359 1.00 0.00 O ATOM 2484 CB VAL A 160 -0.262 11.034 -3.806 1.00 0.00 C ATOM 2485 CG1 VAL A 160 -0.519 12.361 -4.506 1.00 0.00 C ATOM 2486 CG2 VAL A 160 -1.414 10.072 -4.051 1.00 0.00 C ATOM 0 H VAL A 160 0.883 9.152 -2.627 1.00 0.00 H new ATOM 0 HA VAL A 160 0.933 10.030 -5.295 1.00 0.00 H new ATOM 0 HB VAL A 160 -0.189 11.217 -2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -1.462 12.781 -4.155 1.00 0.00 H new ATOM 0 HG12 VAL A 160 0.292 13.054 -4.282 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -0.572 12.200 -5.583 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.344 10.523 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.489 9.858 -5.117 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -1.236 9.145 -3.506 1.00 0.00 H new ATOM 2496 N ARG A 161 2.686 11.806 -3.132 1.00 0.00 N ATOM 2497 CA ARG A 161 3.719 12.828 -3.012 1.00 0.00 C ATOM 2498 C ARG A 161 4.986 12.410 -3.752 1.00 0.00 C ATOM 2499 O ARG A 161 5.686 13.245 -4.324 1.00 0.00 O ATOM 2500 CB ARG A 161 4.010 13.185 -1.562 1.00 0.00 C ATOM 2501 CG ARG A 161 2.870 13.878 -0.833 1.00 0.00 C ATOM 2502 CD ARG A 161 3.231 14.406 0.508 1.00 0.00 C ATOM 2503 NE ARG A 161 3.880 15.707 0.489 1.00 0.00 N ATOM 2504 CZ ARG A 161 4.675 16.180 1.468 1.00 0.00 C ATOM 2505 NH1 ARG A 161 4.893 15.482 2.560 1.00 0.00 N ATOM 2506 NH2 ARG A 161 5.212 17.378 1.313 1.00 0.00 N ATOM 0 H ARG A 161 2.431 11.359 -2.252 1.00 0.00 H new ATOM 0 HA ARG A 161 3.336 13.733 -3.484 1.00 0.00 H new ATOM 0 HB2 ARG A 161 4.266 12.273 -1.023 1.00 0.00 H new ATOM 0 HB3 ARG A 161 4.888 13.831 -1.531 1.00 0.00 H new ATOM 0 HG2 ARG A 161 2.508 14.701 -1.449 1.00 0.00 H new ATOM 0 HG3 ARG A 161 2.044 13.175 -0.723 1.00 0.00 H new ATOM 0 HD2 ARG A 161 2.327 14.474 1.113 1.00 0.00 H new ATOM 0 HD3 ARG A 161 3.891 13.692 1.000 1.00 0.00 H new ATOM 0 HE ARG A 161 3.722 16.304 -0.323 1.00 0.00 H new ATOM 0 HH11 ARG A 161 4.457 14.567 2.676 1.00 0.00 H new ATOM 0 HH12 ARG A 161 5.498 15.855 3.292 1.00 0.00 H new ATOM 0 HH21 ARG A 161 5.020 17.918 0.469 1.00 0.00 H new ATOM 0 HH22 ARG A 161 5.818 17.763 2.037 1.00 0.00 H new ATOM 2520 N GLU A 162 5.274 11.112 -3.736 1.00 0.00 N ATOM 2521 CA GLU A 162 6.394 10.570 -4.495 1.00 0.00 C ATOM 2522 C GLU A 162 6.166 10.733 -5.995 1.00 0.00 C ATOM 2523 O GLU A 162 7.100 11.014 -6.748 1.00 0.00 O ATOM 2524 CB GLU A 162 6.612 9.094 -4.152 1.00 0.00 C ATOM 2525 CG GLU A 162 7.268 8.854 -2.800 1.00 0.00 C ATOM 2526 CD GLU A 162 8.643 9.459 -2.745 1.00 0.00 C ATOM 2527 OE1 GLU A 162 9.439 9.157 -3.601 1.00 0.00 O ATOM 2528 OE2 GLU A 162 8.864 10.308 -1.914 1.00 0.00 O ATOM 0 H GLU A 162 4.747 10.417 -3.206 1.00 0.00 H new ATOM 0 HA GLU A 162 7.288 11.130 -4.220 1.00 0.00 H new ATOM 0 HB2 GLU A 162 5.649 8.583 -4.171 1.00 0.00 H new ATOM 0 HB3 GLU A 162 7.229 8.640 -4.928 1.00 0.00 H new ATOM 0 HG2 GLU A 162 6.648 9.282 -2.012 1.00 0.00 H new ATOM 0 HG3 GLU A 162 7.332 7.783 -2.609 1.00 0.00 H new ATOM 2535 N ILE A 163 4.921 10.555 -6.420 1.00 0.00 N ATOM 2536 CA ILE A 163 4.535 10.850 -7.795 1.00 0.00 C ATOM 2537 C ILE A 163 4.708 12.331 -8.110 1.00 0.00 C ATOM 2538 O ILE A 163 5.165 12.697 -9.193 1.00 0.00 O ATOM 2539 CB ILE A 163 3.076 10.442 -8.071 1.00 0.00 C ATOM 2540 CG1 ILE A 163 2.926 8.920 -8.008 1.00 0.00 C ATOM 2541 CG2 ILE A 163 2.623 10.969 -9.423 1.00 0.00 C ATOM 2542 CD1 ILE A 163 1.491 8.449 -7.949 1.00 0.00 C ATOM 0 H ILE A 163 4.162 10.208 -5.833 1.00 0.00 H new ATOM 0 HA ILE A 163 5.193 10.267 -8.439 1.00 0.00 H new ATOM 0 HB ILE A 163 2.442 10.882 -7.302 1.00 0.00 H new ATOM 0 HG12 ILE A 163 3.407 8.481 -8.882 1.00 0.00 H new ATOM 0 HG13 ILE A 163 3.457 8.548 -7.132 1.00 0.00 H new ATOM 0 HG21 ILE A 163 1.590 10.671 -9.602 1.00 0.00 H new ATOM 0 HG22 ILE A 163 2.694 12.057 -9.432 1.00 0.00 H new ATOM 0 HG23 ILE A 163 3.260 10.557 -10.206 1.00 0.00 H new ATOM 0 HD11 ILE A 163 1.467 7.360 -7.906 1.00 0.00 H new ATOM 0 HD12 ILE A 163 1.010 8.858 -7.060 1.00 0.00 H new ATOM 0 HD13 ILE A 163 0.960 8.789 -8.838 1.00 0.00 H new ATOM 2554 N ARG A 164 4.343 13.181 -7.155 1.00 0.00 N ATOM 2555 CA ARG A 164 4.438 14.624 -7.338 1.00 0.00 C ATOM 2556 C ARG A 164 5.895 15.061 -7.464 1.00 0.00 C ATOM 2557 O ARG A 164 6.203 16.029 -8.158 1.00 0.00 O ATOM 2558 CB ARG A 164 3.716 15.392 -6.242 1.00 0.00 C ATOM 2559 CG ARG A 164 2.201 15.255 -6.256 1.00 0.00 C ATOM 2560 CD ARG A 164 1.518 15.890 -5.100 1.00 0.00 C ATOM 2561 NE ARG A 164 1.647 17.337 -5.044 1.00 0.00 N ATOM 2562 CZ ARG A 164 0.901 18.200 -5.760 1.00 0.00 C ATOM 2563 NH1 ARG A 164 0.000 17.769 -6.614 1.00 0.00 N ATOM 2564 NH2 ARG A 164 1.116 19.494 -5.599 1.00 0.00 N ATOM 0 H ARG A 164 3.979 12.895 -6.246 1.00 0.00 H new ATOM 0 HA ARG A 164 3.931 14.867 -8.272 1.00 0.00 H new ATOM 0 HB2 ARG A 164 4.088 15.053 -5.275 1.00 0.00 H new ATOM 0 HB3 ARG A 164 3.972 16.448 -6.329 1.00 0.00 H new ATOM 0 HG2 ARG A 164 1.817 15.695 -7.176 1.00 0.00 H new ATOM 0 HG3 ARG A 164 1.944 14.196 -6.278 1.00 0.00 H new ATOM 0 HD2 ARG A 164 0.459 15.633 -5.134 1.00 0.00 H new ATOM 0 HD3 ARG A 164 1.919 15.466 -4.179 1.00 0.00 H new ATOM 0 HE ARG A 164 2.352 17.726 -4.418 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -0.143 16.767 -6.743 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -0.557 18.436 -7.148 1.00 0.00 H new ATOM 0 HH21 ARG A 164 1.831 19.815 -4.946 1.00 0.00 H new ATOM 0 HH22 ARG A 164 0.567 20.172 -6.127 1.00 0.00 H new ATOM 2578 N GLN A 165 6.783 14.342 -6.787 1.00 0.00 N ATOM 2579 CA GLN A 165 8.206 14.662 -6.817 1.00 0.00 C ATOM 2580 C GLN A 165 8.862 14.111 -8.080 1.00 0.00 C ATOM 2581 O GLN A 165 9.657 14.792 -8.726 1.00 0.00 O ATOM 2582 CB GLN A 165 8.909 14.098 -5.579 1.00 0.00 C ATOM 2583 CG GLN A 165 8.516 14.777 -4.278 1.00 0.00 C ATOM 2584 CD GLN A 165 8.846 13.931 -3.062 1.00 0.00 C ATOM 2585 OE1 GLN A 165 9.245 12.687 -3.298 1.00 0.00 O flip ATOM 2586 NE2 GLN A 165 8.747 14.393 -1.922 1.00 0.00 N flip ATOM 0 H GLN A 165 6.544 13.535 -6.211 1.00 0.00 H new ATOM 0 HA GLN A 165 8.305 15.747 -6.819 1.00 0.00 H new ATOM 0 HB2 GLN A 165 8.687 13.034 -5.502 1.00 0.00 H new ATOM 0 HB3 GLN A 165 9.987 14.190 -5.713 1.00 0.00 H new ATOM 0 HG2 GLN A 165 9.030 15.735 -4.201 1.00 0.00 H new ATOM 0 HG3 GLN A 165 7.447 14.989 -4.290 1.00 0.00 H new ATOM 0 HE21 GLN A 165 8.436 15.355 -1.787 1.00 0.00 H new ATOM 0 HE22 GLN A 165 8.976 13.813 -1.115 1.00 0.00 H new ATOM 2595 N HIS A 166 8.522 12.873 -8.425 1.00 0.00 N ATOM 2596 CA HIS A 166 9.114 12.212 -9.583 1.00 0.00 C ATOM 2597 C HIS A 166 8.465 12.697 -10.876 1.00 0.00 C ATOM 2598 O HIS A 166 9.151 12.989 -11.856 1.00 0.00 O ATOM 2599 CB HIS A 166 8.982 10.691 -9.467 1.00 0.00 C ATOM 2600 CG HIS A 166 9.683 10.116 -8.275 1.00 0.00 C ATOM 2601 ND1 HIS A 166 9.848 8.759 -8.092 1.00 0.00 N ATOM 2602 CD2 HIS A 166 10.261 10.713 -7.206 1.00 0.00 C ATOM 2603 CE1 HIS A 166 10.498 8.546 -6.961 1.00 0.00 C ATOM 2604 NE2 HIS A 166 10.760 9.715 -6.405 1.00 0.00 N ATOM 2605 OXT HIS A 166 7.271 12.798 -10.947 1.00 0.00 O ATOM 0 H HIS A 166 7.840 12.308 -7.920 1.00 0.00 H new ATOM 0 HA HIS A 166 10.173 12.469 -9.609 1.00 0.00 H new ATOM 0 HB2 HIS A 166 7.925 10.429 -9.417 1.00 0.00 H new ATOM 0 HB3 HIS A 166 9.382 10.230 -10.370 1.00 0.00 H new ATOM 0 HD1 HIS A 166 9.520 8.034 -8.730 1.00 0.00 H new ATOM 0 HD2 HIS A 166 10.319 11.775 -7.018 1.00 0.00 H new ATOM 0 HE1 HIS A 166 10.769 7.581 -6.560 1.00 0.00 H new