USER MOD reduce.3.24.130724 H: found=0, std=0, add=1297, rem=0, adj=42 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 64 TYR OH : rot 15:sc= 0.137 USER MOD Set 1.2: A 99 GLN : amide:sc= 0.606 X(o=0.74,f=0.96) USER MOD Set 2.1: A 94 HIS : no HD1:sc= 0.949 K(o=3,f=-4.6!) USER MOD Set 2.2: A 137 TYR OH : rot 171:sc= 2.04 USER MOD Set 3.1: A 65 SER OG : rot 160:sc= 0.302 USER MOD Set 3.2: A 67 MET CE :methyl -177:sc= -0.147 (180deg=-0.17) USER MOD Set 4.1: A 61 GLN : amide:sc= 1.56 K(o=2.1,f=-6.7!) USER MOD Set 4.2: A 96 TYR OH : rot 180:sc= 0.531 USER MOD Set 5.1: A 22 GLN : amide:sc= -0.338 K(o=0.49,f=-3.4!) USER MOD Set 5.2: A 150 GLN : amide:sc= 0.826 K(o=0.49,f=-1.9) USER MOD Set 6.1: A 16 LYS NZ :NH3+ -169:sc= 2.17 (180deg=1.84) USER MOD Set 6.2: A 58 THR OG1 : rot 150:sc= 0.636 USER MOD Single : A 1 MET CE :methyl 164:sc= -0.0332 (180deg=-0.356) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.627 (180deg=-0.0299) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 150:sc= 0.746 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot -23:sc= 1.25 USER MOD Single : A 20 THR OG1 : rot 157:sc= 0.708 USER MOD Single : A 25 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.31) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 27 HIS : no HE2:sc= 0.821 K(o=0.82,f=-3.5!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot -76:sc= 0.865 USER MOD Single : A 40 TYR OH : rot -10:sc= 0.866 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot -27:sc= 0.462 USER MOD Single : A 70 GLN : amide:sc= 0.042 X(o=0.042,f=0) USER MOD Single : A 71 TYR OH : rot -146:sc= 0.845 USER MOD Single : A 72 MET CE :methyl 180:sc= -1.28 (180deg=-1.28) USER MOD Single : A 74 THR OG1 : rot 81:sc= 0.0364 USER MOD Single : A 80 CYS SG : rot 10:sc= 0.165 USER MOD Single : A 85 ASN : amide:sc= -2.62! C(o=-2.6!,f=-9.1!) USER MOD Single : A 86 ASN : amide:sc= -1.11! C(o=-1.1!,f=-13!) 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 10:sc= -0.831! USER MOD Single : A 95 GLN :FLIP amide:sc= -0.0693 F(o=-2.2!,f=-0.069) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -172:sc= 0.982 (180deg=0.933) USER MOD Single : A 106 SER OG : rot 62:sc= 0.723 USER MOD Single : A 111 MET CE :methyl 173:sc= -0.293 (180deg=-0.422) USER MOD Single : A 116 ASN : amide:sc= 0.987 K(o=0.99,f=-9.9!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 98:sc= 0.478 USER MOD Single : A 124 THR OG1 : rot 52:sc= 0.512 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN :FLIP amide:sc= -0.146 F(o=-2.4!,f=-0.15) USER MOD Single : A 131 GLN :FLIP amide:sc= -0.211 F(o=-2.9!,f=-0.21) USER MOD Single : A 136 SER OG : rot -68:sc= 1.01 USER MOD Single : A 141 TYR OH : rot 26:sc= -0.0119 USER MOD Single : A 144 THR OG1 : rot -140:sc= -0.159 USER MOD Single : A 145 SER OG : rot 130:sc= 0.475 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc=-0.00266 USER MOD Single : A 157 TYR OH : rot 124:sc= 0.922 USER MOD Single : A 158 THR OG1 : rot 71:sc= 0.399 USER MOD Single : A 165 GLN :FLIP amide:sc= -0.146 F(o=-2.3!,f=-0.15) USER MOD Single : A 166 HIS : no HD1:sc= -0.127 X(o=-0.13,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.128 19.807 -8.701 1.00 0.00 N ATOM 2 CA MET A 1 -5.952 19.082 -9.661 1.00 0.00 C ATOM 3 C MET A 1 -5.150 17.979 -10.343 1.00 0.00 C ATOM 4 O MET A 1 -5.154 17.860 -11.569 1.00 0.00 O ATOM 5 CB MET A 1 -6.523 20.043 -10.702 1.00 0.00 C ATOM 6 CG MET A 1 -7.598 20.982 -10.170 1.00 0.00 C ATOM 7 SD MET A 1 -8.208 22.123 -11.425 1.00 0.00 S ATOM 8 CE MET A 1 -9.060 20.994 -12.523 1.00 0.00 C ATOM 0 H1 MET A 1 -5.432 19.572 -7.735 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.131 19.537 -8.825 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.232 20.830 -8.857 1.00 0.00 H new ATOM 0 HA MET A 1 -6.777 18.619 -9.120 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.709 20.639 -11.114 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.940 19.462 -11.525 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.430 20.393 -9.785 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.195 21.551 -9.332 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.722 21.557 -13.182 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.330 20.449 -13.122 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.647 20.289 -11.935 1.00 0.00 H new ATOM 18 N THR A 2 -4.460 17.173 -9.542 1.00 0.00 N ATOM 19 CA THR A 2 -3.663 16.072 -10.067 1.00 0.00 C ATOM 20 C THR A 2 -4.272 14.726 -9.694 1.00 0.00 C ATOM 21 O THR A 2 -4.670 14.512 -8.549 1.00 0.00 O ATOM 22 CB THR A 2 -2.212 16.130 -9.552 1.00 0.00 C ATOM 23 OG1 THR A 2 -1.602 17.357 -9.970 1.00 0.00 O ATOM 24 CG2 THR A 2 -1.408 14.957 -10.093 1.00 0.00 C ATOM 0 H THR A 2 -4.437 17.263 -8.526 1.00 0.00 H new ATOM 0 HA THR A 2 -3.657 16.176 -11.152 1.00 0.00 H new ATOM 0 HB THR A 2 -2.226 16.077 -8.463 1.00 0.00 H new ATOM 0 HG1 THR A 2 -0.680 17.393 -9.640 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.386 15.014 -9.719 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.863 14.022 -9.765 1.00 0.00 H new ATOM 0 HG23 THR A 2 -1.399 14.994 -11.182 1.00 0.00 H new ATOM 32 N GLU A 3 -4.340 13.822 -10.665 1.00 0.00 N ATOM 33 CA GLU A 3 -4.903 12.496 -10.437 1.00 0.00 C ATOM 34 C GLU A 3 -3.819 11.510 -10.010 1.00 0.00 C ATOM 35 O GLU A 3 -2.781 11.392 -10.662 1.00 0.00 O ATOM 36 CB GLU A 3 -5.611 11.990 -11.696 1.00 0.00 C ATOM 37 CG GLU A 3 -6.258 10.620 -11.545 1.00 0.00 C ATOM 38 CD GLU A 3 -6.907 10.178 -12.827 1.00 0.00 C ATOM 39 OE1 GLU A 3 -6.839 10.908 -13.787 1.00 0.00 O ATOM 40 OE2 GLU A 3 -7.373 9.065 -12.881 1.00 0.00 O ATOM 0 H GLU A 3 -4.012 13.983 -11.617 1.00 0.00 H new ATOM 0 HA GLU A 3 -5.633 12.574 -9.631 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.377 12.711 -11.982 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.890 11.950 -12.513 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -5.505 9.891 -11.246 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -7.003 10.653 -10.750 1.00 0.00 H new ATOM 47 N TYR A 4 -4.067 10.809 -8.911 1.00 0.00 N ATOM 48 CA TYR A 4 -3.098 9.860 -8.376 1.00 0.00 C ATOM 49 C TYR A 4 -3.664 8.441 -8.384 1.00 0.00 C ATOM 50 O TYR A 4 -4.658 8.152 -7.719 1.00 0.00 O ATOM 51 CB TYR A 4 -2.687 10.256 -6.955 1.00 0.00 C ATOM 52 CG TYR A 4 -1.977 11.588 -6.872 1.00 0.00 C ATOM 53 CD1 TYR A 4 -0.617 11.686 -7.131 1.00 0.00 C ATOM 54 CD2 TYR A 4 -2.666 12.743 -6.532 1.00 0.00 C ATOM 55 CE1 TYR A 4 0.037 12.900 -7.057 1.00 0.00 C ATOM 56 CE2 TYR A 4 -2.021 13.962 -6.454 1.00 0.00 C ATOM 57 CZ TYR A 4 -0.669 14.037 -6.718 1.00 0.00 C ATOM 58 OH TYR A 4 -0.021 15.248 -6.641 1.00 0.00 O ATOM 0 H TYR A 4 -4.930 10.879 -8.373 1.00 0.00 H new ATOM 0 HA TYR A 4 -2.216 9.882 -9.016 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -3.577 10.290 -6.326 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.037 9.483 -6.546 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -0.061 10.798 -7.395 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.725 12.688 -6.325 1.00 0.00 H new ATOM 0 HE1 TYR A 4 1.095 12.960 -7.263 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -2.572 14.852 -6.188 1.00 0.00 H new ATOM 0 HH TYR A 4 -0.646 15.968 -6.867 1.00 0.00 H new ATOM 68 N LYS A 5 -3.019 7.561 -9.143 1.00 0.00 N ATOM 69 CA LYS A 5 -3.506 6.196 -9.311 1.00 0.00 C ATOM 70 C LYS A 5 -2.776 5.240 -8.371 1.00 0.00 C ATOM 71 O LYS A 5 -1.591 4.958 -8.554 1.00 0.00 O ATOM 72 CB LYS A 5 -3.338 5.741 -10.761 1.00 0.00 C ATOM 73 CG LYS A 5 -4.158 6.538 -11.768 1.00 0.00 C ATOM 74 CD LYS A 5 -3.844 6.116 -13.195 1.00 0.00 C ATOM 75 CE LYS A 5 -4.722 6.850 -14.198 1.00 0.00 C ATOM 76 NZ LYS A 5 -4.456 6.415 -15.596 1.00 0.00 N ATOM 0 H LYS A 5 -2.159 7.768 -9.651 1.00 0.00 H new ATOM 0 HA LYS A 5 -4.567 6.182 -9.061 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -2.284 5.811 -11.032 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.617 4.690 -10.834 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.220 6.395 -11.570 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.952 7.602 -11.647 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.795 6.316 -13.413 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.991 5.041 -13.299 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.771 6.675 -13.958 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.550 7.923 -14.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.075 6.940 -16.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -3.462 6.605 -15.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.645 5.396 -15.684 1.00 0.00 H new ATOM 90 N LEU A 6 -3.491 4.744 -7.368 1.00 0.00 N ATOM 91 CA LEU A 6 -2.895 3.870 -6.363 1.00 0.00 C ATOM 92 C LEU A 6 -3.346 2.425 -6.562 1.00 0.00 C ATOM 93 O LEU A 6 -4.537 2.147 -6.690 1.00 0.00 O ATOM 94 CB LEU A 6 -3.259 4.356 -4.954 1.00 0.00 C ATOM 95 CG LEU A 6 -2.839 3.422 -3.813 1.00 0.00 C ATOM 96 CD1 LEU A 6 -1.319 3.376 -3.708 1.00 0.00 C ATOM 97 CD2 LEU A 6 -3.454 3.903 -2.508 1.00 0.00 C ATOM 0 H LEU A 6 -4.484 4.932 -7.228 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.812 3.905 -6.477 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.798 5.331 -4.793 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -4.338 4.502 -4.905 1.00 0.00 H new ATOM 0 HG LEU A 6 -3.198 2.414 -4.019 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -1.030 2.710 -2.895 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -0.901 3.008 -4.645 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.938 4.378 -3.509 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.155 3.238 -1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -3.108 4.914 -2.294 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -4.540 3.902 -2.596 1.00 0.00 H new ATOM 109 N VAL A 7 -2.381 1.509 -6.585 1.00 0.00 N ATOM 110 CA VAL A 7 -2.681 0.084 -6.523 1.00 0.00 C ATOM 111 C VAL A 7 -2.349 -0.489 -5.150 1.00 0.00 C ATOM 112 O VAL A 7 -1.203 -0.433 -4.703 1.00 0.00 O ATOM 113 CB VAL A 7 -1.908 -0.704 -7.598 1.00 0.00 C ATOM 114 CG1 VAL A 7 -2.199 -2.193 -7.479 1.00 0.00 C ATOM 115 CG2 VAL A 7 -2.268 -0.202 -8.989 1.00 0.00 C ATOM 0 H VAL A 7 -1.387 1.729 -6.646 1.00 0.00 H new ATOM 0 HA VAL A 7 -3.750 -0.020 -6.708 1.00 0.00 H new ATOM 0 HB VAL A 7 -0.841 -0.547 -7.440 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -1.645 -2.734 -8.246 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -1.894 -2.546 -6.494 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -3.267 -2.367 -7.612 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.713 -0.770 -9.736 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -3.337 -0.330 -9.157 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.012 0.854 -9.072 1.00 0.00 H new ATOM 125 N VAL A 8 -3.359 -1.040 -4.484 1.00 0.00 N ATOM 126 CA VAL A 8 -3.177 -1.618 -3.158 1.00 0.00 C ATOM 127 C VAL A 8 -3.054 -3.134 -3.232 1.00 0.00 C ATOM 128 O VAL A 8 -3.925 -3.813 -3.777 1.00 0.00 O ATOM 129 CB VAL A 8 -4.339 -1.250 -2.218 1.00 0.00 C ATOM 130 CG1 VAL A 8 -4.144 -1.895 -0.853 1.00 0.00 C ATOM 131 CG2 VAL A 8 -4.456 0.261 -2.078 1.00 0.00 C ATOM 0 H VAL A 8 -4.312 -1.098 -4.842 1.00 0.00 H new ATOM 0 HA VAL A 8 -2.253 -1.202 -2.756 1.00 0.00 H new ATOM 0 HB VAL A 8 -5.264 -1.629 -2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -4.974 -1.625 -0.201 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -4.108 -2.979 -0.964 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -3.210 -1.544 -0.415 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -5.283 0.502 -1.410 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -3.529 0.661 -1.667 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -4.640 0.704 -3.057 1.00 0.00 H new ATOM 141 N VAL A 9 -1.967 -3.664 -2.678 1.00 0.00 N ATOM 142 CA VAL A 9 -1.743 -5.104 -2.658 1.00 0.00 C ATOM 143 C VAL A 9 -1.377 -5.583 -1.257 1.00 0.00 C ATOM 144 O VAL A 9 -0.675 -4.895 -0.517 1.00 0.00 O ATOM 145 CB VAL A 9 -0.630 -5.517 -3.639 1.00 0.00 C ATOM 146 CG1 VAL A 9 -0.329 -7.003 -3.509 1.00 0.00 C ATOM 147 CG2 VAL A 9 -1.027 -5.180 -5.068 1.00 0.00 C ATOM 0 H VAL A 9 -1.228 -3.116 -2.237 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.677 -5.573 -2.967 1.00 0.00 H new ATOM 0 HB VAL A 9 0.272 -4.958 -3.390 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.460 -7.277 -4.210 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.003 -7.221 -2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -1.228 -7.577 -3.732 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -0.229 -5.479 -5.747 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.942 -5.713 -5.327 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.195 -4.107 -5.155 1.00 0.00 H new ATOM 157 N GLY A 10 -1.858 -6.770 -0.899 1.00 0.00 N ATOM 158 CA GLY A 10 -1.568 -7.323 0.411 1.00 0.00 C ATOM 159 C GLY A 10 -2.281 -8.637 0.656 1.00 0.00 C ATOM 160 O GLY A 10 -3.039 -9.108 -0.193 1.00 0.00 O ATOM 0 H GLY A 10 -2.443 -7.358 -1.493 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.493 -7.473 0.509 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.861 -6.606 1.178 1.00 0.00 H new ATOM 164 N ALA A 11 -2.039 -9.233 1.819 1.00 0.00 N ATOM 165 CA ALA A 11 -2.664 -10.502 2.173 1.00 0.00 C ATOM 166 C ALA A 11 -4.113 -10.298 2.601 1.00 0.00 C ATOM 167 O ALA A 11 -4.397 -9.546 3.534 1.00 0.00 O ATOM 168 CB ALA A 11 -1.877 -11.187 3.279 1.00 0.00 C ATOM 0 H ALA A 11 -1.414 -8.857 2.532 1.00 0.00 H new ATOM 0 HA ALA A 11 -2.659 -11.141 1.290 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.355 -12.133 3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.859 -11.375 2.938 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.852 -10.545 4.159 1.00 0.00 H new ATOM 174 N GLY A 12 -5.029 -10.971 1.912 1.00 0.00 N ATOM 175 CA GLY A 12 -6.430 -10.916 2.289 1.00 0.00 C ATOM 176 C GLY A 12 -6.725 -11.717 3.542 1.00 0.00 C ATOM 177 O GLY A 12 -6.165 -12.793 3.746 1.00 0.00 O ATOM 0 H GLY A 12 -4.826 -11.553 1.099 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -6.720 -9.877 2.449 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.039 -11.294 1.468 1.00 0.00 H new ATOM 181 N GLY A 13 -7.608 -11.190 4.384 1.00 0.00 N ATOM 182 CA GLY A 13 -7.966 -11.878 5.611 1.00 0.00 C ATOM 183 C GLY A 13 -9.073 -11.172 6.369 1.00 0.00 C ATOM 184 O GLY A 13 -10.219 -11.621 6.370 1.00 0.00 O ATOM 0 H GLY A 13 -8.082 -10.299 4.239 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.282 -12.894 5.375 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.086 -11.958 6.249 1.00 0.00 H new ATOM 188 N VAL A 14 -8.729 -10.066 7.021 1.00 0.00 N ATOM 189 CA VAL A 14 -9.683 -9.336 7.847 1.00 0.00 C ATOM 190 C VAL A 14 -10.582 -8.448 6.994 1.00 0.00 C ATOM 191 O VAL A 14 -11.804 -8.472 7.129 1.00 0.00 O ATOM 192 CB VAL A 14 -8.971 -8.470 8.902 1.00 0.00 C ATOM 193 CG1 VAL A 14 -9.979 -7.619 9.661 1.00 0.00 C ATOM 194 CG2 VAL A 14 -8.182 -9.343 9.865 1.00 0.00 C ATOM 0 H VAL A 14 -7.796 -9.656 6.993 1.00 0.00 H new ATOM 0 HA VAL A 14 -10.293 -10.081 8.357 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.275 -7.807 8.389 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.458 -7.013 10.403 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -10.503 -6.967 8.963 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.698 -8.267 10.162 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -7.686 -8.713 10.603 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.859 -10.031 10.371 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -7.435 -9.912 9.312 1.00 0.00 H new ATOM 204 N GLY A 15 -9.967 -7.665 6.114 1.00 0.00 N ATOM 205 CA GLY A 15 -10.711 -6.684 5.345 1.00 0.00 C ATOM 206 C GLY A 15 -9.832 -5.914 4.380 1.00 0.00 C ATOM 207 O GLY A 15 -9.750 -4.687 4.447 1.00 0.00 O ATOM 0 H GLY A 15 -8.966 -7.692 5.919 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -11.502 -7.187 4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -11.196 -5.985 6.026 1.00 0.00 H new ATOM 211 N LYS A 16 -9.170 -6.634 3.482 1.00 0.00 N ATOM 212 CA LYS A 16 -8.283 -6.013 2.505 1.00 0.00 C ATOM 213 C LYS A 16 -9.004 -4.905 1.745 1.00 0.00 C ATOM 214 O LYS A 16 -8.488 -3.795 1.612 1.00 0.00 O ATOM 215 CB LYS A 16 -7.743 -7.059 1.527 1.00 0.00 C ATOM 216 CG LYS A 16 -6.798 -6.502 0.470 1.00 0.00 C ATOM 217 CD LYS A 16 -6.310 -7.598 -0.466 1.00 0.00 C ATOM 218 CE LYS A 16 -5.294 -7.061 -1.464 1.00 0.00 C ATOM 219 NZ LYS A 16 -5.942 -6.278 -2.551 1.00 0.00 N ATOM 0 H LYS A 16 -9.231 -7.650 3.410 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.444 -5.572 3.044 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -7.222 -7.832 2.092 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.584 -7.541 1.028 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.307 -5.729 -0.106 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -5.945 -6.028 0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.861 -8.403 0.116 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.158 -8.026 -1.001 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.573 -6.431 -0.944 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.737 -7.892 -1.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -5.249 -6.089 -3.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.739 -6.820 -2.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.292 -5.376 -2.168 1.00 0.00 H new ATOM 233 N SER A 17 -10.199 -5.210 1.251 1.00 0.00 N ATOM 234 CA SER A 17 -11.013 -4.223 0.551 1.00 0.00 C ATOM 235 C SER A 17 -11.435 -3.100 1.495 1.00 0.00 C ATOM 236 O SER A 17 -11.450 -1.930 1.115 1.00 0.00 O ATOM 237 CB SER A 17 -12.230 -4.888 -0.062 1.00 0.00 C ATOM 238 OG SER A 17 -11.892 -5.707 -1.148 1.00 0.00 O ATOM 0 H SER A 17 -10.626 -6.134 1.322 1.00 0.00 H new ATOM 0 HA SER A 17 -10.414 -3.786 -0.248 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.738 -5.484 0.697 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.934 -4.123 -0.390 1.00 0.00 H new ATOM 0 HG SER A 17 -11.035 -5.415 -1.523 1.00 0.00 H new ATOM 244 N ALA A 18 -11.778 -3.467 2.724 1.00 0.00 N ATOM 245 CA ALA A 18 -12.222 -2.495 3.715 1.00 0.00 C ATOM 246 C ALA A 18 -11.130 -1.473 4.009 1.00 0.00 C ATOM 247 O ALA A 18 -11.401 -0.278 4.133 1.00 0.00 O ATOM 248 CB ALA A 18 -12.644 -3.201 4.995 1.00 0.00 C ATOM 0 H ALA A 18 -11.757 -4.431 3.058 1.00 0.00 H new ATOM 0 HA ALA A 18 -13.081 -1.963 3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.973 -2.463 5.726 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.462 -3.888 4.779 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -11.799 -3.759 5.398 1.00 0.00 H new ATOM 254 N LEU A 19 -9.895 -1.949 4.119 1.00 0.00 N ATOM 255 CA LEU A 19 -8.755 -1.071 4.363 1.00 0.00 C ATOM 256 C LEU A 19 -8.509 -0.152 3.172 1.00 0.00 C ATOM 257 O LEU A 19 -8.200 1.029 3.338 1.00 0.00 O ATOM 258 CB LEU A 19 -7.501 -1.901 4.668 1.00 0.00 C ATOM 259 CG LEU A 19 -6.221 -1.087 4.901 1.00 0.00 C ATOM 260 CD1 LEU A 19 -6.412 -0.140 6.078 1.00 0.00 C ATOM 261 CD2 LEU A 19 -5.057 -2.033 5.154 1.00 0.00 C ATOM 0 H LEU A 19 -9.657 -2.938 4.043 1.00 0.00 H new ATOM 0 HA LEU A 19 -8.983 -0.448 5.228 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.693 -2.508 5.553 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -7.330 -2.589 3.840 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.003 -0.490 4.015 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.498 0.433 6.236 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.236 0.541 5.867 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.638 -0.716 6.975 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.148 -1.455 5.319 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.266 -2.640 6.035 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.922 -2.683 4.289 1.00 0.00 H new ATOM 273 N THR A 20 -8.651 -0.701 1.969 1.00 0.00 N ATOM 274 CA THR A 20 -8.488 0.081 0.749 1.00 0.00 C ATOM 275 C THR A 20 -9.592 1.122 0.611 1.00 0.00 C ATOM 276 O THR A 20 -9.329 2.278 0.277 1.00 0.00 O ATOM 277 CB THR A 20 -8.486 -0.819 -0.502 1.00 0.00 C ATOM 278 OG1 THR A 20 -7.396 -1.747 -0.424 1.00 0.00 O ATOM 279 CG2 THR A 20 -8.343 0.022 -1.762 1.00 0.00 C ATOM 0 H THR A 20 -8.878 -1.683 1.814 1.00 0.00 H new ATOM 0 HA THR A 20 -7.525 0.585 0.825 1.00 0.00 H new ATOM 0 HB THR A 20 -9.431 -1.361 -0.544 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.588 -2.525 -0.988 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.343 -0.629 -2.636 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.177 0.721 -1.830 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.406 0.578 -1.724 1.00 0.00 H new ATOM 287 N ILE A 21 -10.827 0.707 0.873 1.00 0.00 N ATOM 288 CA ILE A 21 -11.984 1.564 0.650 1.00 0.00 C ATOM 289 C ILE A 21 -12.057 2.671 1.697 1.00 0.00 C ATOM 290 O ILE A 21 -12.430 3.804 1.391 1.00 0.00 O ATOM 291 CB ILE A 21 -13.296 0.759 0.672 1.00 0.00 C ATOM 292 CG1 ILE A 21 -13.381 -0.157 -0.552 1.00 0.00 C ATOM 293 CG2 ILE A 21 -14.494 1.696 0.724 1.00 0.00 C ATOM 294 CD1 ILE A 21 -14.499 -1.172 -0.479 1.00 0.00 C ATOM 0 H ILE A 21 -11.052 -0.218 1.240 1.00 0.00 H new ATOM 0 HA ILE A 21 -11.861 2.010 -0.337 1.00 0.00 H new ATOM 0 HB ILE A 21 -13.307 0.138 1.568 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -13.517 0.455 -1.443 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -12.433 -0.682 -0.667 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -15.413 1.111 0.739 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -14.439 2.308 1.624 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -14.489 2.342 -0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -14.495 -1.783 -1.381 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.355 -1.810 0.393 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -15.455 -0.655 -0.396 1.00 0.00 H new ATOM 306 N GLN A 22 -11.699 2.335 2.931 1.00 0.00 N ATOM 307 CA GLN A 22 -11.800 3.279 4.038 1.00 0.00 C ATOM 308 C GLN A 22 -10.853 4.456 3.839 1.00 0.00 C ATOM 309 O GLN A 22 -11.062 5.536 4.393 1.00 0.00 O ATOM 310 CB GLN A 22 -11.491 2.583 5.367 1.00 0.00 C ATOM 311 CG GLN A 22 -10.035 2.184 5.537 1.00 0.00 C ATOM 312 CD GLN A 22 -9.201 3.288 6.157 1.00 0.00 C ATOM 313 OE1 GLN A 22 -9.700 4.091 6.950 1.00 0.00 O ATOM 314 NE2 GLN A 22 -7.924 3.337 5.797 1.00 0.00 N ATOM 0 H GLN A 22 -11.337 1.417 3.190 1.00 0.00 H new ATOM 0 HA GLN A 22 -12.822 3.656 4.063 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -11.772 3.246 6.185 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -12.113 1.692 5.451 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -9.976 1.293 6.162 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -9.618 1.920 4.565 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -7.553 2.652 5.138 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -7.314 4.059 6.179 1.00 0.00 H new ATOM 323 N LEU A 23 -9.809 4.241 3.046 1.00 0.00 N ATOM 324 CA LEU A 23 -8.873 5.308 2.707 1.00 0.00 C ATOM 325 C LEU A 23 -9.521 6.322 1.770 1.00 0.00 C ATOM 326 O LEU A 23 -9.449 7.530 2.000 1.00 0.00 O ATOM 327 CB LEU A 23 -7.606 4.723 2.071 1.00 0.00 C ATOM 328 CG LEU A 23 -6.584 5.757 1.581 1.00 0.00 C ATOM 329 CD1 LEU A 23 -6.216 6.704 2.716 1.00 0.00 C ATOM 330 CD2 LEU A 23 -5.349 5.041 1.054 1.00 0.00 C ATOM 0 H LEU A 23 -9.589 3.338 2.626 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.596 5.824 3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.121 4.073 2.799 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.898 4.097 1.228 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.019 6.345 0.773 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.490 7.435 2.359 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.111 7.221 3.063 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.784 6.135 3.539 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.623 5.776 0.706 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.907 4.444 1.851 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.631 4.390 0.227 1.00 0.00 H new ATOM 342 N ILE A 24 -10.156 5.823 0.713 1.00 0.00 N ATOM 343 CA ILE A 24 -10.751 6.688 -0.298 1.00 0.00 C ATOM 344 C ILE A 24 -12.080 7.262 0.183 1.00 0.00 C ATOM 345 O ILE A 24 -12.496 8.335 -0.251 1.00 0.00 O ATOM 346 CB ILE A 24 -10.975 5.935 -1.622 1.00 0.00 C ATOM 347 CG1 ILE A 24 -11.170 6.927 -2.773 1.00 0.00 C ATOM 348 CG2 ILE A 24 -12.172 5.004 -1.510 1.00 0.00 C ATOM 349 CD1 ILE A 24 -9.933 7.731 -3.102 1.00 0.00 C ATOM 0 H ILE A 24 -10.271 4.825 0.536 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.048 7.503 -0.470 1.00 0.00 H new ATOM 0 HB ILE A 24 -10.091 5.332 -1.832 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -11.484 6.380 -3.662 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -11.979 7.611 -2.517 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -12.315 4.480 -2.455 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.996 4.278 -0.716 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -13.065 5.585 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -10.149 8.411 -3.926 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -9.630 8.306 -2.227 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -9.127 7.057 -3.390 1.00 0.00 H new ATOM 361 N GLN A 25 -12.738 6.540 1.084 1.00 0.00 N ATOM 362 CA GLN A 25 -14.051 6.943 1.573 1.00 0.00 C ATOM 363 C GLN A 25 -13.944 7.591 2.950 1.00 0.00 C ATOM 364 O GLN A 25 -14.807 8.372 3.349 1.00 0.00 O ATOM 365 CB GLN A 25 -14.993 5.739 1.637 1.00 0.00 C ATOM 366 CG GLN A 25 -15.311 5.123 0.286 1.00 0.00 C ATOM 367 CD GLN A 25 -16.028 6.091 -0.635 1.00 0.00 C ATOM 368 OE1 GLN A 25 -16.934 6.816 -0.215 1.00 0.00 O ATOM 369 NE2 GLN A 25 -15.631 6.105 -1.903 1.00 0.00 N ATOM 0 H GLN A 25 -12.384 5.674 1.490 1.00 0.00 H new ATOM 0 HA GLN A 25 -14.458 7.675 0.875 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -14.546 4.976 2.275 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -15.925 6.046 2.112 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -14.386 4.793 -0.187 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -15.929 4.237 0.430 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -14.878 5.489 -2.208 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -16.080 6.732 -2.571 1.00 0.00 H new ATOM 378 N ASN A 26 -12.878 7.261 3.672 1.00 0.00 N ATOM 379 CA ASN A 26 -12.715 7.719 5.047 1.00 0.00 C ATOM 380 C ASN A 26 -13.714 7.028 5.971 1.00 0.00 C ATOM 381 O ASN A 26 -13.929 7.460 7.105 1.00 0.00 O ATOM 382 CB ASN A 26 -12.854 9.227 5.153 1.00 0.00 C ATOM 383 CG ASN A 26 -11.740 9.985 4.486 1.00 0.00 C ATOM 384 OD1 ASN A 26 -10.600 9.514 4.410 1.00 0.00 O ATOM 385 ND2 ASN A 26 -12.045 11.189 4.074 1.00 0.00 N ATOM 0 H ASN A 26 -12.115 6.678 3.328 1.00 0.00 H new ATOM 0 HA ASN A 26 -11.706 7.453 5.362 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -13.803 9.528 4.709 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -12.892 9.506 6.206 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -11.325 11.786 3.667 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -13.002 11.530 4.160 1.00 0.00 H new ATOM 392 N HIS A 27 -14.322 5.953 5.480 1.00 0.00 N ATOM 393 CA HIS A 27 -15.308 5.212 6.255 1.00 0.00 C ATOM 394 C HIS A 27 -15.158 3.709 6.033 1.00 0.00 C ATOM 395 O HIS A 27 -14.790 3.266 4.945 1.00 0.00 O ATOM 396 CB HIS A 27 -16.729 5.658 5.894 1.00 0.00 C ATOM 397 CG HIS A 27 -17.031 7.073 6.276 1.00 0.00 C ATOM 398 ND1 HIS A 27 -16.650 8.150 5.503 1.00 0.00 N ATOM 399 CD2 HIS A 27 -17.676 7.588 7.349 1.00 0.00 C ATOM 400 CE1 HIS A 27 -17.049 9.268 6.084 1.00 0.00 C ATOM 401 NE2 HIS A 27 -17.673 8.954 7.205 1.00 0.00 N ATOM 0 H HIS A 27 -14.148 5.576 4.548 1.00 0.00 H new ATOM 0 HA HIS A 27 -15.132 5.425 7.309 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -16.875 5.542 4.820 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -17.443 4.998 6.386 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -16.140 8.093 4.621 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -18.111 7.030 8.165 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -16.892 10.268 5.707 1.00 0.00 H new ATOM 408 N PHE A 28 -15.440 2.931 7.072 1.00 0.00 N ATOM 409 CA PHE A 28 -15.407 1.477 6.970 1.00 0.00 C ATOM 410 C PHE A 28 -16.781 0.926 6.605 1.00 0.00 C ATOM 411 O PHE A 28 -17.758 1.131 7.327 1.00 0.00 O ATOM 412 CB PHE A 28 -14.920 0.857 8.281 1.00 0.00 C ATOM 413 CG PHE A 28 -13.440 0.988 8.500 1.00 0.00 C ATOM 414 CD1 PHE A 28 -12.563 0.036 8.002 1.00 0.00 C ATOM 415 CD2 PHE A 28 -12.921 2.064 9.203 1.00 0.00 C ATOM 416 CE1 PHE A 28 -11.202 0.153 8.204 1.00 0.00 C ATOM 417 CE2 PHE A 28 -11.559 2.186 9.405 1.00 0.00 C ATOM 418 CZ PHE A 28 -10.699 1.231 8.906 1.00 0.00 C ATOM 0 H PHE A 28 -15.694 3.283 7.995 1.00 0.00 H new ATOM 0 HA PHE A 28 -14.708 1.211 6.177 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -15.444 1.329 9.112 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -15.188 -0.200 8.294 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -12.949 -0.808 7.449 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -13.589 2.816 9.598 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -10.531 -0.598 7.813 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -11.168 3.030 9.954 1.00 0.00 H new ATOM 0 HZ PHE A 28 -9.635 1.326 9.064 1.00 0.00 H new ATOM 428 N VAL A 29 -16.851 0.225 5.476 1.00 0.00 N ATOM 429 CA VAL A 29 -18.111 -0.332 4.999 1.00 0.00 C ATOM 430 C VAL A 29 -17.984 -1.828 4.734 1.00 0.00 C ATOM 431 O VAL A 29 -16.880 -2.351 4.578 1.00 0.00 O ATOM 432 CB VAL A 29 -18.589 0.369 3.714 1.00 0.00 C ATOM 433 CG1 VAL A 29 -18.845 1.846 3.978 1.00 0.00 C ATOM 434 CG2 VAL A 29 -17.568 0.198 2.602 1.00 0.00 C ATOM 0 H VAL A 29 -16.050 0.030 4.876 1.00 0.00 H new ATOM 0 HA VAL A 29 -18.847 -0.166 5.786 1.00 0.00 H new ATOM 0 HB VAL A 29 -19.524 -0.093 3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -19.182 2.327 3.060 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -19.612 1.951 4.745 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -17.924 2.320 4.318 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -17.923 0.700 1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -16.618 0.634 2.910 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -17.430 -0.863 2.395 1.00 0.00 H new ATOM 444 N ASP A 30 -19.122 -2.513 4.683 1.00 0.00 N ATOM 445 CA ASP A 30 -19.143 -3.939 4.381 1.00 0.00 C ATOM 446 C ASP A 30 -18.824 -4.188 2.910 1.00 0.00 C ATOM 447 O ASP A 30 -18.347 -5.260 2.542 1.00 0.00 O ATOM 448 CB ASP A 30 -20.503 -4.544 4.737 1.00 0.00 C ATOM 449 CG ASP A 30 -20.757 -4.685 6.232 1.00 0.00 C ATOM 450 OD1 ASP A 30 -19.824 -4.553 6.988 1.00 0.00 O ATOM 451 OD2 ASP A 30 -21.899 -4.766 6.616 1.00 0.00 O ATOM 0 H ASP A 30 -20.042 -2.103 4.847 1.00 0.00 H new ATOM 0 HA ASP A 30 -18.376 -4.423 4.986 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -21.288 -3.923 4.305 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -20.582 -5.527 4.273 1.00 0.00 H new ATOM 456 N GLU A 31 -19.094 -3.190 2.074 1.00 0.00 N ATOM 457 CA GLU A 31 -18.821 -3.296 0.646 1.00 0.00 C ATOM 458 C GLU A 31 -17.359 -3.656 0.396 1.00 0.00 C ATOM 459 O GLU A 31 -16.453 -3.068 0.988 1.00 0.00 O ATOM 460 CB GLU A 31 -19.172 -1.988 -0.067 1.00 0.00 C ATOM 461 CG GLU A 31 -18.938 -2.009 -1.571 1.00 0.00 C ATOM 462 CD GLU A 31 -19.350 -0.710 -2.205 1.00 0.00 C ATOM 463 OE1 GLU A 31 -19.883 0.125 -1.514 1.00 0.00 O ATOM 464 OE2 GLU A 31 -19.031 -0.505 -3.353 1.00 0.00 O ATOM 0 H GLU A 31 -19.501 -2.300 2.361 1.00 0.00 H new ATOM 0 HA GLU A 31 -19.445 -4.093 0.242 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -20.220 -1.755 0.122 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -18.583 -1.181 0.369 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -17.884 -2.198 -1.775 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -19.501 -2.829 -2.018 1.00 0.00 H new ATOM 471 N TYR A 32 -17.137 -4.626 -0.485 1.00 0.00 N ATOM 472 CA TYR A 32 -15.785 -5.033 -0.848 1.00 0.00 C ATOM 473 C TYR A 32 -15.561 -4.895 -2.352 1.00 0.00 C ATOM 474 O TYR A 32 -16.510 -4.766 -3.123 1.00 0.00 O ATOM 475 CB TYR A 32 -15.521 -6.474 -0.407 1.00 0.00 C ATOM 476 CG TYR A 32 -16.367 -7.501 -1.126 1.00 0.00 C ATOM 477 CD1 TYR A 32 -17.623 -7.846 -0.653 1.00 0.00 C ATOM 478 CD2 TYR A 32 -15.906 -8.123 -2.278 1.00 0.00 C ATOM 479 CE1 TYR A 32 -18.400 -8.784 -1.306 1.00 0.00 C ATOM 480 CE2 TYR A 32 -16.673 -9.062 -2.940 1.00 0.00 C ATOM 481 CZ TYR A 32 -17.921 -9.389 -2.450 1.00 0.00 C ATOM 482 OH TYR A 32 -18.690 -10.323 -3.105 1.00 0.00 O ATOM 0 H TYR A 32 -17.876 -5.144 -0.960 1.00 0.00 H new ATOM 0 HA TYR A 32 -15.085 -4.375 -0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -14.469 -6.706 -0.570 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -15.703 -6.554 0.665 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -18.001 -7.374 0.242 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -14.930 -7.868 -2.664 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -19.376 -9.042 -0.923 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -16.299 -9.537 -3.835 1.00 0.00 H new ATOM 0 HH TYR A 32 -18.207 -10.651 -3.892 1.00 0.00 H new ATOM 492 N ASP A 33 -14.296 -4.922 -2.758 1.00 0.00 N ATOM 493 CA ASP A 33 -13.947 -4.869 -4.174 1.00 0.00 C ATOM 494 C ASP A 33 -13.866 -6.271 -4.767 1.00 0.00 C ATOM 495 O ASP A 33 -12.995 -7.069 -4.420 1.00 0.00 O ATOM 496 CB ASP A 33 -12.621 -4.132 -4.374 1.00 0.00 C ATOM 497 CG ASP A 33 -12.226 -3.934 -5.832 1.00 0.00 C ATOM 498 OD1 ASP A 33 -12.874 -4.493 -6.684 1.00 0.00 O ATOM 499 OD2 ASP A 33 -11.384 -3.107 -6.091 1.00 0.00 O ATOM 0 H ASP A 33 -13.496 -4.980 -2.128 1.00 0.00 H new ATOM 0 HA ASP A 33 -14.733 -4.321 -4.694 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.685 -3.157 -3.892 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -11.831 -4.687 -3.868 1.00 0.00 H new ATOM 504 N PRO A 34 -14.794 -6.581 -5.684 1.00 0.00 N ATOM 505 CA PRO A 34 -14.884 -7.907 -6.304 1.00 0.00 C ATOM 506 C PRO A 34 -13.773 -8.149 -7.318 1.00 0.00 C ATOM 507 O PRO A 34 -13.056 -7.225 -7.701 1.00 0.00 O ATOM 508 CB PRO A 34 -16.266 -7.912 -6.963 1.00 0.00 C ATOM 509 CG PRO A 34 -16.541 -6.478 -7.264 1.00 0.00 C ATOM 510 CD PRO A 34 -15.932 -5.707 -6.123 1.00 0.00 C ATOM 0 HA PRO A 34 -14.763 -8.709 -5.576 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -16.271 -8.516 -7.870 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.022 -8.330 -6.298 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -16.100 -6.185 -8.216 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -17.612 -6.290 -7.338 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -15.585 -4.724 -6.442 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -16.649 -5.546 -5.318 1.00 0.00 H new ATOM 518 N SER A 35 -13.635 -9.398 -7.751 1.00 0.00 N ATOM 519 CA SER A 35 -12.679 -9.744 -8.796 1.00 0.00 C ATOM 520 C SER A 35 -12.891 -8.878 -10.034 1.00 0.00 C ATOM 521 O SER A 35 -11.959 -8.634 -10.802 1.00 0.00 O ATOM 522 CB SER A 35 -12.798 -11.214 -9.149 1.00 0.00 C ATOM 523 OG SER A 35 -14.042 -11.520 -9.717 1.00 0.00 O ATOM 0 H SER A 35 -14.173 -10.187 -7.394 1.00 0.00 H new ATOM 0 HA SER A 35 -11.674 -9.555 -8.419 1.00 0.00 H new ATOM 0 HB2 SER A 35 -12.005 -11.484 -9.846 1.00 0.00 H new ATOM 0 HB3 SER A 35 -12.652 -11.815 -8.252 1.00 0.00 H new ATOM 0 HG SER A 35 -14.078 -12.476 -9.931 1.00 0.00 H new ATOM 529 N ILE A 36 -14.122 -8.416 -10.222 1.00 0.00 N ATOM 530 CA ILE A 36 -14.416 -7.420 -11.245 1.00 0.00 C ATOM 531 C ILE A 36 -13.961 -6.031 -10.806 1.00 0.00 C ATOM 532 O ILE A 36 -14.356 -5.544 -9.749 1.00 0.00 O ATOM 533 CB ILE A 36 -15.919 -7.378 -11.576 1.00 0.00 C ATOM 534 CG1 ILE A 36 -16.377 -8.720 -12.153 1.00 0.00 C ATOM 535 CG2 ILE A 36 -16.218 -6.248 -12.547 1.00 0.00 C ATOM 536 CD1 ILE A 36 -17.876 -8.848 -12.286 1.00 0.00 C ATOM 0 H ILE A 36 -14.932 -8.715 -9.679 1.00 0.00 H new ATOM 0 HA ILE A 36 -13.866 -7.713 -12.139 1.00 0.00 H new ATOM 0 HB ILE A 36 -16.472 -7.194 -10.655 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -15.922 -8.857 -13.134 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -16.008 -9.524 -11.515 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -17.285 -6.233 -12.770 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -15.927 -5.297 -12.100 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -15.657 -6.402 -13.469 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -18.122 -9.825 -12.701 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -18.339 -8.744 -11.305 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -18.251 -8.067 -12.948 1.00 0.00 H new ATOM 548 N GLU A 37 -13.128 -5.402 -11.628 1.00 0.00 N ATOM 549 CA GLU A 37 -12.505 -4.135 -11.262 1.00 0.00 C ATOM 550 C GLU A 37 -13.546 -3.152 -10.733 1.00 0.00 C ATOM 551 O GLU A 37 -14.381 -2.649 -11.486 1.00 0.00 O ATOM 552 CB GLU A 37 -11.768 -3.531 -12.459 1.00 0.00 C ATOM 553 CG GLU A 37 -11.186 -2.148 -12.207 1.00 0.00 C ATOM 554 CD GLU A 37 -12.168 -1.068 -12.564 1.00 0.00 C ATOM 555 OE1 GLU A 37 -12.719 -1.124 -13.638 1.00 0.00 O ATOM 556 OE2 GLU A 37 -12.454 -0.250 -11.722 1.00 0.00 O ATOM 0 H GLU A 37 -12.869 -5.748 -12.552 1.00 0.00 H new ATOM 0 HA GLU A 37 -11.782 -4.331 -10.470 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -10.961 -4.204 -12.750 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.456 -3.474 -13.303 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -10.906 -2.055 -11.158 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.275 -2.022 -12.793 1.00 0.00 H new ATOM 563 N ASP A 38 -13.489 -2.881 -9.434 1.00 0.00 N ATOM 564 CA ASP A 38 -14.290 -1.818 -8.838 1.00 0.00 C ATOM 565 C ASP A 38 -13.401 -0.804 -8.125 1.00 0.00 C ATOM 566 O ASP A 38 -13.312 -0.794 -6.897 1.00 0.00 O ATOM 567 CB ASP A 38 -15.316 -2.398 -7.864 1.00 0.00 C ATOM 568 CG ASP A 38 -16.307 -1.381 -7.312 1.00 0.00 C ATOM 569 OD1 ASP A 38 -16.234 -0.239 -7.703 1.00 0.00 O ATOM 570 OD2 ASP A 38 -17.220 -1.779 -6.630 1.00 0.00 O ATOM 0 H ASP A 38 -12.896 -3.383 -8.773 1.00 0.00 H new ATOM 0 HA ASP A 38 -14.822 -1.307 -9.640 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -15.870 -3.190 -8.368 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -14.787 -2.860 -7.031 1.00 0.00 H new ATOM 575 N SER A 39 -12.743 0.050 -8.903 1.00 0.00 N ATOM 576 CA SER A 39 -11.906 1.106 -8.344 1.00 0.00 C ATOM 577 C SER A 39 -12.765 2.235 -7.778 1.00 0.00 C ATOM 578 O SER A 39 -13.914 2.416 -8.178 1.00 0.00 O ATOM 579 CB SER A 39 -10.958 1.638 -9.400 1.00 0.00 C ATOM 580 OG SER A 39 -11.642 2.180 -10.497 1.00 0.00 O ATOM 0 H SER A 39 -12.773 0.031 -9.922 1.00 0.00 H new ATOM 0 HA SER A 39 -11.319 0.685 -7.528 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.317 2.402 -8.960 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.307 0.833 -9.741 1.00 0.00 H new ATOM 0 HG SER A 39 -11.987 1.455 -11.058 1.00 0.00 H new ATOM 586 N TYR A 40 -12.194 2.992 -6.847 1.00 0.00 N ATOM 587 CA TYR A 40 -12.915 4.085 -6.204 1.00 0.00 C ATOM 588 C TYR A 40 -12.154 5.399 -6.349 1.00 0.00 C ATOM 589 O TYR A 40 -10.924 5.424 -6.300 1.00 0.00 O ATOM 590 CB TYR A 40 -13.153 3.774 -4.725 1.00 0.00 C ATOM 591 CG TYR A 40 -13.976 2.527 -4.485 1.00 0.00 C ATOM 592 CD1 TYR A 40 -15.360 2.590 -4.423 1.00 0.00 C ATOM 593 CD2 TYR A 40 -13.366 1.292 -4.320 1.00 0.00 C ATOM 594 CE1 TYR A 40 -16.116 1.455 -4.204 1.00 0.00 C ATOM 595 CE2 TYR A 40 -14.113 0.150 -4.101 1.00 0.00 C ATOM 596 CZ TYR A 40 -15.490 0.237 -4.044 1.00 0.00 C ATOM 597 OH TYR A 40 -16.239 -0.897 -3.824 1.00 0.00 O ATOM 0 H TYR A 40 -11.235 2.869 -6.521 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.880 4.190 -6.700 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -12.189 3.663 -4.228 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -13.655 4.623 -4.261 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -15.855 3.542 -4.548 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -12.289 1.222 -4.363 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -17.193 1.521 -4.158 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.623 -0.804 -3.975 1.00 0.00 H new ATOM 0 HH TYR A 40 -17.172 -0.646 -3.658 1.00 0.00 H new ATOM 607 N ARG A 41 -12.894 6.487 -6.527 1.00 0.00 N ATOM 608 CA ARG A 41 -12.291 7.787 -6.787 1.00 0.00 C ATOM 609 C ARG A 41 -12.874 8.853 -5.863 1.00 0.00 C ATOM 610 O ARG A 41 -14.075 8.868 -5.596 1.00 0.00 O ATOM 611 CB ARG A 41 -12.405 8.192 -8.250 1.00 0.00 C ATOM 612 CG ARG A 41 -11.334 9.157 -8.732 1.00 0.00 C ATOM 613 CD ARG A 41 -11.364 9.424 -10.193 1.00 0.00 C ATOM 614 NE ARG A 41 -10.930 8.309 -11.018 1.00 0.00 N ATOM 615 CZ ARG A 41 -11.174 8.194 -12.340 1.00 0.00 C ATOM 616 NH1 ARG A 41 -11.879 9.101 -12.979 1.00 0.00 N ATOM 617 NH2 ARG A 41 -10.707 7.130 -12.970 1.00 0.00 N ATOM 0 H ARG A 41 -13.914 6.494 -6.496 1.00 0.00 H new ATOM 0 HA ARG A 41 -11.226 7.699 -6.570 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -12.367 7.293 -8.865 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -13.382 8.647 -8.411 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -11.446 10.101 -8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -10.355 8.757 -8.468 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -12.380 9.697 -10.479 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -10.730 10.285 -10.405 1.00 0.00 H new ATOM 0 HE ARG A 41 -10.404 7.561 -10.566 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -12.250 9.906 -12.475 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -12.055 8.999 -13.979 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -10.179 6.424 -12.457 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -10.875 7.014 -13.969 1.00 0.00 H new ATOM 631 N LYS A 42 -12.014 9.741 -5.377 1.00 0.00 N ATOM 632 CA LYS A 42 -12.435 10.791 -4.458 1.00 0.00 C ATOM 633 C LYS A 42 -11.458 11.963 -4.484 1.00 0.00 C ATOM 634 O LYS A 42 -10.242 11.768 -4.483 1.00 0.00 O ATOM 635 CB LYS A 42 -12.563 10.241 -3.036 1.00 0.00 C ATOM 636 CG LYS A 42 -13.034 11.260 -2.007 1.00 0.00 C ATOM 637 CD LYS A 42 -14.509 11.586 -2.186 1.00 0.00 C ATOM 638 CE LYS A 42 -14.974 12.623 -1.174 1.00 0.00 C ATOM 639 NZ LYS A 42 -16.380 13.045 -1.417 1.00 0.00 N ATOM 0 H LYS A 42 -11.020 9.754 -5.605 1.00 0.00 H new ATOM 0 HA LYS A 42 -13.411 11.151 -4.783 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.260 9.403 -3.045 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -11.596 9.848 -2.723 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.865 10.871 -1.003 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -12.444 12.172 -2.099 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -14.681 11.958 -3.196 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -15.100 10.677 -2.076 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -14.887 12.213 -0.168 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -14.320 13.494 -1.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -16.658 13.752 -0.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -16.459 13.460 -2.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -17.007 12.219 -1.347 1.00 0.00 H new ATOM 653 N GLN A 43 -11.998 13.177 -4.505 1.00 0.00 N ATOM 654 CA GLN A 43 -11.175 14.379 -4.444 1.00 0.00 C ATOM 655 C GLN A 43 -10.952 14.813 -2.999 1.00 0.00 C ATOM 656 O GLN A 43 -11.904 14.973 -2.233 1.00 0.00 O ATOM 657 CB GLN A 43 -11.826 15.517 -5.234 1.00 0.00 C ATOM 658 CG GLN A 43 -11.001 16.791 -5.286 1.00 0.00 C ATOM 659 CD GLN A 43 -11.644 17.863 -6.144 1.00 0.00 C ATOM 660 OE1 GLN A 43 -12.690 18.414 -5.791 1.00 0.00 O ATOM 661 NE2 GLN A 43 -11.024 18.163 -7.279 1.00 0.00 N ATOM 0 H GLN A 43 -13.001 13.354 -4.564 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.208 14.146 -4.890 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -12.013 15.177 -6.253 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -12.796 15.743 -4.791 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -10.864 17.173 -4.274 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -10.010 16.563 -5.677 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -10.161 17.682 -7.531 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -11.411 18.875 -7.899 1.00 0.00 H new ATOM 670 N VAL A 44 -9.689 15.003 -2.630 1.00 0.00 N ATOM 671 CA VAL A 44 -9.336 15.332 -1.255 1.00 0.00 C ATOM 672 C VAL A 44 -8.257 16.410 -1.208 1.00 0.00 C ATOM 673 O VAL A 44 -7.605 16.693 -2.210 1.00 0.00 O ATOM 674 CB VAL A 44 -8.843 14.091 -0.486 1.00 0.00 C ATOM 675 CG1 VAL A 44 -9.921 13.017 -0.462 1.00 0.00 C ATOM 676 CG2 VAL A 44 -7.567 13.550 -1.109 1.00 0.00 C ATOM 0 H VAL A 44 -8.894 14.935 -3.265 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.241 15.707 -0.778 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.626 14.386 0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.556 12.148 0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.812 13.407 0.029 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -10.168 12.726 -1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.234 12.674 -0.553 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.758 13.271 -2.145 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -6.793 14.317 -1.076 1.00 0.00 H new ATOM 686 N VAL A 45 -8.078 17.008 -0.033 1.00 0.00 N ATOM 687 CA VAL A 45 -6.998 17.963 0.179 1.00 0.00 C ATOM 688 C VAL A 45 -5.819 17.310 0.890 1.00 0.00 C ATOM 689 O VAL A 45 -5.965 16.767 1.987 1.00 0.00 O ATOM 690 CB VAL A 45 -7.472 19.179 0.999 1.00 0.00 C ATOM 691 CG1 VAL A 45 -6.315 20.135 1.251 1.00 0.00 C ATOM 692 CG2 VAL A 45 -8.606 19.895 0.282 1.00 0.00 C ATOM 0 H VAL A 45 -8.667 16.847 0.784 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.680 18.304 -0.806 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.842 18.823 1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.667 20.988 1.831 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.530 19.619 1.804 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.917 20.484 0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.928 20.751 0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.261 20.239 -0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.443 19.209 0.149 1.00 0.00 H new ATOM 702 N ILE A 46 -4.650 17.366 0.261 1.00 0.00 N ATOM 703 CA ILE A 46 -3.431 16.841 0.864 1.00 0.00 C ATOM 704 C ILE A 46 -2.358 17.919 0.966 1.00 0.00 C ATOM 705 O ILE A 46 -1.964 18.512 -0.038 1.00 0.00 O ATOM 706 CB ILE A 46 -2.873 15.648 0.066 1.00 0.00 C ATOM 707 CG1 ILE A 46 -3.890 14.504 0.036 1.00 0.00 C ATOM 708 CG2 ILE A 46 -1.556 15.178 0.662 1.00 0.00 C ATOM 709 CD1 ILE A 46 -3.472 13.338 -0.831 1.00 0.00 C ATOM 0 H ILE A 46 -4.521 17.770 -0.667 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.697 16.502 1.865 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.689 15.972 -0.958 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.053 14.148 1.053 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.845 14.888 -0.324 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.176 14.334 0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -0.832 15.993 0.633 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.714 14.869 1.695 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -4.243 12.568 -0.802 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.338 13.678 -1.858 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.534 12.926 -0.459 1.00 0.00 H new ATOM 721 N ASP A 47 -1.890 18.168 2.185 1.00 0.00 N ATOM 722 CA ASP A 47 -0.899 19.210 2.425 1.00 0.00 C ATOM 723 C ASP A 47 -1.418 20.569 1.968 1.00 0.00 C ATOM 724 O ASP A 47 -0.645 21.433 1.556 1.00 0.00 O ATOM 725 CB ASP A 47 0.414 18.879 1.712 1.00 0.00 C ATOM 726 CG ASP A 47 1.196 17.730 2.336 1.00 0.00 C ATOM 727 OD1 ASP A 47 0.887 17.358 3.443 1.00 0.00 O ATOM 728 OD2 ASP A 47 1.985 17.131 1.644 1.00 0.00 O ATOM 0 H ASP A 47 -2.181 17.662 3.022 1.00 0.00 H new ATOM 0 HA ASP A 47 -0.712 19.256 3.498 1.00 0.00 H new ATOM 0 HB2 ASP A 47 0.197 18.633 0.673 1.00 0.00 H new ATOM 0 HB3 ASP A 47 1.043 19.769 1.704 1.00 0.00 H new ATOM 733 N GLY A 48 -2.733 20.750 2.042 1.00 0.00 N ATOM 734 CA GLY A 48 -3.327 22.026 1.687 1.00 0.00 C ATOM 735 C GLY A 48 -3.584 22.150 0.198 1.00 0.00 C ATOM 736 O GLY A 48 -4.097 23.168 -0.266 1.00 0.00 O ATOM 0 H GLY A 48 -3.397 20.036 2.341 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.266 22.149 2.226 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -2.667 22.832 2.007 1.00 0.00 H new ATOM 740 N GLU A 49 -3.226 21.113 -0.552 1.00 0.00 N ATOM 741 CA GLU A 49 -3.411 21.117 -1.998 1.00 0.00 C ATOM 742 C GLU A 49 -4.523 20.155 -2.408 1.00 0.00 C ATOM 743 O GLU A 49 -4.533 18.992 -2.006 1.00 0.00 O ATOM 744 CB GLU A 49 -2.105 20.747 -2.707 1.00 0.00 C ATOM 745 CG GLU A 49 -0.974 21.745 -2.502 1.00 0.00 C ATOM 746 CD GLU A 49 0.252 21.348 -3.276 1.00 0.00 C ATOM 747 OE1 GLU A 49 0.203 20.353 -3.959 1.00 0.00 O ATOM 748 OE2 GLU A 49 1.199 22.099 -3.275 1.00 0.00 O ATOM 0 H GLU A 49 -2.806 20.260 -0.182 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.700 22.124 -2.298 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.779 19.769 -2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.300 20.652 -3.775 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.300 22.737 -2.816 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.732 21.810 -1.441 1.00 0.00 H new ATOM 755 N THR A 50 -5.461 20.651 -3.209 1.00 0.00 N ATOM 756 CA THR A 50 -6.593 19.848 -3.651 1.00 0.00 C ATOM 757 C THR A 50 -6.195 18.919 -4.792 1.00 0.00 C ATOM 758 O THR A 50 -5.626 19.358 -5.792 1.00 0.00 O ATOM 759 CB THR A 50 -7.769 20.731 -4.106 1.00 0.00 C ATOM 760 OG1 THR A 50 -8.193 21.565 -3.020 1.00 0.00 O ATOM 761 CG2 THR A 50 -8.938 19.870 -4.562 1.00 0.00 C ATOM 0 H THR A 50 -5.458 21.607 -3.565 1.00 0.00 H new ATOM 0 HA THR A 50 -6.910 19.252 -2.795 1.00 0.00 H new ATOM 0 HB THR A 50 -7.437 21.348 -4.941 1.00 0.00 H new ATOM 0 HG1 THR A 50 -8.940 22.128 -3.312 1.00 0.00 H new ATOM 0 HG21 THR A 50 -9.760 20.511 -4.880 1.00 0.00 H new ATOM 0 HG22 THR A 50 -8.624 19.242 -5.396 1.00 0.00 H new ATOM 0 HG23 THR A 50 -9.268 19.239 -3.737 1.00 0.00 H new ATOM 769 N CYS A 51 -6.500 17.636 -4.638 1.00 0.00 N ATOM 770 CA CYS A 51 -6.064 16.625 -5.596 1.00 0.00 C ATOM 771 C CYS A 51 -7.105 15.517 -5.730 1.00 0.00 C ATOM 772 O CYS A 51 -8.032 15.422 -4.925 1.00 0.00 O ATOM 773 CB CYS A 51 -4.781 16.087 -4.963 1.00 0.00 C ATOM 774 SG CYS A 51 -5.018 15.276 -3.364 1.00 0.00 S ATOM 0 H CYS A 51 -7.048 17.270 -3.859 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.919 17.019 -6.602 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.321 15.378 -5.651 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.079 16.911 -4.838 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.064 15.775 -2.775 1.00 0.00 H new ATOM 780 N LEU A 52 -6.945 14.684 -6.752 1.00 0.00 N ATOM 781 CA LEU A 52 -7.911 13.630 -7.037 1.00 0.00 C ATOM 782 C LEU A 52 -7.270 12.253 -6.899 1.00 0.00 C ATOM 783 O LEU A 52 -6.297 11.937 -7.583 1.00 0.00 O ATOM 784 CB LEU A 52 -8.497 13.811 -8.443 1.00 0.00 C ATOM 785 CG LEU A 52 -9.552 12.773 -8.849 1.00 0.00 C ATOM 786 CD1 LEU A 52 -10.780 12.900 -7.958 1.00 0.00 C ATOM 787 CD2 LEU A 52 -9.923 12.971 -10.311 1.00 0.00 C ATOM 0 H LEU A 52 -6.155 14.718 -7.397 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.720 13.701 -6.310 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.943 14.804 -8.509 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.682 13.779 -9.166 1.00 0.00 H new ATOM 0 HG LEU A 52 -9.143 11.770 -8.724 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -11.523 12.159 -8.254 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.495 12.733 -6.919 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.203 13.899 -8.062 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.672 12.234 -10.599 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.328 13.973 -10.451 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.035 12.848 -10.932 1.00 0.00 H new ATOM 799 N LEU A 53 -7.823 11.436 -6.008 1.00 0.00 N ATOM 800 CA LEU A 53 -7.264 10.117 -5.730 1.00 0.00 C ATOM 801 C LEU A 53 -8.102 9.020 -6.380 1.00 0.00 C ATOM 802 O LEU A 53 -9.327 9.005 -6.254 1.00 0.00 O ATOM 803 CB LEU A 53 -7.166 9.891 -4.216 1.00 0.00 C ATOM 804 CG LEU A 53 -6.385 10.963 -3.445 1.00 0.00 C ATOM 805 CD1 LEU A 53 -6.292 10.582 -1.973 1.00 0.00 C ATOM 806 CD2 LEU A 53 -4.999 11.118 -4.051 1.00 0.00 C ATOM 0 H LEU A 53 -8.657 11.664 -5.466 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.262 10.074 -6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.175 9.835 -3.807 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -6.696 8.924 -4.039 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.907 11.917 -3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -5.736 11.349 -1.433 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.295 10.499 -1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -5.778 9.625 -1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.445 11.880 -3.502 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.467 10.169 -3.990 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.090 11.417 -5.095 1.00 0.00 H new ATOM 818 N ASP A 54 -7.435 8.105 -7.074 1.00 0.00 N ATOM 819 CA ASP A 54 -8.095 6.920 -7.610 1.00 0.00 C ATOM 820 C ASP A 54 -7.420 5.648 -7.105 1.00 0.00 C ATOM 821 O ASP A 54 -6.296 5.334 -7.493 1.00 0.00 O ATOM 822 CB ASP A 54 -8.092 6.949 -9.141 1.00 0.00 C ATOM 823 CG ASP A 54 -8.817 5.778 -9.793 1.00 0.00 C ATOM 824 OD1 ASP A 54 -9.157 4.852 -9.094 1.00 0.00 O ATOM 825 OD2 ASP A 54 -9.160 5.885 -10.945 1.00 0.00 O ATOM 0 H ASP A 54 -6.437 8.161 -7.279 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.128 6.922 -7.263 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -8.553 7.878 -9.476 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -7.060 6.962 -9.490 1.00 0.00 H new ATOM 830 N ILE A 55 -8.117 4.921 -6.238 1.00 0.00 N ATOM 831 CA ILE A 55 -7.522 3.784 -5.545 1.00 0.00 C ATOM 832 C ILE A 55 -8.165 2.473 -5.987 1.00 0.00 C ATOM 833 O ILE A 55 -9.387 2.323 -5.942 1.00 0.00 O ATOM 834 CB ILE A 55 -7.654 3.922 -4.017 1.00 0.00 C ATOM 835 CG1 ILE A 55 -6.959 5.197 -3.535 1.00 0.00 C ATOM 836 CG2 ILE A 55 -7.075 2.699 -3.321 1.00 0.00 C ATOM 837 CD1 ILE A 55 -7.125 5.461 -2.055 1.00 0.00 C ATOM 0 H ILE A 55 -9.093 5.098 -5.999 1.00 0.00 H new ATOM 0 HA ILE A 55 -6.464 3.773 -5.808 1.00 0.00 H new ATOM 0 HB ILE A 55 -8.712 3.991 -3.764 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.896 5.129 -3.765 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -7.352 6.047 -4.092 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -7.176 2.813 -2.242 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -7.613 1.808 -3.644 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.020 2.599 -3.578 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -6.605 6.381 -1.789 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.185 5.562 -1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.705 4.630 -1.488 1.00 0.00 H new ATOM 849 N LEU A 56 -7.335 1.528 -6.411 1.00 0.00 N ATOM 850 CA LEU A 56 -7.825 0.240 -6.895 1.00 0.00 C ATOM 851 C LEU A 56 -7.346 -0.896 -5.998 1.00 0.00 C ATOM 852 O LEU A 56 -6.145 -1.084 -5.806 1.00 0.00 O ATOM 853 CB LEU A 56 -7.371 0.009 -8.342 1.00 0.00 C ATOM 854 CG LEU A 56 -7.629 -1.401 -8.889 1.00 0.00 C ATOM 855 CD1 LEU A 56 -9.124 -1.685 -8.917 1.00 0.00 C ATOM 856 CD2 LEU A 56 -7.029 -1.524 -10.281 1.00 0.00 C ATOM 0 H LEU A 56 -6.320 1.628 -6.430 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.915 0.256 -6.868 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.878 0.729 -8.984 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.303 0.218 -8.409 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.156 -2.136 -8.238 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.297 -2.688 -9.307 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.527 -1.614 -7.907 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.621 -0.956 -9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.213 -2.526 -10.669 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.489 -0.789 -10.942 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.955 -1.345 -10.231 1.00 0.00 H new ATOM 868 N ASP A 57 -8.293 -1.653 -5.455 1.00 0.00 N ATOM 869 CA ASP A 57 -7.969 -2.858 -4.700 1.00 0.00 C ATOM 870 C ASP A 57 -7.804 -4.054 -5.633 1.00 0.00 C ATOM 871 O ASP A 57 -8.621 -4.279 -6.526 1.00 0.00 O ATOM 872 CB ASP A 57 -9.050 -3.147 -3.657 1.00 0.00 C ATOM 873 CG ASP A 57 -8.704 -4.268 -2.686 1.00 0.00 C ATOM 874 OD1 ASP A 57 -7.748 -4.126 -1.961 1.00 0.00 O ATOM 875 OD2 ASP A 57 -9.482 -5.184 -2.566 1.00 0.00 O ATOM 0 H ASP A 57 -9.291 -1.454 -5.523 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.023 -2.689 -4.185 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -9.242 -2.237 -3.089 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.976 -3.402 -4.172 1.00 0.00 H new ATOM 880 N THR A 58 -6.737 -4.821 -5.420 1.00 0.00 N ATOM 881 CA THR A 58 -6.436 -5.965 -6.270 1.00 0.00 C ATOM 882 C THR A 58 -7.158 -7.216 -5.784 1.00 0.00 C ATOM 883 O THR A 58 -7.550 -7.305 -4.620 1.00 0.00 O ATOM 884 CB THR A 58 -4.923 -6.246 -6.327 1.00 0.00 C ATOM 885 OG1 THR A 58 -4.437 -6.520 -5.006 1.00 0.00 O ATOM 886 CG2 THR A 58 -4.180 -5.048 -6.899 1.00 0.00 C ATOM 0 H THR A 58 -6.068 -4.669 -4.665 1.00 0.00 H new ATOM 0 HA THR A 58 -6.786 -5.713 -7.271 1.00 0.00 H new ATOM 0 HB THR A 58 -4.751 -7.108 -6.971 1.00 0.00 H new ATOM 0 HG1 THR A 58 -3.675 -7.134 -5.059 1.00 0.00 H new ATOM 0 HG21 THR A 58 -3.112 -5.264 -6.932 1.00 0.00 H new ATOM 0 HG22 THR A 58 -4.540 -4.844 -7.907 1.00 0.00 H new ATOM 0 HG23 THR A 58 -4.355 -4.176 -6.268 1.00 0.00 H new ATOM 894 N ALA A 59 -7.331 -8.182 -6.681 1.00 0.00 N ATOM 895 CA ALA A 59 -7.969 -9.445 -6.331 1.00 0.00 C ATOM 896 C ALA A 59 -7.420 -10.589 -7.176 1.00 0.00 C ATOM 897 O ALA A 59 -7.329 -10.484 -8.398 1.00 0.00 O ATOM 898 CB ALA A 59 -9.476 -9.339 -6.501 1.00 0.00 C ATOM 0 H ALA A 59 -7.038 -8.114 -7.656 1.00 0.00 H new ATOM 0 HA ALA A 59 -7.746 -9.659 -5.286 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -9.940 -10.289 -6.236 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -9.861 -8.554 -5.851 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -9.709 -9.098 -7.538 1.00 0.00 H new ATOM 904 N GLY A 60 -7.053 -11.684 -6.516 1.00 0.00 N ATOM 905 CA GLY A 60 -6.524 -12.835 -7.224 1.00 0.00 C ATOM 906 C GLY A 60 -5.102 -12.619 -7.702 1.00 0.00 C ATOM 907 O GLY A 60 -4.836 -12.631 -8.903 1.00 0.00 O ATOM 0 H GLY A 60 -7.113 -11.794 -5.504 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -6.556 -13.706 -6.570 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.162 -13.056 -8.080 1.00 0.00 H new ATOM 911 N GLN A 61 -4.187 -12.420 -6.758 1.00 0.00 N ATOM 912 CA GLN A 61 -2.813 -12.065 -7.091 1.00 0.00 C ATOM 913 C GLN A 61 -2.131 -13.193 -7.860 1.00 0.00 C ATOM 914 O GLN A 61 -1.117 -12.978 -8.525 1.00 0.00 O ATOM 915 CB GLN A 61 -2.016 -11.747 -5.823 1.00 0.00 C ATOM 916 CG GLN A 61 -1.795 -12.941 -4.911 1.00 0.00 C ATOM 917 CD GLN A 61 -2.911 -13.110 -3.897 1.00 0.00 C ATOM 918 OE1 GLN A 61 -4.094 -12.998 -4.231 1.00 0.00 O ATOM 919 NE2 GLN A 61 -2.540 -13.374 -2.649 1.00 0.00 N ATOM 0 H GLN A 61 -4.373 -12.499 -5.758 1.00 0.00 H new ATOM 0 HA GLN A 61 -2.841 -11.178 -7.724 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -1.047 -11.338 -6.109 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -2.537 -10.969 -5.265 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -1.716 -13.845 -5.514 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.847 -12.824 -4.387 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -1.550 -13.458 -2.418 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -3.245 -13.493 -1.922 1.00 0.00 H new ATOM 928 N GLU A 62 -2.694 -14.393 -7.764 1.00 0.00 N ATOM 929 CA GLU A 62 -2.227 -15.521 -8.561 1.00 0.00 C ATOM 930 C GLU A 62 -2.556 -15.318 -10.038 1.00 0.00 C ATOM 931 O GLU A 62 -1.780 -15.696 -10.914 1.00 0.00 O ATOM 932 CB GLU A 62 -2.844 -16.827 -8.056 1.00 0.00 C ATOM 933 CG GLU A 62 -2.331 -17.280 -6.696 1.00 0.00 C ATOM 934 CD GLU A 62 -3.066 -18.501 -6.215 1.00 0.00 C ATOM 935 OE1 GLU A 62 -3.977 -18.925 -6.884 1.00 0.00 O ATOM 936 OE2 GLU A 62 -2.644 -19.076 -5.239 1.00 0.00 O ATOM 0 H GLU A 62 -3.474 -14.609 -7.143 1.00 0.00 H new ATOM 0 HA GLU A 62 -1.144 -15.582 -8.456 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.926 -16.706 -8.001 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.648 -17.613 -8.785 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.265 -17.496 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.449 -16.473 -5.973 1.00 0.00 H new ATOM 943 N GLU A 63 -3.713 -14.720 -10.304 1.00 0.00 N ATOM 944 CA GLU A 63 -4.211 -14.591 -11.667 1.00 0.00 C ATOM 945 C GLU A 63 -4.356 -13.124 -12.059 1.00 0.00 C ATOM 946 O GLU A 63 -5.344 -12.730 -12.679 1.00 0.00 O ATOM 947 CB GLU A 63 -5.552 -15.314 -11.820 1.00 0.00 C ATOM 948 CG GLU A 63 -5.480 -16.821 -11.619 1.00 0.00 C ATOM 949 CD GLU A 63 -6.841 -17.451 -11.723 1.00 0.00 C ATOM 950 OE1 GLU A 63 -7.799 -16.731 -11.866 1.00 0.00 O ATOM 951 OE2 GLU A 63 -6.913 -18.657 -11.772 1.00 0.00 O ATOM 0 H GLU A 63 -4.323 -14.317 -9.592 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.485 -15.054 -12.335 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -6.259 -14.897 -11.103 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -5.949 -15.111 -12.815 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.816 -17.258 -12.365 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.049 -17.040 -10.642 1.00 0.00 H new ATOM 958 N TYR A 64 -3.364 -12.321 -11.691 1.00 0.00 N ATOM 959 CA TYR A 64 -3.422 -10.881 -11.923 1.00 0.00 C ATOM 960 C TYR A 64 -4.304 -10.557 -13.124 1.00 0.00 C ATOM 961 O TYR A 64 -4.090 -11.071 -14.222 1.00 0.00 O ATOM 962 CB TYR A 64 -2.015 -10.315 -12.133 1.00 0.00 C ATOM 963 CG TYR A 64 -1.134 -10.390 -10.907 1.00 0.00 C ATOM 964 CD1 TYR A 64 -1.421 -9.637 -9.779 1.00 0.00 C ATOM 965 CD2 TYR A 64 -0.017 -11.213 -10.880 1.00 0.00 C ATOM 966 CE1 TYR A 64 -0.620 -9.700 -8.655 1.00 0.00 C ATOM 967 CE2 TYR A 64 0.791 -11.285 -9.763 1.00 0.00 C ATOM 968 CZ TYR A 64 0.486 -10.525 -8.651 1.00 0.00 C ATOM 969 OH TYR A 64 1.288 -10.592 -7.534 1.00 0.00 O ATOM 0 H TYR A 64 -2.511 -12.641 -11.232 1.00 0.00 H new ATOM 0 HA TYR A 64 -3.860 -10.415 -11.040 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -1.534 -10.857 -12.947 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -2.096 -9.274 -12.447 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -2.286 -8.990 -9.779 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.225 -11.808 -11.748 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -0.858 -9.107 -7.784 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.656 -11.932 -9.759 1.00 0.00 H new ATOM 0 HH TYR A 64 0.819 -10.195 -6.770 1.00 0.00 H new ATOM 979 N SER A 65 -5.297 -9.702 -12.907 1.00 0.00 N ATOM 980 CA SER A 65 -6.175 -9.259 -13.985 1.00 0.00 C ATOM 981 C SER A 65 -5.508 -8.162 -14.811 1.00 0.00 C ATOM 982 O SER A 65 -4.712 -7.379 -14.296 1.00 0.00 O ATOM 983 CB SER A 65 -7.494 -8.772 -13.419 1.00 0.00 C ATOM 984 OG SER A 65 -8.289 -8.154 -14.395 1.00 0.00 O ATOM 0 H SER A 65 -5.515 -9.301 -11.995 1.00 0.00 H new ATOM 0 HA SER A 65 -6.369 -10.107 -14.642 1.00 0.00 H new ATOM 0 HB2 SER A 65 -8.037 -9.614 -12.989 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.303 -8.069 -12.609 1.00 0.00 H new ATOM 0 HG SER A 65 -9.223 -8.144 -14.098 1.00 0.00 H new ATOM 990 N ALA A 66 -5.840 -8.116 -16.097 1.00 0.00 N ATOM 991 CA ALA A 66 -5.407 -7.021 -16.958 1.00 0.00 C ATOM 992 C ALA A 66 -5.983 -5.691 -16.485 1.00 0.00 C ATOM 993 O ALA A 66 -5.392 -4.635 -16.707 1.00 0.00 O ATOM 994 CB ALA A 66 -5.815 -7.292 -18.399 1.00 0.00 C ATOM 0 H ALA A 66 -6.407 -8.823 -16.566 1.00 0.00 H new ATOM 0 HA ALA A 66 -4.320 -6.956 -16.905 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -5.486 -6.467 -19.031 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -5.352 -8.218 -18.740 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -6.899 -7.385 -18.459 1.00 0.00 H new ATOM 1000 N MET A 67 -7.139 -5.750 -15.831 1.00 0.00 N ATOM 1001 CA MET A 67 -7.778 -4.552 -15.300 1.00 0.00 C ATOM 1002 C MET A 67 -6.945 -3.944 -14.177 1.00 0.00 C ATOM 1003 O MET A 67 -6.862 -2.723 -14.044 1.00 0.00 O ATOM 1004 CB MET A 67 -9.185 -4.878 -14.802 1.00 0.00 C ATOM 1005 CG MET A 67 -10.179 -5.222 -15.903 1.00 0.00 C ATOM 1006 SD MET A 67 -11.865 -5.395 -15.288 1.00 0.00 S ATOM 1007 CE MET A 67 -11.780 -7.009 -14.517 1.00 0.00 C ATOM 0 H MET A 67 -7.652 -6.614 -15.656 1.00 0.00 H new ATOM 0 HA MET A 67 -7.851 -3.819 -16.104 1.00 0.00 H new ATOM 0 HB2 MET A 67 -9.126 -5.716 -14.108 1.00 0.00 H new ATOM 0 HB3 MET A 67 -9.565 -4.025 -14.240 1.00 0.00 H new ATOM 0 HG2 MET A 67 -10.153 -4.444 -16.666 1.00 0.00 H new ATOM 0 HG3 MET A 67 -9.875 -6.152 -16.384 1.00 0.00 H new ATOM 0 HE1 MET A 67 -12.764 -7.282 -14.135 1.00 0.00 H new ATOM 0 HE2 MET A 67 -11.458 -7.747 -15.252 1.00 0.00 H new ATOM 0 HE3 MET A 67 -11.066 -6.982 -13.694 1.00 0.00 H new ATOM 1017 N ARG A 68 -6.331 -4.803 -13.369 1.00 0.00 N ATOM 1018 CA ARG A 68 -5.407 -4.354 -12.336 1.00 0.00 C ATOM 1019 C ARG A 68 -4.057 -3.976 -12.941 1.00 0.00 C ATOM 1020 O ARG A 68 -3.421 -3.013 -12.514 1.00 0.00 O ATOM 1021 CB ARG A 68 -5.254 -5.374 -11.217 1.00 0.00 C ATOM 1022 CG ARG A 68 -6.197 -5.178 -10.040 1.00 0.00 C ATOM 1023 CD ARG A 68 -7.623 -5.453 -10.347 1.00 0.00 C ATOM 1024 NE ARG A 68 -8.505 -5.422 -9.191 1.00 0.00 N ATOM 1025 CZ ARG A 68 -9.714 -6.014 -9.134 1.00 0.00 C ATOM 1026 NH1 ARG A 68 -10.205 -6.652 -10.173 1.00 0.00 N ATOM 1027 NH2 ARG A 68 -10.405 -5.917 -8.011 1.00 0.00 N ATOM 0 H ARG A 68 -6.458 -5.814 -13.411 1.00 0.00 H new ATOM 0 HA ARG A 68 -5.836 -3.460 -11.883 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -5.413 -6.371 -11.629 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -4.228 -5.340 -10.851 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -5.881 -5.828 -9.224 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -6.106 -4.152 -9.683 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -7.973 -4.721 -11.075 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -7.698 -6.433 -10.819 1.00 0.00 H new ATOM 0 HE ARG A 68 -8.186 -4.916 -8.365 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -9.669 -6.704 -11.039 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -11.122 -7.095 -10.113 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -10.020 -5.404 -7.218 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -11.323 -6.355 -7.938 1.00 0.00 H new ATOM 1041 N ASP A 69 -3.626 -4.742 -13.937 1.00 0.00 N ATOM 1042 CA ASP A 69 -2.322 -4.531 -14.555 1.00 0.00 C ATOM 1043 C ASP A 69 -2.224 -3.132 -15.155 1.00 0.00 C ATOM 1044 O ASP A 69 -1.140 -2.556 -15.238 1.00 0.00 O ATOM 1045 CB ASP A 69 -2.058 -5.587 -15.631 1.00 0.00 C ATOM 1046 CG ASP A 69 -1.757 -6.978 -15.089 1.00 0.00 C ATOM 1047 OD1 ASP A 69 -1.510 -7.093 -13.911 1.00 0.00 O ATOM 1048 OD2 ASP A 69 -1.929 -7.927 -15.815 1.00 0.00 O ATOM 0 H ASP A 69 -4.161 -5.515 -14.334 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.563 -4.626 -13.778 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.928 -5.646 -16.286 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.219 -5.260 -16.245 1.00 0.00 H new ATOM 1053 N GLN A 70 -3.365 -2.594 -15.574 1.00 0.00 N ATOM 1054 CA GLN A 70 -3.401 -1.280 -16.207 1.00 0.00 C ATOM 1055 C GLN A 70 -2.758 -0.226 -15.311 1.00 0.00 C ATOM 1056 O GLN A 70 -1.872 0.511 -15.743 1.00 0.00 O ATOM 1057 CB GLN A 70 -4.842 -0.878 -16.529 1.00 0.00 C ATOM 1058 CG GLN A 70 -4.972 0.453 -17.248 1.00 0.00 C ATOM 1059 CD GLN A 70 -6.403 0.757 -17.650 1.00 0.00 C ATOM 1060 OE1 GLN A 70 -6.905 0.236 -18.649 1.00 0.00 O ATOM 1061 NE2 GLN A 70 -7.066 1.608 -16.875 1.00 0.00 N ATOM 0 H GLN A 70 -4.275 -3.046 -15.487 1.00 0.00 H new ATOM 0 HA GLN A 70 -2.834 -1.341 -17.136 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -5.295 -1.656 -17.144 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -5.411 -0.833 -15.600 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -4.602 1.249 -16.602 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -4.342 0.445 -18.137 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -6.611 2.015 -16.058 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -8.031 1.855 -17.097 1.00 0.00 H new ATOM 1070 N TYR A 71 -3.209 -0.163 -14.065 1.00 0.00 N ATOM 1071 CA TYR A 71 -2.645 0.769 -13.094 1.00 0.00 C ATOM 1072 C TYR A 71 -1.271 0.301 -12.626 1.00 0.00 C ATOM 1073 O TYR A 71 -0.377 1.111 -12.380 1.00 0.00 O ATOM 1074 CB TYR A 71 -3.584 0.931 -11.897 1.00 0.00 C ATOM 1075 CG TYR A 71 -4.794 1.792 -12.179 1.00 0.00 C ATOM 1076 CD1 TYR A 71 -5.012 2.324 -13.442 1.00 0.00 C ATOM 1077 CD2 TYR A 71 -5.718 2.070 -11.182 1.00 0.00 C ATOM 1078 CE1 TYR A 71 -6.116 3.113 -13.705 1.00 0.00 C ATOM 1079 CE2 TYR A 71 -6.825 2.856 -11.433 1.00 0.00 C ATOM 1080 CZ TYR A 71 -7.022 3.376 -12.697 1.00 0.00 C ATOM 1081 OH TYR A 71 -8.123 4.159 -12.952 1.00 0.00 O ATOM 0 H TYR A 71 -3.963 -0.745 -13.702 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.531 1.737 -13.582 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.919 -0.055 -11.575 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.027 1.365 -11.067 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -4.307 2.118 -14.233 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.569 1.664 -10.192 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -6.269 3.521 -14.693 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.533 3.063 -10.645 1.00 0.00 H new ATOM 0 HH TYR A 71 -8.341 4.686 -12.155 1.00 0.00 H new ATOM 1091 N MET A 72 -1.110 -1.013 -12.503 1.00 0.00 N ATOM 1092 CA MET A 72 0.128 -1.587 -11.987 1.00 0.00 C ATOM 1093 C MET A 72 1.300 -1.270 -12.910 1.00 0.00 C ATOM 1094 O MET A 72 2.411 -1.006 -12.449 1.00 0.00 O ATOM 1095 CB MET A 72 -0.020 -3.098 -11.815 1.00 0.00 C ATOM 1096 CG MET A 72 -0.945 -3.515 -10.681 1.00 0.00 C ATOM 1097 SD MET A 72 -1.555 -5.202 -10.867 1.00 0.00 S ATOM 1098 CE MET A 72 -0.053 -6.137 -10.595 1.00 0.00 C ATOM 0 H MET A 72 -1.821 -1.700 -12.754 1.00 0.00 H new ATOM 0 HA MET A 72 0.332 -1.141 -11.013 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.394 -3.522 -12.747 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.966 -3.530 -11.641 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.414 -3.427 -9.733 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.791 -2.830 -10.637 1.00 0.00 H new ATOM 0 HE1 MET A 72 -0.268 -7.202 -10.678 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.690 -5.857 -11.342 1.00 0.00 H new ATOM 0 HE3 MET A 72 0.335 -5.921 -9.599 1.00 0.00 H new ATOM 1108 N ARG A 73 1.047 -1.301 -14.214 1.00 0.00 N ATOM 1109 CA ARG A 73 2.087 -1.040 -15.201 1.00 0.00 C ATOM 1110 C ARG A 73 2.502 0.428 -15.180 1.00 0.00 C ATOM 1111 O ARG A 73 3.659 0.763 -15.433 1.00 0.00 O ATOM 1112 CB ARG A 73 1.681 -1.489 -16.597 1.00 0.00 C ATOM 1113 CG ARG A 73 1.744 -2.989 -16.831 1.00 0.00 C ATOM 1114 CD ARG A 73 1.248 -3.423 -18.162 1.00 0.00 C ATOM 1115 NE ARG A 73 1.659 -4.763 -18.551 1.00 0.00 N ATOM 1116 CZ ARG A 73 1.052 -5.503 -19.500 1.00 0.00 C ATOM 1117 NH1 ARG A 73 -0.010 -5.056 -20.132 1.00 0.00 N ATOM 1118 NH2 ARG A 73 1.542 -6.702 -19.762 1.00 0.00 N ATOM 0 H ARG A 73 0.130 -1.504 -14.612 1.00 0.00 H new ATOM 0 HA ARG A 73 2.955 -1.638 -14.924 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.664 -1.148 -16.791 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.326 -0.995 -17.324 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.776 -3.319 -16.716 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.161 -3.490 -16.058 1.00 0.00 H new ATOM 0 HD2 ARG A 73 0.159 -3.376 -18.163 1.00 0.00 H new ATOM 0 HD3 ARG A 73 1.598 -2.716 -18.914 1.00 0.00 H new ATOM 0 HE ARG A 73 2.462 -5.171 -18.072 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.388 -4.136 -19.907 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.457 -5.630 -20.848 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.357 -7.043 -19.252 1.00 0.00 H new ATOM 0 HH22 ARG A 73 1.105 -7.287 -20.475 1.00 0.00 H new ATOM 1132 N THR A 74 1.547 1.302 -14.875 1.00 0.00 N ATOM 1133 CA THR A 74 1.821 2.732 -14.787 1.00 0.00 C ATOM 1134 C THR A 74 2.619 3.062 -13.530 1.00 0.00 C ATOM 1135 O THR A 74 3.618 3.778 -13.589 1.00 0.00 O ATOM 1136 CB THR A 74 0.521 3.557 -14.789 1.00 0.00 C ATOM 1137 OG1 THR A 74 -0.198 3.317 -16.006 1.00 0.00 O ATOM 1138 CG2 THR A 74 0.832 5.042 -14.673 1.00 0.00 C ATOM 0 H THR A 74 0.578 1.045 -14.685 1.00 0.00 H new ATOM 0 HA THR A 74 2.408 2.995 -15.667 1.00 0.00 H new ATOM 0 HB THR A 74 -0.085 3.255 -13.935 1.00 0.00 H new ATOM 0 HG1 THR A 74 -0.698 2.478 -15.930 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.098 5.610 -14.676 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.369 5.230 -13.743 1.00 0.00 H new ATOM 0 HG23 THR A 74 1.449 5.352 -15.517 1.00 0.00 H new ATOM 1146 N GLY A 75 2.172 2.534 -12.395 1.00 0.00 N ATOM 1147 CA GLY A 75 3.002 2.527 -11.204 1.00 0.00 C ATOM 1148 C GLY A 75 3.089 3.893 -10.552 1.00 0.00 C ATOM 1149 O GLY A 75 4.077 4.207 -9.887 1.00 0.00 O ATOM 0 H GLY A 75 1.251 2.111 -12.279 1.00 0.00 H new ATOM 0 HA2 GLY A 75 2.599 1.811 -10.488 1.00 0.00 H new ATOM 0 HA3 GLY A 75 4.004 2.187 -11.465 1.00 0.00 H new ATOM 1153 N GLU A 76 2.057 4.708 -10.744 1.00 0.00 N ATOM 1154 CA GLU A 76 1.987 6.016 -10.106 1.00 0.00 C ATOM 1155 C GLU A 76 2.240 5.903 -8.604 1.00 0.00 C ATOM 1156 O GLU A 76 3.229 6.423 -8.090 1.00 0.00 O ATOM 1157 CB GLU A 76 0.627 6.668 -10.366 1.00 0.00 C ATOM 1158 CG GLU A 76 0.394 7.081 -11.812 1.00 0.00 C ATOM 1159 CD GLU A 76 -0.596 8.208 -11.907 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -1.067 8.647 -10.885 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -0.798 8.705 -12.989 1.00 0.00 O ATOM 0 H GLU A 76 1.258 4.485 -11.337 1.00 0.00 H new ATOM 0 HA GLU A 76 2.765 6.645 -10.539 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.158 5.973 -10.068 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.532 7.548 -9.730 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.339 7.386 -12.262 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.030 6.226 -12.382 1.00 0.00 H new ATOM 1168 N GLY A 77 1.336 5.220 -7.909 1.00 0.00 N ATOM 1169 CA GLY A 77 1.591 4.844 -6.530 1.00 0.00 C ATOM 1170 C GLY A 77 1.240 3.396 -6.250 1.00 0.00 C ATOM 1171 O GLY A 77 0.365 2.824 -6.899 1.00 0.00 O ATOM 0 H GLY A 77 0.432 4.920 -8.275 1.00 0.00 H new ATOM 0 HA2 GLY A 77 2.643 5.011 -6.300 1.00 0.00 H new ATOM 0 HA3 GLY A 77 1.014 5.489 -5.868 1.00 0.00 H new ATOM 1175 N PHE A 78 1.926 2.799 -5.280 1.00 0.00 N ATOM 1176 CA PHE A 78 1.748 1.383 -4.976 1.00 0.00 C ATOM 1177 C PHE A 78 1.864 1.132 -3.476 1.00 0.00 C ATOM 1178 O PHE A 78 2.846 1.521 -2.843 1.00 0.00 O ATOM 1179 CB PHE A 78 2.774 0.539 -5.734 1.00 0.00 C ATOM 1180 CG PHE A 78 2.483 -0.935 -5.710 1.00 0.00 C ATOM 1181 CD1 PHE A 78 2.976 -1.737 -4.693 1.00 0.00 C ATOM 1182 CD2 PHE A 78 1.713 -1.520 -6.704 1.00 0.00 C ATOM 1183 CE1 PHE A 78 2.710 -3.093 -4.670 1.00 0.00 C ATOM 1184 CE2 PHE A 78 1.444 -2.875 -6.684 1.00 0.00 C ATOM 1185 CZ PHE A 78 1.942 -3.662 -5.667 1.00 0.00 C ATOM 0 H PHE A 78 2.610 3.274 -4.691 1.00 0.00 H new ATOM 0 HA PHE A 78 0.748 1.091 -5.298 1.00 0.00 H new ATOM 0 HB2 PHE A 78 2.813 0.875 -6.770 1.00 0.00 H new ATOM 0 HB3 PHE A 78 3.761 0.712 -5.305 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.575 -1.297 -3.909 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.319 -0.909 -7.503 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.102 -3.707 -3.873 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.844 -3.318 -7.465 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.732 -4.721 -5.650 1.00 0.00 H new ATOM 1195 N LEU A 79 0.853 0.477 -2.913 1.00 0.00 N ATOM 1196 CA LEU A 79 0.801 0.246 -1.473 1.00 0.00 C ATOM 1197 C LEU A 79 0.982 -1.234 -1.153 1.00 0.00 C ATOM 1198 O LEU A 79 0.251 -2.085 -1.662 1.00 0.00 O ATOM 1199 CB LEU A 79 -0.527 0.760 -0.901 1.00 0.00 C ATOM 1200 CG LEU A 79 -0.721 0.531 0.604 1.00 0.00 C ATOM 1201 CD1 LEU A 79 0.317 1.321 1.390 1.00 0.00 C ATOM 1202 CD2 LEU A 79 -2.130 0.944 1.004 1.00 0.00 C ATOM 0 H LEU A 79 0.060 0.098 -3.431 1.00 0.00 H new ATOM 0 HA LEU A 79 1.619 0.795 -1.008 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.602 1.829 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.346 0.277 -1.435 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.588 -0.527 0.831 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.171 1.152 2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 79 1.317 0.994 1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.207 2.383 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.267 0.781 2.073 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.278 1.999 0.776 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.855 0.348 0.450 1.00 0.00 H new ATOM 1214 N CYS A 80 1.960 -1.535 -0.305 1.00 0.00 N ATOM 1215 CA CYS A 80 2.172 -2.898 0.164 1.00 0.00 C ATOM 1216 C CYS A 80 1.718 -3.053 1.612 1.00 0.00 C ATOM 1217 O CYS A 80 2.265 -2.421 2.516 1.00 0.00 O ATOM 1218 CB CYS A 80 3.688 -3.064 0.053 1.00 0.00 C ATOM 1219 SG CYS A 80 4.329 -2.971 -1.636 1.00 0.00 S ATOM 0 H CYS A 80 2.618 -0.852 0.071 1.00 0.00 H new ATOM 0 HA CYS A 80 1.611 -3.640 -0.404 1.00 0.00 H new ATOM 0 HB2 CYS A 80 4.170 -2.294 0.655 1.00 0.00 H new ATOM 0 HB3 CYS A 80 3.968 -4.026 0.482 1.00 0.00 H new ATOM 0 HG CYS A 80 3.387 -2.567 -2.436 1.00 0.00 H new ATOM 1225 N VAL A 81 0.714 -3.898 1.825 1.00 0.00 N ATOM 1226 CA VAL A 81 0.197 -4.149 3.165 1.00 0.00 C ATOM 1227 C VAL A 81 0.457 -5.588 3.595 1.00 0.00 C ATOM 1228 O VAL A 81 0.077 -6.532 2.903 1.00 0.00 O ATOM 1229 CB VAL A 81 -1.314 -3.861 3.251 1.00 0.00 C ATOM 1230 CG1 VAL A 81 -1.836 -4.164 4.648 1.00 0.00 C ATOM 1231 CG2 VAL A 81 -1.603 -2.416 2.878 1.00 0.00 C ATOM 0 H VAL A 81 0.243 -4.420 1.087 1.00 0.00 H new ATOM 0 HA VAL A 81 0.724 -3.472 3.837 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.828 -4.510 2.542 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.905 -3.955 4.690 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.662 -5.214 4.881 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.315 -3.540 5.374 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.675 -2.231 2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.077 -1.751 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.265 -2.229 1.859 1.00 0.00 H new ATOM 1241 N PHE A 82 1.107 -5.748 4.743 1.00 0.00 N ATOM 1242 CA PHE A 82 1.423 -7.073 5.264 1.00 0.00 C ATOM 1243 C PHE A 82 1.404 -7.076 6.789 1.00 0.00 C ATOM 1244 O PHE A 82 1.472 -6.023 7.424 1.00 0.00 O ATOM 1245 CB PHE A 82 2.786 -7.541 4.751 1.00 0.00 C ATOM 1246 CG PHE A 82 3.939 -6.722 5.260 1.00 0.00 C ATOM 1247 CD1 PHE A 82 4.293 -5.534 4.639 1.00 0.00 C ATOM 1248 CD2 PHE A 82 4.669 -7.138 6.362 1.00 0.00 C ATOM 1249 CE1 PHE A 82 5.353 -4.780 5.105 1.00 0.00 C ATOM 1250 CE2 PHE A 82 5.730 -6.385 6.832 1.00 0.00 C ATOM 1251 CZ PHE A 82 6.071 -5.208 6.203 1.00 0.00 C ATOM 0 H PHE A 82 1.425 -4.977 5.330 1.00 0.00 H new ATOM 0 HA PHE A 82 0.660 -7.766 4.910 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.935 -8.581 5.041 1.00 0.00 H new ATOM 0 HB3 PHE A 82 2.784 -7.511 3.661 1.00 0.00 H new ATOM 0 HD1 PHE A 82 3.733 -5.194 3.780 1.00 0.00 H new ATOM 0 HD2 PHE A 82 4.407 -8.060 6.859 1.00 0.00 H new ATOM 0 HE1 PHE A 82 5.619 -3.857 4.611 1.00 0.00 H new ATOM 0 HE2 PHE A 82 6.291 -6.720 7.692 1.00 0.00 H new ATOM 0 HZ PHE A 82 6.900 -4.620 6.569 1.00 0.00 H new ATOM 1261 N ALA A 83 1.311 -8.266 7.373 1.00 0.00 N ATOM 1262 CA ALA A 83 1.149 -8.400 8.815 1.00 0.00 C ATOM 1263 C ALA A 83 2.497 -8.350 9.526 1.00 0.00 C ATOM 1264 O ALA A 83 3.482 -8.916 9.050 1.00 0.00 O ATOM 1265 CB ALA A 83 0.423 -9.695 9.147 1.00 0.00 C ATOM 0 H ALA A 83 1.345 -9.152 6.869 1.00 0.00 H new ATOM 0 HA ALA A 83 0.550 -7.560 9.168 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.309 -9.782 10.228 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.561 -9.691 8.678 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.000 -10.541 8.774 1.00 0.00 H new ATOM 1271 N ILE A 84 2.533 -7.671 10.668 1.00 0.00 N ATOM 1272 CA ILE A 84 3.758 -7.562 11.452 1.00 0.00 C ATOM 1273 C ILE A 84 3.987 -8.815 12.288 1.00 0.00 C ATOM 1274 O ILE A 84 5.106 -9.089 12.723 1.00 0.00 O ATOM 1275 CB ILE A 84 3.728 -6.334 12.380 1.00 0.00 C ATOM 1276 CG1 ILE A 84 5.151 -5.922 12.766 1.00 0.00 C ATOM 1277 CG2 ILE A 84 2.898 -6.625 13.621 1.00 0.00 C ATOM 1278 CD1 ILE A 84 5.911 -5.238 11.652 1.00 0.00 C ATOM 0 H ILE A 84 1.729 -7.189 11.071 1.00 0.00 H new ATOM 0 HA ILE A 84 4.577 -7.447 10.743 1.00 0.00 H new ATOM 0 HB ILE A 84 3.264 -5.506 11.845 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.105 -5.254 13.626 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.703 -6.808 13.080 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.887 -5.746 14.266 1.00 0.00 H new ATOM 0 HG22 ILE A 84 1.878 -6.871 13.327 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.333 -7.466 14.161 1.00 0.00 H new ATOM 0 HD11 ILE A 84 6.910 -4.976 12.001 1.00 0.00 H new ATOM 0 HD12 ILE A 84 5.989 -5.911 10.798 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.382 -4.333 11.353 1.00 0.00 H new ATOM 1290 N ASN A 85 2.919 -9.576 12.511 1.00 0.00 N ATOM 1291 CA ASN A 85 2.973 -10.726 13.407 1.00 0.00 C ATOM 1292 C ASN A 85 3.007 -12.031 12.617 1.00 0.00 C ATOM 1293 O ASN A 85 3.342 -13.085 13.154 1.00 0.00 O ATOM 1294 CB ASN A 85 1.807 -10.728 14.379 1.00 0.00 C ATOM 1295 CG ASN A 85 0.464 -10.839 13.712 1.00 0.00 C ATOM 1296 OD1 ASN A 85 0.366 -11.062 12.500 1.00 0.00 O ATOM 1297 ND2 ASN A 85 -0.569 -10.603 14.481 1.00 0.00 N ATOM 0 H ASN A 85 2.007 -9.417 12.084 1.00 0.00 H new ATOM 0 HA ASN A 85 3.894 -10.646 13.985 1.00 0.00 H new ATOM 0 HB2 ASN A 85 1.927 -11.558 15.075 1.00 0.00 H new ATOM 0 HB3 ASN A 85 1.835 -9.812 14.969 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.509 -10.598 14.085 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -0.434 -10.425 15.476 1.00 0.00 H new ATOM 1304 N ASN A 86 2.659 -11.949 11.336 1.00 0.00 N ATOM 1305 CA ASN A 86 2.807 -13.084 10.432 1.00 0.00 C ATOM 1306 C ASN A 86 4.193 -13.097 9.796 1.00 0.00 C ATOM 1307 O ASN A 86 4.537 -12.214 9.009 1.00 0.00 O ATOM 1308 CB ASN A 86 1.735 -13.083 9.359 1.00 0.00 C ATOM 1309 CG ASN A 86 1.812 -14.258 8.423 1.00 0.00 C ATOM 1310 OD1 ASN A 86 2.901 -14.744 8.095 1.00 0.00 O ATOM 1311 ND2 ASN A 86 0.671 -14.664 7.929 1.00 0.00 N ATOM 0 H ASN A 86 2.274 -11.110 10.902 1.00 0.00 H new ATOM 0 HA ASN A 86 2.689 -13.990 11.026 1.00 0.00 H new ATOM 0 HB2 ASN A 86 0.755 -13.075 9.837 1.00 0.00 H new ATOM 0 HB3 ASN A 86 1.815 -12.163 8.780 1.00 0.00 H new ATOM 0 HD21 ASN A 86 0.652 -15.415 7.239 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -0.200 -14.229 8.233 1.00 0.00 H new ATOM 1318 N THR A 87 4.989 -14.105 10.141 1.00 0.00 N ATOM 1319 CA THR A 87 6.372 -14.177 9.690 1.00 0.00 C ATOM 1320 C THR A 87 6.450 -14.323 8.175 1.00 0.00 C ATOM 1321 O THR A 87 7.252 -13.659 7.518 1.00 0.00 O ATOM 1322 CB THR A 87 7.121 -15.350 10.348 1.00 0.00 C ATOM 1323 OG1 THR A 87 7.155 -15.162 11.769 1.00 0.00 O ATOM 1324 CG2 THR A 87 8.544 -15.440 9.817 1.00 0.00 C ATOM 0 H THR A 87 4.698 -14.883 10.732 1.00 0.00 H new ATOM 0 HA THR A 87 6.848 -13.243 9.987 1.00 0.00 H new ATOM 0 HB THR A 87 6.597 -16.275 10.110 1.00 0.00 H new ATOM 0 HG1 THR A 87 7.631 -15.910 12.187 1.00 0.00 H new ATOM 0 HG21 THR A 87 9.058 -16.275 10.293 1.00 0.00 H new ATOM 0 HG22 THR A 87 8.521 -15.596 8.738 1.00 0.00 H new ATOM 0 HG23 THR A 87 9.074 -14.514 10.038 1.00 0.00 H new ATOM 1332 N LYS A 88 5.611 -15.193 7.626 1.00 0.00 N ATOM 1333 CA LYS A 88 5.611 -15.457 6.191 1.00 0.00 C ATOM 1334 C LYS A 88 5.153 -14.227 5.412 1.00 0.00 C ATOM 1335 O LYS A 88 5.556 -14.021 4.268 1.00 0.00 O ATOM 1336 CB LYS A 88 4.715 -16.653 5.865 1.00 0.00 C ATOM 1337 CG LYS A 88 5.260 -17.994 6.338 1.00 0.00 C ATOM 1338 CD LYS A 88 4.319 -19.133 5.975 1.00 0.00 C ATOM 1339 CE LYS A 88 4.869 -20.474 6.435 1.00 0.00 C ATOM 1340 NZ LYS A 88 3.951 -21.597 6.102 1.00 0.00 N ATOM 0 H LYS A 88 4.921 -15.729 8.153 1.00 0.00 H new ATOM 0 HA LYS A 88 6.632 -15.693 5.891 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.736 -16.492 6.317 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.565 -16.696 4.786 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.238 -18.170 5.889 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.405 -17.969 7.418 1.00 0.00 H new ATOM 0 HD2 LYS A 88 3.344 -18.962 6.432 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.166 -19.151 4.896 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.838 -20.648 5.968 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.034 -20.448 7.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.364 -22.492 6.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.034 -21.445 6.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.813 -21.639 5.072 1.00 0.00 H new ATOM 1354 N SER A 89 4.311 -13.413 6.041 1.00 0.00 N ATOM 1355 CA SER A 89 3.808 -12.199 5.410 1.00 0.00 C ATOM 1356 C SER A 89 4.956 -11.279 5.008 1.00 0.00 C ATOM 1357 O SER A 89 4.878 -10.571 4.005 1.00 0.00 O ATOM 1358 CB SER A 89 2.854 -11.481 6.344 1.00 0.00 C ATOM 1359 OG SER A 89 2.134 -10.472 5.689 1.00 0.00 O ATOM 0 H SER A 89 3.963 -13.572 6.987 1.00 0.00 H new ATOM 0 HA SER A 89 3.269 -12.480 4.506 1.00 0.00 H new ATOM 0 HB2 SER A 89 2.158 -12.201 6.774 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.415 -11.047 7.171 1.00 0.00 H new ATOM 0 HG SER A 89 2.280 -10.541 4.722 1.00 0.00 H new ATOM 1365 N PHE A 90 6.023 -11.295 5.800 1.00 0.00 N ATOM 1366 CA PHE A 90 7.226 -10.536 5.479 1.00 0.00 C ATOM 1367 C PHE A 90 7.825 -11.002 4.154 1.00 0.00 C ATOM 1368 O PHE A 90 8.244 -10.191 3.331 1.00 0.00 O ATOM 1369 CB PHE A 90 8.258 -10.666 6.600 1.00 0.00 C ATOM 1370 CG PHE A 90 7.924 -9.865 7.826 1.00 0.00 C ATOM 1371 CD1 PHE A 90 7.076 -10.377 8.797 1.00 0.00 C ATOM 1372 CD2 PHE A 90 8.456 -8.598 8.012 1.00 0.00 C ATOM 1373 CE1 PHE A 90 6.768 -9.641 9.925 1.00 0.00 C ATOM 1374 CE2 PHE A 90 8.151 -7.861 9.139 1.00 0.00 C ATOM 1375 CZ PHE A 90 7.306 -8.383 10.097 1.00 0.00 C ATOM 0 H PHE A 90 6.079 -11.826 6.669 1.00 0.00 H new ATOM 0 HA PHE A 90 6.947 -9.487 5.381 1.00 0.00 H new ATOM 0 HB2 PHE A 90 8.350 -11.716 6.877 1.00 0.00 H new ATOM 0 HB3 PHE A 90 9.231 -10.349 6.224 1.00 0.00 H new ATOM 0 HD1 PHE A 90 6.652 -11.362 8.670 1.00 0.00 H new ATOM 0 HD2 PHE A 90 9.117 -8.183 7.266 1.00 0.00 H new ATOM 0 HE1 PHE A 90 6.105 -10.051 10.673 1.00 0.00 H new ATOM 0 HE2 PHE A 90 8.574 -6.876 9.271 1.00 0.00 H new ATOM 0 HZ PHE A 90 7.067 -7.808 10.979 1.00 0.00 H new ATOM 1385 N GLU A 91 7.859 -12.317 3.958 1.00 0.00 N ATOM 1386 CA GLU A 91 8.404 -12.892 2.734 1.00 0.00 C ATOM 1387 C GLU A 91 7.489 -12.612 1.547 1.00 0.00 C ATOM 1388 O GLU A 91 7.954 -12.443 0.417 1.00 0.00 O ATOM 1389 CB GLU A 91 8.614 -14.399 2.896 1.00 0.00 C ATOM 1390 CG GLU A 91 9.728 -14.779 3.862 1.00 0.00 C ATOM 1391 CD GLU A 91 9.803 -16.268 4.050 1.00 0.00 C ATOM 1392 OE1 GLU A 91 8.977 -16.959 3.504 1.00 0.00 O ATOM 1393 OE2 GLU A 91 10.750 -16.724 4.646 1.00 0.00 O ATOM 0 H GLU A 91 7.516 -13.003 4.630 1.00 0.00 H new ATOM 0 HA GLU A 91 9.369 -12.423 2.542 1.00 0.00 H new ATOM 0 HB2 GLU A 91 7.682 -14.848 3.240 1.00 0.00 H new ATOM 0 HB3 GLU A 91 8.834 -14.830 1.919 1.00 0.00 H new ATOM 0 HG2 GLU A 91 10.681 -14.409 3.485 1.00 0.00 H new ATOM 0 HG3 GLU A 91 9.558 -14.297 4.825 1.00 0.00 H new ATOM 1400 N ASP A 92 6.188 -12.565 1.808 1.00 0.00 N ATOM 1401 CA ASP A 92 5.202 -12.382 0.749 1.00 0.00 C ATOM 1402 C ASP A 92 5.451 -11.081 -0.007 1.00 0.00 C ATOM 1403 O ASP A 92 5.158 -10.977 -1.199 1.00 0.00 O ATOM 1404 CB ASP A 92 3.784 -12.393 1.327 1.00 0.00 C ATOM 1405 CG ASP A 92 3.297 -13.766 1.768 1.00 0.00 C ATOM 1406 OD1 ASP A 92 3.939 -14.737 1.442 1.00 0.00 O ATOM 1407 OD2 ASP A 92 2.380 -13.825 2.553 1.00 0.00 O ATOM 0 H ASP A 92 5.791 -12.651 2.744 1.00 0.00 H new ATOM 0 HA ASP A 92 5.302 -13.212 0.049 1.00 0.00 H new ATOM 0 HB2 ASP A 92 3.747 -11.716 2.181 1.00 0.00 H new ATOM 0 HB3 ASP A 92 3.096 -12.000 0.578 1.00 0.00 H new ATOM 1412 N ILE A 93 5.995 -10.089 0.694 1.00 0.00 N ATOM 1413 CA ILE A 93 6.345 -8.818 0.073 1.00 0.00 C ATOM 1414 C ILE A 93 7.407 -9.009 -1.006 1.00 0.00 C ATOM 1415 O ILE A 93 7.307 -8.444 -2.097 1.00 0.00 O ATOM 1416 CB ILE A 93 6.858 -7.804 1.112 1.00 0.00 C ATOM 1417 CG1 ILE A 93 5.729 -7.403 2.067 1.00 0.00 C ATOM 1418 CG2 ILE A 93 7.435 -6.579 0.420 1.00 0.00 C ATOM 1419 CD1 ILE A 93 4.554 -6.745 1.381 1.00 0.00 C ATOM 0 H ILE A 93 6.202 -10.143 1.691 1.00 0.00 H new ATOM 0 HA ILE A 93 5.435 -8.427 -0.381 1.00 0.00 H new ATOM 0 HB ILE A 93 7.651 -8.273 1.694 1.00 0.00 H new ATOM 0 HG12 ILE A 93 5.379 -8.291 2.594 1.00 0.00 H new ATOM 0 HG13 ILE A 93 6.127 -6.722 2.819 1.00 0.00 H new ATOM 0 HG21 ILE A 93 7.793 -5.873 1.169 1.00 0.00 H new ATOM 0 HG22 ILE A 93 8.264 -6.880 -0.221 1.00 0.00 H new ATOM 0 HG23 ILE A 93 6.662 -6.105 -0.185 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.796 -6.490 2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.888 -5.838 0.877 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.129 -7.432 0.649 1.00 0.00 H new ATOM 1431 N HIS A 94 8.422 -9.809 -0.697 1.00 0.00 N ATOM 1432 CA HIS A 94 9.465 -10.130 -1.663 1.00 0.00 C ATOM 1433 C HIS A 94 8.887 -10.895 -2.850 1.00 0.00 C ATOM 1434 O HIS A 94 9.233 -10.625 -4.001 1.00 0.00 O ATOM 1435 CB HIS A 94 10.583 -10.945 -1.004 1.00 0.00 C ATOM 1436 CG HIS A 94 11.393 -10.166 -0.016 1.00 0.00 C ATOM 1437 ND1 HIS A 94 11.975 -8.955 -0.323 1.00 0.00 N ATOM 1438 CD2 HIS A 94 11.719 -10.427 1.272 1.00 0.00 C ATOM 1439 CE1 HIS A 94 12.624 -8.502 0.737 1.00 0.00 C ATOM 1440 NE2 HIS A 94 12.484 -9.376 1.716 1.00 0.00 N ATOM 0 H HIS A 94 8.544 -10.247 0.216 1.00 0.00 H new ATOM 0 HA HIS A 94 9.886 -9.192 -2.026 1.00 0.00 H new ATOM 0 HB2 HIS A 94 10.144 -11.807 -0.502 1.00 0.00 H new ATOM 0 HB3 HIS A 94 11.245 -11.331 -1.779 1.00 0.00 H new ATOM 0 HD2 HIS A 94 11.432 -11.298 1.843 1.00 0.00 H new ATOM 0 HE1 HIS A 94 13.175 -7.575 0.792 1.00 0.00 H new ATOM 0 HE2 HIS A 94 12.880 -9.286 2.652 1.00 0.00 H new ATOM 1447 N GLN A 95 8.008 -11.849 -2.563 1.00 0.00 N ATOM 1448 CA GLN A 95 7.399 -12.666 -3.607 1.00 0.00 C ATOM 1449 C GLN A 95 6.521 -11.817 -4.520 1.00 0.00 C ATOM 1450 O GLN A 95 6.606 -11.914 -5.744 1.00 0.00 O ATOM 1451 CB GLN A 95 6.568 -13.795 -2.989 1.00 0.00 C ATOM 1452 CG GLN A 95 7.389 -14.852 -2.272 1.00 0.00 C ATOM 1453 CD GLN A 95 6.532 -15.779 -1.430 1.00 0.00 C ATOM 1454 OE1 GLN A 95 5.250 -15.453 -1.314 1.00 0.00 O flip ATOM 1455 NE2 GLN A 95 7.017 -16.779 -0.894 1.00 0.00 N flip ATOM 0 H GLN A 95 7.701 -12.076 -1.617 1.00 0.00 H new ATOM 0 HA GLN A 95 8.201 -13.101 -4.203 1.00 0.00 H new ATOM 0 HB2 GLN A 95 5.857 -13.364 -2.284 1.00 0.00 H new ATOM 0 HB3 GLN A 95 5.986 -14.275 -3.776 1.00 0.00 H new ATOM 0 HG2 GLN A 95 7.941 -15.439 -3.006 1.00 0.00 H new ATOM 0 HG3 GLN A 95 8.126 -14.364 -1.634 1.00 0.00 H new ATOM 0 HE21 GLN A 95 8.008 -16.990 -1.011 1.00 0.00 H new ATOM 0 HE22 GLN A 95 6.427 -17.394 -0.334 1.00 0.00 H new ATOM 1464 N TYR A 96 5.677 -10.986 -3.916 1.00 0.00 N ATOM 1465 CA TYR A 96 4.759 -10.146 -4.674 1.00 0.00 C ATOM 1466 C TYR A 96 5.521 -9.134 -5.525 1.00 0.00 C ATOM 1467 O TYR A 96 5.178 -8.895 -6.682 1.00 0.00 O ATOM 1468 CB TYR A 96 3.793 -9.423 -3.733 1.00 0.00 C ATOM 1469 CG TYR A 96 2.771 -10.332 -3.087 1.00 0.00 C ATOM 1470 CD1 TYR A 96 2.541 -11.609 -3.578 1.00 0.00 C ATOM 1471 CD2 TYR A 96 2.038 -9.910 -1.988 1.00 0.00 C ATOM 1472 CE1 TYR A 96 1.608 -12.442 -2.993 1.00 0.00 C ATOM 1473 CE2 TYR A 96 1.103 -10.735 -1.393 1.00 0.00 C ATOM 1474 CZ TYR A 96 0.891 -12.001 -1.899 1.00 0.00 C ATOM 1475 OH TYR A 96 -0.039 -12.828 -1.311 1.00 0.00 O ATOM 0 H TYR A 96 5.611 -10.877 -2.904 1.00 0.00 H new ATOM 0 HA TYR A 96 4.185 -10.790 -5.340 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.367 -8.925 -2.952 1.00 0.00 H new ATOM 0 HB3 TYR A 96 3.272 -8.645 -4.291 1.00 0.00 H new ATOM 0 HD1 TYR A 96 3.102 -11.958 -4.433 1.00 0.00 H new ATOM 0 HD2 TYR A 96 2.201 -8.919 -1.590 1.00 0.00 H new ATOM 0 HE1 TYR A 96 1.440 -13.433 -3.389 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.541 -10.391 -0.537 1.00 0.00 H new ATOM 0 HH TYR A 96 -0.454 -12.366 -0.553 1.00 0.00 H new ATOM 1485 N ARG A 97 6.557 -8.540 -4.938 1.00 0.00 N ATOM 1486 CA ARG A 97 7.352 -7.535 -5.632 1.00 0.00 C ATOM 1487 C ARG A 97 7.951 -8.101 -6.914 1.00 0.00 C ATOM 1488 O ARG A 97 7.830 -7.506 -7.985 1.00 0.00 O ATOM 1489 CB ARG A 97 8.422 -6.930 -4.734 1.00 0.00 C ATOM 1490 CG ARG A 97 9.322 -5.908 -5.411 1.00 0.00 C ATOM 1491 CD ARG A 97 10.572 -6.475 -5.978 1.00 0.00 C ATOM 1492 NE ARG A 97 11.484 -7.032 -4.991 1.00 0.00 N ATOM 1493 CZ ARG A 97 12.556 -7.793 -5.284 1.00 0.00 C ATOM 1494 NH1 ARG A 97 12.835 -8.121 -6.526 1.00 0.00 N ATOM 1495 NH2 ARG A 97 13.308 -8.221 -4.285 1.00 0.00 N ATOM 0 H ARG A 97 6.864 -8.738 -3.986 1.00 0.00 H new ATOM 0 HA ARG A 97 6.679 -6.723 -5.907 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.935 -6.456 -3.882 1.00 0.00 H new ATOM 0 HB3 ARG A 97 9.043 -7.735 -4.340 1.00 0.00 H new ATOM 0 HG2 ARG A 97 8.763 -5.421 -6.210 1.00 0.00 H new ATOM 0 HG3 ARG A 97 9.583 -5.135 -4.688 1.00 0.00 H new ATOM 0 HD2 ARG A 97 10.310 -7.255 -6.693 1.00 0.00 H new ATOM 0 HD3 ARG A 97 11.091 -5.694 -6.534 1.00 0.00 H new ATOM 0 HE ARG A 97 11.299 -6.832 -4.008 1.00 0.00 H new ATOM 0 HH11 ARG A 97 12.236 -7.798 -7.286 1.00 0.00 H new ATOM 0 HH12 ARG A 97 13.651 -8.698 -6.730 1.00 0.00 H new ATOM 0 HH21 ARG A 97 13.070 -7.973 -3.325 1.00 0.00 H new ATOM 0 HH22 ARG A 97 14.127 -8.799 -4.474 1.00 0.00 H new ATOM 1509 N GLU A 98 8.597 -9.259 -6.800 1.00 0.00 N ATOM 1510 CA GLU A 98 9.238 -9.891 -7.946 1.00 0.00 C ATOM 1511 C GLU A 98 8.199 -10.455 -8.910 1.00 0.00 C ATOM 1512 O GLU A 98 8.342 -10.342 -10.127 1.00 0.00 O ATOM 1513 CB GLU A 98 10.188 -11.000 -7.485 1.00 0.00 C ATOM 1514 CG GLU A 98 10.978 -11.658 -8.607 1.00 0.00 C ATOM 1515 CD GLU A 98 11.957 -10.698 -9.222 1.00 0.00 C ATOM 1516 OE1 GLU A 98 12.127 -9.629 -8.687 1.00 0.00 O ATOM 1517 OE2 GLU A 98 12.617 -11.075 -10.162 1.00 0.00 O ATOM 0 H GLU A 98 8.689 -9.777 -5.926 1.00 0.00 H new ATOM 0 HA GLU A 98 9.815 -9.130 -8.471 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.888 -10.584 -6.760 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.610 -11.765 -6.967 1.00 0.00 H new ATOM 0 HG2 GLU A 98 11.511 -12.526 -8.219 1.00 0.00 H new ATOM 0 HG3 GLU A 98 10.292 -12.022 -9.372 1.00 0.00 H new ATOM 1524 N GLN A 99 7.153 -11.060 -8.356 1.00 0.00 N ATOM 1525 CA GLN A 99 6.144 -11.733 -9.166 1.00 0.00 C ATOM 1526 C GLN A 99 5.347 -10.725 -9.988 1.00 0.00 C ATOM 1527 O GLN A 99 5.146 -10.912 -11.189 1.00 0.00 O ATOM 1528 CB GLN A 99 5.196 -12.544 -8.280 1.00 0.00 C ATOM 1529 CG GLN A 99 4.113 -13.287 -9.042 1.00 0.00 C ATOM 1530 CD GLN A 99 3.175 -14.048 -8.124 1.00 0.00 C ATOM 1531 OE1 GLN A 99 3.246 -15.275 -8.021 1.00 0.00 O ATOM 1532 NE2 GLN A 99 2.288 -13.323 -7.453 1.00 0.00 N ATOM 0 H GLN A 99 6.982 -11.098 -7.351 1.00 0.00 H new ATOM 0 HA GLN A 99 6.659 -12.410 -9.847 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.780 -13.264 -7.707 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.724 -11.873 -7.563 1.00 0.00 H new ATOM 0 HG2 GLN A 99 3.538 -12.576 -9.636 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.577 -13.983 -9.740 1.00 0.00 H new ATOM 0 HE21 GLN A 99 2.265 -12.310 -7.569 1.00 0.00 H new ATOM 0 HE22 GLN A 99 1.630 -13.779 -6.822 1.00 0.00 H new ATOM 1541 N ILE A 100 4.895 -9.661 -9.334 1.00 0.00 N ATOM 1542 CA ILE A 100 4.164 -8.601 -10.016 1.00 0.00 C ATOM 1543 C ILE A 100 4.984 -8.017 -11.162 1.00 0.00 C ATOM 1544 O ILE A 100 4.482 -7.840 -12.272 1.00 0.00 O ATOM 1545 CB ILE A 100 3.776 -7.470 -9.045 1.00 0.00 C ATOM 1546 CG1 ILE A 100 2.678 -7.941 -8.088 1.00 0.00 C ATOM 1547 CG2 ILE A 100 3.323 -6.239 -9.816 1.00 0.00 C ATOM 1548 CD1 ILE A 100 2.427 -6.998 -6.934 1.00 0.00 C ATOM 0 H ILE A 100 5.022 -9.510 -8.333 1.00 0.00 H new ATOM 0 HA ILE A 100 3.255 -9.051 -10.417 1.00 0.00 H new ATOM 0 HB ILE A 100 4.653 -7.202 -8.456 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.752 -8.069 -8.648 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.949 -8.920 -7.692 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.053 -5.450 -9.115 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.133 -5.893 -10.457 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.458 -6.492 -10.429 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.636 -7.400 -6.301 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.340 -6.888 -6.349 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.124 -6.024 -7.319 1.00 0.00 H new ATOM 1560 N LYS A 101 6.249 -7.720 -10.886 1.00 0.00 N ATOM 1561 CA LYS A 101 7.131 -7.122 -11.882 1.00 0.00 C ATOM 1562 C LYS A 101 7.210 -7.995 -13.132 1.00 0.00 C ATOM 1563 O LYS A 101 7.148 -7.495 -14.254 1.00 0.00 O ATOM 1564 CB LYS A 101 8.529 -6.906 -11.301 1.00 0.00 C ATOM 1565 CG LYS A 101 9.496 -6.194 -12.238 1.00 0.00 C ATOM 1566 CD LYS A 101 10.851 -5.983 -11.579 1.00 0.00 C ATOM 1567 CE LYS A 101 11.828 -5.298 -12.524 1.00 0.00 C ATOM 1568 NZ LYS A 101 13.172 -5.132 -11.910 1.00 0.00 N ATOM 0 H LYS A 101 6.687 -7.884 -9.980 1.00 0.00 H new ATOM 0 HA LYS A 101 6.715 -6.154 -12.163 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.442 -6.328 -10.381 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.951 -7.874 -11.031 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.620 -6.779 -13.149 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.078 -5.231 -12.532 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.730 -5.380 -10.679 1.00 0.00 H new ATOM 0 HD3 LYS A 101 11.259 -6.944 -11.266 1.00 0.00 H new ATOM 0 HE2 LYS A 101 11.917 -5.883 -13.440 1.00 0.00 H new ATOM 0 HE3 LYS A 101 11.435 -4.321 -12.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 13.807 -4.662 -12.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.092 -4.553 -11.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 13.559 -6.065 -11.664 1.00 0.00 H new ATOM 1582 N ARG A 102 7.346 -9.301 -12.928 1.00 0.00 N ATOM 1583 CA ARG A 102 7.523 -10.233 -14.035 1.00 0.00 C ATOM 1584 C ARG A 102 6.236 -10.369 -14.843 1.00 0.00 C ATOM 1585 O ARG A 102 6.261 -10.377 -16.073 1.00 0.00 O ATOM 1586 CB ARG A 102 8.039 -11.587 -13.570 1.00 0.00 C ATOM 1587 CG ARG A 102 9.470 -11.584 -13.054 1.00 0.00 C ATOM 1588 CD ARG A 102 9.968 -12.915 -12.622 1.00 0.00 C ATOM 1589 NE ARG A 102 11.226 -12.880 -11.894 1.00 0.00 N ATOM 1590 CZ ARG A 102 11.985 -13.960 -11.625 1.00 0.00 C ATOM 1591 NH1 ARG A 102 11.601 -15.165 -11.989 1.00 0.00 N ATOM 1592 NH2 ARG A 102 13.116 -13.781 -10.965 1.00 0.00 N ATOM 0 H ARG A 102 7.337 -9.738 -12.006 1.00 0.00 H new ATOM 0 HA ARG A 102 8.289 -9.817 -14.690 1.00 0.00 H new ATOM 0 HB2 ARG A 102 7.384 -11.958 -12.781 1.00 0.00 H new ATOM 0 HB3 ARG A 102 7.969 -12.291 -14.399 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.125 -11.201 -13.836 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.539 -10.893 -12.214 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.212 -13.385 -11.993 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.089 -13.547 -13.502 1.00 0.00 H new ATOM 0 HE ARG A 102 11.557 -11.974 -11.564 1.00 0.00 H new ATOM 0 HH11 ARG A 102 10.717 -15.291 -12.482 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.187 -15.973 -11.778 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.394 -12.844 -10.674 1.00 0.00 H new ATOM 0 HH22 ARG A 102 13.711 -14.580 -10.747 1.00 0.00 H new ATOM 1606 N VAL A 103 5.112 -10.476 -14.141 1.00 0.00 N ATOM 1607 CA VAL A 103 3.832 -10.747 -14.784 1.00 0.00 C ATOM 1608 C VAL A 103 3.420 -9.592 -15.692 1.00 0.00 C ATOM 1609 O VAL A 103 2.929 -9.805 -16.801 1.00 0.00 O ATOM 1610 CB VAL A 103 2.720 -10.996 -13.748 1.00 0.00 C ATOM 1611 CG1 VAL A 103 1.356 -11.006 -14.423 1.00 0.00 C ATOM 1612 CG2 VAL A 103 2.960 -12.305 -13.012 1.00 0.00 C ATOM 0 H VAL A 103 5.062 -10.379 -13.127 1.00 0.00 H new ATOM 0 HA VAL A 103 3.964 -11.648 -15.383 1.00 0.00 H new ATOM 0 HB VAL A 103 2.739 -10.184 -13.021 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.582 -11.183 -13.676 1.00 0.00 H new ATOM 0 HG12 VAL A 103 1.182 -10.044 -14.905 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.326 -11.798 -15.171 1.00 0.00 H new ATOM 0 HG21 VAL A 103 2.164 -12.464 -12.284 1.00 0.00 H new ATOM 0 HG22 VAL A 103 2.968 -13.128 -13.727 1.00 0.00 H new ATOM 0 HG23 VAL A 103 3.920 -12.262 -12.497 1.00 0.00 H new ATOM 1622 N LYS A 104 3.624 -8.369 -15.213 1.00 0.00 N ATOM 1623 CA LYS A 104 3.230 -7.180 -15.961 1.00 0.00 C ATOM 1624 C LYS A 104 4.339 -6.743 -16.914 1.00 0.00 C ATOM 1625 O LYS A 104 4.182 -5.782 -17.664 1.00 0.00 O ATOM 1626 CB LYS A 104 2.873 -6.039 -15.007 1.00 0.00 C ATOM 1627 CG LYS A 104 4.067 -5.423 -14.290 1.00 0.00 C ATOM 1628 CD LYS A 104 3.623 -4.400 -13.256 1.00 0.00 C ATOM 1629 CE LYS A 104 4.816 -3.759 -12.562 1.00 0.00 C ATOM 1630 NZ LYS A 104 4.397 -2.857 -11.454 1.00 0.00 N ATOM 0 H LYS A 104 4.059 -8.175 -14.311 1.00 0.00 H new ATOM 0 HA LYS A 104 2.349 -7.431 -16.552 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.360 -5.259 -15.569 1.00 0.00 H new ATOM 0 HB3 LYS A 104 2.169 -6.411 -14.262 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.646 -6.208 -13.803 1.00 0.00 H new ATOM 0 HG3 LYS A 104 4.724 -4.946 -15.017 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.023 -3.629 -13.739 1.00 0.00 H new ATOM 0 HD3 LYS A 104 2.985 -4.882 -12.515 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.468 -4.538 -12.168 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.398 -3.194 -13.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 5.225 -2.338 -11.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 3.690 -2.181 -11.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.984 -3.421 -10.684 1.00 0.00 H new ATOM 1644 N ASP A 105 5.458 -7.458 -16.877 1.00 0.00 N ATOM 1645 CA ASP A 105 6.533 -7.244 -17.839 1.00 0.00 C ATOM 1646 C ASP A 105 6.976 -5.785 -17.842 1.00 0.00 C ATOM 1647 O ASP A 105 7.195 -5.195 -18.901 1.00 0.00 O ATOM 1648 CB ASP A 105 6.091 -7.665 -19.243 1.00 0.00 C ATOM 1649 CG ASP A 105 5.790 -9.151 -19.389 1.00 0.00 C ATOM 1650 OD1 ASP A 105 6.621 -9.945 -19.015 1.00 0.00 O ATOM 1651 OD2 ASP A 105 4.677 -9.480 -19.723 1.00 0.00 O ATOM 0 H ASP A 105 5.644 -8.190 -16.192 1.00 0.00 H new ATOM 0 HA ASP A 105 7.381 -7.861 -17.540 1.00 0.00 H new ATOM 0 HB2 ASP A 105 5.201 -7.098 -19.516 1.00 0.00 H new ATOM 0 HB3 ASP A 105 6.872 -7.393 -19.953 1.00 0.00 H new ATOM 1656 N SER A 106 7.105 -5.208 -16.652 1.00 0.00 N ATOM 1657 CA SER A 106 7.446 -3.796 -16.520 1.00 0.00 C ATOM 1658 C SER A 106 8.505 -3.590 -15.441 1.00 0.00 C ATOM 1659 O SER A 106 8.882 -4.529 -14.739 1.00 0.00 O ATOM 1660 CB SER A 106 6.204 -2.984 -16.205 1.00 0.00 C ATOM 1661 OG SER A 106 5.203 -3.159 -17.171 1.00 0.00 O ATOM 0 H SER A 106 6.979 -5.696 -15.765 1.00 0.00 H new ATOM 0 HA SER A 106 7.859 -3.453 -17.469 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.819 -3.275 -15.227 1.00 0.00 H new ATOM 0 HB3 SER A 106 6.467 -1.928 -16.143 1.00 0.00 H new ATOM 0 HG SER A 106 4.928 -4.099 -17.190 1.00 0.00 H new ATOM 1667 N ASP A 107 8.982 -2.357 -15.316 1.00 0.00 N ATOM 1668 CA ASP A 107 10.029 -2.035 -14.354 1.00 0.00 C ATOM 1669 C ASP A 107 9.470 -1.992 -12.936 1.00 0.00 C ATOM 1670 O ASP A 107 8.265 -2.142 -12.730 1.00 0.00 O ATOM 1671 CB ASP A 107 10.688 -0.699 -14.703 1.00 0.00 C ATOM 1672 CG ASP A 107 9.781 0.513 -14.533 1.00 0.00 C ATOM 1673 OD1 ASP A 107 8.767 0.386 -13.889 1.00 0.00 O ATOM 1674 OD2 ASP A 107 10.182 1.587 -14.912 1.00 0.00 O ATOM 0 H ASP A 107 8.660 -1.563 -15.869 1.00 0.00 H new ATOM 0 HA ASP A 107 10.784 -2.820 -14.402 1.00 0.00 H new ATOM 0 HB2 ASP A 107 11.570 -0.568 -14.076 1.00 0.00 H new ATOM 0 HB3 ASP A 107 11.034 -0.737 -15.736 1.00 0.00 H new ATOM 1679 N ASP A 108 10.350 -1.789 -11.963 1.00 0.00 N ATOM 1680 CA ASP A 108 9.949 -1.763 -10.561 1.00 0.00 C ATOM 1681 C ASP A 108 9.447 -0.379 -10.166 1.00 0.00 C ATOM 1682 O ASP A 108 10.171 0.611 -10.273 1.00 0.00 O ATOM 1683 CB ASP A 108 11.115 -2.179 -9.661 1.00 0.00 C ATOM 1684 CG ASP A 108 10.761 -2.285 -8.183 1.00 0.00 C ATOM 1685 OD1 ASP A 108 9.643 -1.984 -7.836 1.00 0.00 O ATOM 1686 OD2 ASP A 108 11.555 -2.811 -7.440 1.00 0.00 O ATOM 0 H ASP A 108 11.347 -1.640 -12.119 1.00 0.00 H new ATOM 0 HA ASP A 108 9.134 -2.475 -10.430 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.495 -3.142 -10.001 1.00 0.00 H new ATOM 0 HB3 ASP A 108 11.924 -1.458 -9.778 1.00 0.00 H new ATOM 1691 N VAL A 109 8.200 -0.315 -9.709 1.00 0.00 N ATOM 1692 CA VAL A 109 7.557 0.960 -9.413 1.00 0.00 C ATOM 1693 C VAL A 109 7.676 1.305 -7.934 1.00 0.00 C ATOM 1694 O VAL A 109 7.837 0.435 -7.078 1.00 0.00 O ATOM 1695 CB VAL A 109 6.069 0.946 -9.810 1.00 0.00 C ATOM 1696 CG1 VAL A 109 5.915 0.662 -11.296 1.00 0.00 C ATOM 1697 CG2 VAL A 109 5.307 -0.084 -8.990 1.00 0.00 C ATOM 0 H VAL A 109 7.615 -1.132 -9.536 1.00 0.00 H new ATOM 0 HA VAL A 109 8.073 1.718 -10.002 1.00 0.00 H new ATOM 0 HB VAL A 109 5.650 1.930 -9.602 1.00 0.00 H new ATOM 0 HG11 VAL A 109 4.857 0.656 -11.558 1.00 0.00 H new ATOM 0 HG12 VAL A 109 6.426 1.436 -11.869 1.00 0.00 H new ATOM 0 HG13 VAL A 109 6.351 -0.309 -11.528 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.258 -0.079 -9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 109 5.729 -1.074 -9.166 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.388 0.162 -7.931 1.00 0.00 H new ATOM 1707 N PRO A 110 7.597 2.608 -7.623 1.00 0.00 N ATOM 1708 CA PRO A 110 7.697 3.099 -6.245 1.00 0.00 C ATOM 1709 C PRO A 110 6.539 2.622 -5.375 1.00 0.00 C ATOM 1710 O PRO A 110 5.382 2.651 -5.793 1.00 0.00 O ATOM 1711 CB PRO A 110 7.704 4.624 -6.397 1.00 0.00 C ATOM 1712 CG PRO A 110 7.059 4.868 -7.719 1.00 0.00 C ATOM 1713 CD PRO A 110 7.487 3.718 -8.591 1.00 0.00 C ATOM 0 HA PRO A 110 8.586 2.724 -5.739 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.152 5.106 -5.590 1.00 0.00 H new ATOM 0 HB3 PRO A 110 8.719 5.021 -6.371 1.00 0.00 H new ATOM 0 HG2 PRO A 110 5.974 4.907 -7.625 1.00 0.00 H new ATOM 0 HG3 PRO A 110 7.377 5.821 -8.141 1.00 0.00 H new ATOM 0 HD2 PRO A 110 6.756 3.506 -9.371 1.00 0.00 H new ATOM 0 HD3 PRO A 110 8.436 3.918 -9.089 1.00 0.00 H new ATOM 1721 N MET A 111 6.860 2.184 -4.161 1.00 0.00 N ATOM 1722 CA MET A 111 5.864 1.585 -3.279 1.00 0.00 C ATOM 1723 C MET A 111 6.172 1.900 -1.819 1.00 0.00 C ATOM 1724 O MET A 111 7.302 2.245 -1.472 1.00 0.00 O ATOM 1725 CB MET A 111 5.807 0.074 -3.495 1.00 0.00 C ATOM 1726 CG MET A 111 7.108 -0.656 -3.194 1.00 0.00 C ATOM 1727 SD MET A 111 7.054 -2.397 -3.663 1.00 0.00 S ATOM 1728 CE MET A 111 7.063 -2.267 -5.448 1.00 0.00 C ATOM 0 H MET A 111 7.799 2.232 -3.767 1.00 0.00 H new ATOM 0 HA MET A 111 4.891 2.012 -3.522 1.00 0.00 H new ATOM 0 HB2 MET A 111 5.019 -0.341 -2.867 1.00 0.00 H new ATOM 0 HB3 MET A 111 5.526 -0.122 -4.530 1.00 0.00 H new ATOM 0 HG2 MET A 111 7.925 -0.167 -3.724 1.00 0.00 H new ATOM 0 HG3 MET A 111 7.326 -0.577 -2.129 1.00 0.00 H new ATOM 0 HE1 MET A 111 7.158 -3.261 -5.885 1.00 0.00 H new ATOM 0 HE2 MET A 111 6.132 -1.810 -5.784 1.00 0.00 H new ATOM 0 HE3 MET A 111 7.904 -1.650 -5.764 1.00 0.00 H new ATOM 1738 N VAL A 112 5.158 1.779 -0.968 1.00 0.00 N ATOM 1739 CA VAL A 112 5.338 1.973 0.467 1.00 0.00 C ATOM 1740 C VAL A 112 4.922 0.730 1.247 1.00 0.00 C ATOM 1741 O VAL A 112 3.864 0.151 0.993 1.00 0.00 O ATOM 1742 CB VAL A 112 4.536 3.183 0.978 1.00 0.00 C ATOM 1743 CG1 VAL A 112 4.713 3.343 2.481 1.00 0.00 C ATOM 1744 CG2 VAL A 112 4.963 4.451 0.256 1.00 0.00 C ATOM 0 H VAL A 112 4.204 1.548 -1.246 1.00 0.00 H new ATOM 0 HA VAL A 112 6.400 2.160 0.629 1.00 0.00 H new ATOM 0 HB VAL A 112 3.481 3.007 0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.139 4.203 2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 112 4.359 2.445 2.987 1.00 0.00 H new ATOM 0 HG13 VAL A 112 5.768 3.496 2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 112 4.385 5.295 0.631 1.00 0.00 H new ATOM 0 HG22 VAL A 112 6.024 4.631 0.432 1.00 0.00 H new ATOM 0 HG23 VAL A 112 4.787 4.337 -0.814 1.00 0.00 H new ATOM 1754 N LEU A 113 5.757 0.325 2.195 1.00 0.00 N ATOM 1755 CA LEU A 113 5.502 -0.880 2.976 1.00 0.00 C ATOM 1756 C LEU A 113 4.843 -0.536 4.308 1.00 0.00 C ATOM 1757 O LEU A 113 5.343 0.295 5.065 1.00 0.00 O ATOM 1758 CB LEU A 113 6.809 -1.649 3.208 1.00 0.00 C ATOM 1759 CG LEU A 113 7.257 -2.541 2.043 1.00 0.00 C ATOM 1760 CD1 LEU A 113 7.688 -1.682 0.863 1.00 0.00 C ATOM 1761 CD2 LEU A 113 8.394 -3.442 2.500 1.00 0.00 C ATOM 0 H LEU A 113 6.618 0.813 2.442 1.00 0.00 H new ATOM 0 HA LEU A 113 4.817 -1.514 2.413 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.601 -0.931 3.421 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.694 -2.270 4.097 1.00 0.00 H new ATOM 0 HG LEU A 113 6.423 -3.166 1.722 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.004 -2.325 0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.851 -1.063 0.539 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.518 -1.042 1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 113 8.712 -4.075 1.672 1.00 0.00 H new ATOM 0 HD22 LEU A 113 9.233 -2.830 2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.053 -4.067 3.325 1.00 0.00 H new ATOM 1773 N VAL A 114 3.717 -1.186 4.590 1.00 0.00 N ATOM 1774 CA VAL A 114 2.980 -0.937 5.823 1.00 0.00 C ATOM 1775 C VAL A 114 2.769 -2.228 6.606 1.00 0.00 C ATOM 1776 O VAL A 114 2.264 -3.215 6.073 1.00 0.00 O ATOM 1777 CB VAL A 114 1.611 -0.288 5.542 1.00 0.00 C ATOM 1778 CG1 VAL A 114 0.845 -0.078 6.840 1.00 0.00 C ATOM 1779 CG2 VAL A 114 1.787 1.032 4.809 1.00 0.00 C ATOM 0 H VAL A 114 3.296 -1.888 3.981 1.00 0.00 H new ATOM 0 HA VAL A 114 3.582 -0.249 6.417 1.00 0.00 H new ATOM 0 HB VAL A 114 1.035 -0.961 4.906 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.119 0.381 6.623 1.00 0.00 H new ATOM 0 HG12 VAL A 114 0.687 -1.039 7.329 1.00 0.00 H new ATOM 0 HG13 VAL A 114 1.418 0.575 7.499 1.00 0.00 H new ATOM 0 HG21 VAL A 114 0.810 1.476 4.619 1.00 0.00 H new ATOM 0 HG22 VAL A 114 2.381 1.711 5.420 1.00 0.00 H new ATOM 0 HG23 VAL A 114 2.296 0.857 3.861 1.00 0.00 H new ATOM 1789 N GLY A 115 3.160 -2.213 7.877 1.00 0.00 N ATOM 1790 CA GLY A 115 2.907 -3.348 8.745 1.00 0.00 C ATOM 1791 C GLY A 115 1.541 -3.285 9.398 1.00 0.00 C ATOM 1792 O GLY A 115 1.120 -2.231 9.871 1.00 0.00 O ATOM 0 H GLY A 115 3.648 -1.435 8.321 1.00 0.00 H new ATOM 0 HA2 GLY A 115 2.988 -4.269 8.167 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.674 -3.388 9.518 1.00 0.00 H new ATOM 1796 N ASN A 116 0.847 -4.420 9.424 1.00 0.00 N ATOM 1797 CA ASN A 116 -0.508 -4.473 9.962 1.00 0.00 C ATOM 1798 C ASN A 116 -0.541 -5.244 11.277 1.00 0.00 C ATOM 1799 O ASN A 116 0.418 -5.929 11.633 1.00 0.00 O ATOM 1800 CB ASN A 116 -1.478 -5.084 8.968 1.00 0.00 C ATOM 1801 CG ASN A 116 -2.923 -4.844 9.307 1.00 0.00 C ATOM 1802 OD1 ASN A 116 -3.253 -3.997 10.145 1.00 0.00 O ATOM 1803 ND2 ASN A 116 -3.781 -5.640 8.720 1.00 0.00 N ATOM 0 H ASN A 116 1.200 -5.313 9.080 1.00 0.00 H new ATOM 0 HA ASN A 116 -0.823 -3.447 10.152 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -1.274 -4.677 7.978 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -1.300 -6.158 8.914 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -4.773 -5.577 8.948 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -3.457 -6.323 8.035 1.00 0.00 H new ATOM 1810 N LYS A 117 -1.652 -5.130 11.997 1.00 0.00 N ATOM 1811 CA LYS A 117 -1.867 -5.916 13.205 1.00 0.00 C ATOM 1812 C LYS A 117 -0.768 -5.650 14.229 1.00 0.00 C ATOM 1813 O LYS A 117 -0.082 -6.572 14.672 1.00 0.00 O ATOM 1814 CB LYS A 117 -1.929 -7.407 12.873 1.00 0.00 C ATOM 1815 CG LYS A 117 -3.090 -7.802 11.970 1.00 0.00 C ATOM 1816 CD LYS A 117 -3.164 -9.311 11.790 1.00 0.00 C ATOM 1817 CE LYS A 117 -4.339 -9.708 10.910 1.00 0.00 C ATOM 1818 NZ LYS A 117 -4.385 -11.177 10.673 1.00 0.00 N ATOM 0 H LYS A 117 -2.419 -4.499 11.764 1.00 0.00 H new ATOM 0 HA LYS A 117 -2.821 -5.614 13.637 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -0.995 -7.699 12.393 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.999 -7.971 13.803 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -4.025 -7.439 12.397 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -2.976 -7.323 10.998 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.236 -9.672 11.346 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -3.259 -9.791 12.764 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -5.269 -9.387 11.380 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.269 -9.188 9.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -5.200 -11.406 10.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.509 -11.480 10.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -4.478 -11.673 11.583 1.00 0.00 H new ATOM 1832 N CYS A 118 -0.606 -4.384 14.603 1.00 0.00 N ATOM 1833 CA CYS A 118 0.381 -4.002 15.607 1.00 0.00 C ATOM 1834 C CYS A 118 -0.200 -4.119 17.013 1.00 0.00 C ATOM 1835 O CYS A 118 0.530 -4.332 17.981 1.00 0.00 O ATOM 1836 CB CYS A 118 0.670 -2.542 15.260 1.00 0.00 C ATOM 1837 SG CYS A 118 1.585 -2.303 13.719 1.00 0.00 S ATOM 0 H CYS A 118 -1.146 -3.605 14.225 1.00 0.00 H new ATOM 0 HA CYS A 118 1.270 -4.633 15.601 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -0.276 -2.004 15.193 1.00 0.00 H new ATOM 0 HB3 CYS A 118 1.235 -2.093 16.077 1.00 0.00 H new ATOM 0 HG CYS A 118 0.753 -2.025 12.759 1.00 0.00 H new ATOM 1843 N ASP A 119 -1.517 -3.978 17.115 1.00 0.00 N ATOM 1844 CA ASP A 119 -2.207 -4.153 18.389 1.00 0.00 C ATOM 1845 C ASP A 119 -2.910 -5.505 18.445 1.00 0.00 C ATOM 1846 O ASP A 119 -3.396 -5.920 19.499 1.00 0.00 O ATOM 1847 CB ASP A 119 -3.215 -3.024 18.614 1.00 0.00 C ATOM 1848 CG ASP A 119 -2.586 -1.665 18.895 1.00 0.00 C ATOM 1849 OD1 ASP A 119 -1.409 -1.621 19.161 1.00 0.00 O ATOM 1850 OD2 ASP A 119 -3.245 -0.675 18.688 1.00 0.00 O ATOM 0 H ASP A 119 -2.128 -3.743 16.333 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.461 -4.120 19.183 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -3.852 -2.941 17.733 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.861 -3.292 19.450 1.00 0.00 H new ATOM 1855 N LEU A 120 -2.961 -6.187 17.308 1.00 0.00 N ATOM 1856 CA LEU A 120 -3.661 -7.464 17.211 1.00 0.00 C ATOM 1857 C LEU A 120 -2.675 -8.629 17.245 1.00 0.00 C ATOM 1858 O LEU A 120 -1.688 -8.641 16.511 1.00 0.00 O ATOM 1859 CB LEU A 120 -4.505 -7.513 15.931 1.00 0.00 C ATOM 1860 CG LEU A 120 -5.534 -6.384 15.784 1.00 0.00 C ATOM 1861 CD1 LEU A 120 -6.240 -6.493 14.440 1.00 0.00 C ATOM 1862 CD2 LEU A 120 -6.536 -6.457 16.927 1.00 0.00 C ATOM 0 H LEU A 120 -2.526 -5.878 16.439 1.00 0.00 H new ATOM 0 HA LEU A 120 -4.324 -7.556 18.071 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.835 -7.487 15.072 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.030 -8.468 15.897 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.025 -5.421 15.825 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -6.968 -5.688 14.345 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.507 -6.416 13.637 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -6.751 -7.454 14.374 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -7.267 -5.655 16.822 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -7.047 -7.419 16.902 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -6.013 -6.349 17.877 1.00 0.00 H new ATOM 1874 N ALA A 121 -2.953 -9.606 18.100 1.00 0.00 N ATOM 1875 CA ALA A 121 -2.098 -10.781 18.221 1.00 0.00 C ATOM 1876 C ALA A 121 -0.635 -10.380 18.378 1.00 0.00 C ATOM 1877 O ALA A 121 0.111 -10.325 17.401 1.00 0.00 O ATOM 1878 CB ALA A 121 -2.272 -11.687 17.012 1.00 0.00 C ATOM 0 H ALA A 121 -3.763 -9.608 18.720 1.00 0.00 H new ATOM 0 HA ALA A 121 -2.397 -11.327 19.116 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -1.628 -12.560 17.116 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.311 -12.009 16.945 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -2.002 -11.142 16.107 1.00 0.00 H new ATOM 1884 N ALA A 122 -0.231 -10.102 19.613 1.00 0.00 N ATOM 1885 CA ALA A 122 1.108 -9.594 19.883 1.00 0.00 C ATOM 1886 C ALA A 122 2.174 -10.562 19.382 1.00 0.00 C ATOM 1887 O ALA A 122 2.010 -11.780 19.469 1.00 0.00 O ATOM 1888 CB ALA A 122 1.285 -9.336 21.373 1.00 0.00 C ATOM 0 H ALA A 122 -0.812 -10.220 20.443 1.00 0.00 H new ATOM 0 HA ALA A 122 1.227 -8.653 19.346 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.290 -8.957 21.560 1.00 0.00 H new ATOM 0 HB2 ALA A 122 0.552 -8.600 21.704 1.00 0.00 H new ATOM 0 HB3 ALA A 122 1.140 -10.266 21.923 1.00 0.00 H new ATOM 1894 N ARG A 123 3.265 -10.015 18.855 1.00 0.00 N ATOM 1895 CA ARG A 123 4.288 -10.825 18.205 1.00 0.00 C ATOM 1896 C ARG A 123 5.634 -10.665 18.905 1.00 0.00 C ATOM 1897 O ARG A 123 5.762 -9.905 19.865 1.00 0.00 O ATOM 1898 CB ARG A 123 4.394 -10.532 16.715 1.00 0.00 C ATOM 1899 CG ARG A 123 4.262 -9.064 16.342 1.00 0.00 C ATOM 1900 CD ARG A 123 5.485 -8.257 16.591 1.00 0.00 C ATOM 1901 NE ARG A 123 5.329 -6.834 16.338 1.00 0.00 N ATOM 1902 CZ ARG A 123 6.317 -5.924 16.452 1.00 0.00 C ATOM 1903 NH1 ARG A 123 7.519 -6.276 16.852 1.00 0.00 N ATOM 1904 NH2 ARG A 123 6.038 -4.662 16.175 1.00 0.00 N ATOM 0 H ARG A 123 3.463 -9.014 18.866 1.00 0.00 H new ATOM 0 HA ARG A 123 3.982 -11.867 18.296 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.355 -10.899 16.355 1.00 0.00 H new ATOM 0 HB3 ARG A 123 3.621 -11.096 16.192 1.00 0.00 H new ATOM 0 HG2 ARG A 123 4.002 -8.992 15.286 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.435 -8.631 16.904 1.00 0.00 H new ATOM 0 HD2 ARG A 123 5.793 -8.397 17.627 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.291 -8.639 15.964 1.00 0.00 H new ATOM 0 HE ARG A 123 4.408 -6.501 16.054 1.00 0.00 H new ATOM 0 HH11 ARG A 123 7.715 -7.250 17.081 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.255 -5.575 16.933 1.00 0.00 H new ATOM 0 HH21 ARG A 123 5.096 -4.400 15.884 1.00 0.00 H new ATOM 0 HH22 ARG A 123 6.765 -3.950 16.252 1.00 0.00 H new ATOM 1918 N THR A 124 6.638 -11.388 18.419 1.00 0.00 N ATOM 1919 CA THR A 124 8.018 -11.150 18.823 1.00 0.00 C ATOM 1920 C THR A 124 8.911 -10.904 17.611 1.00 0.00 C ATOM 1921 O THR A 124 9.701 -11.765 17.224 1.00 0.00 O ATOM 1922 CB THR A 124 8.583 -12.332 19.633 1.00 0.00 C ATOM 1923 OG1 THR A 124 8.471 -13.537 18.864 1.00 0.00 O ATOM 1924 CG2 THR A 124 7.821 -12.496 20.939 1.00 0.00 C ATOM 0 H THR A 124 6.521 -12.144 17.744 1.00 0.00 H new ATOM 0 HA THR A 124 8.012 -10.261 19.454 1.00 0.00 H new ATOM 0 HB THR A 124 9.630 -12.132 19.858 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.873 -13.400 17.981 1.00 0.00 H new ATOM 0 HG21 THR A 124 8.234 -13.336 21.498 1.00 0.00 H new ATOM 0 HG22 THR A 124 7.913 -11.585 21.531 1.00 0.00 H new ATOM 0 HG23 THR A 124 6.769 -12.685 20.725 1.00 0.00 H new ATOM 1932 N VAL A 125 8.779 -9.721 17.016 1.00 0.00 N ATOM 1933 CA VAL A 125 9.540 -9.380 15.819 1.00 0.00 C ATOM 1934 C VAL A 125 10.414 -8.154 16.055 1.00 0.00 C ATOM 1935 O VAL A 125 9.961 -7.156 16.615 1.00 0.00 O ATOM 1936 CB VAL A 125 8.613 -9.115 14.618 1.00 0.00 C ATOM 1937 CG1 VAL A 125 9.425 -8.702 13.400 1.00 0.00 C ATOM 1938 CG2 VAL A 125 7.777 -10.347 14.306 1.00 0.00 C ATOM 0 H VAL A 125 8.154 -8.985 17.343 1.00 0.00 H new ATOM 0 HA VAL A 125 10.175 -10.237 15.593 1.00 0.00 H new ATOM 0 HB VAL A 125 7.939 -8.299 14.878 1.00 0.00 H new ATOM 0 HG11 VAL A 125 8.754 -8.519 12.561 1.00 0.00 H new ATOM 0 HG12 VAL A 125 9.982 -7.792 13.625 1.00 0.00 H new ATOM 0 HG13 VAL A 125 10.122 -9.499 13.140 1.00 0.00 H new ATOM 0 HG21 VAL A 125 7.128 -10.141 13.455 1.00 0.00 H new ATOM 0 HG22 VAL A 125 8.435 -11.182 14.067 1.00 0.00 H new ATOM 0 HG23 VAL A 125 7.168 -10.602 15.173 1.00 0.00 H new ATOM 1948 N GLU A 126 11.670 -8.238 15.625 1.00 0.00 N ATOM 1949 CA GLU A 126 12.596 -7.120 15.754 1.00 0.00 C ATOM 1950 C GLU A 126 12.200 -5.975 14.828 1.00 0.00 C ATOM 1951 O GLU A 126 12.104 -6.149 13.613 1.00 0.00 O ATOM 1952 CB GLU A 126 14.027 -7.571 15.455 1.00 0.00 C ATOM 1953 CG GLU A 126 15.089 -6.518 15.733 1.00 0.00 C ATOM 1954 CD GLU A 126 16.471 -7.052 15.469 1.00 0.00 C ATOM 1955 OE1 GLU A 126 16.586 -8.203 15.128 1.00 0.00 O ATOM 1956 OE2 GLU A 126 17.400 -6.279 15.500 1.00 0.00 O ATOM 0 H GLU A 126 12.068 -9.068 15.185 1.00 0.00 H new ATOM 0 HA GLU A 126 12.550 -6.761 16.782 1.00 0.00 H new ATOM 0 HB2 GLU A 126 14.247 -8.457 16.050 1.00 0.00 H new ATOM 0 HB3 GLU A 126 14.091 -7.866 14.408 1.00 0.00 H new ATOM 0 HG2 GLU A 126 14.909 -5.643 15.108 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.016 -6.189 16.770 1.00 0.00 H new ATOM 1963 N SER A 127 11.971 -4.803 15.410 1.00 0.00 N ATOM 1964 CA SER A 127 11.496 -3.652 14.652 1.00 0.00 C ATOM 1965 C SER A 127 12.540 -3.203 13.634 1.00 0.00 C ATOM 1966 O SER A 127 12.208 -2.614 12.605 1.00 0.00 O ATOM 1967 CB SER A 127 11.147 -2.514 15.591 1.00 0.00 C ATOM 1968 OG SER A 127 12.274 -2.016 16.257 1.00 0.00 O ATOM 0 H SER A 127 12.107 -4.625 16.405 1.00 0.00 H new ATOM 0 HA SER A 127 10.598 -3.946 14.108 1.00 0.00 H new ATOM 0 HB2 SER A 127 10.676 -1.710 15.026 1.00 0.00 H new ATOM 0 HB3 SER A 127 10.417 -2.859 16.323 1.00 0.00 H new ATOM 0 HG SER A 127 12.006 -1.284 16.850 1.00 0.00 H new ATOM 1974 N ARG A 128 13.804 -3.486 13.929 1.00 0.00 N ATOM 1975 CA ARG A 128 14.896 -3.146 13.024 1.00 0.00 C ATOM 1976 C ARG A 128 14.743 -3.872 11.690 1.00 0.00 C ATOM 1977 O ARG A 128 15.008 -3.305 10.631 1.00 0.00 O ATOM 1978 CB ARG A 128 16.261 -3.400 13.647 1.00 0.00 C ATOM 1979 CG ARG A 128 16.625 -2.468 14.790 1.00 0.00 C ATOM 1980 CD ARG A 128 17.919 -2.783 15.449 1.00 0.00 C ATOM 1981 NE ARG A 128 18.257 -1.911 16.562 1.00 0.00 N ATOM 1982 CZ ARG A 128 19.334 -2.068 17.356 1.00 0.00 C ATOM 1983 NH1 ARG A 128 20.158 -3.078 17.190 1.00 0.00 N ATOM 1984 NH2 ARG A 128 19.527 -1.190 18.326 1.00 0.00 N ATOM 0 H ARG A 128 14.098 -3.950 14.788 1.00 0.00 H new ATOM 0 HA ARG A 128 14.837 -2.074 12.833 1.00 0.00 H new ATOM 0 HB2 ARG A 128 16.293 -4.427 14.011 1.00 0.00 H new ATOM 0 HB3 ARG A 128 17.021 -3.313 12.870 1.00 0.00 H new ATOM 0 HG2 ARG A 128 16.663 -1.446 14.412 1.00 0.00 H new ATOM 0 HG3 ARG A 128 15.832 -2.502 15.537 1.00 0.00 H new ATOM 0 HD2 ARG A 128 17.889 -3.812 15.806 1.00 0.00 H new ATOM 0 HD3 ARG A 128 18.714 -2.727 14.705 1.00 0.00 H new ATOM 0 HE ARG A 128 17.635 -1.126 16.755 1.00 0.00 H new ATOM 0 HH11 ARG A 128 19.987 -3.759 16.450 1.00 0.00 H new ATOM 0 HH12 ARG A 128 20.968 -3.181 17.801 1.00 0.00 H new ATOM 0 HH21 ARG A 128 18.870 -0.421 18.456 1.00 0.00 H new ATOM 0 HH22 ARG A 128 20.333 -1.282 18.944 1.00 0.00 H new ATOM 1998 N GLN A 129 14.312 -5.128 11.753 1.00 0.00 N ATOM 1999 CA GLN A 129 14.120 -5.930 10.550 1.00 0.00 C ATOM 2000 C GLN A 129 12.955 -5.399 9.721 1.00 0.00 C ATOM 2001 O GLN A 129 13.057 -5.269 8.503 1.00 0.00 O ATOM 2002 CB GLN A 129 13.870 -7.396 10.916 1.00 0.00 C ATOM 2003 CG GLN A 129 15.077 -8.104 11.508 1.00 0.00 C ATOM 2004 CD GLN A 129 14.712 -9.428 12.152 1.00 0.00 C ATOM 2005 OE1 GLN A 129 13.416 -9.676 12.300 1.00 0.00 O flip ATOM 2006 NE2 GLN A 129 15.586 -10.221 12.510 1.00 0.00 N flip ATOM 0 H GLN A 129 14.089 -5.612 12.623 1.00 0.00 H new ATOM 0 HA GLN A 129 15.030 -5.862 9.954 1.00 0.00 H new ATOM 0 HB2 GLN A 129 13.047 -7.446 11.630 1.00 0.00 H new ATOM 0 HB3 GLN A 129 13.550 -7.932 10.023 1.00 0.00 H new ATOM 0 HG2 GLN A 129 15.815 -8.275 10.724 1.00 0.00 H new ATOM 0 HG3 GLN A 129 15.545 -7.458 12.251 1.00 0.00 H new ATOM 0 HE21 GLN A 129 16.570 -9.989 12.377 1.00 0.00 H new ATOM 0 HE22 GLN A 129 15.324 -11.109 12.939 1.00 0.00 H new ATOM 2015 N ALA A 130 11.849 -5.093 10.392 1.00 0.00 N ATOM 2016 CA ALA A 130 10.650 -4.620 9.713 1.00 0.00 C ATOM 2017 C ALA A 130 10.917 -3.313 8.976 1.00 0.00 C ATOM 2018 O ALA A 130 10.447 -3.114 7.856 1.00 0.00 O ATOM 2019 CB ALA A 130 9.514 -4.444 10.709 1.00 0.00 C ATOM 0 H ALA A 130 11.759 -5.165 11.406 1.00 0.00 H new ATOM 0 HA ALA A 130 10.360 -5.369 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 130 8.625 -4.090 10.188 1.00 0.00 H new ATOM 0 HB2 ALA A 130 9.298 -5.399 11.187 1.00 0.00 H new ATOM 0 HB3 ALA A 130 9.804 -3.716 11.467 1.00 0.00 H new ATOM 2025 N GLN A 131 11.672 -2.424 9.612 1.00 0.00 N ATOM 2026 CA GLN A 131 12.051 -1.159 8.990 1.00 0.00 C ATOM 2027 C GLN A 131 13.036 -1.390 7.848 1.00 0.00 C ATOM 2028 O GLN A 131 12.891 -0.817 6.767 1.00 0.00 O ATOM 2029 CB GLN A 131 12.669 -0.215 10.025 1.00 0.00 C ATOM 2030 CG GLN A 131 11.692 0.275 11.081 1.00 0.00 C ATOM 2031 CD GLN A 131 12.391 0.750 12.341 1.00 0.00 C ATOM 2032 OE1 GLN A 131 13.681 0.450 12.450 1.00 0.00 O flip ATOM 2033 NE2 GLN A 131 11.780 1.382 13.206 1.00 0.00 N flip ATOM 0 H GLN A 131 12.034 -2.555 10.557 1.00 0.00 H new ATOM 0 HA GLN A 131 11.149 -0.700 8.586 1.00 0.00 H new ATOM 0 HB2 GLN A 131 13.495 -0.726 10.519 1.00 0.00 H new ATOM 0 HB3 GLN A 131 13.091 0.647 9.508 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.096 1.090 10.670 1.00 0.00 H new ATOM 0 HG3 GLN A 131 11.001 -0.529 11.334 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.789 1.590 13.081 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.265 1.696 14.046 1.00 0.00 H new ATOM 2042 N ASP A 132 14.036 -2.227 8.094 1.00 0.00 N ATOM 2043 CA ASP A 132 15.068 -2.500 7.101 1.00 0.00 C ATOM 2044 C ASP A 132 14.458 -3.089 5.833 1.00 0.00 C ATOM 2045 O ASP A 132 14.977 -2.893 4.733 1.00 0.00 O ATOM 2046 CB ASP A 132 16.123 -3.452 7.671 1.00 0.00 C ATOM 2047 CG ASP A 132 17.107 -2.797 8.632 1.00 0.00 C ATOM 2048 OD1 ASP A 132 17.128 -1.591 8.699 1.00 0.00 O ATOM 2049 OD2 ASP A 132 17.714 -3.504 9.400 1.00 0.00 O ATOM 0 H ASP A 132 14.155 -2.729 8.974 1.00 0.00 H new ATOM 0 HA ASP A 132 15.550 -1.556 6.846 1.00 0.00 H new ATOM 0 HB2 ASP A 132 15.618 -4.268 8.188 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.680 -3.894 6.845 1.00 0.00 H new ATOM 2054 N LEU A 133 13.355 -3.812 5.993 1.00 0.00 N ATOM 2055 CA LEU A 133 12.649 -4.393 4.856 1.00 0.00 C ATOM 2056 C LEU A 133 12.221 -3.311 3.869 1.00 0.00 C ATOM 2057 O LEU A 133 12.422 -3.443 2.663 1.00 0.00 O ATOM 2058 CB LEU A 133 11.433 -5.192 5.338 1.00 0.00 C ATOM 2059 CG LEU A 133 10.569 -5.799 4.225 1.00 0.00 C ATOM 2060 CD1 LEU A 133 11.386 -6.794 3.413 1.00 0.00 C ATOM 2061 CD2 LEU A 133 9.350 -6.474 4.838 1.00 0.00 C ATOM 0 H LEU A 133 12.930 -4.010 6.899 1.00 0.00 H new ATOM 0 HA LEU A 133 13.330 -5.070 4.340 1.00 0.00 H new ATOM 0 HB2 LEU A 133 11.780 -5.996 5.986 1.00 0.00 H new ATOM 0 HB3 LEU A 133 10.807 -4.539 5.947 1.00 0.00 H new ATOM 0 HG LEU A 133 10.232 -5.008 3.555 1.00 0.00 H new ATOM 0 HD11 LEU A 133 10.764 -7.219 2.626 1.00 0.00 H new ATOM 0 HD12 LEU A 133 12.240 -6.285 2.966 1.00 0.00 H new ATOM 0 HD13 LEU A 133 11.741 -7.592 4.066 1.00 0.00 H new ATOM 0 HD21 LEU A 133 8.736 -6.905 4.047 1.00 0.00 H new ATOM 0 HD22 LEU A 133 9.674 -7.263 5.517 1.00 0.00 H new ATOM 0 HD23 LEU A 133 8.766 -5.738 5.390 1.00 0.00 H new ATOM 2073 N ALA A 134 11.632 -2.239 4.392 1.00 0.00 N ATOM 2074 CA ALA A 134 11.247 -1.101 3.569 1.00 0.00 C ATOM 2075 C ALA A 134 12.469 -0.291 3.147 1.00 0.00 C ATOM 2076 O ALA A 134 12.504 0.273 2.054 1.00 0.00 O ATOM 2077 CB ALA A 134 10.260 -0.218 4.317 1.00 0.00 C ATOM 0 H ALA A 134 11.412 -2.137 5.383 1.00 0.00 H new ATOM 0 HA ALA A 134 10.766 -1.482 2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 134 9.981 0.629 3.690 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.369 -0.796 4.564 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.721 0.147 5.235 1.00 0.00 H new ATOM 2083 N ARG A 135 13.470 -0.239 4.022 1.00 0.00 N ATOM 2084 CA ARG A 135 14.670 0.545 3.762 1.00 0.00 C ATOM 2085 C ARG A 135 15.445 -0.022 2.577 1.00 0.00 C ATOM 2086 O ARG A 135 16.093 0.716 1.835 1.00 0.00 O ATOM 2087 CB ARG A 135 15.550 0.676 4.997 1.00 0.00 C ATOM 2088 CG ARG A 135 14.989 1.569 6.092 1.00 0.00 C ATOM 2089 CD ARG A 135 15.759 1.539 7.361 1.00 0.00 C ATOM 2090 NE ARG A 135 15.223 2.389 8.412 1.00 0.00 N ATOM 2091 CZ ARG A 135 15.671 2.412 9.682 1.00 0.00 C ATOM 2092 NH1 ARG A 135 16.636 1.610 10.074 1.00 0.00 N ATOM 2093 NH2 ARG A 135 15.099 3.247 10.532 1.00 0.00 N ATOM 0 H ARG A 135 13.472 -0.731 4.916 1.00 0.00 H new ATOM 0 HA ARG A 135 14.349 1.553 3.501 1.00 0.00 H new ATOM 0 HB2 ARG A 135 15.720 -0.318 5.411 1.00 0.00 H new ATOM 0 HB3 ARG A 135 16.522 1.065 4.693 1.00 0.00 H new ATOM 0 HG2 ARG A 135 14.955 2.595 5.726 1.00 0.00 H new ATOM 0 HG3 ARG A 135 13.961 1.270 6.297 1.00 0.00 H new ATOM 0 HD2 ARG A 135 15.795 0.512 7.725 1.00 0.00 H new ATOM 0 HD3 ARG A 135 16.786 1.841 7.155 1.00 0.00 H new ATOM 0 HE ARG A 135 14.453 3.012 8.170 1.00 0.00 H new ATOM 0 HH11 ARG A 135 17.057 0.958 9.413 1.00 0.00 H new ATOM 0 HH12 ARG A 135 16.964 1.640 11.039 1.00 0.00 H new ATOM 0 HH21 ARG A 135 14.339 3.852 10.220 1.00 0.00 H new ATOM 0 HH22 ARG A 135 15.417 3.287 11.500 1.00 0.00 H new ATOM 2107 N SER A 136 15.375 -1.339 2.408 1.00 0.00 N ATOM 2108 CA SER A 136 16.064 -2.005 1.309 1.00 0.00 C ATOM 2109 C SER A 136 15.488 -1.574 -0.036 1.00 0.00 C ATOM 2110 O SER A 136 16.159 -1.653 -1.066 1.00 0.00 O ATOM 2111 CB SER A 136 15.971 -3.510 1.468 1.00 0.00 C ATOM 2112 OG SER A 136 14.692 -3.994 1.166 1.00 0.00 O ATOM 0 H SER A 136 14.849 -1.965 3.018 1.00 0.00 H new ATOM 0 HA SER A 136 17.114 -1.713 1.336 1.00 0.00 H new ATOM 0 HB2 SER A 136 16.702 -3.989 0.817 1.00 0.00 H new ATOM 0 HB3 SER A 136 16.229 -3.783 2.491 1.00 0.00 H new ATOM 0 HG SER A 136 14.056 -3.682 1.843 1.00 0.00 H new ATOM 2118 N TYR A 137 14.240 -1.121 -0.019 1.00 0.00 N ATOM 2119 CA TYR A 137 13.584 -0.639 -1.230 1.00 0.00 C ATOM 2120 C TYR A 137 13.546 0.886 -1.260 1.00 0.00 C ATOM 2121 O TYR A 137 12.959 1.485 -2.159 1.00 0.00 O ATOM 2122 CB TYR A 137 12.166 -1.204 -1.332 1.00 0.00 C ATOM 2123 CG TYR A 137 12.116 -2.702 -1.538 1.00 0.00 C ATOM 2124 CD1 TYR A 137 12.548 -3.271 -2.727 1.00 0.00 C ATOM 2125 CD2 TYR A 137 11.634 -3.542 -0.546 1.00 0.00 C ATOM 2126 CE1 TYR A 137 12.505 -4.638 -2.921 1.00 0.00 C ATOM 2127 CE2 TYR A 137 11.586 -4.910 -0.728 1.00 0.00 C ATOM 2128 CZ TYR A 137 12.023 -5.454 -1.919 1.00 0.00 C ATOM 2129 OH TYR A 137 11.977 -6.817 -2.108 1.00 0.00 O ATOM 0 H TYR A 137 13.661 -1.077 0.820 1.00 0.00 H new ATOM 0 HA TYR A 137 14.163 -0.984 -2.087 1.00 0.00 H new ATOM 0 HB2 TYR A 137 11.620 -0.954 -0.423 1.00 0.00 H new ATOM 0 HB3 TYR A 137 11.650 -0.716 -2.159 1.00 0.00 H new ATOM 0 HD1 TYR A 137 12.924 -2.635 -3.514 1.00 0.00 H new ATOM 0 HD2 TYR A 137 11.290 -3.119 0.386 1.00 0.00 H new ATOM 0 HE1 TYR A 137 12.847 -5.065 -3.852 1.00 0.00 H new ATOM 0 HE2 TYR A 137 11.209 -5.550 0.056 1.00 0.00 H new ATOM 0 HH TYR A 137 11.754 -7.257 -1.261 1.00 0.00 H new ATOM 2139 N GLY A 138 14.179 1.506 -0.269 1.00 0.00 N ATOM 2140 CA GLY A 138 14.367 2.945 -0.295 1.00 0.00 C ATOM 2141 C GLY A 138 13.092 3.703 0.017 1.00 0.00 C ATOM 2142 O GLY A 138 12.815 4.739 -0.588 1.00 0.00 O ATOM 0 H GLY A 138 14.565 1.038 0.551 1.00 0.00 H new ATOM 0 HA2 GLY A 138 15.136 3.221 0.427 1.00 0.00 H new ATOM 0 HA3 GLY A 138 14.732 3.243 -1.278 1.00 0.00 H new ATOM 2146 N ILE A 139 12.316 3.185 0.963 1.00 0.00 N ATOM 2147 CA ILE A 139 11.076 3.835 1.372 1.00 0.00 C ATOM 2148 C ILE A 139 10.849 3.689 2.874 1.00 0.00 C ATOM 2149 O ILE A 139 10.967 2.602 3.442 1.00 0.00 O ATOM 2150 CB ILE A 139 9.862 3.262 0.619 1.00 0.00 C ATOM 2151 CG1 ILE A 139 8.636 4.157 0.822 1.00 0.00 C ATOM 2152 CG2 ILE A 139 9.571 1.843 1.082 1.00 0.00 C ATOM 2153 CD1 ILE A 139 8.637 5.399 -0.039 1.00 0.00 C ATOM 0 H ILE A 139 12.523 2.319 1.460 1.00 0.00 H new ATOM 0 HA ILE A 139 11.177 4.892 1.124 1.00 0.00 H new ATOM 0 HB ILE A 139 10.095 3.235 -0.445 1.00 0.00 H new ATOM 0 HG12 ILE A 139 7.737 3.579 0.608 1.00 0.00 H new ATOM 0 HG13 ILE A 139 8.583 4.453 1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 139 8.710 1.453 0.540 1.00 0.00 H new ATOM 0 HG22 ILE A 139 10.438 1.212 0.888 1.00 0.00 H new ATOM 0 HG23 ILE A 139 9.356 1.846 2.151 1.00 0.00 H new ATOM 0 HD11 ILE A 139 7.738 5.981 0.161 1.00 0.00 H new ATOM 0 HD12 ILE A 139 9.517 6.000 0.190 1.00 0.00 H new ATOM 0 HD13 ILE A 139 8.657 5.113 -1.091 1.00 0.00 H new ATOM 2165 N PRO A 140 10.515 4.807 3.533 1.00 0.00 N ATOM 2166 CA PRO A 140 10.179 4.815 4.960 1.00 0.00 C ATOM 2167 C PRO A 140 9.112 3.785 5.311 1.00 0.00 C ATOM 2168 O PRO A 140 8.226 3.495 4.505 1.00 0.00 O ATOM 2169 CB PRO A 140 9.695 6.245 5.218 1.00 0.00 C ATOM 2170 CG PRO A 140 10.385 7.064 4.181 1.00 0.00 C ATOM 2171 CD PRO A 140 10.437 6.192 2.954 1.00 0.00 C ATOM 0 HA PRO A 140 11.031 4.542 5.582 1.00 0.00 H new ATOM 0 HB2 PRO A 140 8.611 6.320 5.127 1.00 0.00 H new ATOM 0 HB3 PRO A 140 9.954 6.577 6.223 1.00 0.00 H new ATOM 0 HG2 PRO A 140 9.841 7.988 3.984 1.00 0.00 H new ATOM 0 HG3 PRO A 140 11.387 7.346 4.505 1.00 0.00 H new ATOM 0 HD2 PRO A 140 9.553 6.320 2.329 1.00 0.00 H new ATOM 0 HD3 PRO A 140 11.303 6.420 2.332 1.00 0.00 H new ATOM 2179 N TYR A 141 9.200 3.236 6.517 1.00 0.00 N ATOM 2180 CA TYR A 141 8.336 2.132 6.919 1.00 0.00 C ATOM 2181 C TYR A 141 7.285 2.600 7.922 1.00 0.00 C ATOM 2182 O TYR A 141 7.598 3.307 8.880 1.00 0.00 O ATOM 2183 CB TYR A 141 9.164 0.992 7.516 1.00 0.00 C ATOM 2184 CG TYR A 141 8.341 -0.199 7.954 1.00 0.00 C ATOM 2185 CD1 TYR A 141 7.609 -0.937 7.034 1.00 0.00 C ATOM 2186 CD2 TYR A 141 8.300 -0.583 9.286 1.00 0.00 C ATOM 2187 CE1 TYR A 141 6.856 -2.025 7.429 1.00 0.00 C ATOM 2188 CE2 TYR A 141 7.551 -1.671 9.692 1.00 0.00 C ATOM 2189 CZ TYR A 141 6.830 -2.389 8.760 1.00 0.00 C ATOM 2190 OH TYR A 141 6.082 -3.474 9.160 1.00 0.00 O ATOM 0 H TYR A 141 9.861 3.537 7.233 1.00 0.00 H new ATOM 0 HA TYR A 141 7.823 1.765 6.030 1.00 0.00 H new ATOM 0 HB2 TYR A 141 9.897 0.664 6.779 1.00 0.00 H new ATOM 0 HB3 TYR A 141 9.721 1.371 8.373 1.00 0.00 H new ATOM 0 HD1 TYR A 141 7.629 -0.655 5.992 1.00 0.00 H new ATOM 0 HD2 TYR A 141 8.863 -0.023 10.018 1.00 0.00 H new ATOM 0 HE1 TYR A 141 6.291 -2.588 6.701 1.00 0.00 H new ATOM 0 HE2 TYR A 141 7.530 -1.958 10.733 1.00 0.00 H new ATOM 0 HH TYR A 141 5.976 -4.094 8.408 1.00 0.00 H new ATOM 2200 N ILE A 142 6.039 2.201 7.692 1.00 0.00 N ATOM 2201 CA ILE A 142 4.936 2.608 8.554 1.00 0.00 C ATOM 2202 C ILE A 142 4.302 1.404 9.241 1.00 0.00 C ATOM 2203 O ILE A 142 4.004 0.397 8.599 1.00 0.00 O ATOM 2204 CB ILE A 142 3.853 3.368 7.766 1.00 0.00 C ATOM 2205 CG1 ILE A 142 4.429 4.657 7.174 1.00 0.00 C ATOM 2206 CG2 ILE A 142 2.661 3.675 8.659 1.00 0.00 C ATOM 2207 CD1 ILE A 142 3.503 5.350 6.201 1.00 0.00 C ATOM 0 H ILE A 142 5.768 1.597 6.916 1.00 0.00 H new ATOM 0 HA ILE A 142 5.355 3.274 9.308 1.00 0.00 H new ATOM 0 HB ILE A 142 3.513 2.735 6.947 1.00 0.00 H new ATOM 0 HG12 ILE A 142 4.667 5.344 7.986 1.00 0.00 H new ATOM 0 HG13 ILE A 142 5.366 4.426 6.667 1.00 0.00 H new ATOM 0 HG21 ILE A 142 1.906 4.212 8.086 1.00 0.00 H new ATOM 0 HG22 ILE A 142 2.237 2.743 9.034 1.00 0.00 H new ATOM 0 HG23 ILE A 142 2.984 4.290 9.499 1.00 0.00 H new ATOM 0 HD11 ILE A 142 3.981 6.254 5.825 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.284 4.682 5.368 1.00 0.00 H new ATOM 0 HD13 ILE A 142 2.575 5.614 6.707 1.00 0.00 H new ATOM 2219 N GLU A 143 4.097 1.517 10.549 1.00 0.00 N ATOM 2220 CA GLU A 143 3.378 0.493 11.300 1.00 0.00 C ATOM 2221 C GLU A 143 2.015 1.005 11.754 1.00 0.00 C ATOM 2222 O GLU A 143 1.908 2.077 12.350 1.00 0.00 O ATOM 2223 CB GLU A 143 4.200 0.038 12.507 1.00 0.00 C ATOM 2224 CG GLU A 143 5.484 -0.700 12.152 1.00 0.00 C ATOM 2225 CD GLU A 143 6.241 -1.103 13.387 1.00 0.00 C ATOM 2226 OE1 GLU A 143 5.774 -0.826 14.465 1.00 0.00 O ATOM 2227 OE2 GLU A 143 7.230 -1.787 13.255 1.00 0.00 O ATOM 0 H GLU A 143 4.418 2.306 11.111 1.00 0.00 H new ATOM 0 HA GLU A 143 3.221 -0.360 10.640 1.00 0.00 H new ATOM 0 HB2 GLU A 143 4.452 0.911 13.110 1.00 0.00 H new ATOM 0 HB3 GLU A 143 3.582 -0.611 13.128 1.00 0.00 H new ATOM 0 HG2 GLU A 143 5.246 -1.586 11.563 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.112 -0.063 11.529 1.00 0.00 H new ATOM 2234 N THR A 144 0.972 0.233 11.466 1.00 0.00 N ATOM 2235 CA THR A 144 -0.384 0.602 11.851 1.00 0.00 C ATOM 2236 C THR A 144 -1.243 -0.634 12.090 1.00 0.00 C ATOM 2237 O THR A 144 -0.773 -1.763 11.958 1.00 0.00 O ATOM 2238 CB THR A 144 -1.057 1.483 10.783 1.00 0.00 C ATOM 2239 OG1 THR A 144 -2.274 2.029 11.305 1.00 0.00 O ATOM 2240 CG2 THR A 144 -1.365 0.667 9.537 1.00 0.00 C ATOM 0 H THR A 144 1.041 -0.654 10.966 1.00 0.00 H new ATOM 0 HA THR A 144 -0.303 1.171 12.777 1.00 0.00 H new ATOM 0 HB THR A 144 -0.375 2.290 10.518 1.00 0.00 H new ATOM 0 HG1 THR A 144 -2.963 2.017 10.608 1.00 0.00 H new ATOM 0 HG21 THR A 144 -1.841 1.305 8.792 1.00 0.00 H new ATOM 0 HG22 THR A 144 -0.439 0.262 9.129 1.00 0.00 H new ATOM 0 HG23 THR A 144 -2.037 -0.152 9.795 1.00 0.00 H new ATOM 2248 N SER A 145 -2.505 -0.412 12.445 1.00 0.00 N ATOM 2249 CA SER A 145 -3.478 -1.495 12.526 1.00 0.00 C ATOM 2250 C SER A 145 -4.750 -1.139 11.762 1.00 0.00 C ATOM 2251 O SER A 145 -5.404 -0.139 12.058 1.00 0.00 O ATOM 2252 CB SER A 145 -3.798 -1.804 13.975 1.00 0.00 C ATOM 2253 OG SER A 145 -2.711 -2.385 14.642 1.00 0.00 O ATOM 0 H SER A 145 -2.877 0.508 12.681 1.00 0.00 H new ATOM 0 HA SER A 145 -3.044 -2.383 12.066 1.00 0.00 H new ATOM 0 HB2 SER A 145 -4.088 -0.886 14.486 1.00 0.00 H new ATOM 0 HB3 SER A 145 -4.654 -2.478 14.021 1.00 0.00 H new ATOM 0 HG SER A 145 -2.550 -1.907 15.482 1.00 0.00 H new ATOM 2259 N ALA A 146 -5.095 -1.965 10.780 1.00 0.00 N ATOM 2260 CA ALA A 146 -6.195 -1.660 9.874 1.00 0.00 C ATOM 2261 C ALA A 146 -7.510 -1.525 10.635 1.00 0.00 C ATOM 2262 O ALA A 146 -8.430 -0.838 10.191 1.00 0.00 O ATOM 2263 CB ALA A 146 -6.310 -2.733 8.803 1.00 0.00 C ATOM 0 H ALA A 146 -4.628 -2.852 10.592 1.00 0.00 H new ATOM 0 HA ALA A 146 -5.984 -0.705 9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -7.136 -2.492 8.134 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -5.382 -2.779 8.233 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -6.495 -3.699 9.274 1.00 0.00 H new ATOM 2269 N LYS A 147 -7.594 -2.187 11.784 1.00 0.00 N ATOM 2270 CA LYS A 147 -8.851 -2.298 12.514 1.00 0.00 C ATOM 2271 C LYS A 147 -9.303 -0.936 13.031 1.00 0.00 C ATOM 2272 O LYS A 147 -10.450 -0.534 12.834 1.00 0.00 O ATOM 2273 CB LYS A 147 -8.713 -3.285 13.675 1.00 0.00 C ATOM 2274 CG LYS A 147 -10.009 -3.548 14.433 1.00 0.00 C ATOM 2275 CD LYS A 147 -9.800 -4.564 15.547 1.00 0.00 C ATOM 2276 CE LYS A 147 -11.083 -4.796 16.332 1.00 0.00 C ATOM 2277 NZ LYS A 147 -10.885 -5.761 17.448 1.00 0.00 N ATOM 0 H LYS A 147 -6.805 -2.655 12.230 1.00 0.00 H new ATOM 0 HA LYS A 147 -9.608 -2.672 11.825 1.00 0.00 H new ATOM 0 HB2 LYS A 147 -8.333 -4.231 13.289 1.00 0.00 H new ATOM 0 HB3 LYS A 147 -7.968 -2.904 14.374 1.00 0.00 H new ATOM 0 HG2 LYS A 147 -10.383 -2.615 14.854 1.00 0.00 H new ATOM 0 HG3 LYS A 147 -10.769 -3.913 13.743 1.00 0.00 H new ATOM 0 HD2 LYS A 147 -9.456 -5.507 15.122 1.00 0.00 H new ATOM 0 HD3 LYS A 147 -9.018 -4.213 16.220 1.00 0.00 H new ATOM 0 HE2 LYS A 147 -11.440 -3.847 16.732 1.00 0.00 H new ATOM 0 HE3 LYS A 147 -11.856 -5.171 15.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 -11.782 -5.891 17.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 -10.568 -6.675 17.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 -10.166 -5.392 18.102 1.00 0.00 H new ATOM 2291 N THR A 148 -8.393 -0.228 13.694 1.00 0.00 N ATOM 2292 CA THR A 148 -8.750 0.977 14.433 1.00 0.00 C ATOM 2293 C THR A 148 -7.915 2.167 13.978 1.00 0.00 C ATOM 2294 O THR A 148 -8.258 3.319 14.247 1.00 0.00 O ATOM 2295 CB THR A 148 -8.570 0.784 15.950 1.00 0.00 C ATOM 2296 OG1 THR A 148 -7.198 0.484 16.236 1.00 0.00 O ATOM 2297 CG2 THR A 148 -9.449 -0.351 16.452 1.00 0.00 C ATOM 0 H THR A 148 -7.403 -0.469 13.734 1.00 0.00 H new ATOM 0 HA THR A 148 -9.802 1.174 14.225 1.00 0.00 H new ATOM 0 HB THR A 148 -8.861 1.705 16.455 1.00 0.00 H new ATOM 0 HG1 THR A 148 -7.084 0.363 17.202 1.00 0.00 H new ATOM 0 HG21 THR A 148 -9.308 -0.472 17.526 1.00 0.00 H new ATOM 0 HG22 THR A 148 -10.494 -0.120 16.247 1.00 0.00 H new ATOM 0 HG23 THR A 148 -9.175 -1.275 15.943 1.00 0.00 H new ATOM 2305 N ARG A 149 -6.814 1.883 13.288 1.00 0.00 N ATOM 2306 CA ARG A 149 -5.811 2.900 12.996 1.00 0.00 C ATOM 2307 C ARG A 149 -5.750 3.189 11.498 1.00 0.00 C ATOM 2308 O ARG A 149 -5.982 2.302 10.676 1.00 0.00 O ATOM 2309 CB ARG A 149 -4.443 2.536 13.553 1.00 0.00 C ATOM 2310 CG ARG A 149 -4.379 2.419 15.068 1.00 0.00 C ATOM 2311 CD ARG A 149 -3.050 2.022 15.596 1.00 0.00 C ATOM 2312 NE ARG A 149 -3.043 1.664 17.005 1.00 0.00 N ATOM 2313 CZ ARG A 149 -2.903 2.543 18.016 1.00 0.00 C ATOM 2314 NH1 ARG A 149 -2.719 3.823 17.781 1.00 0.00 N ATOM 2315 NH2 ARG A 149 -2.930 2.080 19.253 1.00 0.00 N ATOM 0 H ARG A 149 -6.595 0.957 12.921 1.00 0.00 H new ATOM 0 HA ARG A 149 -6.118 3.814 13.503 1.00 0.00 H new ATOM 0 HB2 ARG A 149 -4.130 1.588 13.116 1.00 0.00 H new ATOM 0 HB3 ARG A 149 -3.724 3.289 13.231 1.00 0.00 H new ATOM 0 HG2 ARG A 149 -4.659 3.377 15.506 1.00 0.00 H new ATOM 0 HG3 ARG A 149 -5.119 1.689 15.396 1.00 0.00 H new ATOM 0 HD2 ARG A 149 -2.681 1.175 15.017 1.00 0.00 H new ATOM 0 HD3 ARG A 149 -2.351 2.843 15.439 1.00 0.00 H new ATOM 0 HE ARG A 149 -3.152 0.679 17.245 1.00 0.00 H new ATOM 0 HH11 ARG A 149 -2.680 4.165 16.821 1.00 0.00 H new ATOM 0 HH12 ARG A 149 -2.615 4.475 18.559 1.00 0.00 H new ATOM 0 HH21 ARG A 149 -3.054 1.082 19.421 1.00 0.00 H new ATOM 0 HH22 ARG A 149 -2.827 2.721 20.040 1.00 0.00 H new ATOM 2329 N GLN A 150 -5.436 4.433 11.153 1.00 0.00 N ATOM 2330 CA GLN A 150 -5.104 4.783 9.777 1.00 0.00 C ATOM 2331 C GLN A 150 -3.595 4.877 9.588 1.00 0.00 C ATOM 2332 O GLN A 150 -2.951 5.792 10.101 1.00 0.00 O ATOM 2333 CB GLN A 150 -5.760 6.110 9.385 1.00 0.00 C ATOM 2334 CG GLN A 150 -7.189 5.976 8.889 1.00 0.00 C ATOM 2335 CD GLN A 150 -8.160 5.630 10.003 1.00 0.00 C ATOM 2336 OE1 GLN A 150 -8.021 6.103 11.134 1.00 0.00 O ATOM 2337 NE2 GLN A 150 -9.146 4.798 9.690 1.00 0.00 N ATOM 0 H GLN A 150 -5.404 5.215 11.807 1.00 0.00 H new ATOM 0 HA GLN A 150 -5.487 3.994 9.130 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -5.748 6.777 10.247 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -5.160 6.583 8.607 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -7.497 6.911 8.420 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -7.233 5.204 8.120 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -9.222 4.431 8.741 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -9.828 4.526 10.398 1.00 0.00 H new ATOM 2346 N GLY A 151 -3.034 3.924 8.848 1.00 0.00 N ATOM 2347 CA GLY A 151 -1.626 3.985 8.503 1.00 0.00 C ATOM 2348 C GLY A 151 -1.400 4.048 7.006 1.00 0.00 C ATOM 2349 O GLY A 151 -0.394 4.590 6.545 1.00 0.00 O ATOM 0 H GLY A 151 -3.530 3.111 8.482 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -1.177 4.860 8.973 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -1.117 3.110 8.908 1.00 0.00 H new ATOM 2353 N VAL A 152 -2.334 3.491 6.243 1.00 0.00 N ATOM 2354 CA VAL A 152 -2.248 3.513 4.788 1.00 0.00 C ATOM 2355 C VAL A 152 -2.431 4.927 4.247 1.00 0.00 C ATOM 2356 O VAL A 152 -1.933 5.261 3.175 1.00 0.00 O ATOM 2357 CB VAL A 152 -3.299 2.588 4.145 1.00 0.00 C ATOM 2358 CG1 VAL A 152 -3.101 1.153 4.611 1.00 0.00 C ATOM 2359 CG2 VAL A 152 -4.705 3.065 4.478 1.00 0.00 C ATOM 0 H VAL A 152 -3.160 3.018 6.609 1.00 0.00 H new ATOM 0 HA VAL A 152 -1.253 3.153 4.527 1.00 0.00 H new ATOM 0 HB VAL A 152 -3.171 2.621 3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -3.852 0.513 4.147 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -2.106 0.812 4.325 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.203 1.105 5.695 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -5.434 2.400 4.015 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -4.844 3.061 5.559 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -4.845 4.077 4.098 1.00 0.00 H new ATOM 2369 N GLU A 153 -3.150 5.753 5.001 1.00 0.00 N ATOM 2370 CA GLU A 153 -3.369 7.143 4.615 1.00 0.00 C ATOM 2371 C GLU A 153 -2.047 7.900 4.535 1.00 0.00 C ATOM 2372 O GLU A 153 -1.785 8.613 3.565 1.00 0.00 O ATOM 2373 CB GLU A 153 -4.314 7.830 5.603 1.00 0.00 C ATOM 2374 CG GLU A 153 -4.644 9.275 5.255 1.00 0.00 C ATOM 2375 CD GLU A 153 -5.645 9.854 6.215 1.00 0.00 C ATOM 2376 OE1 GLU A 153 -6.043 9.159 7.119 1.00 0.00 O ATOM 2377 OE2 GLU A 153 -5.928 11.025 6.114 1.00 0.00 O ATOM 0 H GLU A 153 -3.590 5.485 5.881 1.00 0.00 H new ATOM 0 HA GLU A 153 -3.829 7.152 3.627 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -5.242 7.261 5.656 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -3.866 7.801 6.596 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -3.733 9.873 5.273 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -5.039 9.326 4.240 1.00 0.00 H new ATOM 2384 N ASP A 154 -1.218 7.740 5.560 1.00 0.00 N ATOM 2385 CA ASP A 154 0.104 8.357 5.577 1.00 0.00 C ATOM 2386 C ASP A 154 0.994 7.763 4.490 1.00 0.00 C ATOM 2387 O ASP A 154 1.816 8.462 3.897 1.00 0.00 O ATOM 2388 CB ASP A 154 0.760 8.186 6.950 1.00 0.00 C ATOM 2389 CG ASP A 154 0.166 9.061 8.045 1.00 0.00 C ATOM 2390 OD1 ASP A 154 -0.575 9.959 7.723 1.00 0.00 O ATOM 2391 OD2 ASP A 154 0.329 8.732 9.195 1.00 0.00 O ATOM 0 H ASP A 154 -1.437 7.189 6.390 1.00 0.00 H new ATOM 0 HA ASP A 154 -0.018 9.422 5.378 1.00 0.00 H new ATOM 0 HB2 ASP A 154 0.677 7.142 7.251 1.00 0.00 H new ATOM 0 HB3 ASP A 154 1.823 8.408 6.861 1.00 0.00 H new ATOM 2396 N ALA A 155 0.827 6.470 4.235 1.00 0.00 N ATOM 2397 CA ALA A 155 1.595 5.789 3.201 1.00 0.00 C ATOM 2398 C ALA A 155 1.288 6.363 1.820 1.00 0.00 C ATOM 2399 O ALA A 155 2.194 6.604 1.023 1.00 0.00 O ATOM 2400 CB ALA A 155 1.310 4.296 3.228 1.00 0.00 C ATOM 0 H ALA A 155 0.166 5.872 4.731 1.00 0.00 H new ATOM 0 HA ALA A 155 2.654 5.949 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 155 1.891 3.801 2.450 1.00 0.00 H new ATOM 0 HB2 ALA A 155 1.587 3.890 4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 155 0.248 4.125 3.052 1.00 0.00 H new ATOM 2406 N PHE A 156 0.006 6.577 1.546 1.00 0.00 N ATOM 2407 CA PHE A 156 -0.420 7.129 0.266 1.00 0.00 C ATOM 2408 C PHE A 156 0.041 8.577 0.119 1.00 0.00 C ATOM 2409 O PHE A 156 0.424 9.011 -0.968 1.00 0.00 O ATOM 2410 CB PHE A 156 -1.940 7.041 0.124 1.00 0.00 C ATOM 2411 CG PHE A 156 -2.435 7.299 -1.270 1.00 0.00 C ATOM 2412 CD1 PHE A 156 -1.546 7.393 -2.331 1.00 0.00 C ATOM 2413 CD2 PHE A 156 -3.791 7.447 -1.525 1.00 0.00 C ATOM 2414 CE1 PHE A 156 -2.001 7.630 -3.614 1.00 0.00 C ATOM 2415 CE2 PHE A 156 -4.247 7.682 -2.807 1.00 0.00 C ATOM 2416 CZ PHE A 156 -3.350 7.775 -3.853 1.00 0.00 C ATOM 0 H PHE A 156 -0.756 6.376 2.193 1.00 0.00 H new ATOM 0 HA PHE A 156 0.040 6.539 -0.527 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -2.268 6.050 0.438 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -2.401 7.759 0.802 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -0.487 7.280 -2.152 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -4.498 7.378 -0.711 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -1.298 7.702 -4.431 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -5.305 7.793 -2.992 1.00 0.00 H new ATOM 0 HZ PHE A 156 -3.705 7.961 -4.856 1.00 0.00 H new ATOM 2426 N TYR A 157 -0.003 9.320 1.219 1.00 0.00 N ATOM 2427 CA TYR A 157 0.474 10.698 1.231 1.00 0.00 C ATOM 2428 C TYR A 157 1.960 10.761 0.893 1.00 0.00 C ATOM 2429 O TYR A 157 2.417 11.684 0.216 1.00 0.00 O ATOM 2430 CB TYR A 157 0.216 11.345 2.593 1.00 0.00 C ATOM 2431 CG TYR A 157 -1.246 11.607 2.880 1.00 0.00 C ATOM 2432 CD1 TYR A 157 -2.225 11.276 1.954 1.00 0.00 C ATOM 2433 CD2 TYR A 157 -1.644 12.182 4.078 1.00 0.00 C ATOM 2434 CE1 TYR A 157 -3.561 11.513 2.210 1.00 0.00 C ATOM 2435 CE2 TYR A 157 -2.977 12.424 4.346 1.00 0.00 C ATOM 2436 CZ TYR A 157 -3.933 12.087 3.409 1.00 0.00 C ATOM 2437 OH TYR A 157 -5.263 12.324 3.670 1.00 0.00 O ATOM 0 H TYR A 157 -0.364 8.991 2.114 1.00 0.00 H new ATOM 0 HA TYR A 157 -0.077 11.251 0.471 1.00 0.00 H new ATOM 0 HB2 TYR A 157 0.619 10.699 3.373 1.00 0.00 H new ATOM 0 HB3 TYR A 157 0.761 12.287 2.646 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -1.937 10.825 1.016 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -0.899 12.445 4.814 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -4.310 11.251 1.477 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -3.270 12.874 5.283 1.00 0.00 H new ATOM 0 HH TYR A 157 -5.515 11.884 4.509 1.00 0.00 H new ATOM 2447 N THR A 158 2.712 9.774 1.369 1.00 0.00 N ATOM 2448 CA THR A 158 4.123 9.653 1.024 1.00 0.00 C ATOM 2449 C THR A 158 4.305 9.411 -0.471 1.00 0.00 C ATOM 2450 O THR A 158 5.184 9.997 -1.102 1.00 0.00 O ATOM 2451 CB THR A 158 4.800 8.512 1.806 1.00 0.00 C ATOM 2452 OG1 THR A 158 4.746 8.795 3.211 1.00 0.00 O ATOM 2453 CG2 THR A 158 6.251 8.359 1.379 1.00 0.00 C ATOM 0 H THR A 158 2.367 9.046 1.995 1.00 0.00 H new ATOM 0 HA THR A 158 4.596 10.597 1.296 1.00 0.00 H new ATOM 0 HB THR A 158 4.271 7.583 1.594 1.00 0.00 H new ATOM 0 HG1 THR A 158 3.824 8.697 3.529 1.00 0.00 H new ATOM 0 HG21 THR A 158 6.713 7.548 1.942 1.00 0.00 H new ATOM 0 HG22 THR A 158 6.295 8.132 0.314 1.00 0.00 H new ATOM 0 HG23 THR A 158 6.788 9.288 1.574 1.00 0.00 H new ATOM 2461 N LEU A 159 3.467 8.544 -1.031 1.00 0.00 N ATOM 2462 CA LEU A 159 3.474 8.296 -2.468 1.00 0.00 C ATOM 2463 C LEU A 159 3.137 9.566 -3.242 1.00 0.00 C ATOM 2464 O LEU A 159 3.753 9.863 -4.266 1.00 0.00 O ATOM 2465 CB LEU A 159 2.484 7.176 -2.817 1.00 0.00 C ATOM 2466 CG LEU A 159 2.911 5.769 -2.381 1.00 0.00 C ATOM 2467 CD1 LEU A 159 1.733 4.810 -2.491 1.00 0.00 C ATOM 2468 CD2 LEU A 159 4.071 5.299 -3.245 1.00 0.00 C ATOM 0 H LEU A 159 2.776 8.002 -0.512 1.00 0.00 H new ATOM 0 HA LEU A 159 4.477 7.981 -2.757 1.00 0.00 H new ATOM 0 HB2 LEU A 159 1.523 7.406 -2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 159 2.328 7.173 -3.896 1.00 0.00 H new ATOM 0 HG LEU A 159 3.236 5.793 -1.341 1.00 0.00 H new ATOM 0 HD11 LEU A 159 2.045 3.813 -2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 159 0.923 5.154 -1.848 1.00 0.00 H new ATOM 0 HD13 LEU A 159 1.387 4.776 -3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 159 4.374 4.299 -2.935 1.00 0.00 H new ATOM 0 HD22 LEU A 159 3.761 5.276 -4.290 1.00 0.00 H new ATOM 0 HD23 LEU A 159 4.911 5.984 -3.131 1.00 0.00 H new ATOM 2480 N VAL A 160 2.156 10.312 -2.746 1.00 0.00 N ATOM 2481 CA VAL A 160 1.773 11.579 -3.359 1.00 0.00 C ATOM 2482 C VAL A 160 2.921 12.582 -3.308 1.00 0.00 C ATOM 2483 O VAL A 160 3.200 13.270 -4.290 1.00 0.00 O ATOM 2484 CB VAL A 160 0.538 12.190 -2.669 1.00 0.00 C ATOM 2485 CG1 VAL A 160 0.319 13.620 -3.140 1.00 0.00 C ATOM 2486 CG2 VAL A 160 -0.696 11.345 -2.941 1.00 0.00 C ATOM 0 H VAL A 160 1.611 10.061 -1.921 1.00 0.00 H new ATOM 0 HA VAL A 160 1.526 11.365 -4.399 1.00 0.00 H new ATOM 0 HB VAL A 160 0.715 12.204 -1.594 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -0.557 14.037 -2.643 1.00 0.00 H new ATOM 0 HG12 VAL A 160 1.195 14.221 -2.896 1.00 0.00 H new ATOM 0 HG13 VAL A 160 0.162 13.628 -4.219 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -1.559 11.791 -2.446 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -0.877 11.300 -4.015 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -0.539 10.337 -2.557 1.00 0.00 H new ATOM 2496 N ARG A 161 3.583 12.658 -2.159 1.00 0.00 N ATOM 2497 CA ARG A 161 4.715 13.562 -1.988 1.00 0.00 C ATOM 2498 C ARG A 161 5.860 13.181 -2.920 1.00 0.00 C ATOM 2499 O ARG A 161 6.519 14.047 -3.496 1.00 0.00 O ATOM 2500 CB ARG A 161 5.175 13.640 -0.540 1.00 0.00 C ATOM 2501 CG ARG A 161 4.242 14.403 0.387 1.00 0.00 C ATOM 2502 CD ARG A 161 4.631 14.360 1.819 1.00 0.00 C ATOM 2503 NE ARG A 161 3.740 15.090 2.709 1.00 0.00 N ATOM 2504 CZ ARG A 161 3.790 15.035 4.053 1.00 0.00 C ATOM 2505 NH1 ARG A 161 4.655 14.260 4.669 1.00 0.00 N ATOM 2506 NH2 ARG A 161 2.926 15.763 4.740 1.00 0.00 N ATOM 0 H ARG A 161 3.356 12.105 -1.332 1.00 0.00 H new ATOM 0 HA ARG A 161 4.376 14.561 -2.261 1.00 0.00 H new ATOM 0 HB2 ARG A 161 5.295 12.627 -0.157 1.00 0.00 H new ATOM 0 HB3 ARG A 161 6.158 14.111 -0.511 1.00 0.00 H new ATOM 0 HG2 ARG A 161 4.201 15.444 0.065 1.00 0.00 H new ATOM 0 HG3 ARG A 161 3.236 13.997 0.284 1.00 0.00 H new ATOM 0 HD2 ARG A 161 4.672 13.319 2.140 1.00 0.00 H new ATOM 0 HD3 ARG A 161 5.638 14.765 1.921 1.00 0.00 H new ATOM 0 HE ARG A 161 3.028 15.685 2.285 1.00 0.00 H new ATOM 0 HH11 ARG A 161 5.303 13.688 4.128 1.00 0.00 H new ATOM 0 HH12 ARG A 161 4.678 14.231 5.688 1.00 0.00 H new ATOM 0 HH21 ARG A 161 2.247 16.345 4.250 1.00 0.00 H new ATOM 0 HH22 ARG A 161 2.939 15.742 5.760 1.00 0.00 H new ATOM 2520 N GLU A 162 6.092 11.880 -3.063 1.00 0.00 N ATOM 2521 CA GLU A 162 7.155 11.385 -3.931 1.00 0.00 C ATOM 2522 C GLU A 162 6.870 11.727 -5.390 1.00 0.00 C ATOM 2523 O GLU A 162 7.771 12.117 -6.133 1.00 0.00 O ATOM 2524 CB GLU A 162 7.322 9.872 -3.767 1.00 0.00 C ATOM 2525 CG GLU A 162 8.089 9.456 -2.519 1.00 0.00 C ATOM 2526 CD GLU A 162 9.495 9.989 -2.539 1.00 0.00 C ATOM 2527 OE1 GLU A 162 10.192 9.735 -3.491 1.00 0.00 O ATOM 2528 OE2 GLU A 162 9.837 10.742 -1.658 1.00 0.00 O ATOM 0 H GLU A 162 5.559 11.150 -2.590 1.00 0.00 H new ATOM 0 HA GLU A 162 8.084 11.874 -3.638 1.00 0.00 H new ATOM 0 HB2 GLU A 162 6.335 9.410 -3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 162 7.837 9.478 -4.643 1.00 0.00 H new ATOM 0 HG2 GLU A 162 7.571 9.822 -1.632 1.00 0.00 H new ATOM 0 HG3 GLU A 162 8.111 8.368 -2.449 1.00 0.00 H new ATOM 2535 N ILE A 163 5.612 11.580 -5.791 1.00 0.00 N ATOM 2536 CA ILE A 163 5.199 11.917 -7.147 1.00 0.00 C ATOM 2537 C ILE A 163 5.356 13.411 -7.414 1.00 0.00 C ATOM 2538 O ILE A 163 5.802 13.819 -8.487 1.00 0.00 O ATOM 2539 CB ILE A 163 3.740 11.506 -7.413 1.00 0.00 C ATOM 2540 CG1 ILE A 163 3.607 9.981 -7.417 1.00 0.00 C ATOM 2541 CG2 ILE A 163 3.254 12.089 -8.730 1.00 0.00 C ATOM 2542 CD1 ILE A 163 2.178 9.492 -7.358 1.00 0.00 C ATOM 0 H ILE A 163 4.861 11.230 -5.196 1.00 0.00 H new ATOM 0 HA ILE A 163 5.849 11.360 -7.822 1.00 0.00 H new ATOM 0 HB ILE A 163 3.117 11.904 -6.612 1.00 0.00 H new ATOM 0 HG12 ILE A 163 4.079 9.587 -8.317 1.00 0.00 H new ATOM 0 HG13 ILE A 163 4.155 9.576 -6.566 1.00 0.00 H new ATOM 0 HG21 ILE A 163 2.221 11.788 -8.902 1.00 0.00 H new ATOM 0 HG22 ILE A 163 3.313 13.177 -8.690 1.00 0.00 H new ATOM 0 HG23 ILE A 163 3.879 11.721 -9.544 1.00 0.00 H new ATOM 0 HD11 ILE A 163 2.166 8.402 -7.364 1.00 0.00 H new ATOM 0 HD12 ILE A 163 1.707 9.855 -6.445 1.00 0.00 H new ATOM 0 HD13 ILE A 163 1.629 9.866 -8.222 1.00 0.00 H new ATOM 2554 N ARG A 164 4.987 14.223 -6.429 1.00 0.00 N ATOM 2555 CA ARG A 164 5.086 15.673 -6.556 1.00 0.00 C ATOM 2556 C ARG A 164 6.545 16.110 -6.666 1.00 0.00 C ATOM 2557 O ARG A 164 6.862 17.071 -7.363 1.00 0.00 O ATOM 2558 CB ARG A 164 4.367 16.401 -5.430 1.00 0.00 C ATOM 2559 CG ARG A 164 2.850 16.321 -5.484 1.00 0.00 C ATOM 2560 CD ARG A 164 2.164 16.928 -4.315 1.00 0.00 C ATOM 2561 NE ARG A 164 0.714 16.806 -4.336 1.00 0.00 N ATOM 2562 CZ ARG A 164 -0.103 17.216 -3.347 1.00 0.00 C ATOM 2563 NH1 ARG A 164 0.381 17.739 -2.242 1.00 0.00 N ATOM 2564 NH2 ARG A 164 -1.405 17.056 -3.507 1.00 0.00 N ATOM 0 H ARG A 164 4.617 13.902 -5.534 1.00 0.00 H new ATOM 0 HA ARG A 164 4.579 15.953 -7.479 1.00 0.00 H new ATOM 0 HB2 ARG A 164 4.704 15.991 -4.478 1.00 0.00 H new ATOM 0 HB3 ARG A 164 4.662 17.450 -5.448 1.00 0.00 H new ATOM 0 HG2 ARG A 164 2.504 16.816 -6.391 1.00 0.00 H new ATOM 0 HG3 ARG A 164 2.556 15.274 -5.560 1.00 0.00 H new ATOM 0 HD2 ARG A 164 2.542 16.462 -3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 164 2.426 17.985 -4.264 1.00 0.00 H new ATOM 0 HE ARG A 164 0.286 16.380 -5.158 1.00 0.00 H new ATOM 0 HH11 ARG A 164 1.389 17.839 -2.124 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -0.252 18.045 -1.503 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -1.765 16.632 -4.362 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -2.049 17.357 -2.776 1.00 0.00 H new ATOM 2578 N GLN A 165 7.425 15.394 -5.973 1.00 0.00 N ATOM 2579 CA GLN A 165 8.857 15.643 -6.073 1.00 0.00 C ATOM 2580 C GLN A 165 9.393 15.203 -7.433 1.00 0.00 C ATOM 2581 O GLN A 165 10.169 15.918 -8.066 1.00 0.00 O ATOM 2582 CB GLN A 165 9.609 14.911 -4.958 1.00 0.00 C ATOM 2583 CG GLN A 165 9.409 15.509 -3.577 1.00 0.00 C ATOM 2584 CD GLN A 165 9.790 14.546 -2.468 1.00 0.00 C ATOM 2585 OE1 GLN A 165 10.067 13.301 -2.837 1.00 0.00 O flip ATOM 2586 NE2 GLN A 165 9.839 14.919 -1.292 1.00 0.00 N flip ATOM 0 H GLN A 165 7.171 14.638 -5.337 1.00 0.00 H new ATOM 0 HA GLN A 165 9.018 16.716 -5.965 1.00 0.00 H new ATOM 0 HB2 GLN A 165 9.287 13.870 -4.941 1.00 0.00 H new ATOM 0 HB3 GLN A 165 10.674 14.912 -5.192 1.00 0.00 H new ATOM 0 HG2 GLN A 165 10.006 16.417 -3.487 1.00 0.00 H new ATOM 0 HG3 GLN A 165 8.366 15.801 -3.458 1.00 0.00 H new ATOM 0 HE21 GLN A 165 9.618 15.886 -1.054 1.00 0.00 H new ATOM 0 HE22 GLN A 165 10.101 14.260 -0.559 1.00 0.00 H new ATOM 2595 N HIS A 166 8.972 14.023 -7.874 1.00 0.00 N ATOM 2596 CA HIS A 166 9.410 13.486 -9.158 1.00 0.00 C ATOM 2597 C HIS A 166 8.907 14.353 -10.309 1.00 0.00 C ATOM 2598 O HIS A 166 7.920 15.075 -10.169 1.00 0.00 O ATOM 2599 CB HIS A 166 8.927 12.042 -9.336 1.00 0.00 C ATOM 2600 CG HIS A 166 9.510 11.087 -8.343 1.00 0.00 C ATOM 2601 ND1 HIS A 166 8.954 9.851 -8.085 1.00 0.00 N ATOM 2602 CD2 HIS A 166 10.598 11.184 -7.543 1.00 0.00 C ATOM 2603 CE1 HIS A 166 9.677 9.229 -7.169 1.00 0.00 C ATOM 2604 NE2 HIS A 166 10.679 10.017 -6.824 1.00 0.00 N ATOM 2605 OXT HIS A 166 9.474 14.335 -11.366 1.00 0.00 O ATOM 0 H HIS A 166 8.328 13.420 -7.362 1.00 0.00 H new ATOM 0 HA HIS A 166 10.500 13.493 -9.169 1.00 0.00 H new ATOM 0 HB2 HIS A 166 7.840 12.019 -9.254 1.00 0.00 H new ATOM 0 HB3 HIS A 166 9.178 11.705 -10.342 1.00 0.00 H new ATOM 0 HD2 HIS A 166 11.276 12.023 -7.482 1.00 0.00 H new ATOM 0 HE1 HIS A 166 9.481 8.244 -6.771 1.00 0.00 H new ATOM 0 HE2 HIS A 166 11.397 9.795 -6.135 1.00 0.00 H new TER 2612 HIS A 166