USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1314 hydrogens (19 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 HIS :FLIP no HD1:sc= -0.471 F(o=-2.3!,f=-0.95) USER MOD Set 1.2: A 137 TYR OH : rot -144:sc= -0.478 USER MOD Set 2.1: A 87 THR OG1 : rot 180:sc= 1.02 USER MOD Set 2.2: A 124 THR OG1 : rot 125:sc= 1.2 USER MOD Set 3.1: A 101 LYS NZ :NH3+ 133:sc= -1.79 (180deg=-4.99!) USER MOD Set 3.2: A 111 MET CE :methyl -164:sc= -8.09! (180deg=-11.7!) USER MOD Set 4.1: A 1 MET CE :methyl -163:sc= -1.37 (180deg=-2.03!) USER MOD Set 4.2: A 43 GLN :FLIP amide:sc= -0.0858 F(o=-3.8,f=-1.5) USER MOD Single : A 1 MET N :NH3+ -113:sc= 0.798 (180deg=-0.29) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 30:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ -167:sc= -0.034 (180deg=-0.231) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.273 K(o=-0.27,f=-2.7) USER MOD Single : A 25 GLN : amide:sc= -1.48 K(o=-1.5,f=-4.1!) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.711! F(o=-2.5,f=-0.71!) USER MOD Single : A 27 HIS : no HD1:sc= -0.556 K(o=-0.56,f=-1.3) USER MOD Single : A 32 TYR OH : rot -37:sc= 0.931 USER MOD Single : A 35 SER OG : rot 180:sc=-0.00199 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= -1.04 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 29:sc= 0.0134 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl -159:sc= -0.428 (180deg=-0.706) USER MOD Single : A 70 GLN : amide:sc= -0.416 K(o=-0.42,f=-2.9!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -158:sc= -0.434 (180deg=-1.06) USER MOD Single : A 74 THR OG1 : rot -82:sc= -0.319 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.816 USER MOD Single : A 85 ASN : amide:sc= -4.92 K(o=-4.9,f=-11!) USER MOD Single : A 86 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -40:sc= 0.953 USER MOD Single : A 95 GLN : amide:sc= -3.63! C(o=-3.6!,f=-4.2!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 38:sc= 0.383 USER MOD Single : A 116 ASN : amide:sc= -1.07 K(o=-1.1,f=-8.6!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 93:sc= 0.109 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -1.36! C(o=-1.4!,f=-3!) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot -120:sc= 0.363 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 144:sc= -1.27 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 74:sc= 0.439 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.214 X(o=-0.21,f=-0.086) USER MOD Single : A 219 GNP O2' : rot -127:sc= -0.467 USER MOD Single : A 219 GNP O3' : rot 136:sc= 0.115 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.054 -18.163 -16.459 1.00 62.23 N ATOM 2 CA MET A 1 -9.625 -18.570 -16.434 1.00 63.45 C ATOM 3 C MET A 1 -9.089 -18.621 -15.008 1.00 34.23 C ATOM 4 O MET A 1 -9.695 -18.078 -14.084 1.00 64.13 O ATOM 5 CB MET A 1 -8.817 -17.573 -17.266 1.00 74.04 C ATOM 6 CG MET A 1 -9.080 -16.121 -16.903 1.00 34.53 C ATOM 7 SD MET A 1 -10.328 -15.357 -17.957 1.00 32.31 S ATOM 8 CE MET A 1 -9.616 -15.634 -19.577 1.00 60.42 C ATOM 0 H1 MET A 1 -11.636 -18.961 -16.785 1.00 62.23 H new ATOM 0 H2 MET A 1 -11.352 -17.884 -15.502 1.00 62.23 H new ATOM 0 H3 MET A 1 -11.175 -17.359 -17.107 1.00 62.23 H new ATOM 0 HA MET A 1 -9.533 -19.571 -16.855 1.00 63.45 H new ATOM 0 HB2 MET A 1 -7.755 -17.784 -17.139 1.00 74.04 H new ATOM 0 HB3 MET A 1 -9.048 -17.722 -18.321 1.00 74.04 H new ATOM 0 HG2 MET A 1 -9.403 -16.063 -15.864 1.00 34.53 H new ATOM 0 HG3 MET A 1 -8.150 -15.557 -16.980 1.00 34.53 H new ATOM 0 HE1 MET A 1 -10.094 -14.975 -20.302 1.00 60.42 H new ATOM 0 HE2 MET A 1 -8.547 -15.424 -19.545 1.00 60.42 H new ATOM 0 HE3 MET A 1 -9.774 -16.672 -19.871 1.00 60.42 H new ATOM 18 N THR A 2 -7.947 -19.278 -14.840 1.00 55.12 N ATOM 19 CA THR A 2 -7.319 -19.408 -13.532 1.00 13.04 C ATOM 20 C THR A 2 -7.111 -18.036 -12.889 1.00 43.41 C ATOM 21 O THR A 2 -6.832 -17.054 -13.575 1.00 74.33 O ATOM 22 CB THR A 2 -5.986 -20.155 -13.671 1.00 5.10 C ATOM 23 OG1 THR A 2 -6.146 -21.523 -13.337 1.00 42.21 O ATOM 24 CG2 THR A 2 -4.874 -19.603 -12.803 1.00 4.03 C ATOM 0 H THR A 2 -7.436 -19.731 -15.598 1.00 55.12 H new ATOM 0 HA THR A 2 -7.978 -19.981 -12.880 1.00 13.04 H new ATOM 0 HB THR A 2 -5.699 -20.023 -14.714 1.00 5.10 H new ATOM 0 HG1 THR A 2 -5.287 -21.986 -13.432 1.00 42.21 H new ATOM 0 HG21 THR A 2 -3.966 -20.186 -12.960 1.00 4.03 H new ATOM 0 HG22 THR A 2 -4.687 -18.563 -13.069 1.00 4.03 H new ATOM 0 HG23 THR A 2 -5.167 -19.663 -11.755 1.00 4.03 H new ATOM 32 N GLU A 3 -7.248 -17.981 -11.568 1.00 52.34 N ATOM 33 CA GLU A 3 -7.073 -16.734 -10.832 1.00 11.52 C ATOM 34 C GLU A 3 -5.792 -16.769 -10.005 1.00 73.13 C ATOM 35 O GLU A 3 -5.574 -17.694 -9.222 1.00 10.25 O ATOM 36 CB GLU A 3 -8.276 -16.481 -9.921 1.00 60.03 C ATOM 37 CG GLU A 3 -9.420 -15.753 -10.609 1.00 21.34 C ATOM 38 CD GLU A 3 -10.780 -16.226 -10.136 1.00 4.21 C ATOM 39 OE1 GLU A 3 -10.971 -16.350 -8.908 1.00 62.14 O ATOM 40 OE2 GLU A 3 -11.655 -16.471 -10.993 1.00 11.23 O ATOM 0 H GLU A 3 -7.480 -18.785 -10.985 1.00 52.34 H new ATOM 0 HA GLU A 3 -6.997 -15.921 -11.554 1.00 11.52 H new ATOM 0 HB2 GLU A 3 -8.640 -17.436 -9.541 1.00 60.03 H new ATOM 0 HB3 GLU A 3 -7.952 -15.898 -9.059 1.00 60.03 H new ATOM 0 HG2 GLU A 3 -9.327 -14.683 -10.425 1.00 21.34 H new ATOM 0 HG3 GLU A 3 -9.343 -15.899 -11.686 1.00 21.34 H new ATOM 47 N TYR A 4 -4.947 -15.760 -10.186 1.00 74.21 N ATOM 48 CA TYR A 4 -3.687 -15.681 -9.457 1.00 1.11 C ATOM 49 C TYR A 4 -3.783 -14.691 -8.301 1.00 64.45 C ATOM 50 O TYR A 4 -3.853 -13.480 -8.511 1.00 71.54 O ATOM 51 CB TYR A 4 -2.553 -15.271 -10.400 1.00 0.30 C ATOM 52 CG TYR A 4 -1.927 -16.433 -11.137 1.00 64.10 C ATOM 53 CD1 TYR A 4 -2.640 -17.132 -12.104 1.00 50.02 C ATOM 54 CD2 TYR A 4 -0.624 -16.832 -10.866 1.00 21.12 C ATOM 55 CE1 TYR A 4 -2.072 -18.195 -12.780 1.00 43.42 C ATOM 56 CE2 TYR A 4 -0.049 -17.893 -11.538 1.00 11.34 C ATOM 57 CZ TYR A 4 -0.776 -18.571 -12.495 1.00 64.04 C ATOM 58 OH TYR A 4 -0.206 -19.629 -13.166 1.00 1.34 O ATOM 0 H TYR A 4 -5.112 -14.987 -10.830 1.00 74.21 H new ATOM 0 HA TYR A 4 -3.474 -16.668 -9.047 1.00 1.11 H new ATOM 0 HB2 TYR A 4 -2.937 -14.556 -11.127 1.00 0.30 H new ATOM 0 HB3 TYR A 4 -1.782 -14.758 -9.825 1.00 0.30 H new ATOM 0 HD1 TYR A 4 -3.655 -16.840 -12.331 1.00 50.02 H new ATOM 0 HD2 TYR A 4 -0.051 -16.304 -10.118 1.00 21.12 H new ATOM 0 HE1 TYR A 4 -2.640 -18.729 -13.528 1.00 43.42 H new ATOM 0 HE2 TYR A 4 0.965 -18.191 -11.315 1.00 11.34 H new ATOM 0 HH TYR A 4 -0.593 -19.693 -14.064 1.00 1.34 H new ATOM 68 N LYS A 5 -3.784 -15.215 -7.079 1.00 11.23 N ATOM 69 CA LYS A 5 -3.868 -14.377 -5.888 1.00 31.54 C ATOM 70 C LYS A 5 -2.493 -13.837 -5.508 1.00 44.23 C ATOM 71 O LYS A 5 -1.716 -14.511 -4.831 1.00 2.43 O ATOM 72 CB LYS A 5 -4.456 -15.171 -4.720 1.00 20.41 C ATOM 73 CG LYS A 5 -5.975 -15.132 -4.659 1.00 73.14 C ATOM 74 CD LYS A 5 -6.467 -14.329 -3.464 1.00 62.33 C ATOM 75 CE LYS A 5 -7.705 -14.954 -2.844 1.00 52.33 C ATOM 76 NZ LYS A 5 -8.612 -13.930 -2.258 1.00 43.34 N ATOM 0 H LYS A 5 -3.728 -16.215 -6.888 1.00 11.23 H new ATOM 0 HA LYS A 5 -4.523 -13.535 -6.111 1.00 31.54 H new ATOM 0 HB2 LYS A 5 -4.131 -16.208 -4.797 1.00 20.41 H new ATOM 0 HB3 LYS A 5 -4.053 -14.779 -3.786 1.00 20.41 H new ATOM 0 HG2 LYS A 5 -6.365 -14.694 -5.578 1.00 73.14 H new ATOM 0 HG3 LYS A 5 -6.364 -16.149 -4.600 1.00 73.14 H new ATOM 0 HD2 LYS A 5 -5.676 -14.266 -2.716 1.00 62.33 H new ATOM 0 HD3 LYS A 5 -6.691 -13.309 -3.777 1.00 62.33 H new ATOM 0 HE2 LYS A 5 -8.243 -15.523 -3.603 1.00 52.33 H new ATOM 0 HE3 LYS A 5 -7.406 -15.659 -2.069 1.00 52.33 H new ATOM 0 HZ1 LYS A 5 -9.444 -14.398 -1.846 1.00 43.34 H new ATOM 0 HZ2 LYS A 5 -8.108 -13.404 -1.516 1.00 43.34 H new ATOM 0 HZ3 LYS A 5 -8.919 -13.271 -3.002 1.00 43.34 H new ATOM 90 N LEU A 6 -2.196 -12.619 -5.951 1.00 63.44 N ATOM 91 CA LEU A 6 -0.913 -11.991 -5.657 1.00 43.45 C ATOM 92 C LEU A 6 -1.025 -11.048 -4.465 1.00 44.00 C ATOM 93 O LEU A 6 -1.662 -9.997 -4.548 1.00 12.43 O ATOM 94 CB LEU A 6 -0.404 -11.225 -6.880 1.00 42.01 C ATOM 95 CG LEU A 6 -0.378 -12.029 -8.182 1.00 12.43 C ATOM 96 CD1 LEU A 6 0.226 -11.202 -9.307 1.00 50.03 C ATOM 97 CD2 LEU A 6 0.398 -13.324 -7.993 1.00 31.14 C ATOM 0 H LEU A 6 -2.826 -12.048 -6.514 1.00 63.44 H new ATOM 0 HA LEU A 6 -0.203 -12.779 -5.407 1.00 43.45 H new ATOM 0 HB2 LEU A 6 -1.031 -10.346 -7.026 1.00 42.01 H new ATOM 0 HB3 LEU A 6 0.604 -10.866 -6.672 1.00 42.01 H new ATOM 0 HG LEU A 6 -1.403 -12.280 -8.453 1.00 12.43 H new ATOM 0 HD11 LEU A 6 0.237 -11.789 -10.225 1.00 50.03 H new ATOM 0 HD12 LEU A 6 -0.371 -10.303 -9.458 1.00 50.03 H new ATOM 0 HD13 LEU A 6 1.246 -10.921 -9.045 1.00 50.03 H new ATOM 0 HD21 LEU A 6 0.406 -13.883 -8.929 1.00 31.14 H new ATOM 0 HD22 LEU A 6 1.422 -13.095 -7.698 1.00 31.14 H new ATOM 0 HD23 LEU A 6 -0.078 -13.923 -7.217 1.00 31.14 H new ATOM 109 N VAL A 7 -0.400 -11.429 -3.356 1.00 1.44 N ATOM 110 CA VAL A 7 -0.425 -10.619 -2.146 1.00 13.02 C ATOM 111 C VAL A 7 0.674 -9.562 -2.171 1.00 63.54 C ATOM 112 O VAL A 7 1.850 -9.872 -1.986 1.00 40.12 O ATOM 113 CB VAL A 7 -0.258 -11.496 -0.889 1.00 55.43 C ATOM 114 CG1 VAL A 7 -0.315 -10.647 0.370 1.00 51.44 C ATOM 115 CG2 VAL A 7 -1.318 -12.585 -0.852 1.00 41.32 C ATOM 0 H VAL A 7 0.131 -12.296 -3.271 1.00 1.44 H new ATOM 0 HA VAL A 7 -1.395 -10.124 -2.109 1.00 13.02 H new ATOM 0 HB VAL A 7 0.721 -11.973 -0.933 1.00 55.43 H new ATOM 0 HG11 VAL A 7 -0.195 -11.286 1.245 1.00 51.44 H new ATOM 0 HG12 VAL A 7 0.486 -9.908 0.347 1.00 51.44 H new ATOM 0 HG13 VAL A 7 -1.277 -10.137 0.422 1.00 51.44 H new ATOM 0 HG21 VAL A 7 -1.184 -13.193 0.042 1.00 41.32 H new ATOM 0 HG22 VAL A 7 -2.308 -12.129 -0.835 1.00 41.32 H new ATOM 0 HG23 VAL A 7 -1.224 -13.215 -1.737 1.00 41.32 H new ATOM 125 N VAL A 8 0.282 -8.313 -2.401 1.00 64.42 N ATOM 126 CA VAL A 8 1.233 -7.211 -2.450 1.00 14.41 C ATOM 127 C VAL A 8 1.453 -6.617 -1.063 1.00 43.20 C ATOM 128 O VAL A 8 0.509 -6.450 -0.291 1.00 54.30 O ATOM 129 CB VAL A 8 0.749 -6.104 -3.405 1.00 32.24 C ATOM 130 CG1 VAL A 8 1.765 -4.976 -3.478 1.00 54.35 C ATOM 131 CG2 VAL A 8 0.477 -6.675 -4.788 1.00 21.31 C ATOM 0 H VAL A 8 -0.688 -8.040 -2.556 1.00 64.42 H new ATOM 0 HA VAL A 8 2.176 -7.614 -2.820 1.00 14.41 H new ATOM 0 HB VAL A 8 -0.183 -5.696 -3.014 1.00 32.24 H new ATOM 0 HG11 VAL A 8 1.404 -4.204 -4.158 1.00 54.35 H new ATOM 0 HG12 VAL A 8 1.906 -4.548 -2.485 1.00 54.35 H new ATOM 0 HG13 VAL A 8 2.715 -5.365 -3.843 1.00 54.35 H new ATOM 0 HG21 VAL A 8 0.136 -5.879 -5.450 1.00 21.31 H new ATOM 0 HG22 VAL A 8 1.392 -7.112 -5.188 1.00 21.31 H new ATOM 0 HG23 VAL A 8 -0.292 -7.444 -4.719 1.00 21.31 H new ATOM 141 N VAL A 9 2.705 -6.296 -0.754 1.00 20.54 N ATOM 142 CA VAL A 9 3.048 -5.718 0.539 1.00 12.15 C ATOM 143 C VAL A 9 4.115 -4.638 0.391 1.00 10.32 C ATOM 144 O VAL A 9 4.954 -4.699 -0.508 1.00 74.42 O ATOM 145 CB VAL A 9 3.549 -6.794 1.525 1.00 11.22 C ATOM 146 CG1 VAL A 9 2.499 -7.880 1.708 1.00 42.32 C ATOM 147 CG2 VAL A 9 4.865 -7.393 1.049 1.00 65.25 C ATOM 0 H VAL A 9 3.498 -6.427 -1.382 1.00 20.54 H new ATOM 0 HA VAL A 9 2.137 -5.272 0.938 1.00 12.15 H new ATOM 0 HB VAL A 9 3.723 -6.318 2.490 1.00 11.22 H new ATOM 0 HG11 VAL A 9 2.869 -8.630 2.407 1.00 42.32 H new ATOM 0 HG12 VAL A 9 1.584 -7.438 2.102 1.00 42.32 H new ATOM 0 HG13 VAL A 9 2.291 -8.350 0.747 1.00 42.32 H new ATOM 0 HG21 VAL A 9 5.199 -8.149 1.760 1.00 65.25 H new ATOM 0 HG22 VAL A 9 4.723 -7.852 0.071 1.00 65.25 H new ATOM 0 HG23 VAL A 9 5.617 -6.607 0.975 1.00 65.25 H new ATOM 157 N GLY A 10 4.077 -3.649 1.277 1.00 14.22 N ATOM 158 CA GLY A 10 5.047 -2.571 1.224 1.00 22.22 C ATOM 159 C GLY A 10 5.117 -1.788 2.519 1.00 52.31 C ATOM 160 O GLY A 10 4.680 -2.265 3.566 1.00 21.44 O ATOM 0 H GLY A 10 3.393 -3.574 2.030 1.00 14.22 H new ATOM 0 HA2 GLY A 10 6.031 -2.983 0.999 1.00 22.22 H new ATOM 0 HA3 GLY A 10 4.790 -1.895 0.408 1.00 22.22 H new ATOM 164 N ALA A 11 5.670 -0.582 2.448 1.00 31.03 N ATOM 165 CA ALA A 11 5.797 0.269 3.625 1.00 32.42 C ATOM 166 C ALA A 11 4.680 1.307 3.676 1.00 23.04 C ATOM 167 O ALA A 11 4.860 2.400 4.213 1.00 64.51 O ATOM 168 CB ALA A 11 7.157 0.952 3.636 1.00 50.41 C ATOM 0 H ALA A 11 6.037 -0.172 1.589 1.00 31.03 H new ATOM 0 HA ALA A 11 5.711 -0.361 4.510 1.00 32.42 H new ATOM 0 HB1 ALA A 11 7.239 1.585 4.520 1.00 50.41 H new ATOM 0 HB2 ALA A 11 7.943 0.197 3.656 1.00 50.41 H new ATOM 0 HB3 ALA A 11 7.264 1.564 2.740 1.00 50.41 H new ATOM 174 N GLY A 12 3.526 0.957 3.116 1.00 64.45 N ATOM 175 CA GLY A 12 2.398 1.870 3.109 1.00 54.05 C ATOM 176 C GLY A 12 2.609 3.045 2.176 1.00 62.13 C ATOM 177 O GLY A 12 1.886 3.203 1.192 1.00 4.11 O ATOM 0 H GLY A 12 3.352 0.058 2.667 1.00 64.45 H new ATOM 0 HA2 GLY A 12 1.499 1.330 2.811 1.00 54.05 H new ATOM 0 HA3 GLY A 12 2.227 2.239 4.120 1.00 54.05 H new ATOM 181 N GLY A 13 3.603 3.873 2.484 1.00 55.41 N ATOM 182 CA GLY A 13 3.891 5.029 1.655 1.00 3.51 C ATOM 183 C GLY A 13 4.937 4.739 0.597 1.00 73.22 C ATOM 184 O GLY A 13 5.852 5.535 0.387 1.00 64.45 O ATOM 0 H GLY A 13 4.214 3.764 3.293 1.00 55.41 H new ATOM 0 HA2 GLY A 13 2.973 5.363 1.172 1.00 3.51 H new ATOM 0 HA3 GLY A 13 4.235 5.848 2.286 1.00 3.51 H new ATOM 188 N VAL A 14 4.804 3.597 -0.070 1.00 15.42 N ATOM 189 CA VAL A 14 5.748 3.205 -1.111 1.00 31.10 C ATOM 190 C VAL A 14 5.089 3.212 -2.488 1.00 22.24 C ATOM 191 O VAL A 14 5.747 3.459 -3.498 1.00 54.45 O ATOM 192 CB VAL A 14 6.331 1.805 -0.843 1.00 41.55 C ATOM 193 CG1 VAL A 14 7.299 1.847 0.330 1.00 43.01 C ATOM 194 CG2 VAL A 14 5.215 0.801 -0.592 1.00 20.13 C ATOM 0 H VAL A 14 4.052 2.927 0.092 1.00 15.42 H new ATOM 0 HA VAL A 14 6.555 3.938 -1.094 1.00 31.10 H new ATOM 0 HB VAL A 14 6.883 1.484 -1.727 1.00 41.55 H new ATOM 0 HG11 VAL A 14 7.701 0.849 0.505 1.00 43.01 H new ATOM 0 HG12 VAL A 14 8.115 2.533 0.104 1.00 43.01 H new ATOM 0 HG13 VAL A 14 6.775 2.189 1.222 1.00 43.01 H new ATOM 0 HG21 VAL A 14 5.646 -0.183 -0.405 1.00 20.13 H new ATOM 0 HG22 VAL A 14 4.633 1.113 0.275 1.00 20.13 H new ATOM 0 HG23 VAL A 14 4.566 0.752 -1.466 1.00 20.13 H new ATOM 204 N GLY A 15 3.789 2.940 -2.520 1.00 3.42 N ATOM 205 CA GLY A 15 3.066 2.921 -3.778 1.00 3.53 C ATOM 206 C GLY A 15 2.604 1.529 -4.159 1.00 2.33 C ATOM 207 O GLY A 15 2.470 1.215 -5.342 1.00 71.33 O ATOM 0 H GLY A 15 3.223 2.732 -1.697 1.00 3.42 H new ATOM 0 HA2 GLY A 15 2.201 3.581 -3.707 1.00 3.53 H new ATOM 0 HA3 GLY A 15 3.705 3.317 -4.567 1.00 3.53 H new ATOM 211 N LYS A 16 2.364 0.692 -3.156 1.00 10.04 N ATOM 212 CA LYS A 16 1.917 -0.676 -3.394 1.00 33.14 C ATOM 213 C LYS A 16 0.589 -0.696 -4.144 1.00 33.10 C ATOM 214 O LYS A 16 0.443 -1.399 -5.144 1.00 62.12 O ATOM 215 CB LYS A 16 1.782 -1.426 -2.068 1.00 32.30 C ATOM 216 CG LYS A 16 0.882 -0.728 -1.063 1.00 4.12 C ATOM 217 CD LYS A 16 1.316 -1.011 0.366 1.00 72.44 C ATOM 218 CE LYS A 16 1.175 -2.486 0.708 1.00 54.33 C ATOM 219 NZ LYS A 16 -0.241 -2.941 0.632 1.00 50.44 N ATOM 0 H LYS A 16 2.471 0.936 -2.171 1.00 10.04 H new ATOM 0 HA LYS A 16 2.665 -1.174 -4.011 1.00 33.14 H new ATOM 0 HB2 LYS A 16 1.389 -2.424 -2.263 1.00 32.30 H new ATOM 0 HB3 LYS A 16 2.772 -1.553 -1.630 1.00 32.30 H new ATOM 0 HG2 LYS A 16 0.899 0.347 -1.243 1.00 4.12 H new ATOM 0 HG3 LYS A 16 -0.147 -1.059 -1.204 1.00 4.12 H new ATOM 0 HD2 LYS A 16 2.353 -0.702 0.501 1.00 72.44 H new ATOM 0 HD3 LYS A 16 0.715 -0.417 1.055 1.00 72.44 H new ATOM 0 HE2 LYS A 16 1.783 -3.077 0.024 1.00 54.33 H new ATOM 0 HE3 LYS A 16 1.560 -2.664 1.712 1.00 54.33 H new ATOM 0 HZ1 LYS A 16 -0.329 -3.876 1.078 1.00 50.44 H new ATOM 0 HZ2 LYS A 16 -0.851 -2.261 1.129 1.00 50.44 H new ATOM 0 HZ3 LYS A 16 -0.533 -3.004 -0.364 1.00 50.44 H new ATOM 233 N SER A 17 -0.375 0.077 -3.657 1.00 2.32 N ATOM 234 CA SER A 17 -1.690 0.143 -4.285 1.00 2.10 C ATOM 235 C SER A 17 -1.620 0.892 -5.613 1.00 10.32 C ATOM 236 O SER A 17 -2.399 0.626 -6.528 1.00 4.34 O ATOM 237 CB SER A 17 -2.690 0.826 -3.353 1.00 23.11 C ATOM 238 OG SER A 17 -2.291 2.154 -3.063 1.00 21.43 O ATOM 0 H SER A 17 -0.271 0.666 -2.831 1.00 2.32 H new ATOM 0 HA SER A 17 -2.024 -0.876 -4.479 1.00 2.10 H new ATOM 0 HB2 SER A 17 -3.677 0.832 -3.815 1.00 23.11 H new ATOM 0 HB3 SER A 17 -2.775 0.258 -2.427 1.00 23.11 H new ATOM 244 N ALA A 18 -0.683 1.829 -5.711 1.00 62.40 N ATOM 245 CA ALA A 18 -0.511 2.615 -6.925 1.00 62.43 C ATOM 246 C ALA A 18 -0.173 1.721 -8.115 1.00 64.55 C ATOM 247 O ALA A 18 -0.795 1.819 -9.173 1.00 4.02 O ATOM 248 CB ALA A 18 0.573 3.665 -6.725 1.00 25.22 C ATOM 0 H ALA A 18 -0.031 2.062 -4.962 1.00 62.40 H new ATOM 0 HA ALA A 18 -1.454 3.119 -7.139 1.00 62.43 H new ATOM 0 HB1 ALA A 18 0.691 4.245 -7.640 1.00 25.22 H new ATOM 0 HB2 ALA A 18 0.290 4.329 -5.908 1.00 25.22 H new ATOM 0 HB3 ALA A 18 1.515 3.174 -6.483 1.00 25.22 H new ATOM 254 N LEU A 19 0.816 0.851 -7.935 1.00 51.52 N ATOM 255 CA LEU A 19 1.237 -0.061 -8.993 1.00 64.34 C ATOM 256 C LEU A 19 0.071 -0.925 -9.464 1.00 43.13 C ATOM 257 O LEU A 19 -0.002 -1.305 -10.632 1.00 14.13 O ATOM 258 CB LEU A 19 2.380 -0.953 -8.503 1.00 14.31 C ATOM 259 CG LEU A 19 3.683 -0.218 -8.182 1.00 50.03 C ATOM 260 CD1 LEU A 19 4.645 -1.135 -7.442 1.00 31.25 C ATOM 261 CD2 LEU A 19 4.323 0.311 -9.457 1.00 41.44 C ATOM 0 H LEU A 19 1.341 0.758 -7.066 1.00 51.52 H new ATOM 0 HA LEU A 19 1.586 0.537 -9.834 1.00 64.34 H new ATOM 0 HB2 LEU A 19 2.050 -1.483 -7.609 1.00 14.31 H new ATOM 0 HB3 LEU A 19 2.584 -1.707 -9.263 1.00 14.31 H new ATOM 0 HG LEU A 19 3.451 0.629 -7.536 1.00 50.03 H new ATOM 0 HD11 LEU A 19 5.566 -0.595 -7.222 1.00 31.25 H new ATOM 0 HD12 LEU A 19 4.187 -1.466 -6.510 1.00 31.25 H new ATOM 0 HD13 LEU A 19 4.872 -2.002 -8.063 1.00 31.25 H new ATOM 0 HD21 LEU A 19 5.249 0.831 -9.211 1.00 41.44 H new ATOM 0 HD22 LEU A 19 4.541 -0.521 -10.127 1.00 41.44 H new ATOM 0 HD23 LEU A 19 3.638 1.002 -9.948 1.00 41.44 H new ATOM 273 N THR A 20 -0.838 -1.233 -8.545 1.00 13.02 N ATOM 274 CA THR A 20 -2.000 -2.052 -8.866 1.00 20.43 C ATOM 275 C THR A 20 -2.895 -1.355 -9.885 1.00 1.03 C ATOM 276 O THR A 20 -3.155 -1.887 -10.963 1.00 4.43 O ATOM 277 CB THR A 20 -2.797 -2.360 -7.597 1.00 10.55 C ATOM 278 OG1 THR A 20 -1.950 -2.875 -6.585 1.00 61.53 O ATOM 279 CG2 THR A 20 -3.909 -3.362 -7.819 1.00 22.03 C ATOM 0 H THR A 20 -0.792 -0.928 -7.573 1.00 13.02 H new ATOM 0 HA THR A 20 -1.645 -2.986 -9.302 1.00 20.43 H new ATOM 0 HB THR A 20 -3.239 -1.411 -7.295 1.00 10.55 H new ATOM 0 HG1 THR A 20 -2.478 -3.064 -5.781 1.00 61.53 H new ATOM 0 HG21 THR A 20 -4.435 -3.536 -6.880 1.00 22.03 H new ATOM 0 HG22 THR A 20 -4.608 -2.972 -8.559 1.00 22.03 H new ATOM 0 HG23 THR A 20 -3.487 -4.301 -8.178 1.00 22.03 H new ATOM 287 N ILE A 21 -3.363 -0.161 -9.536 1.00 52.31 N ATOM 288 CA ILE A 21 -4.231 0.611 -10.421 1.00 63.01 C ATOM 289 C ILE A 21 -3.587 0.808 -11.790 1.00 10.14 C ATOM 290 O ILE A 21 -4.280 0.918 -12.802 1.00 42.12 O ATOM 291 CB ILE A 21 -4.568 1.990 -9.818 1.00 32.24 C ATOM 292 CG1 ILE A 21 -5.122 1.836 -8.400 1.00 63.21 C ATOM 293 CG2 ILE A 21 -5.563 2.730 -10.699 1.00 73.31 C ATOM 294 CD1 ILE A 21 -6.262 0.847 -8.296 1.00 53.11 C ATOM 0 H ILE A 21 -3.156 0.294 -8.647 1.00 52.31 H new ATOM 0 HA ILE A 21 -5.152 0.040 -10.536 1.00 63.01 H new ATOM 0 HB ILE A 21 -3.650 2.575 -9.768 1.00 32.24 H new ATOM 0 HG12 ILE A 21 -4.317 1.519 -7.737 1.00 63.21 H new ATOM 0 HG13 ILE A 21 -5.463 2.809 -8.045 1.00 63.21 H new ATOM 0 HG21 ILE A 21 -5.789 3.701 -10.257 1.00 73.31 H new ATOM 0 HG22 ILE A 21 -5.134 2.874 -11.691 1.00 73.31 H new ATOM 0 HG23 ILE A 21 -6.480 2.147 -10.781 1.00 73.31 H new ATOM 0 HD11 ILE A 21 -6.602 0.791 -7.262 1.00 53.11 H new ATOM 0 HD12 ILE A 21 -7.085 1.173 -8.932 1.00 53.11 H new ATOM 0 HD13 ILE A 21 -5.921 -0.137 -8.619 1.00 53.11 H new ATOM 306 N GLN A 22 -2.260 0.848 -11.816 1.00 15.23 N ATOM 307 CA GLN A 22 -1.528 1.027 -13.063 1.00 3.22 C ATOM 308 C GLN A 22 -1.731 -0.172 -13.984 1.00 52.52 C ATOM 309 O GLN A 22 -2.061 -0.016 -15.159 1.00 44.30 O ATOM 310 CB GLN A 22 -0.036 1.222 -12.782 1.00 53.12 C ATOM 311 CG GLN A 22 0.284 2.536 -12.086 1.00 44.40 C ATOM 312 CD GLN A 22 1.077 3.485 -12.963 1.00 2.12 C ATOM 313 OE1 GLN A 22 2.308 3.495 -12.932 1.00 41.34 O ATOM 314 NE2 GLN A 22 0.375 4.289 -13.752 1.00 3.01 N ATOM 0 H GLN A 22 -1.670 0.759 -10.989 1.00 15.23 H new ATOM 0 HA GLN A 22 -1.914 1.917 -13.559 1.00 3.22 H new ATOM 0 HB2 GLN A 22 0.320 0.397 -12.165 1.00 53.12 H new ATOM 0 HB3 GLN A 22 0.512 1.176 -13.723 1.00 53.12 H new ATOM 0 HG2 GLN A 22 -0.646 3.018 -11.784 1.00 44.40 H new ATOM 0 HG3 GLN A 22 0.848 2.332 -11.176 1.00 44.40 H new ATOM 0 HE21 GLN A 22 -0.644 4.247 -13.746 1.00 3.01 H new ATOM 0 HE22 GLN A 22 0.855 4.949 -14.365 1.00 3.01 H new ATOM 323 N LEU A 23 -1.532 -1.367 -13.440 1.00 13.22 N ATOM 324 CA LEU A 23 -1.693 -2.598 -14.207 1.00 74.43 C ATOM 325 C LEU A 23 -3.171 -2.944 -14.402 1.00 71.23 C ATOM 326 O LEU A 23 -3.505 -3.882 -15.125 1.00 72.22 O ATOM 327 CB LEU A 23 -0.975 -3.755 -13.509 1.00 11.41 C ATOM 328 CG LEU A 23 -0.842 -5.033 -14.343 1.00 71.43 C ATOM 329 CD1 LEU A 23 0.616 -5.459 -14.443 1.00 34.42 C ATOM 330 CD2 LEU A 23 -1.685 -6.150 -13.747 1.00 61.33 C ATOM 0 H LEU A 23 -1.258 -1.510 -12.468 1.00 13.22 H new ATOM 0 HA LEU A 23 -1.249 -2.439 -15.190 1.00 74.43 H new ATOM 0 HB2 LEU A 23 0.022 -3.422 -13.220 1.00 11.41 H new ATOM 0 HB3 LEU A 23 -1.510 -3.993 -12.590 1.00 11.41 H new ATOM 0 HG LEU A 23 -1.208 -4.825 -15.349 1.00 71.43 H new ATOM 0 HD11 LEU A 23 0.689 -6.369 -15.039 1.00 34.42 H new ATOM 0 HD12 LEU A 23 1.195 -4.667 -14.917 1.00 34.42 H new ATOM 0 HD13 LEU A 23 1.009 -5.647 -13.444 1.00 34.42 H new ATOM 0 HD21 LEU A 23 -1.578 -7.050 -14.353 1.00 61.33 H new ATOM 0 HD22 LEU A 23 -1.350 -6.355 -12.730 1.00 61.33 H new ATOM 0 HD23 LEU A 23 -2.732 -5.847 -13.730 1.00 61.33 H new ATOM 342 N ILE A 24 -4.053 -2.184 -13.753 1.00 71.50 N ATOM 343 CA ILE A 24 -5.488 -2.419 -13.862 1.00 44.42 C ATOM 344 C ILE A 24 -6.138 -1.415 -14.813 1.00 52.31 C ATOM 345 O ILE A 24 -6.494 -1.754 -15.941 1.00 2.23 O ATOM 346 CB ILE A 24 -6.176 -2.341 -12.481 1.00 73.32 C ATOM 347 CG1 ILE A 24 -5.659 -3.456 -11.569 1.00 1.42 C ATOM 348 CG2 ILE A 24 -7.691 -2.428 -12.625 1.00 35.02 C ATOM 349 CD1 ILE A 24 -6.136 -4.836 -11.968 1.00 2.11 C ATOM 0 H ILE A 24 -3.798 -1.403 -13.149 1.00 71.50 H new ATOM 0 HA ILE A 24 -5.619 -3.424 -14.263 1.00 44.42 H new ATOM 0 HB ILE A 24 -5.934 -1.379 -12.029 1.00 73.32 H new ATOM 0 HG12 ILE A 24 -4.569 -3.442 -11.574 1.00 1.42 H new ATOM 0 HG13 ILE A 24 -5.976 -3.253 -10.546 1.00 1.42 H new ATOM 0 HG21 ILE A 24 -8.154 -2.371 -11.640 1.00 35.02 H new ATOM 0 HG22 ILE A 24 -8.046 -1.602 -13.241 1.00 35.02 H new ATOM 0 HG23 ILE A 24 -7.958 -3.373 -13.097 1.00 35.02 H new ATOM 0 HD11 ILE A 24 -5.730 -5.575 -11.277 1.00 2.11 H new ATOM 0 HD12 ILE A 24 -7.225 -4.868 -11.935 1.00 2.11 H new ATOM 0 HD13 ILE A 24 -5.797 -5.060 -12.979 1.00 2.11 H new ATOM 361 N GLN A 25 -6.295 -0.179 -14.348 1.00 22.34 N ATOM 362 CA GLN A 25 -6.907 0.870 -15.156 1.00 23.33 C ATOM 363 C GLN A 25 -5.852 1.667 -15.920 1.00 12.44 C ATOM 364 O GLN A 25 -6.152 2.294 -16.936 1.00 73.15 O ATOM 365 CB GLN A 25 -7.731 1.807 -14.271 1.00 64.03 C ATOM 366 CG GLN A 25 -8.974 1.153 -13.689 1.00 2.44 C ATOM 367 CD GLN A 25 -9.098 1.358 -12.192 1.00 71.41 C ATOM 368 OE1 GLN A 25 -8.486 2.263 -11.625 1.00 54.23 O ATOM 369 NE2 GLN A 25 -9.895 0.517 -11.545 1.00 33.03 N ATOM 0 H GLN A 25 -6.007 0.120 -13.416 1.00 22.34 H new ATOM 0 HA GLN A 25 -7.564 0.393 -15.883 1.00 23.33 H new ATOM 0 HB2 GLN A 25 -7.104 2.168 -13.456 1.00 64.03 H new ATOM 0 HB3 GLN A 25 -8.028 2.678 -14.855 1.00 64.03 H new ATOM 0 HG2 GLN A 25 -9.857 1.559 -14.181 1.00 2.44 H new ATOM 0 HG3 GLN A 25 -8.952 0.085 -13.904 1.00 2.44 H new ATOM 0 HE21 GLN A 25 -10.383 -0.219 -12.056 1.00 33.03 H new ATOM 0 HE22 GLN A 25 -10.020 0.606 -10.537 1.00 33.03 H new ATOM 378 N ASN A 26 -4.618 1.640 -15.426 1.00 2.34 N ATOM 379 CA ASN A 26 -3.522 2.362 -16.066 1.00 43.33 C ATOM 380 C ASN A 26 -3.757 3.869 -16.013 1.00 54.41 C ATOM 381 O ASN A 26 -3.265 4.612 -16.861 1.00 0.21 O ATOM 382 CB ASN A 26 -3.353 1.918 -17.524 1.00 45.40 C ATOM 383 CG ASN A 26 -3.797 0.485 -17.762 1.00 25.20 C ATOM 384 OD1 ASN A 26 -4.922 0.322 -18.450 1.00 71.03 O flip ATOM 385 ND2 ASN A 26 -3.137 -0.461 -17.335 1.00 72.44 N flip ATOM 0 H ASN A 26 -4.351 1.127 -14.586 1.00 2.34 H new ATOM 0 HA ASN A 26 -2.610 2.128 -15.517 1.00 43.33 H new ATOM 0 HB2 ASN A 26 -3.927 2.583 -18.170 1.00 45.40 H new ATOM 0 HB3 ASN A 26 -2.306 2.021 -17.811 1.00 45.40 H new ATOM 0 HD21 ASN A 26 -2.279 -0.289 -16.811 1.00 72.44 H new ATOM 0 HD22 ASN A 26 -3.448 -1.418 -17.505 1.00 72.44 H new ATOM 392 N HIS A 27 -4.507 4.314 -15.009 1.00 70.34 N ATOM 393 CA HIS A 27 -4.801 5.734 -14.847 1.00 20.35 C ATOM 394 C HIS A 27 -4.090 6.304 -13.618 1.00 24.22 C ATOM 395 O HIS A 27 -4.007 7.520 -13.447 1.00 4.15 O ATOM 396 CB HIS A 27 -6.318 5.956 -14.751 1.00 20.33 C ATOM 397 CG HIS A 27 -6.829 6.159 -13.354 1.00 10.14 C ATOM 398 ND1 HIS A 27 -6.784 5.179 -12.385 1.00 53.43 N ATOM 399 CD2 HIS A 27 -7.396 7.239 -12.766 1.00 22.02 C ATOM 400 CE1 HIS A 27 -7.300 5.648 -11.263 1.00 25.13 C ATOM 401 NE2 HIS A 27 -7.679 6.896 -11.468 1.00 34.22 N ATOM 0 H HIS A 27 -4.921 3.713 -14.297 1.00 70.34 H new ATOM 0 HA HIS A 27 -4.428 6.264 -15.724 1.00 20.35 H new ATOM 0 HB2 HIS A 27 -6.584 6.826 -15.352 1.00 20.33 H new ATOM 0 HB3 HIS A 27 -6.827 5.098 -15.190 1.00 20.33 H new ATOM 0 HD2 HIS A 27 -7.590 8.194 -13.232 1.00 22.02 H new ATOM 0 HE1 HIS A 27 -7.396 5.103 -10.335 1.00 25.13 H new ATOM 0 HE2 HIS A 27 -8.112 7.506 -10.774 1.00 34.22 H new ATOM 410 N PHE A 28 -3.581 5.418 -12.763 1.00 75.41 N ATOM 411 CA PHE A 28 -2.883 5.836 -11.553 1.00 34.30 C ATOM 412 C PHE A 28 -3.854 6.462 -10.560 1.00 23.24 C ATOM 413 O PHE A 28 -4.754 7.209 -10.945 1.00 15.00 O ATOM 414 CB PHE A 28 -1.769 6.828 -11.897 1.00 22.24 C ATOM 415 CG PHE A 28 -0.762 7.012 -10.797 1.00 41.54 C ATOM 416 CD1 PHE A 28 -0.221 5.917 -10.144 1.00 44.30 C ATOM 417 CD2 PHE A 28 -0.357 8.283 -10.419 1.00 4.33 C ATOM 418 CE1 PHE A 28 0.707 6.086 -9.133 1.00 15.04 C ATOM 419 CE2 PHE A 28 0.569 8.457 -9.409 1.00 12.43 C ATOM 420 CZ PHE A 28 1.102 7.357 -8.765 1.00 53.35 C ATOM 0 H PHE A 28 -3.640 4.407 -12.888 1.00 75.41 H new ATOM 0 HA PHE A 28 -2.439 4.953 -11.093 1.00 34.30 H new ATOM 0 HB2 PHE A 28 -1.254 6.486 -12.795 1.00 22.24 H new ATOM 0 HB3 PHE A 28 -2.215 7.794 -12.134 1.00 22.24 H new ATOM 0 HD1 PHE A 28 -0.527 4.921 -10.427 1.00 44.30 H new ATOM 0 HD2 PHE A 28 -0.770 9.146 -10.920 1.00 4.33 H new ATOM 0 HE1 PHE A 28 1.123 5.225 -8.631 1.00 15.04 H new ATOM 0 HE2 PHE A 28 0.876 9.452 -9.123 1.00 12.43 H new ATOM 0 HZ PHE A 28 1.826 7.491 -7.975 1.00 53.35 H new ATOM 430 N VAL A 29 -3.671 6.151 -9.280 1.00 71.22 N ATOM 431 CA VAL A 29 -4.535 6.682 -8.231 1.00 33.13 C ATOM 432 C VAL A 29 -4.644 8.203 -8.326 1.00 34.10 C ATOM 433 O VAL A 29 -3.699 8.880 -8.732 1.00 44.15 O ATOM 434 CB VAL A 29 -4.026 6.279 -6.829 1.00 31.02 C ATOM 435 CG1 VAL A 29 -4.629 7.159 -5.741 1.00 60.51 C ATOM 436 CG2 VAL A 29 -4.335 4.815 -6.562 1.00 15.13 C ATOM 0 H VAL A 29 -2.932 5.534 -8.944 1.00 71.22 H new ATOM 0 HA VAL A 29 -5.525 6.250 -8.378 1.00 33.13 H new ATOM 0 HB VAL A 29 -2.946 6.424 -6.808 1.00 31.02 H new ATOM 0 HG11 VAL A 29 -4.249 6.847 -4.768 1.00 60.51 H new ATOM 0 HG12 VAL A 29 -4.356 8.199 -5.921 1.00 60.51 H new ATOM 0 HG13 VAL A 29 -5.715 7.062 -5.754 1.00 60.51 H new ATOM 0 HG21 VAL A 29 -3.972 4.541 -5.571 1.00 15.13 H new ATOM 0 HG22 VAL A 29 -5.412 4.656 -6.611 1.00 15.13 H new ATOM 0 HG23 VAL A 29 -3.843 4.196 -7.312 1.00 15.13 H new ATOM 446 N ASP A 30 -5.805 8.729 -7.954 1.00 14.31 N ATOM 447 CA ASP A 30 -6.043 10.166 -7.998 1.00 12.11 C ATOM 448 C ASP A 30 -7.409 10.515 -7.409 1.00 61.24 C ATOM 449 O ASP A 30 -7.552 11.515 -6.706 1.00 20.35 O ATOM 450 CB ASP A 30 -5.949 10.671 -9.440 1.00 55.25 C ATOM 451 CG ASP A 30 -6.201 12.163 -9.552 1.00 62.34 C ATOM 452 OD1 ASP A 30 -5.558 12.931 -8.805 1.00 43.15 O ATOM 453 OD2 ASP A 30 -7.041 12.562 -10.385 1.00 71.22 O ATOM 0 H ASP A 30 -6.597 8.181 -7.618 1.00 14.31 H new ATOM 0 HA ASP A 30 -5.277 10.655 -7.396 1.00 12.11 H new ATOM 0 HB2 ASP A 30 -4.960 10.442 -9.838 1.00 55.25 H new ATOM 0 HB3 ASP A 30 -6.672 10.137 -10.056 1.00 55.25 H new ATOM 458 N GLU A 31 -8.409 9.687 -7.698 1.00 50.43 N ATOM 459 CA GLU A 31 -9.758 9.918 -7.192 1.00 52.14 C ATOM 460 C GLU A 31 -10.528 8.606 -7.055 1.00 73.42 C ATOM 461 O GLU A 31 -11.756 8.586 -7.140 1.00 52.45 O ATOM 462 CB GLU A 31 -10.518 10.875 -8.116 1.00 22.31 C ATOM 463 CG GLU A 31 -10.866 10.275 -9.470 1.00 61.53 C ATOM 464 CD GLU A 31 -10.662 11.250 -10.611 1.00 13.03 C ATOM 465 OE1 GLU A 31 -11.542 12.112 -10.821 1.00 74.20 O ATOM 466 OE2 GLU A 31 -9.622 11.153 -11.297 1.00 61.44 O ATOM 0 H GLU A 31 -8.311 8.853 -8.278 1.00 50.43 H new ATOM 0 HA GLU A 31 -9.671 10.369 -6.204 1.00 52.14 H new ATOM 0 HB2 GLU A 31 -11.437 11.189 -7.621 1.00 22.31 H new ATOM 0 HB3 GLU A 31 -9.916 11.771 -8.270 1.00 22.31 H new ATOM 0 HG2 GLU A 31 -10.252 9.390 -9.639 1.00 61.53 H new ATOM 0 HG3 GLU A 31 -11.905 9.945 -9.461 1.00 61.53 H new ATOM 473 N TYR A 32 -9.801 7.515 -6.839 1.00 41.53 N ATOM 474 CA TYR A 32 -10.422 6.203 -6.687 1.00 51.51 C ATOM 475 C TYR A 32 -11.344 6.177 -5.475 1.00 0.55 C ATOM 476 O TYR A 32 -11.331 7.092 -4.652 1.00 25.44 O ATOM 477 CB TYR A 32 -9.350 5.115 -6.560 1.00 24.40 C ATOM 478 CG TYR A 32 -8.653 5.094 -5.217 1.00 33.11 C ATOM 479 CD1 TYR A 32 -7.685 6.039 -4.901 1.00 54.44 C ATOM 480 CD2 TYR A 32 -8.964 4.130 -4.267 1.00 52.21 C ATOM 481 CE1 TYR A 32 -7.046 6.023 -3.675 1.00 2.35 C ATOM 482 CE2 TYR A 32 -8.330 4.108 -3.039 1.00 52.52 C ATOM 483 CZ TYR A 32 -7.373 5.055 -2.748 1.00 63.34 C ATOM 484 OH TYR A 32 -6.740 5.037 -1.527 1.00 11.21 O ATOM 0 H TYR A 32 -8.784 7.512 -6.765 1.00 41.53 H new ATOM 0 HA TYR A 32 -11.019 6.005 -7.577 1.00 51.51 H new ATOM 0 HB2 TYR A 32 -9.811 4.143 -6.734 1.00 24.40 H new ATOM 0 HB3 TYR A 32 -8.605 5.260 -7.343 1.00 24.40 H new ATOM 0 HD1 TYR A 32 -7.427 6.798 -5.625 1.00 54.44 H new ATOM 0 HD2 TYR A 32 -9.713 3.385 -4.491 1.00 52.21 H new ATOM 0 HE1 TYR A 32 -6.295 6.764 -3.444 1.00 2.35 H new ATOM 0 HE2 TYR A 32 -8.584 3.352 -2.311 1.00 52.52 H new ATOM 0 HH TYR A 32 -5.802 5.296 -1.641 1.00 11.21 H new ATOM 494 N ASP A 33 -12.141 5.122 -5.372 1.00 63.43 N ATOM 495 CA ASP A 33 -13.070 4.974 -4.261 1.00 51.14 C ATOM 496 C ASP A 33 -12.347 4.458 -3.017 1.00 50.32 C ATOM 497 O ASP A 33 -11.673 3.429 -3.067 1.00 71.32 O ATOM 498 CB ASP A 33 -14.202 4.018 -4.640 1.00 40.12 C ATOM 499 CG ASP A 33 -14.750 4.285 -6.029 1.00 22.32 C ATOM 500 OD1 ASP A 33 -15.533 5.247 -6.183 1.00 13.11 O ATOM 501 OD2 ASP A 33 -14.398 3.533 -6.961 1.00 75.14 O ATOM 0 H ASP A 33 -12.162 4.356 -6.045 1.00 63.43 H new ATOM 0 HA ASP A 33 -13.492 5.954 -4.037 1.00 51.14 H new ATOM 0 HB2 ASP A 33 -13.839 2.992 -4.588 1.00 40.12 H new ATOM 0 HB3 ASP A 33 -15.008 4.108 -3.912 1.00 40.12 H new ATOM 506 N PRO A 34 -12.476 5.165 -1.880 1.00 41.03 N ATOM 507 CA PRO A 34 -11.828 4.765 -0.627 1.00 54.11 C ATOM 508 C PRO A 34 -12.510 3.564 0.016 1.00 41.33 C ATOM 509 O PRO A 34 -11.868 2.758 0.691 1.00 14.41 O ATOM 510 CB PRO A 34 -11.976 6.003 0.256 1.00 71.14 C ATOM 511 CG PRO A 34 -13.209 6.674 -0.242 1.00 41.04 C ATOM 512 CD PRO A 34 -13.261 6.406 -1.724 1.00 2.14 C ATOM 0 HA PRO A 34 -10.794 4.456 -0.779 1.00 54.11 H new ATOM 0 HB2 PRO A 34 -12.070 5.731 1.307 1.00 71.14 H new ATOM 0 HB3 PRO A 34 -11.108 6.656 0.172 1.00 71.14 H new ATOM 0 HG2 PRO A 34 -14.095 6.281 0.256 1.00 41.04 H new ATOM 0 HG3 PRO A 34 -13.179 7.745 -0.040 1.00 41.04 H new ATOM 0 HD2 PRO A 34 -14.286 6.279 -2.073 1.00 2.14 H new ATOM 0 HD3 PRO A 34 -12.830 7.228 -2.295 1.00 2.14 H new ATOM 520 N SER A 35 -13.816 3.447 -0.200 1.00 74.13 N ATOM 521 CA SER A 35 -14.588 2.342 0.354 1.00 35.34 C ATOM 522 C SER A 35 -14.105 1.011 -0.207 1.00 34.23 C ATOM 523 O SER A 35 -13.111 0.956 -0.930 1.00 15.42 O ATOM 524 CB SER A 35 -16.075 2.530 0.048 1.00 70.31 C ATOM 525 OG SER A 35 -16.322 2.452 -1.345 1.00 70.24 O ATOM 0 H SER A 35 -14.362 4.105 -0.756 1.00 74.13 H new ATOM 0 HA SER A 35 -14.445 2.334 1.435 1.00 35.34 H new ATOM 0 HB2 SER A 35 -16.656 1.767 0.567 1.00 70.31 H new ATOM 0 HB3 SER A 35 -16.408 3.496 0.426 1.00 70.31 H new ATOM 0 HG SER A 35 -17.280 2.574 -1.515 1.00 70.24 H new ATOM 531 N ILE A 36 -14.817 -0.061 0.132 1.00 30.10 N ATOM 532 CA ILE A 36 -14.469 -1.399 -0.338 1.00 32.32 C ATOM 533 C ILE A 36 -12.978 -1.683 -0.167 1.00 25.25 C ATOM 534 O ILE A 36 -12.264 -0.933 0.499 1.00 4.52 O ATOM 535 CB ILE A 36 -14.876 -1.594 -1.817 1.00 34.34 C ATOM 536 CG1 ILE A 36 -13.932 -0.843 -2.763 1.00 53.33 C ATOM 537 CG2 ILE A 36 -16.307 -1.123 -2.028 1.00 61.44 C ATOM 538 CD1 ILE A 36 -13.975 -1.351 -4.187 1.00 44.30 C ATOM 0 H ILE A 36 -15.641 -0.028 0.732 1.00 30.10 H new ATOM 0 HA ILE A 36 -15.026 -2.108 0.275 1.00 32.32 H new ATOM 0 HB ILE A 36 -14.805 -2.657 -2.047 1.00 34.34 H new ATOM 0 HG12 ILE A 36 -14.190 0.216 -2.756 1.00 53.33 H new ATOM 0 HG13 ILE A 36 -12.912 -0.925 -2.387 1.00 53.33 H new ATOM 0 HG21 ILE A 36 -16.586 -1.264 -3.072 1.00 61.44 H new ATOM 0 HG22 ILE A 36 -16.978 -1.701 -1.392 1.00 61.44 H new ATOM 0 HG23 ILE A 36 -16.384 -0.067 -1.771 1.00 61.44 H new ATOM 0 HD11 ILE A 36 -13.283 -0.774 -4.800 1.00 44.30 H new ATOM 0 HD12 ILE A 36 -13.688 -2.402 -4.207 1.00 44.30 H new ATOM 0 HD13 ILE A 36 -14.985 -1.243 -4.581 1.00 44.30 H new ATOM 550 N GLU A 37 -12.513 -2.769 -0.777 1.00 45.12 N ATOM 551 CA GLU A 37 -11.109 -3.149 -0.695 1.00 61.24 C ATOM 552 C GLU A 37 -10.319 -2.546 -1.853 1.00 72.43 C ATOM 553 O GLU A 37 -10.865 -1.802 -2.667 1.00 10.01 O ATOM 554 CB GLU A 37 -10.970 -4.673 -0.698 1.00 1.32 C ATOM 555 CG GLU A 37 -10.550 -5.248 0.644 1.00 34.02 C ATOM 556 CD GLU A 37 -11.066 -6.657 0.862 1.00 74.00 C ATOM 557 OE1 GLU A 37 -12.104 -7.007 0.264 1.00 52.05 O ATOM 558 OE2 GLU A 37 -10.430 -7.409 1.631 1.00 33.22 O ATOM 0 H GLU A 37 -13.089 -3.401 -1.333 1.00 45.12 H new ATOM 0 HA GLU A 37 -10.703 -2.761 0.239 1.00 61.24 H new ATOM 0 HB2 GLU A 37 -11.922 -5.116 -0.992 1.00 1.32 H new ATOM 0 HB3 GLU A 37 -10.238 -4.961 -1.452 1.00 1.32 H new ATOM 0 HG2 GLU A 37 -9.462 -5.249 0.710 1.00 34.02 H new ATOM 0 HG3 GLU A 37 -10.917 -4.603 1.442 1.00 34.02 H new ATOM 565 N ASP A 38 -9.033 -2.872 -1.921 1.00 71.14 N ATOM 566 CA ASP A 38 -8.171 -2.362 -2.981 1.00 15.34 C ATOM 567 C ASP A 38 -7.712 -3.487 -3.903 1.00 64.13 C ATOM 568 O ASP A 38 -6.654 -3.400 -4.526 1.00 3.54 O ATOM 569 CB ASP A 38 -6.956 -1.656 -2.379 1.00 60.14 C ATOM 570 CG ASP A 38 -7.255 -0.223 -1.988 1.00 55.54 C ATOM 571 OD1 ASP A 38 -7.207 0.658 -2.873 1.00 43.02 O ATOM 572 OD2 ASP A 38 -7.538 0.020 -0.795 1.00 55.30 O ATOM 0 H ASP A 38 -8.565 -3.487 -1.255 1.00 71.14 H new ATOM 0 HA ASP A 38 -8.747 -1.648 -3.570 1.00 15.34 H new ATOM 0 HB2 ASP A 38 -6.618 -2.206 -1.501 1.00 60.14 H new ATOM 0 HB3 ASP A 38 -6.138 -1.670 -3.099 1.00 60.14 H new ATOM 577 N SER A 39 -8.514 -4.544 -3.984 1.00 62.24 N ATOM 578 CA SER A 39 -8.191 -5.686 -4.829 1.00 24.23 C ATOM 579 C SER A 39 -8.820 -5.539 -6.212 1.00 32.00 C ATOM 580 O SER A 39 -9.947 -5.062 -6.344 1.00 30.12 O ATOM 581 CB SER A 39 -8.670 -6.982 -4.173 1.00 72.44 C ATOM 582 OG SER A 39 -8.579 -8.074 -5.073 1.00 13.12 O ATOM 0 H SER A 39 -9.393 -4.632 -3.474 1.00 62.24 H new ATOM 0 HA SER A 39 -7.108 -5.724 -4.947 1.00 24.23 H new ATOM 0 HB2 SER A 39 -8.071 -7.187 -3.286 1.00 72.44 H new ATOM 0 HB3 SER A 39 -9.702 -6.865 -3.841 1.00 72.44 H new ATOM 0 HG SER A 39 -8.889 -8.891 -4.629 1.00 13.12 H new ATOM 588 N TYR A 40 -8.084 -5.954 -7.238 1.00 55.40 N ATOM 589 CA TYR A 40 -8.569 -5.869 -8.611 1.00 53.30 C ATOM 590 C TYR A 40 -8.223 -7.135 -9.388 1.00 22.31 C ATOM 591 O TYR A 40 -7.406 -7.944 -8.946 1.00 2.21 O ATOM 592 CB TYR A 40 -7.973 -4.647 -9.311 1.00 64.01 C ATOM 593 CG TYR A 40 -8.100 -3.369 -8.514 1.00 72.41 C ATOM 594 CD1 TYR A 40 -7.195 -3.065 -7.504 1.00 43.23 C ATOM 595 CD2 TYR A 40 -9.126 -2.468 -8.769 1.00 10.21 C ATOM 596 CE1 TYR A 40 -7.308 -1.898 -6.772 1.00 22.51 C ATOM 597 CE2 TYR A 40 -9.246 -1.300 -8.041 1.00 31.33 C ATOM 598 CZ TYR A 40 -8.335 -1.019 -7.044 1.00 15.31 C ATOM 599 OH TYR A 40 -8.453 0.143 -6.316 1.00 72.13 O ATOM 0 H TYR A 40 -7.150 -6.352 -7.145 1.00 55.40 H new ATOM 0 HA TYR A 40 -9.654 -5.767 -8.581 1.00 53.30 H new ATOM 0 HB2 TYR A 40 -6.919 -4.834 -9.515 1.00 64.01 H new ATOM 0 HB3 TYR A 40 -8.466 -4.515 -10.274 1.00 64.01 H new ATOM 0 HD1 TYR A 40 -6.390 -3.752 -7.288 1.00 43.23 H new ATOM 0 HD2 TYR A 40 -9.841 -2.684 -9.549 1.00 10.21 H new ATOM 0 HE1 TYR A 40 -6.596 -1.676 -5.991 1.00 22.51 H new ATOM 0 HE2 TYR A 40 -10.050 -0.610 -8.252 1.00 31.33 H new ATOM 0 HH TYR A 40 -9.228 0.651 -6.634 1.00 72.13 H new ATOM 609 N ARG A 41 -8.849 -7.301 -10.549 1.00 34.44 N ATOM 610 CA ARG A 41 -8.608 -8.469 -11.388 1.00 11.05 C ATOM 611 C ARG A 41 -8.212 -8.051 -12.801 1.00 70.32 C ATOM 612 O ARG A 41 -8.842 -7.179 -13.400 1.00 64.25 O ATOM 613 CB ARG A 41 -9.853 -9.355 -11.435 1.00 1.31 C ATOM 614 CG ARG A 41 -9.968 -10.308 -10.256 1.00 60.32 C ATOM 615 CD ARG A 41 -11.408 -10.736 -10.022 1.00 53.22 C ATOM 616 NE ARG A 41 -11.677 -12.067 -10.561 1.00 73.54 N ATOM 617 CZ ARG A 41 -12.899 -12.532 -10.811 1.00 31.32 C ATOM 618 NH1 ARG A 41 -13.965 -11.779 -10.571 1.00 52.14 N ATOM 619 NH2 ARG A 41 -13.055 -13.754 -11.303 1.00 62.45 N ATOM 0 H ARG A 41 -9.527 -6.641 -10.930 1.00 34.44 H new ATOM 0 HA ARG A 41 -7.785 -9.035 -10.952 1.00 11.05 H new ATOM 0 HB2 ARG A 41 -10.739 -8.721 -11.466 1.00 1.31 H new ATOM 0 HB3 ARG A 41 -9.842 -9.933 -12.359 1.00 1.31 H new ATOM 0 HG2 ARG A 41 -9.351 -11.188 -10.437 1.00 60.32 H new ATOM 0 HG3 ARG A 41 -9.580 -9.826 -9.358 1.00 60.32 H new ATOM 0 HD2 ARG A 41 -11.619 -10.728 -8.953 1.00 53.22 H new ATOM 0 HD3 ARG A 41 -12.081 -10.014 -10.485 1.00 53.22 H new ATOM 0 HE ARG A 41 -10.882 -12.675 -10.757 1.00 73.54 H new ATOM 0 HH11 ARG A 41 -13.850 -10.839 -10.193 1.00 52.14 H new ATOM 0 HH12 ARG A 41 -14.899 -12.141 -10.765 1.00 52.14 H new ATOM 0 HH21 ARG A 41 -12.239 -14.337 -11.489 1.00 62.45 H new ATOM 0 HH22 ARG A 41 -13.991 -14.111 -11.495 1.00 62.45 H new ATOM 633 N LYS A 42 -7.166 -8.681 -13.328 1.00 40.45 N ATOM 634 CA LYS A 42 -6.687 -8.376 -14.671 1.00 14.41 C ATOM 635 C LYS A 42 -6.408 -9.654 -15.454 1.00 12.43 C ATOM 636 O LYS A 42 -5.756 -10.571 -14.955 1.00 61.42 O ATOM 637 CB LYS A 42 -5.420 -7.521 -14.600 1.00 2.34 C ATOM 638 CG LYS A 42 -4.952 -7.013 -15.954 1.00 25.12 C ATOM 639 CD LYS A 42 -5.768 -5.813 -16.410 1.00 21.14 C ATOM 640 CE LYS A 42 -5.144 -5.142 -17.625 1.00 23.13 C ATOM 641 NZ LYS A 42 -6.034 -5.215 -18.817 1.00 40.33 N ATOM 0 H LYS A 42 -6.635 -9.405 -12.845 1.00 40.45 H new ATOM 0 HA LYS A 42 -7.467 -7.818 -15.189 1.00 14.41 H new ATOM 0 HB2 LYS A 42 -5.603 -6.669 -13.945 1.00 2.34 H new ATOM 0 HB3 LYS A 42 -4.621 -8.107 -14.145 1.00 2.34 H new ATOM 0 HG2 LYS A 42 -3.899 -6.738 -15.897 1.00 25.12 H new ATOM 0 HG3 LYS A 42 -5.033 -7.811 -16.692 1.00 25.12 H new ATOM 0 HD2 LYS A 42 -6.782 -6.132 -16.650 1.00 21.14 H new ATOM 0 HD3 LYS A 42 -5.845 -5.093 -15.595 1.00 21.14 H new ATOM 0 HE2 LYS A 42 -4.931 -4.098 -17.394 1.00 23.13 H new ATOM 0 HE3 LYS A 42 -4.191 -5.619 -17.854 1.00 23.13 H new ATOM 0 HZ1 LYS A 42 -5.573 -4.747 -19.623 1.00 40.33 H new ATOM 0 HZ2 LYS A 42 -6.217 -6.211 -19.053 1.00 40.33 H new ATOM 0 HZ3 LYS A 42 -6.934 -4.738 -18.608 1.00 40.33 H new ATOM 655 N GLN A 43 -6.907 -9.707 -16.685 1.00 4.52 N ATOM 656 CA GLN A 43 -6.711 -10.873 -17.539 1.00 15.23 C ATOM 657 C GLN A 43 -5.502 -10.682 -18.449 1.00 41.43 C ATOM 658 O GLN A 43 -5.444 -9.732 -19.230 1.00 1.23 O ATOM 659 CB GLN A 43 -7.962 -11.130 -18.381 1.00 13.53 C ATOM 660 CG GLN A 43 -8.042 -12.542 -18.939 1.00 14.10 C ATOM 661 CD GLN A 43 -8.574 -12.578 -20.358 1.00 23.14 C ATOM 662 OE1 GLN A 43 -7.790 -13.145 -21.268 1.00 60.40 O flip ATOM 663 NE2 GLN A 43 -9.675 -12.102 -20.634 1.00 1.44 N flip ATOM 0 H GLN A 43 -7.450 -8.957 -17.113 1.00 4.52 H new ATOM 0 HA GLN A 43 -6.529 -11.736 -16.899 1.00 15.23 H new ATOM 0 HB2 GLN A 43 -8.845 -10.939 -17.772 1.00 13.53 H new ATOM 0 HB3 GLN A 43 -7.985 -10.420 -19.208 1.00 13.53 H new ATOM 0 HG2 GLN A 43 -7.051 -12.995 -18.915 1.00 14.10 H new ATOM 0 HG3 GLN A 43 -8.684 -13.146 -18.298 1.00 14.10 H new ATOM 0 HE21 GLN A 43 -10.244 -11.676 -19.903 1.00 1.44 H new ATOM 0 HE22 GLN A 43 -10.018 -12.134 -21.594 1.00 1.44 H new ATOM 672 N VAL A 44 -4.535 -11.588 -18.342 1.00 44.25 N ATOM 673 CA VAL A 44 -3.328 -11.515 -19.155 1.00 32.50 C ATOM 674 C VAL A 44 -2.842 -12.906 -19.552 1.00 43.41 C ATOM 675 O VAL A 44 -3.483 -13.911 -19.241 1.00 62.43 O ATOM 676 CB VAL A 44 -2.196 -10.775 -18.411 1.00 22.40 C ATOM 677 CG1 VAL A 44 -2.649 -9.381 -18.004 1.00 65.33 C ATOM 678 CG2 VAL A 44 -1.738 -11.569 -17.196 1.00 2.22 C ATOM 0 H VAL A 44 -4.565 -12.380 -17.700 1.00 44.25 H new ATOM 0 HA VAL A 44 -3.586 -10.958 -20.056 1.00 32.50 H new ATOM 0 HB VAL A 44 -1.348 -10.677 -19.089 1.00 22.40 H new ATOM 0 HG11 VAL A 44 -1.839 -8.873 -17.481 1.00 65.33 H new ATOM 0 HG12 VAL A 44 -2.919 -8.812 -18.894 1.00 65.33 H new ATOM 0 HG13 VAL A 44 -3.514 -9.457 -17.346 1.00 65.33 H new ATOM 0 HG21 VAL A 44 -0.940 -11.028 -16.688 1.00 2.22 H new ATOM 0 HG22 VAL A 44 -2.577 -11.705 -16.513 1.00 2.22 H new ATOM 0 HG23 VAL A 44 -1.369 -12.543 -17.516 1.00 2.22 H new ATOM 688 N VAL A 45 -1.705 -12.957 -20.238 1.00 50.34 N ATOM 689 CA VAL A 45 -1.130 -14.222 -20.677 1.00 22.34 C ATOM 690 C VAL A 45 0.301 -14.379 -20.172 1.00 61.23 C ATOM 691 O VAL A 45 1.165 -13.549 -20.455 1.00 22.32 O ATOM 692 CB VAL A 45 -1.145 -14.347 -22.211 1.00 31.53 C ATOM 693 CG1 VAL A 45 -0.314 -13.242 -22.840 1.00 51.24 C ATOM 694 CG2 VAL A 45 -0.645 -15.718 -22.644 1.00 71.33 C ATOM 0 H VAL A 45 -1.163 -12.134 -20.502 1.00 50.34 H new ATOM 0 HA VAL A 45 -1.748 -15.014 -20.255 1.00 22.34 H new ATOM 0 HB VAL A 45 -2.173 -14.240 -22.557 1.00 31.53 H new ATOM 0 HG11 VAL A 45 -0.334 -13.344 -23.925 1.00 51.24 H new ATOM 0 HG12 VAL A 45 -0.725 -12.273 -22.559 1.00 51.24 H new ATOM 0 HG13 VAL A 45 0.715 -13.315 -22.488 1.00 51.24 H new ATOM 0 HG21 VAL A 45 -0.664 -15.785 -23.732 1.00 71.33 H new ATOM 0 HG22 VAL A 45 0.375 -15.862 -22.289 1.00 71.33 H new ATOM 0 HG23 VAL A 45 -1.288 -16.490 -22.222 1.00 71.33 H new ATOM 704 N ILE A 46 0.543 -15.448 -19.419 1.00 50.15 N ATOM 705 CA ILE A 46 1.868 -15.713 -18.870 1.00 74.25 C ATOM 706 C ILE A 46 2.581 -16.809 -19.656 1.00 52.51 C ATOM 707 O ILE A 46 2.239 -17.987 -19.546 1.00 14.24 O ATOM 708 CB ILE A 46 1.786 -16.130 -17.390 1.00 64.43 C ATOM 709 CG1 ILE A 46 0.877 -15.171 -16.616 1.00 44.43 C ATOM 710 CG2 ILE A 46 3.175 -16.175 -16.770 1.00 53.31 C ATOM 711 CD1 ILE A 46 1.486 -13.804 -16.389 1.00 11.51 C ATOM 0 H ILE A 46 -0.161 -16.144 -19.175 1.00 50.15 H new ATOM 0 HA ILE A 46 2.436 -14.786 -18.950 1.00 74.25 H new ATOM 0 HB ILE A 46 1.357 -17.130 -17.334 1.00 64.43 H new ATOM 0 HG12 ILE A 46 -0.061 -15.055 -17.160 1.00 44.43 H new ATOM 0 HG13 ILE A 46 0.633 -15.615 -15.651 1.00 44.43 H new ATOM 0 HG21 ILE A 46 3.097 -16.472 -15.724 1.00 53.31 H new ATOM 0 HG22 ILE A 46 3.790 -16.897 -17.307 1.00 53.31 H new ATOM 0 HG23 ILE A 46 3.634 -15.189 -16.834 1.00 53.31 H new ATOM 0 HD11 ILE A 46 0.784 -13.181 -15.835 1.00 11.51 H new ATOM 0 HD12 ILE A 46 2.409 -13.907 -15.818 1.00 11.51 H new ATOM 0 HD13 ILE A 46 1.704 -13.339 -17.350 1.00 11.51 H new ATOM 723 N ASP A 47 3.571 -16.414 -20.450 1.00 62.42 N ATOM 724 CA ASP A 47 4.332 -17.364 -21.255 1.00 71.51 C ATOM 725 C ASP A 47 3.417 -18.115 -22.216 1.00 30.33 C ATOM 726 O ASP A 47 3.597 -19.309 -22.456 1.00 32.20 O ATOM 727 CB ASP A 47 5.068 -18.354 -20.353 1.00 53.11 C ATOM 728 CG ASP A 47 6.290 -18.951 -21.025 1.00 51.44 C ATOM 729 OD1 ASP A 47 7.361 -18.310 -20.985 1.00 75.13 O ATOM 730 OD2 ASP A 47 6.175 -20.058 -21.590 1.00 25.40 O ATOM 0 H ASP A 47 3.865 -15.443 -20.554 1.00 62.42 H new ATOM 0 HA ASP A 47 5.063 -16.805 -21.839 1.00 71.51 H new ATOM 0 HB2 ASP A 47 5.371 -17.849 -19.436 1.00 53.11 H new ATOM 0 HB3 ASP A 47 4.387 -19.155 -20.066 1.00 53.11 H new ATOM 735 N GLY A 48 2.434 -17.409 -22.763 1.00 24.12 N ATOM 736 CA GLY A 48 1.503 -18.023 -23.691 1.00 62.21 C ATOM 737 C GLY A 48 0.394 -18.782 -22.986 1.00 21.13 C ATOM 738 O GLY A 48 -0.244 -19.653 -23.580 1.00 44.21 O ATOM 0 H GLY A 48 2.265 -16.420 -22.580 1.00 24.12 H new ATOM 0 HA2 GLY A 48 1.065 -17.252 -24.325 1.00 62.21 H new ATOM 0 HA3 GLY A 48 2.045 -18.704 -24.347 1.00 62.21 H new ATOM 742 N GLU A 49 0.161 -18.452 -21.720 1.00 34.32 N ATOM 743 CA GLU A 49 -0.881 -19.109 -20.938 1.00 13.50 C ATOM 744 C GLU A 49 -1.833 -18.082 -20.334 1.00 64.14 C ATOM 745 O GLU A 49 -1.522 -17.448 -19.326 1.00 50.23 O ATOM 746 CB GLU A 49 -0.256 -19.957 -19.828 1.00 63.00 C ATOM 747 CG GLU A 49 -1.278 -20.711 -18.992 1.00 51.04 C ATOM 748 CD GLU A 49 -0.632 -21.662 -18.003 1.00 14.25 C ATOM 749 OE1 GLU A 49 0.025 -21.178 -17.057 1.00 74.04 O ATOM 750 OE2 GLU A 49 -0.784 -22.889 -18.175 1.00 4.33 O ATOM 0 H GLU A 49 0.679 -17.734 -21.214 1.00 34.32 H new ATOM 0 HA GLU A 49 -1.449 -19.758 -21.605 1.00 13.50 H new ATOM 0 HB2 GLU A 49 0.436 -20.672 -20.274 1.00 63.00 H new ATOM 0 HB3 GLU A 49 0.330 -19.311 -19.175 1.00 63.00 H new ATOM 0 HG2 GLU A 49 -1.899 -19.996 -18.451 1.00 51.04 H new ATOM 0 HG3 GLU A 49 -1.939 -21.272 -19.652 1.00 51.04 H new ATOM 757 N THR A 50 -2.996 -17.923 -20.959 1.00 5.43 N ATOM 758 CA THR A 50 -3.995 -16.973 -20.486 1.00 71.01 C ATOM 759 C THR A 50 -4.453 -17.318 -19.073 1.00 34.43 C ATOM 760 O THR A 50 -4.882 -18.439 -18.804 1.00 34.34 O ATOM 761 CB THR A 50 -5.197 -16.952 -21.432 1.00 22.12 C ATOM 762 OG1 THR A 50 -4.796 -16.598 -22.744 1.00 52.41 O ATOM 763 CG2 THR A 50 -6.280 -15.984 -21.007 1.00 11.12 C ATOM 0 H THR A 50 -3.269 -18.441 -21.795 1.00 5.43 H new ATOM 0 HA THR A 50 -3.537 -15.984 -20.467 1.00 71.01 H new ATOM 0 HB THR A 50 -5.605 -17.962 -21.401 1.00 22.12 H new ATOM 0 HG1 THR A 50 -5.578 -16.592 -23.335 1.00 52.41 H new ATOM 0 HG21 THR A 50 -7.102 -16.020 -21.722 1.00 11.12 H new ATOM 0 HG22 THR A 50 -6.647 -16.260 -20.018 1.00 11.12 H new ATOM 0 HG23 THR A 50 -5.872 -14.974 -20.974 1.00 11.12 H new ATOM 771 N CYS A 51 -4.363 -16.341 -18.175 1.00 41.34 N ATOM 772 CA CYS A 51 -4.773 -16.536 -16.788 1.00 53.42 C ATOM 773 C CYS A 51 -5.091 -15.200 -16.125 1.00 40.10 C ATOM 774 O CYS A 51 -4.527 -14.167 -16.485 1.00 11.54 O ATOM 775 CB CYS A 51 -3.677 -17.259 -16.003 1.00 44.44 C ATOM 776 SG CYS A 51 -3.681 -19.055 -16.210 1.00 74.21 S ATOM 0 H CYS A 51 -4.010 -15.407 -18.383 1.00 41.34 H new ATOM 0 HA CYS A 51 -5.674 -17.149 -16.785 1.00 53.42 H new ATOM 0 HB2 CYS A 51 -2.707 -16.871 -16.313 1.00 44.44 H new ATOM 0 HB3 CYS A 51 -3.790 -17.026 -14.944 1.00 44.44 H new ATOM 0 HG CYS A 51 -4.151 -19.355 -17.384 1.00 74.21 H new ATOM 782 N LEU A 52 -5.996 -15.231 -15.155 1.00 21.43 N ATOM 783 CA LEU A 52 -6.390 -14.024 -14.438 1.00 44.10 C ATOM 784 C LEU A 52 -5.345 -13.651 -13.392 1.00 1.22 C ATOM 785 O LEU A 52 -4.635 -14.513 -12.874 1.00 34.10 O ATOM 786 CB LEU A 52 -7.754 -14.225 -13.772 1.00 31.31 C ATOM 787 CG LEU A 52 -8.779 -13.124 -14.046 1.00 75.43 C ATOM 788 CD1 LEU A 52 -9.206 -13.142 -15.506 1.00 31.25 C ATOM 789 CD2 LEU A 52 -9.985 -13.283 -13.134 1.00 34.14 C ATOM 0 H LEU A 52 -6.471 -16.079 -14.846 1.00 21.43 H new ATOM 0 HA LEU A 52 -6.464 -13.208 -15.157 1.00 44.10 H new ATOM 0 HB2 LEU A 52 -8.168 -15.176 -14.107 1.00 31.31 H new ATOM 0 HB3 LEU A 52 -7.607 -14.303 -12.695 1.00 31.31 H new ATOM 0 HG LEU A 52 -8.314 -12.160 -13.838 1.00 75.43 H new ATOM 0 HD11 LEU A 52 -9.936 -12.351 -15.681 1.00 31.25 H new ATOM 0 HD12 LEU A 52 -8.336 -12.980 -16.142 1.00 31.25 H new ATOM 0 HD13 LEU A 52 -9.653 -14.107 -15.742 1.00 31.25 H new ATOM 0 HD21 LEU A 52 -10.705 -12.492 -13.342 1.00 34.14 H new ATOM 0 HD22 LEU A 52 -10.450 -14.253 -13.312 1.00 34.14 H new ATOM 0 HD23 LEU A 52 -9.666 -13.219 -12.094 1.00 34.14 H new ATOM 801 N LEU A 53 -5.255 -12.360 -13.087 1.00 24.34 N ATOM 802 CA LEU A 53 -4.296 -11.873 -12.104 1.00 30.34 C ATOM 803 C LEU A 53 -4.996 -11.075 -11.009 1.00 62.41 C ATOM 804 O LEU A 53 -5.128 -9.855 -11.103 1.00 14.11 O ATOM 805 CB LEU A 53 -3.234 -11.005 -12.783 1.00 23.12 C ATOM 806 CG LEU A 53 -2.197 -11.773 -13.604 1.00 34.42 C ATOM 807 CD1 LEU A 53 -1.141 -10.825 -14.151 1.00 65.21 C ATOM 808 CD2 LEU A 53 -1.551 -12.863 -12.761 1.00 61.34 C ATOM 0 H LEU A 53 -5.835 -11.633 -13.507 1.00 24.34 H new ATOM 0 HA LEU A 53 -3.813 -12.736 -11.647 1.00 30.34 H new ATOM 0 HB2 LEU A 53 -3.734 -10.290 -13.436 1.00 23.12 H new ATOM 0 HB3 LEU A 53 -2.714 -10.429 -12.018 1.00 23.12 H new ATOM 0 HG LEU A 53 -2.705 -12.244 -14.446 1.00 34.42 H new ATOM 0 HD11 LEU A 53 -0.412 -11.389 -14.732 1.00 65.21 H new ATOM 0 HD12 LEU A 53 -1.616 -10.080 -14.789 1.00 65.21 H new ATOM 0 HD13 LEU A 53 -0.637 -10.325 -13.324 1.00 65.21 H new ATOM 0 HD21 LEU A 53 -0.816 -13.399 -13.361 1.00 61.34 H new ATOM 0 HD22 LEU A 53 -1.057 -12.413 -11.900 1.00 61.34 H new ATOM 0 HD23 LEU A 53 -2.316 -13.559 -12.418 1.00 61.34 H new ATOM 820 N ASP A 54 -5.443 -11.774 -9.970 1.00 52.53 N ATOM 821 CA ASP A 54 -6.131 -11.132 -8.855 1.00 1.41 C ATOM 822 C ASP A 54 -5.140 -10.399 -7.956 1.00 53.52 C ATOM 823 O ASP A 54 -4.500 -11.006 -7.097 1.00 53.24 O ATOM 824 CB ASP A 54 -6.907 -12.172 -8.044 1.00 51.14 C ATOM 825 CG ASP A 54 -8.406 -11.952 -8.105 1.00 50.13 C ATOM 826 OD1 ASP A 54 -8.895 -11.002 -7.456 1.00 42.35 O ATOM 827 OD2 ASP A 54 -9.092 -12.728 -8.802 1.00 33.14 O ATOM 0 H ASP A 54 -5.341 -12.785 -9.877 1.00 52.53 H new ATOM 0 HA ASP A 54 -6.832 -10.402 -9.260 1.00 1.41 H new ATOM 0 HB2 ASP A 54 -6.673 -13.169 -8.418 1.00 51.14 H new ATOM 0 HB3 ASP A 54 -6.579 -12.137 -7.005 1.00 51.14 H new ATOM 832 N ILE A 55 -5.020 -9.092 -8.159 1.00 23.20 N ATOM 833 CA ILE A 55 -4.108 -8.277 -7.366 1.00 34.23 C ATOM 834 C ILE A 55 -4.794 -7.751 -6.110 1.00 41.52 C ATOM 835 O ILE A 55 -5.652 -6.870 -6.181 1.00 4.20 O ATOM 836 CB ILE A 55 -3.567 -7.084 -8.178 1.00 63.23 C ATOM 837 CG1 ILE A 55 -3.095 -7.549 -9.557 1.00 4.12 C ATOM 838 CG2 ILE A 55 -2.435 -6.402 -7.425 1.00 70.51 C ATOM 839 CD1 ILE A 55 -2.034 -8.626 -9.502 1.00 35.03 C ATOM 0 H ILE A 55 -5.543 -8.574 -8.866 1.00 23.20 H new ATOM 0 HA ILE A 55 -3.275 -8.921 -7.082 1.00 34.23 H new ATOM 0 HB ILE A 55 -4.372 -6.362 -8.316 1.00 63.23 H new ATOM 0 HG12 ILE A 55 -3.952 -7.923 -10.118 1.00 4.12 H new ATOM 0 HG13 ILE A 55 -2.703 -6.692 -10.106 1.00 4.12 H new ATOM 0 HG21 ILE A 55 -2.063 -5.561 -8.011 1.00 70.51 H new ATOM 0 HG22 ILE A 55 -2.803 -6.041 -6.465 1.00 70.51 H new ATOM 0 HG23 ILE A 55 -1.627 -7.115 -7.259 1.00 70.51 H new ATOM 0 HD11 ILE A 55 -1.747 -8.907 -10.516 1.00 35.03 H new ATOM 0 HD12 ILE A 55 -1.161 -8.250 -8.969 1.00 35.03 H new ATOM 0 HD13 ILE A 55 -2.428 -9.499 -8.982 1.00 35.03 H new ATOM 851 N LEU A 56 -4.410 -8.295 -4.960 1.00 25.15 N ATOM 852 CA LEU A 56 -4.988 -7.880 -3.688 1.00 32.45 C ATOM 853 C LEU A 56 -4.054 -6.921 -2.956 1.00 52.34 C ATOM 854 O LEU A 56 -2.888 -7.234 -2.715 1.00 54.25 O ATOM 855 CB LEU A 56 -5.280 -9.107 -2.815 1.00 53.32 C ATOM 856 CG LEU A 56 -5.550 -8.811 -1.338 1.00 11.51 C ATOM 857 CD1 LEU A 56 -6.531 -9.818 -0.760 1.00 55.41 C ATOM 858 CD2 LEU A 56 -4.248 -8.821 -0.552 1.00 33.12 C ATOM 0 H LEU A 56 -3.701 -9.024 -4.883 1.00 25.15 H new ATOM 0 HA LEU A 56 -5.924 -7.359 -3.889 1.00 32.45 H new ATOM 0 HB2 LEU A 56 -6.144 -9.628 -3.228 1.00 53.32 H new ATOM 0 HB3 LEU A 56 -4.433 -9.790 -2.883 1.00 53.32 H new ATOM 0 HG LEU A 56 -5.995 -7.819 -1.260 1.00 11.51 H new ATOM 0 HD11 LEU A 56 -6.710 -9.590 0.291 1.00 55.41 H new ATOM 0 HD12 LEU A 56 -7.472 -9.765 -1.308 1.00 55.41 H new ATOM 0 HD13 LEU A 56 -6.116 -10.822 -0.848 1.00 55.41 H new ATOM 0 HD21 LEU A 56 -4.455 -8.609 0.497 1.00 33.12 H new ATOM 0 HD22 LEU A 56 -3.778 -9.801 -0.639 1.00 33.12 H new ATOM 0 HD23 LEU A 56 -3.577 -8.060 -0.950 1.00 33.12 H new ATOM 870 N ASP A 57 -4.577 -5.751 -2.603 1.00 23.41 N ATOM 871 CA ASP A 57 -3.796 -4.743 -1.896 1.00 32.34 C ATOM 872 C ASP A 57 -4.361 -4.504 -0.500 1.00 73.43 C ATOM 873 O ASP A 57 -5.385 -3.840 -0.339 1.00 61.14 O ATOM 874 CB ASP A 57 -3.779 -3.433 -2.684 1.00 0.03 C ATOM 875 CG ASP A 57 -2.909 -2.376 -2.033 1.00 1.44 C ATOM 876 OD1 ASP A 57 -1.695 -2.342 -2.325 1.00 11.41 O ATOM 877 OD2 ASP A 57 -3.443 -1.581 -1.230 1.00 53.14 O ATOM 0 H ASP A 57 -5.541 -5.478 -2.796 1.00 23.41 H new ATOM 0 HA ASP A 57 -2.774 -5.111 -1.799 1.00 32.34 H new ATOM 0 HB2 ASP A 57 -3.418 -3.625 -3.694 1.00 0.03 H new ATOM 0 HB3 ASP A 57 -4.797 -3.055 -2.776 1.00 0.03 H new ATOM 882 N THR A 58 -3.690 -5.052 0.508 1.00 34.12 N ATOM 883 CA THR A 58 -4.128 -4.900 1.890 1.00 64.12 C ATOM 884 C THR A 58 -3.807 -3.502 2.410 1.00 3.52 C ATOM 885 O THR A 58 -3.087 -2.740 1.764 1.00 52.11 O ATOM 886 CB THR A 58 -3.461 -5.953 2.780 1.00 72.11 C ATOM 887 OG1 THR A 58 -2.139 -5.567 3.109 1.00 4.11 O ATOM 888 CG2 THR A 58 -3.395 -7.324 2.142 1.00 33.10 C ATOM 0 H THR A 58 -2.841 -5.605 0.393 1.00 34.12 H new ATOM 0 HA THR A 58 -5.208 -5.042 1.920 1.00 64.12 H new ATOM 0 HB THR A 58 -4.087 -6.016 3.670 1.00 72.11 H new ATOM 0 HG1 THR A 58 -1.731 -6.252 3.679 1.00 4.11 H new ATOM 0 HG21 THR A 58 -2.911 -8.021 2.826 1.00 33.10 H new ATOM 0 HG22 THR A 58 -4.404 -7.672 1.923 1.00 33.10 H new ATOM 0 HG23 THR A 58 -2.822 -7.267 1.216 1.00 33.10 H new ATOM 896 N ALA A 59 -4.346 -3.173 3.579 1.00 43.42 N ATOM 897 CA ALA A 59 -4.118 -1.866 4.184 1.00 4.23 C ATOM 898 C ALA A 59 -2.631 -1.616 4.410 1.00 13.32 C ATOM 899 O ALA A 59 -1.842 -2.554 4.522 1.00 52.32 O ATOM 900 CB ALA A 59 -4.877 -1.754 5.496 1.00 23.34 C ATOM 0 H ALA A 59 -4.943 -3.793 4.126 1.00 43.42 H new ATOM 0 HA ALA A 59 -4.487 -1.106 3.495 1.00 4.23 H new ATOM 0 HB1 ALA A 59 -4.698 -0.773 5.937 1.00 23.34 H new ATOM 0 HB2 ALA A 59 -5.944 -1.880 5.311 1.00 23.34 H new ATOM 0 HB3 ALA A 59 -4.534 -2.529 6.182 1.00 23.34 H new ATOM 906 N GLY A 60 -2.256 -0.342 4.481 1.00 64.32 N ATOM 907 CA GLY A 60 -0.866 0.011 4.697 1.00 14.21 C ATOM 908 C GLY A 60 -0.636 0.649 6.053 1.00 60.02 C ATOM 909 O GLY A 60 0.438 0.509 6.637 1.00 64.24 O ATOM 0 H GLY A 60 -2.891 0.451 4.393 1.00 64.32 H new ATOM 0 HA2 GLY A 60 -0.249 -0.883 4.610 1.00 14.21 H new ATOM 0 HA3 GLY A 60 -0.543 0.699 3.915 1.00 14.21 H new ATOM 913 N GLN A 61 -1.648 1.349 6.555 1.00 42.43 N ATOM 914 CA GLN A 61 -1.554 2.010 7.851 1.00 53.43 C ATOM 915 C GLN A 61 -2.533 1.401 8.854 1.00 54.05 C ATOM 916 O GLN A 61 -2.792 1.978 9.909 1.00 23.33 O ATOM 917 CB GLN A 61 -1.827 3.507 7.701 1.00 32.33 C ATOM 918 CG GLN A 61 -3.040 3.819 6.840 1.00 3.44 C ATOM 919 CD GLN A 61 -3.286 5.308 6.697 1.00 3.22 C ATOM 920 OE1 GLN A 61 -4.212 5.858 7.294 1.00 23.23 O ATOM 921 NE2 GLN A 61 -2.454 5.971 5.901 1.00 44.34 N ATOM 0 H GLN A 61 -2.544 1.473 6.083 1.00 42.43 H new ATOM 0 HA GLN A 61 -0.542 1.864 8.230 1.00 53.43 H new ATOM 0 HB2 GLN A 61 -1.971 3.943 8.690 1.00 32.33 H new ATOM 0 HB3 GLN A 61 -0.950 3.986 7.266 1.00 32.33 H new ATOM 0 HG2 GLN A 61 -2.902 3.381 5.852 1.00 3.44 H new ATOM 0 HG3 GLN A 61 -3.921 3.349 7.277 1.00 3.44 H new ATOM 0 HE21 GLN A 61 -1.700 5.476 5.425 1.00 44.34 H new ATOM 0 HE22 GLN A 61 -2.569 6.975 5.766 1.00 44.34 H new ATOM 930 N GLU A 62 -3.075 0.232 8.519 1.00 51.21 N ATOM 931 CA GLU A 62 -4.025 -0.449 9.389 1.00 72.14 C ATOM 932 C GLU A 62 -3.401 -1.693 10.018 1.00 31.33 C ATOM 933 O GLU A 62 -3.857 -2.169 11.057 1.00 4.52 O ATOM 934 CB GLU A 62 -5.274 -0.836 8.600 1.00 54.53 C ATOM 935 CG GLU A 62 -6.560 -0.642 9.379 1.00 21.21 C ATOM 936 CD GLU A 62 -7.784 -0.587 8.485 1.00 54.01 C ATOM 937 OE1 GLU A 62 -7.945 -1.494 7.641 1.00 41.41 O ATOM 938 OE2 GLU A 62 -8.581 0.365 8.626 1.00 60.14 O ATOM 0 H GLU A 62 -2.871 -0.262 7.650 1.00 51.21 H new ATOM 0 HA GLU A 62 -4.302 0.236 10.190 1.00 72.14 H new ATOM 0 HB2 GLU A 62 -5.317 -0.242 7.687 1.00 54.53 H new ATOM 0 HB3 GLU A 62 -5.195 -1.880 8.297 1.00 54.53 H new ATOM 0 HG2 GLU A 62 -6.674 -1.457 10.094 1.00 21.21 H new ATOM 0 HG3 GLU A 62 -6.495 0.281 9.956 1.00 21.21 H new ATOM 945 N GLU A 63 -2.358 -2.217 9.377 1.00 75.13 N ATOM 946 CA GLU A 63 -1.672 -3.407 9.870 1.00 33.22 C ATOM 947 C GLU A 63 -2.569 -4.637 9.751 1.00 33.32 C ATOM 948 O GLU A 63 -2.454 -5.411 8.800 1.00 44.35 O ATOM 949 CB GLU A 63 -1.227 -3.211 11.323 1.00 53.51 C ATOM 950 CG GLU A 63 0.270 -3.000 11.478 1.00 52.44 C ATOM 951 CD GLU A 63 0.613 -2.082 12.635 1.00 22.51 C ATOM 952 OE1 GLU A 63 -0.202 -1.983 13.576 1.00 23.21 O ATOM 953 OE2 GLU A 63 1.697 -1.461 12.599 1.00 51.42 O ATOM 0 H GLU A 63 -1.970 -1.835 8.514 1.00 75.13 H new ATOM 0 HA GLU A 63 -0.786 -3.566 9.255 1.00 33.22 H new ATOM 0 HB2 GLU A 63 -1.752 -2.352 11.742 1.00 53.51 H new ATOM 0 HB3 GLU A 63 -1.525 -4.082 11.906 1.00 53.51 H new ATOM 0 HG2 GLU A 63 0.755 -3.964 11.628 1.00 52.44 H new ATOM 0 HG3 GLU A 63 0.672 -2.581 10.555 1.00 52.44 H new ATOM 960 N TYR A 64 -3.465 -4.813 10.720 1.00 12.12 N ATOM 961 CA TYR A 64 -4.383 -5.949 10.719 1.00 22.04 C ATOM 962 C TYR A 64 -3.636 -7.261 10.488 1.00 73.54 C ATOM 963 O TYR A 64 -3.553 -7.748 9.361 1.00 61.41 O ATOM 964 CB TYR A 64 -5.457 -5.761 9.646 1.00 70.14 C ATOM 965 CG TYR A 64 -6.813 -5.390 10.204 1.00 73.42 C ATOM 966 CD1 TYR A 64 -7.412 -6.161 11.192 1.00 44.30 C ATOM 967 CD2 TYR A 64 -7.491 -4.269 9.743 1.00 34.23 C ATOM 968 CE1 TYR A 64 -8.652 -5.825 11.704 1.00 2.55 C ATOM 969 CE2 TYR A 64 -8.731 -3.926 10.250 1.00 15.05 C ATOM 970 CZ TYR A 64 -9.305 -4.708 11.231 1.00 72.22 C ATOM 971 OH TYR A 64 -10.539 -4.370 11.740 1.00 12.35 O ATOM 0 H TYR A 64 -3.575 -4.184 11.515 1.00 12.12 H new ATOM 0 HA TYR A 64 -4.860 -5.997 11.698 1.00 22.04 H new ATOM 0 HB2 TYR A 64 -5.134 -4.984 8.953 1.00 70.14 H new ATOM 0 HB3 TYR A 64 -5.550 -6.683 9.071 1.00 70.14 H new ATOM 0 HD1 TYR A 64 -6.902 -7.036 11.566 1.00 44.30 H new ATOM 0 HD2 TYR A 64 -7.042 -3.655 8.976 1.00 34.23 H new ATOM 0 HE1 TYR A 64 -9.106 -6.435 12.471 1.00 2.55 H new ATOM 0 HE2 TYR A 64 -9.247 -3.052 9.881 1.00 15.05 H new ATOM 0 HH TYR A 64 -10.862 -3.556 11.301 1.00 12.35 H new ATOM 981 N SER A 65 -3.094 -7.826 11.562 1.00 23.54 N ATOM 982 CA SER A 65 -2.354 -9.079 11.474 1.00 53.42 C ATOM 983 C SER A 65 -3.302 -10.259 11.282 1.00 20.41 C ATOM 984 O SER A 65 -2.958 -11.245 10.630 1.00 11.24 O ATOM 985 CB SER A 65 -1.510 -9.287 12.733 1.00 71.45 C ATOM 986 OG SER A 65 -2.306 -9.192 13.902 1.00 45.20 O ATOM 0 H SER A 65 -3.153 -7.436 12.503 1.00 23.54 H new ATOM 0 HA SER A 65 -1.694 -9.022 10.608 1.00 53.42 H new ATOM 0 HB2 SER A 65 -1.029 -10.265 12.695 1.00 71.45 H new ATOM 0 HB3 SER A 65 -0.715 -8.542 12.769 1.00 71.45 H new ATOM 0 HG SER A 65 -1.744 -9.330 14.693 1.00 45.20 H new ATOM 992 N ALA A 66 -4.495 -10.153 11.856 1.00 43.02 N ATOM 993 CA ALA A 66 -5.492 -11.211 11.749 1.00 45.34 C ATOM 994 C ALA A 66 -5.873 -11.462 10.294 1.00 10.52 C ATOM 995 O ALA A 66 -5.904 -12.606 9.838 1.00 12.20 O ATOM 996 CB ALA A 66 -6.726 -10.858 12.565 1.00 4.35 C ATOM 0 H ALA A 66 -4.795 -9.344 12.401 1.00 43.02 H new ATOM 0 HA ALA A 66 -5.056 -12.127 12.147 1.00 45.34 H new ATOM 0 HB1 ALA A 66 -7.462 -11.657 12.476 1.00 4.35 H new ATOM 0 HB2 ALA A 66 -6.447 -10.736 13.612 1.00 4.35 H new ATOM 0 HB3 ALA A 66 -7.154 -9.927 12.193 1.00 4.35 H new ATOM 1002 N MET A 67 -6.164 -10.388 9.569 1.00 25.02 N ATOM 1003 CA MET A 67 -6.544 -10.492 8.165 1.00 72.25 C ATOM 1004 C MET A 67 -5.320 -10.711 7.282 1.00 64.43 C ATOM 1005 O MET A 67 -5.405 -11.352 6.234 1.00 74.34 O ATOM 1006 CB MET A 67 -7.291 -9.232 7.722 1.00 52.22 C ATOM 1007 CG MET A 67 -8.804 -9.358 7.812 1.00 12.40 C ATOM 1008 SD MET A 67 -9.545 -8.127 8.902 1.00 2.01 S ATOM 1009 CE MET A 67 -9.438 -8.965 10.481 1.00 72.31 C ATOM 0 H MET A 67 -6.144 -9.434 9.931 1.00 25.02 H new ATOM 0 HA MET A 67 -7.203 -11.353 8.057 1.00 72.25 H new ATOM 0 HB2 MET A 67 -6.967 -8.393 8.337 1.00 52.22 H new ATOM 0 HB3 MET A 67 -7.015 -8.999 6.694 1.00 52.22 H new ATOM 0 HG2 MET A 67 -9.232 -9.258 6.815 1.00 12.40 H new ATOM 0 HG3 MET A 67 -9.060 -10.355 8.170 1.00 12.40 H new ATOM 0 HE1 MET A 67 -10.160 -8.532 11.173 1.00 72.31 H new ATOM 0 HE2 MET A 67 -9.655 -10.025 10.346 1.00 72.31 H new ATOM 0 HE3 MET A 67 -8.433 -8.850 10.887 1.00 72.31 H new ATOM 1019 N ARG A 68 -4.182 -10.174 7.710 1.00 14.13 N ATOM 1020 CA ARG A 68 -2.942 -10.311 6.957 1.00 11.44 C ATOM 1021 C ARG A 68 -2.573 -11.779 6.775 1.00 24.00 C ATOM 1022 O ARG A 68 -2.067 -12.178 5.726 1.00 2.12 O ATOM 1023 CB ARG A 68 -1.806 -9.567 7.664 1.00 62.41 C ATOM 1024 CG ARG A 68 -1.543 -8.181 7.098 1.00 25.13 C ATOM 1025 CD ARG A 68 -0.074 -7.803 7.205 1.00 22.54 C ATOM 1026 NE ARG A 68 0.159 -6.804 8.246 1.00 60.44 N ATOM 1027 CZ ARG A 68 1.353 -6.548 8.773 1.00 43.00 C ATOM 1028 NH1 ARG A 68 2.425 -7.215 8.362 1.00 63.35 N ATOM 1029 NH2 ARG A 68 1.478 -5.624 9.715 1.00 23.45 N ATOM 0 H ARG A 68 -4.094 -9.640 8.575 1.00 14.13 H new ATOM 0 HA ARG A 68 -3.095 -9.872 5.971 1.00 11.44 H new ATOM 0 HB2 ARG A 68 -2.045 -9.478 8.724 1.00 62.41 H new ATOM 0 HB3 ARG A 68 -0.894 -10.159 7.591 1.00 62.41 H new ATOM 0 HG2 ARG A 68 -1.852 -8.149 6.053 1.00 25.13 H new ATOM 0 HG3 ARG A 68 -2.148 -7.448 7.632 1.00 25.13 H new ATOM 0 HD2 ARG A 68 0.515 -8.695 7.420 1.00 22.54 H new ATOM 0 HD3 ARG A 68 0.272 -7.416 6.247 1.00 22.54 H new ATOM 0 HE ARG A 68 -0.641 -6.272 8.588 1.00 60.44 H new ATOM 0 HH11 ARG A 68 2.335 -7.928 7.638 1.00 63.35 H new ATOM 0 HH12 ARG A 68 3.338 -7.014 8.770 1.00 63.35 H new ATOM 0 HH21 ARG A 68 0.658 -5.109 10.036 1.00 23.45 H new ATOM 0 HH22 ARG A 68 2.394 -5.428 10.119 1.00 23.45 H new ATOM 1043 N ASP A 69 -2.832 -12.581 7.803 1.00 11.40 N ATOM 1044 CA ASP A 69 -2.530 -14.007 7.755 1.00 73.21 C ATOM 1045 C ASP A 69 -3.490 -14.731 6.817 1.00 0.22 C ATOM 1046 O ASP A 69 -3.142 -15.748 6.216 1.00 23.13 O ATOM 1047 CB ASP A 69 -2.609 -14.615 9.156 1.00 62.03 C ATOM 1048 CG ASP A 69 -1.641 -13.964 10.125 1.00 40.12 C ATOM 1049 OD1 ASP A 69 -0.564 -13.518 9.676 1.00 32.13 O ATOM 1050 OD2 ASP A 69 -1.960 -13.900 11.330 1.00 44.11 O ATOM 0 H ASP A 69 -3.250 -12.268 8.679 1.00 11.40 H new ATOM 0 HA ASP A 69 -1.516 -14.127 7.374 1.00 73.21 H new ATOM 0 HB2 ASP A 69 -3.625 -14.511 9.537 1.00 62.03 H new ATOM 0 HB3 ASP A 69 -2.398 -15.683 9.098 1.00 62.03 H new ATOM 1055 N GLN A 70 -4.703 -14.198 6.697 1.00 60.03 N ATOM 1056 CA GLN A 70 -5.718 -14.788 5.834 1.00 1.11 C ATOM 1057 C GLN A 70 -5.315 -14.671 4.366 1.00 41.23 C ATOM 1058 O GLN A 70 -5.500 -15.604 3.584 1.00 3.24 O ATOM 1059 CB GLN A 70 -7.070 -14.103 6.070 1.00 12.24 C ATOM 1060 CG GLN A 70 -8.096 -14.363 4.978 1.00 61.12 C ATOM 1061 CD GLN A 70 -9.489 -14.602 5.529 1.00 30.45 C ATOM 1062 OE1 GLN A 70 -9.677 -14.728 6.739 1.00 74.24 O ATOM 1063 NE2 GLN A 70 -10.473 -14.667 4.641 1.00 23.23 N ATOM 0 H GLN A 70 -5.006 -13.357 7.188 1.00 60.03 H new ATOM 0 HA GLN A 70 -5.808 -15.846 6.080 1.00 1.11 H new ATOM 0 HB2 GLN A 70 -7.476 -14.442 7.023 1.00 12.24 H new ATOM 0 HB3 GLN A 70 -6.911 -13.028 6.156 1.00 12.24 H new ATOM 0 HG2 GLN A 70 -8.120 -13.512 4.297 1.00 61.12 H new ATOM 0 HG3 GLN A 70 -7.787 -15.230 4.394 1.00 61.12 H new ATOM 0 HE21 GLN A 70 -10.271 -14.557 3.647 1.00 23.23 H new ATOM 0 HE22 GLN A 70 -11.431 -14.827 4.952 1.00 23.23 H new ATOM 1072 N TYR A 71 -4.767 -13.518 3.999 1.00 10.53 N ATOM 1073 CA TYR A 71 -4.342 -13.275 2.625 1.00 1.04 C ATOM 1074 C TYR A 71 -3.120 -14.115 2.269 1.00 44.03 C ATOM 1075 O TYR A 71 -2.967 -14.554 1.129 1.00 25.32 O ATOM 1076 CB TYR A 71 -4.034 -11.790 2.423 1.00 52.52 C ATOM 1077 CG TYR A 71 -5.140 -10.875 2.899 1.00 45.55 C ATOM 1078 CD1 TYR A 71 -6.465 -11.122 2.560 1.00 2.55 C ATOM 1079 CD2 TYR A 71 -4.859 -9.766 3.685 1.00 54.31 C ATOM 1080 CE1 TYR A 71 -7.478 -10.286 2.991 1.00 4.22 C ATOM 1081 CE2 TYR A 71 -5.867 -8.926 4.121 1.00 72.50 C ATOM 1082 CZ TYR A 71 -7.174 -9.191 3.771 1.00 33.32 C ATOM 1083 OH TYR A 71 -8.180 -8.358 4.203 1.00 73.20 O ATOM 0 H TYR A 71 -4.606 -12.736 4.634 1.00 10.53 H new ATOM 0 HA TYR A 71 -5.158 -13.566 1.963 1.00 1.04 H new ATOM 0 HB2 TYR A 71 -3.115 -11.542 2.953 1.00 52.52 H new ATOM 0 HB3 TYR A 71 -3.851 -11.606 1.364 1.00 52.52 H new ATOM 0 HD1 TYR A 71 -6.707 -11.980 1.951 1.00 2.55 H new ATOM 0 HD2 TYR A 71 -3.836 -9.556 3.961 1.00 54.31 H new ATOM 0 HE1 TYR A 71 -8.503 -10.490 2.718 1.00 4.22 H new ATOM 0 HE2 TYR A 71 -5.632 -8.067 4.732 1.00 72.50 H new ATOM 0 HH TYR A 71 -7.797 -7.635 4.743 1.00 73.20 H new ATOM 1093 N MET A 72 -2.250 -14.335 3.250 1.00 33.41 N ATOM 1094 CA MET A 72 -1.041 -15.122 3.035 1.00 32.44 C ATOM 1095 C MET A 72 -1.383 -16.558 2.651 1.00 73.20 C ATOM 1096 O MET A 72 -0.842 -17.100 1.688 1.00 11.13 O ATOM 1097 CB MET A 72 -0.172 -15.116 4.296 1.00 70.15 C ATOM 1098 CG MET A 72 0.351 -13.737 4.668 1.00 2.34 C ATOM 1099 SD MET A 72 2.115 -13.741 5.047 1.00 52.40 S ATOM 1100 CE MET A 72 2.476 -11.988 5.002 1.00 54.03 C ATOM 0 H MET A 72 -2.360 -13.980 4.200 1.00 33.41 H new ATOM 0 HA MET A 72 -0.486 -14.668 2.214 1.00 32.44 H new ATOM 0 HB2 MET A 72 -0.752 -15.512 5.129 1.00 70.15 H new ATOM 0 HB3 MET A 72 0.673 -15.788 4.148 1.00 70.15 H new ATOM 0 HG2 MET A 72 0.162 -13.047 3.846 1.00 2.34 H new ATOM 0 HG3 MET A 72 -0.201 -13.364 5.531 1.00 2.34 H new ATOM 0 HE1 MET A 72 3.541 -11.840 4.826 1.00 54.03 H new ATOM 0 HE2 MET A 72 1.907 -11.520 4.199 1.00 54.03 H new ATOM 0 HE3 MET A 72 2.200 -11.535 5.954 1.00 54.03 H new ATOM 1110 N ARG A 73 -2.281 -17.171 3.415 1.00 44.35 N ATOM 1111 CA ARG A 73 -2.694 -18.547 3.160 1.00 1.02 C ATOM 1112 C ARG A 73 -3.532 -18.650 1.886 1.00 61.32 C ATOM 1113 O ARG A 73 -3.671 -19.730 1.313 1.00 41.10 O ATOM 1114 CB ARG A 73 -3.485 -19.089 4.352 1.00 71.44 C ATOM 1115 CG ARG A 73 -2.721 -19.022 5.664 1.00 23.24 C ATOM 1116 CD ARG A 73 -3.646 -19.180 6.859 1.00 44.43 C ATOM 1117 NE ARG A 73 -4.301 -20.487 6.875 1.00 43.00 N ATOM 1118 CZ ARG A 73 -5.405 -20.755 7.569 1.00 65.20 C ATOM 1119 NH1 ARG A 73 -5.978 -19.814 8.309 1.00 31.13 N ATOM 1120 NH2 ARG A 73 -5.936 -21.969 7.524 1.00 62.24 N ATOM 0 H ARG A 73 -2.737 -16.736 4.217 1.00 44.35 H new ATOM 0 HA ARG A 73 -1.794 -19.147 3.022 1.00 1.02 H new ATOM 0 HB2 ARG A 73 -4.412 -18.524 4.451 1.00 71.44 H new ATOM 0 HB3 ARG A 73 -3.762 -20.124 4.154 1.00 71.44 H new ATOM 0 HG2 ARG A 73 -1.963 -19.805 5.684 1.00 23.24 H new ATOM 0 HG3 ARG A 73 -2.197 -18.069 5.732 1.00 23.24 H new ATOM 0 HD2 ARG A 73 -3.076 -19.049 7.779 1.00 44.43 H new ATOM 0 HD3 ARG A 73 -4.402 -18.396 6.838 1.00 44.43 H new ATOM 0 HE ARG A 73 -3.888 -21.238 6.322 1.00 43.00 H new ATOM 0 HH11 ARG A 73 -5.573 -18.879 8.348 1.00 31.13 H new ATOM 0 HH12 ARG A 73 -6.824 -20.026 8.838 1.00 31.13 H new ATOM 0 HH21 ARG A 73 -5.499 -22.696 6.958 1.00 62.24 H new ATOM 0 HH22 ARG A 73 -6.782 -22.176 8.055 1.00 62.24 H new ATOM 1134 N THR A 74 -4.087 -17.524 1.446 1.00 52.31 N ATOM 1135 CA THR A 74 -4.907 -17.498 0.240 1.00 2.34 C ATOM 1136 C THR A 74 -4.132 -16.923 -0.946 1.00 40.02 C ATOM 1137 O THR A 74 -4.625 -16.919 -2.074 1.00 3.42 O ATOM 1138 CB THR A 74 -6.176 -16.678 0.477 1.00 54.41 C ATOM 1139 OG1 THR A 74 -5.852 -15.354 0.862 1.00 20.22 O ATOM 1140 CG2 THR A 74 -7.074 -17.260 1.548 1.00 74.50 C ATOM 0 H THR A 74 -3.984 -16.620 1.906 1.00 52.31 H new ATOM 0 HA THR A 74 -5.182 -18.526 0.003 1.00 2.34 H new ATOM 0 HB THR A 74 -6.712 -16.694 -0.472 1.00 54.41 H new ATOM 0 HG1 THR A 74 -5.657 -15.331 1.822 1.00 20.22 H new ATOM 0 HG21 THR A 74 -7.956 -16.630 1.666 1.00 74.50 H new ATOM 0 HG22 THR A 74 -7.382 -18.265 1.258 1.00 74.50 H new ATOM 0 HG23 THR A 74 -6.532 -17.305 2.492 1.00 74.50 H new ATOM 1148 N GLY A 75 -2.919 -16.437 -0.687 1.00 0.22 N ATOM 1149 CA GLY A 75 -2.110 -15.869 -1.746 1.00 52.35 C ATOM 1150 C GLY A 75 -1.053 -16.830 -2.252 1.00 61.04 C ATOM 1151 O GLY A 75 -0.166 -17.240 -1.503 1.00 44.52 O ATOM 0 H GLY A 75 -2.486 -16.428 0.236 1.00 0.22 H new ATOM 0 HA2 GLY A 75 -2.756 -15.576 -2.574 1.00 52.35 H new ATOM 0 HA3 GLY A 75 -1.627 -14.962 -1.382 1.00 52.35 H new ATOM 1155 N GLU A 76 -1.144 -17.188 -3.529 1.00 33.44 N ATOM 1156 CA GLU A 76 -0.187 -18.106 -4.136 1.00 54.50 C ATOM 1157 C GLU A 76 1.217 -17.508 -4.134 1.00 41.44 C ATOM 1158 O GLU A 76 2.210 -18.235 -4.114 1.00 55.15 O ATOM 1159 CB GLU A 76 -0.610 -18.444 -5.566 1.00 23.12 C ATOM 1160 CG GLU A 76 -2.029 -18.985 -5.668 1.00 45.32 C ATOM 1161 CD GLU A 76 -2.104 -20.289 -6.436 1.00 55.40 C ATOM 1162 OE1 GLU A 76 -1.243 -20.513 -7.313 1.00 54.24 O ATOM 1163 OE2 GLU A 76 -3.026 -21.087 -6.161 1.00 23.33 O ATOM 0 H GLU A 76 -1.871 -16.856 -4.163 1.00 33.44 H new ATOM 0 HA GLU A 76 -0.172 -19.021 -3.544 1.00 54.50 H new ATOM 0 HB2 GLU A 76 -0.526 -17.549 -6.182 1.00 23.12 H new ATOM 0 HB3 GLU A 76 0.081 -19.180 -5.977 1.00 23.12 H new ATOM 0 HG2 GLU A 76 -2.429 -19.135 -4.665 1.00 45.32 H new ATOM 0 HG3 GLU A 76 -2.662 -18.244 -6.156 1.00 45.32 H new ATOM 1170 N GLY A 77 1.291 -16.181 -4.154 1.00 73.10 N ATOM 1171 CA GLY A 77 2.577 -15.509 -4.154 1.00 31.12 C ATOM 1172 C GLY A 77 2.532 -14.177 -3.430 1.00 41.43 C ATOM 1173 O GLY A 77 1.456 -13.686 -3.087 1.00 55.52 O ATOM 0 H GLY A 77 0.483 -15.559 -4.170 1.00 73.10 H new ATOM 0 HA2 GLY A 77 3.320 -16.152 -3.682 1.00 31.12 H new ATOM 0 HA3 GLY A 77 2.901 -15.350 -5.182 1.00 31.12 H new ATOM 1177 N PHE A 78 3.703 -13.591 -3.197 1.00 42.01 N ATOM 1178 CA PHE A 78 3.790 -12.309 -2.509 1.00 22.00 C ATOM 1179 C PHE A 78 4.694 -11.344 -3.268 1.00 0.14 C ATOM 1180 O PHE A 78 5.685 -11.751 -3.875 1.00 51.45 O ATOM 1181 CB PHE A 78 4.317 -12.505 -1.086 1.00 73.23 C ATOM 1182 CG PHE A 78 3.467 -13.423 -0.256 1.00 74.44 C ATOM 1183 CD1 PHE A 78 3.622 -14.797 -0.340 1.00 10.43 C ATOM 1184 CD2 PHE A 78 2.513 -12.911 0.607 1.00 60.32 C ATOM 1185 CE1 PHE A 78 2.840 -15.644 0.424 1.00 3.23 C ATOM 1186 CE2 PHE A 78 1.729 -13.751 1.373 1.00 11.12 C ATOM 1187 CZ PHE A 78 1.892 -15.120 1.281 1.00 32.33 C ATOM 0 H PHE A 78 4.603 -13.984 -3.474 1.00 42.01 H new ATOM 0 HA PHE A 78 2.788 -11.881 -2.464 1.00 22.00 H new ATOM 0 HB2 PHE A 78 5.330 -12.904 -1.134 1.00 73.23 H new ATOM 0 HB3 PHE A 78 4.379 -11.535 -0.593 1.00 73.23 H new ATOM 0 HD1 PHE A 78 4.361 -15.211 -1.009 1.00 10.43 H new ATOM 0 HD2 PHE A 78 2.380 -11.842 0.682 1.00 60.32 H new ATOM 0 HE1 PHE A 78 2.970 -16.714 0.351 1.00 3.23 H new ATOM 0 HE2 PHE A 78 0.989 -13.338 2.043 1.00 11.12 H new ATOM 0 HZ PHE A 78 1.279 -15.779 1.878 1.00 32.33 H new ATOM 1197 N LEU A 79 4.345 -10.063 -3.229 1.00 55.32 N ATOM 1198 CA LEU A 79 5.125 -9.037 -3.913 1.00 1.13 C ATOM 1199 C LEU A 79 5.681 -8.022 -2.918 1.00 53.43 C ATOM 1200 O LEU A 79 4.930 -7.374 -2.192 1.00 24.13 O ATOM 1201 CB LEU A 79 4.263 -8.325 -4.957 1.00 53.32 C ATOM 1202 CG LEU A 79 4.991 -7.957 -6.254 1.00 73.21 C ATOM 1203 CD1 LEU A 79 4.179 -8.388 -7.465 1.00 70.14 C ATOM 1204 CD2 LEU A 79 5.271 -6.462 -6.304 1.00 54.34 C ATOM 0 H LEU A 79 3.528 -9.710 -2.731 1.00 55.32 H new ATOM 0 HA LEU A 79 5.962 -9.524 -4.413 1.00 1.13 H new ATOM 0 HB2 LEU A 79 3.414 -8.964 -5.203 1.00 53.32 H new ATOM 0 HB3 LEU A 79 3.859 -7.415 -4.514 1.00 53.32 H new ATOM 0 HG LEU A 79 5.944 -8.487 -6.274 1.00 73.21 H new ATOM 0 HD11 LEU A 79 4.713 -8.118 -8.376 1.00 70.14 H new ATOM 0 HD12 LEU A 79 4.031 -9.468 -7.438 1.00 70.14 H new ATOM 0 HD13 LEU A 79 3.210 -7.888 -7.450 1.00 70.14 H new ATOM 0 HD21 LEU A 79 5.788 -6.220 -7.232 1.00 54.34 H new ATOM 0 HD22 LEU A 79 4.330 -5.914 -6.259 1.00 54.34 H new ATOM 0 HD23 LEU A 79 5.896 -6.180 -5.456 1.00 54.34 H new ATOM 1216 N CYS A 80 7.004 -7.890 -2.894 1.00 53.50 N ATOM 1217 CA CYS A 80 7.661 -6.954 -1.989 1.00 51.45 C ATOM 1218 C CYS A 80 7.967 -5.638 -2.698 1.00 51.23 C ATOM 1219 O CYS A 80 8.947 -5.533 -3.436 1.00 22.52 O ATOM 1220 CB CYS A 80 8.953 -7.562 -1.441 1.00 41.11 C ATOM 1221 SG CYS A 80 8.698 -8.785 -0.135 1.00 23.32 S ATOM 0 H CYS A 80 7.641 -8.419 -3.490 1.00 53.50 H new ATOM 0 HA CYS A 80 6.983 -6.752 -1.160 1.00 51.45 H new ATOM 0 HB2 CYS A 80 9.498 -8.030 -2.261 1.00 41.11 H new ATOM 0 HB3 CYS A 80 9.584 -6.761 -1.056 1.00 41.11 H new ATOM 0 HG CYS A 80 9.848 -9.243 0.261 1.00 23.32 H new ATOM 1227 N VAL A 81 7.122 -4.639 -2.470 1.00 71.20 N ATOM 1228 CA VAL A 81 7.301 -3.331 -3.087 1.00 35.25 C ATOM 1229 C VAL A 81 7.784 -2.303 -2.067 1.00 40.40 C ATOM 1230 O VAL A 81 7.277 -2.238 -0.947 1.00 11.12 O ATOM 1231 CB VAL A 81 5.992 -2.833 -3.735 1.00 23.03 C ATOM 1232 CG1 VAL A 81 4.861 -2.822 -2.717 1.00 14.40 C ATOM 1233 CG2 VAL A 81 6.181 -1.453 -4.350 1.00 50.45 C ATOM 0 H VAL A 81 6.306 -4.710 -1.862 1.00 71.20 H new ATOM 0 HA VAL A 81 8.058 -3.445 -3.863 1.00 35.25 H new ATOM 0 HB VAL A 81 5.724 -3.523 -4.535 1.00 23.03 H new ATOM 0 HG11 VAL A 81 3.947 -2.468 -3.193 1.00 14.40 H new ATOM 0 HG12 VAL A 81 4.705 -3.831 -2.336 1.00 14.40 H new ATOM 0 HG13 VAL A 81 5.121 -2.159 -1.892 1.00 14.40 H new ATOM 0 HG21 VAL A 81 5.244 -1.124 -4.800 1.00 50.45 H new ATOM 0 HG22 VAL A 81 6.479 -0.747 -3.575 1.00 50.45 H new ATOM 0 HG23 VAL A 81 6.955 -1.499 -5.116 1.00 50.45 H new ATOM 1243 N PHE A 82 8.766 -1.501 -2.463 1.00 71.01 N ATOM 1244 CA PHE A 82 9.316 -0.476 -1.586 1.00 61.21 C ATOM 1245 C PHE A 82 9.816 0.718 -2.392 1.00 24.32 C ATOM 1246 O PHE A 82 9.940 0.645 -3.616 1.00 64.35 O ATOM 1247 CB PHE A 82 10.453 -1.052 -0.736 1.00 40.50 C ATOM 1248 CG PHE A 82 11.692 -1.379 -1.521 1.00 74.24 C ATOM 1249 CD1 PHE A 82 11.678 -2.374 -2.484 1.00 1.31 C ATOM 1250 CD2 PHE A 82 12.872 -0.690 -1.292 1.00 30.00 C ATOM 1251 CE1 PHE A 82 12.817 -2.676 -3.207 1.00 53.35 C ATOM 1252 CE2 PHE A 82 14.015 -0.986 -2.011 1.00 10.43 C ATOM 1253 CZ PHE A 82 13.987 -1.981 -2.969 1.00 41.41 C ATOM 0 H PHE A 82 9.197 -1.542 -3.386 1.00 71.01 H new ATOM 0 HA PHE A 82 8.520 -0.135 -0.924 1.00 61.21 H new ATOM 0 HB2 PHE A 82 10.708 -0.337 0.046 1.00 40.50 H new ATOM 0 HB3 PHE A 82 10.100 -1.956 -0.239 1.00 40.50 H new ATOM 0 HD1 PHE A 82 10.766 -2.921 -2.673 1.00 1.31 H new ATOM 0 HD2 PHE A 82 12.899 0.088 -0.543 1.00 30.00 H new ATOM 0 HE1 PHE A 82 12.792 -3.453 -3.956 1.00 53.35 H new ATOM 0 HE2 PHE A 82 14.928 -0.440 -1.824 1.00 10.43 H new ATOM 0 HZ PHE A 82 14.879 -2.215 -3.531 1.00 41.41 H new ATOM 1263 N ALA A 83 10.101 1.816 -1.702 1.00 24.45 N ATOM 1264 CA ALA A 83 10.586 3.025 -2.355 1.00 73.45 C ATOM 1265 C ALA A 83 12.067 3.245 -2.072 1.00 3.03 C ATOM 1266 O ALA A 83 12.486 3.304 -0.916 1.00 53.00 O ATOM 1267 CB ALA A 83 9.774 4.229 -1.903 1.00 53.31 C ATOM 0 H ALA A 83 10.004 1.894 -0.690 1.00 24.45 H new ATOM 0 HA ALA A 83 10.464 2.902 -3.431 1.00 73.45 H new ATOM 0 HB1 ALA A 83 10.147 5.126 -2.398 1.00 53.31 H new ATOM 0 HB2 ALA A 83 8.726 4.080 -2.163 1.00 53.31 H new ATOM 0 HB3 ALA A 83 9.867 4.346 -0.823 1.00 53.31 H new ATOM 1273 N ILE A 84 12.857 3.366 -3.134 1.00 34.43 N ATOM 1274 CA ILE A 84 14.291 3.579 -2.998 1.00 33.13 C ATOM 1275 C ILE A 84 14.581 4.889 -2.276 1.00 10.40 C ATOM 1276 O ILE A 84 15.576 5.010 -1.561 1.00 10.30 O ATOM 1277 CB ILE A 84 14.990 3.595 -4.370 1.00 10.13 C ATOM 1278 CG1 ILE A 84 14.306 4.587 -5.308 1.00 71.22 C ATOM 1279 CG2 ILE A 84 14.987 2.205 -4.979 1.00 22.44 C ATOM 1280 CD1 ILE A 84 15.160 4.987 -6.492 1.00 23.14 C ATOM 0 H ILE A 84 12.527 3.320 -4.098 1.00 34.43 H new ATOM 0 HA ILE A 84 14.682 2.748 -2.412 1.00 33.13 H new ATOM 0 HB ILE A 84 16.023 3.911 -4.228 1.00 10.13 H new ATOM 0 HG12 ILE A 84 13.377 4.149 -5.672 1.00 71.22 H new ATOM 0 HG13 ILE A 84 14.038 5.481 -4.745 1.00 71.22 H new ATOM 0 HG21 ILE A 84 15.484 2.231 -5.949 1.00 22.44 H new ATOM 0 HG22 ILE A 84 15.515 1.517 -4.319 1.00 22.44 H new ATOM 0 HG23 ILE A 84 13.959 1.866 -5.108 1.00 22.44 H new ATOM 0 HD11 ILE A 84 14.611 5.693 -7.115 1.00 23.14 H new ATOM 0 HD12 ILE A 84 16.078 5.455 -6.137 1.00 23.14 H new ATOM 0 HD13 ILE A 84 15.407 4.102 -7.078 1.00 23.14 H new ATOM 1292 N ASN A 85 13.702 5.867 -2.465 1.00 30.50 N ATOM 1293 CA ASN A 85 13.859 7.169 -1.829 1.00 74.14 C ATOM 1294 C ASN A 85 13.720 7.056 -0.313 1.00 14.11 C ATOM 1295 O ASN A 85 14.311 7.835 0.434 1.00 13.55 O ATOM 1296 CB ASN A 85 12.830 8.160 -2.372 1.00 22.33 C ATOM 1297 CG ASN A 85 12.727 8.126 -3.887 1.00 0.32 C ATOM 1298 OD1 ASN A 85 12.562 7.063 -4.486 1.00 72.14 O ATOM 1299 ND2 ASN A 85 12.820 9.293 -4.513 1.00 33.24 N ATOM 0 H ASN A 85 12.873 5.782 -3.054 1.00 30.50 H new ATOM 0 HA ASN A 85 14.859 7.535 -2.060 1.00 74.14 H new ATOM 0 HB2 ASN A 85 11.854 7.937 -1.940 1.00 22.33 H new ATOM 0 HB3 ASN A 85 13.098 9.167 -2.053 1.00 22.33 H new ATOM 0 HD21 ASN A 85 12.755 9.333 -5.530 1.00 33.24 H new ATOM 0 HD22 ASN A 85 12.957 10.150 -3.977 1.00 33.24 H new ATOM 1306 N ASN A 86 12.935 6.080 0.135 1.00 50.44 N ATOM 1307 CA ASN A 86 12.722 5.865 1.563 1.00 62.33 C ATOM 1308 C ASN A 86 13.439 4.605 2.036 1.00 72.34 C ATOM 1309 O ASN A 86 13.017 3.488 1.732 1.00 23.31 O ATOM 1310 CB ASN A 86 11.226 5.759 1.869 1.00 60.23 C ATOM 1311 CG ASN A 86 10.876 6.312 3.237 1.00 60.13 C ATOM 1312 OD1 ASN A 86 11.557 7.197 3.754 1.00 64.44 O ATOM 1313 ND2 ASN A 86 9.808 5.790 3.831 1.00 25.44 N ATOM 0 H ASN A 86 12.437 5.426 -0.469 1.00 50.44 H new ATOM 0 HA ASN A 86 13.135 6.720 2.098 1.00 62.33 H new ATOM 0 HB2 ASN A 86 10.663 6.298 1.107 1.00 60.23 H new ATOM 0 HB3 ASN A 86 10.919 4.715 1.813 1.00 60.23 H new ATOM 0 HD21 ASN A 86 9.524 6.122 4.753 1.00 25.44 H new ATOM 0 HD22 ASN A 86 9.272 5.058 3.365 1.00 25.44 H new ATOM 1320 N THR A 87 14.522 4.792 2.780 1.00 61.42 N ATOM 1321 CA THR A 87 15.297 3.669 3.295 1.00 0.01 C ATOM 1322 C THR A 87 14.463 2.821 4.251 1.00 15.51 C ATOM 1323 O THR A 87 14.737 1.635 4.442 1.00 73.33 O ATOM 1324 CB THR A 87 16.553 4.172 4.007 1.00 62.21 C ATOM 1325 OG1 THR A 87 17.219 5.145 3.221 1.00 21.32 O ATOM 1326 CG2 THR A 87 17.546 3.074 4.316 1.00 63.24 C ATOM 0 H THR A 87 14.884 5.709 3.040 1.00 61.42 H new ATOM 0 HA THR A 87 15.590 3.047 2.449 1.00 0.01 H new ATOM 0 HB THR A 87 16.201 4.597 4.947 1.00 62.21 H new ATOM 0 HG1 THR A 87 18.019 5.456 3.694 1.00 21.32 H new ATOM 0 HG21 THR A 87 18.413 3.499 4.821 1.00 63.24 H new ATOM 0 HG22 THR A 87 17.078 2.331 4.962 1.00 63.24 H new ATOM 0 HG23 THR A 87 17.863 2.599 3.388 1.00 63.24 H new ATOM 1334 N LYS A 88 13.444 3.432 4.849 1.00 54.12 N ATOM 1335 CA LYS A 88 12.574 2.735 5.780 1.00 52.33 C ATOM 1336 C LYS A 88 11.804 1.622 5.071 1.00 50.14 C ATOM 1337 O LYS A 88 11.635 0.529 5.611 1.00 5.33 O ATOM 1338 CB LYS A 88 11.607 3.731 6.427 1.00 25.53 C ATOM 1339 CG LYS A 88 10.468 3.077 7.184 1.00 14.55 C ATOM 1340 CD LYS A 88 10.255 3.722 8.545 1.00 30.31 C ATOM 1341 CE LYS A 88 11.432 3.465 9.473 1.00 11.42 C ATOM 1342 NZ LYS A 88 10.995 3.249 10.879 1.00 73.23 N ATOM 0 H LYS A 88 13.203 4.412 4.702 1.00 54.12 H new ATOM 0 HA LYS A 88 13.185 2.277 6.558 1.00 52.33 H new ATOM 0 HB2 LYS A 88 12.164 4.372 7.111 1.00 25.53 H new ATOM 0 HB3 LYS A 88 11.192 4.376 5.652 1.00 25.53 H new ATOM 0 HG2 LYS A 88 9.552 3.151 6.598 1.00 14.55 H new ATOM 0 HG3 LYS A 88 10.679 2.015 7.313 1.00 14.55 H new ATOM 0 HD2 LYS A 88 10.115 4.796 8.422 1.00 30.31 H new ATOM 0 HD3 LYS A 88 9.343 3.331 8.996 1.00 30.31 H new ATOM 0 HE2 LYS A 88 11.983 2.591 9.126 1.00 11.42 H new ATOM 0 HE3 LYS A 88 12.118 4.311 9.432 1.00 11.42 H new ATOM 0 HZ1 LYS A 88 11.827 3.077 11.479 1.00 73.23 H new ATOM 0 HZ2 LYS A 88 10.491 4.093 11.219 1.00 73.23 H new ATOM 0 HZ3 LYS A 88 10.361 2.426 10.923 1.00 73.23 H new ATOM 1356 N SER A 89 11.343 1.909 3.857 1.00 61.20 N ATOM 1357 CA SER A 89 10.596 0.931 3.073 1.00 11.33 C ATOM 1358 C SER A 89 11.438 -0.316 2.823 1.00 22.23 C ATOM 1359 O SER A 89 10.989 -1.438 3.056 1.00 45.51 O ATOM 1360 CB SER A 89 10.155 1.542 1.743 1.00 61.20 C ATOM 1361 OG SER A 89 11.274 1.860 0.932 1.00 52.22 O ATOM 0 H SER A 89 11.473 2.809 3.396 1.00 61.20 H new ATOM 0 HA SER A 89 9.711 0.643 3.640 1.00 11.33 H new ATOM 0 HB2 SER A 89 9.506 0.843 1.215 1.00 61.20 H new ATOM 0 HB3 SER A 89 9.569 2.442 1.929 1.00 61.20 H new ATOM 0 HG SER A 89 11.987 2.234 1.491 1.00 52.22 H new ATOM 1367 N PHE A 90 12.664 -0.110 2.352 1.00 34.23 N ATOM 1368 CA PHE A 90 13.576 -1.215 2.077 1.00 20.44 C ATOM 1369 C PHE A 90 13.810 -2.044 3.337 1.00 31.33 C ATOM 1370 O PHE A 90 14.043 -3.250 3.265 1.00 34.32 O ATOM 1371 CB PHE A 90 14.907 -0.676 1.543 1.00 22.30 C ATOM 1372 CG PHE A 90 15.967 -1.729 1.367 1.00 12.12 C ATOM 1373 CD1 PHE A 90 15.837 -2.709 0.396 1.00 23.31 C ATOM 1374 CD2 PHE A 90 17.096 -1.732 2.172 1.00 4.34 C ATOM 1375 CE1 PHE A 90 16.814 -3.673 0.231 1.00 51.11 C ATOM 1376 CE2 PHE A 90 18.075 -2.693 2.012 1.00 73.40 C ATOM 1377 CZ PHE A 90 17.934 -3.665 1.040 1.00 64.53 C ATOM 0 H PHE A 90 13.049 0.813 2.153 1.00 34.23 H new ATOM 0 HA PHE A 90 13.125 -1.858 1.321 1.00 20.44 H new ATOM 0 HB2 PHE A 90 14.731 -0.188 0.584 1.00 22.30 H new ATOM 0 HB3 PHE A 90 15.278 0.088 2.226 1.00 22.30 H new ATOM 0 HD1 PHE A 90 14.963 -2.720 -0.239 1.00 23.31 H new ATOM 0 HD2 PHE A 90 17.211 -0.974 2.933 1.00 4.34 H new ATOM 0 HE1 PHE A 90 16.702 -4.432 -0.530 1.00 51.11 H new ATOM 0 HE2 PHE A 90 18.950 -2.685 2.646 1.00 73.40 H new ATOM 0 HZ PHE A 90 18.698 -4.417 0.913 1.00 64.53 H new ATOM 1387 N GLU A 91 13.744 -1.386 4.490 1.00 42.53 N ATOM 1388 CA GLU A 91 13.945 -2.058 5.767 1.00 44.53 C ATOM 1389 C GLU A 91 12.681 -2.793 6.199 1.00 54.22 C ATOM 1390 O GLU A 91 12.748 -3.805 6.897 1.00 72.24 O ATOM 1391 CB GLU A 91 14.353 -1.046 6.840 1.00 53.30 C ATOM 1392 CG GLU A 91 15.594 -0.244 6.482 1.00 13.12 C ATOM 1393 CD GLU A 91 16.714 -0.419 7.491 1.00 43.14 C ATOM 1394 OE1 GLU A 91 17.184 -1.564 7.663 1.00 42.34 O ATOM 1395 OE2 GLU A 91 17.118 0.587 8.110 1.00 33.33 O ATOM 0 H GLU A 91 13.553 -0.387 4.565 1.00 42.53 H new ATOM 0 HA GLU A 91 14.744 -2.789 5.644 1.00 44.53 H new ATOM 0 HB2 GLU A 91 13.525 -0.359 7.013 1.00 53.30 H new ATOM 0 HB3 GLU A 91 14.530 -1.574 7.777 1.00 53.30 H new ATOM 0 HG2 GLU A 91 15.947 -0.548 5.497 1.00 13.12 H new ATOM 0 HG3 GLU A 91 15.333 0.812 6.415 1.00 13.12 H new ATOM 1402 N ASP A 92 11.528 -2.277 5.783 1.00 34.33 N ATOM 1403 CA ASP A 92 10.249 -2.884 6.132 1.00 42.41 C ATOM 1404 C ASP A 92 9.992 -4.134 5.297 1.00 42.34 C ATOM 1405 O ASP A 92 9.590 -5.171 5.825 1.00 25.42 O ATOM 1406 CB ASP A 92 9.112 -1.880 5.937 1.00 42.20 C ATOM 1407 CG ASP A 92 9.162 -0.743 6.939 1.00 43.32 C ATOM 1408 OD1 ASP A 92 9.947 -0.839 7.908 1.00 14.42 O ATOM 1409 OD2 ASP A 92 8.418 0.243 6.757 1.00 74.24 O ATOM 0 H ASP A 92 11.454 -1.440 5.204 1.00 34.33 H new ATOM 0 HA ASP A 92 10.289 -3.175 7.182 1.00 42.41 H new ATOM 0 HB2 ASP A 92 9.161 -1.472 4.927 1.00 42.20 H new ATOM 0 HB3 ASP A 92 8.156 -2.397 6.026 1.00 42.20 H new ATOM 1414 N ILE A 93 10.233 -4.033 3.992 1.00 31.54 N ATOM 1415 CA ILE A 93 10.036 -5.154 3.089 1.00 4.23 C ATOM 1416 C ILE A 93 10.789 -6.387 3.589 1.00 72.43 C ATOM 1417 O ILE A 93 10.401 -7.522 3.311 1.00 54.12 O ATOM 1418 CB ILE A 93 10.507 -4.787 1.662 1.00 42.04 C ATOM 1419 CG1 ILE A 93 9.404 -4.060 0.898 1.00 12.02 C ATOM 1420 CG2 ILE A 93 10.937 -6.015 0.891 1.00 31.43 C ATOM 1421 CD1 ILE A 93 8.084 -4.800 0.880 1.00 62.32 C ATOM 0 H ILE A 93 10.566 -3.182 3.539 1.00 31.54 H new ATOM 0 HA ILE A 93 8.971 -5.385 3.059 1.00 4.23 H new ATOM 0 HB ILE A 93 11.366 -4.124 1.764 1.00 42.04 H new ATOM 0 HG12 ILE A 93 9.253 -3.077 1.344 1.00 12.02 H new ATOM 0 HG13 ILE A 93 9.733 -3.897 -0.128 1.00 12.02 H new ATOM 0 HG21 ILE A 93 11.262 -5.722 -0.107 1.00 31.43 H new ATOM 0 HG22 ILE A 93 11.761 -6.502 1.413 1.00 31.43 H new ATOM 0 HG23 ILE A 93 10.098 -6.707 0.811 1.00 31.43 H new ATOM 0 HD11 ILE A 93 7.350 -4.221 0.319 1.00 62.32 H new ATOM 0 HD12 ILE A 93 8.218 -5.772 0.406 1.00 62.32 H new ATOM 0 HD13 ILE A 93 7.731 -4.940 1.902 1.00 62.32 H new ATOM 1433 N HIS A 94 11.865 -6.149 4.333 1.00 2.45 N ATOM 1434 CA HIS A 94 12.673 -7.230 4.878 1.00 33.30 C ATOM 1435 C HIS A 94 11.868 -8.053 5.881 1.00 50.44 C ATOM 1436 O HIS A 94 11.788 -9.277 5.773 1.00 64.34 O ATOM 1437 CB HIS A 94 13.931 -6.656 5.544 1.00 1.40 C ATOM 1438 CG HIS A 94 14.488 -7.512 6.642 1.00 11.53 C ATOM 1439 ND1 HIS A 94 14.034 -7.752 7.896 1.00 75.44 N flip ATOM 1440 CD2 HIS A 94 15.648 -8.245 6.508 1.00 34.22 C flip ATOM 1441 CE1 HIS A 94 14.920 -8.619 8.489 1.00 2.30 C flip ATOM 1442 NE2 HIS A 94 15.883 -8.901 7.630 1.00 43.12 N flip ATOM 0 H HIS A 94 12.196 -5.214 4.572 1.00 2.45 H new ATOM 0 HA HIS A 94 12.972 -7.888 4.062 1.00 33.30 H new ATOM 0 HB2 HIS A 94 14.699 -6.514 4.784 1.00 1.40 H new ATOM 0 HB3 HIS A 94 13.697 -5.671 5.949 1.00 1.40 H new ATOM 0 HD2 HIS A 94 16.268 -8.278 5.624 1.00 34.22 H new ATOM 0 HE1 HIS A 94 14.842 -9.007 9.494 1.00 2.30 H new ATOM 0 HE2 HIS A 94 16.674 -9.521 7.804 1.00 43.12 H new ATOM 1451 N GLN A 95 11.280 -7.372 6.858 1.00 50.33 N ATOM 1452 CA GLN A 95 10.490 -8.033 7.883 1.00 23.32 C ATOM 1453 C GLN A 95 9.201 -8.603 7.292 1.00 64.32 C ATOM 1454 O GLN A 95 8.674 -9.607 7.771 1.00 22.33 O ATOM 1455 CB GLN A 95 10.180 -7.041 9.010 1.00 72.02 C ATOM 1456 CG GLN A 95 8.980 -6.148 8.740 1.00 74.52 C ATOM 1457 CD GLN A 95 9.298 -4.672 8.845 1.00 20.54 C ATOM 1458 OE1 GLN A 95 10.307 -4.280 9.432 1.00 53.11 O ATOM 1459 NE2 GLN A 95 8.430 -3.846 8.273 1.00 62.14 N ATOM 0 H GLN A 95 11.338 -6.359 6.959 1.00 50.33 H new ATOM 0 HA GLN A 95 11.063 -8.866 8.291 1.00 23.32 H new ATOM 0 HB2 GLN A 95 10.005 -7.597 9.931 1.00 72.02 H new ATOM 0 HB3 GLN A 95 11.055 -6.414 9.178 1.00 72.02 H new ATOM 0 HG2 GLN A 95 8.595 -6.360 7.742 1.00 74.52 H new ATOM 0 HG3 GLN A 95 8.187 -6.393 9.446 1.00 74.52 H new ATOM 0 HE21 GLN A 95 7.608 -4.219 7.798 1.00 62.14 H new ATOM 0 HE22 GLN A 95 8.585 -2.838 8.309 1.00 62.14 H new ATOM 1468 N TYR A 96 8.701 -7.949 6.248 1.00 42.34 N ATOM 1469 CA TYR A 96 7.476 -8.377 5.588 1.00 52.14 C ATOM 1470 C TYR A 96 7.653 -9.757 4.965 1.00 54.13 C ATOM 1471 O TYR A 96 6.768 -10.608 5.056 1.00 51.53 O ATOM 1472 CB TYR A 96 7.076 -7.359 4.519 1.00 65.32 C ATOM 1473 CG TYR A 96 6.215 -6.232 5.043 1.00 32.23 C ATOM 1474 CD1 TYR A 96 4.960 -6.483 5.583 1.00 44.35 C ATOM 1475 CD2 TYR A 96 6.659 -4.917 4.996 1.00 24.12 C ATOM 1476 CE1 TYR A 96 4.171 -5.454 6.060 1.00 31.43 C ATOM 1477 CE2 TYR A 96 5.876 -3.882 5.472 1.00 43.54 C ATOM 1478 CZ TYR A 96 4.633 -4.156 6.002 1.00 72.14 C ATOM 1479 OH TYR A 96 3.850 -3.129 6.476 1.00 23.53 O ATOM 0 H TYR A 96 9.129 -7.117 5.841 1.00 42.34 H new ATOM 0 HA TYR A 96 6.683 -8.439 6.333 1.00 52.14 H new ATOM 0 HB2 TYR A 96 7.978 -6.938 4.075 1.00 65.32 H new ATOM 0 HB3 TYR A 96 6.539 -7.874 3.722 1.00 65.32 H new ATOM 0 HD1 TYR A 96 4.595 -7.498 5.631 1.00 44.35 H new ATOM 0 HD2 TYR A 96 7.632 -4.699 4.581 1.00 24.12 H new ATOM 0 HE1 TYR A 96 3.197 -5.665 6.476 1.00 31.43 H new ATOM 0 HE2 TYR A 96 6.236 -2.865 5.429 1.00 43.54 H new ATOM 0 HH TYR A 96 4.323 -2.278 6.362 1.00 23.53 H new ATOM 1489 N ARG A 97 8.803 -9.973 4.337 1.00 73.51 N ATOM 1490 CA ARG A 97 9.099 -11.253 3.705 1.00 43.41 C ATOM 1491 C ARG A 97 9.163 -12.367 4.747 1.00 22.14 C ATOM 1492 O ARG A 97 8.832 -13.517 4.461 1.00 74.24 O ATOM 1493 CB ARG A 97 10.424 -11.169 2.938 1.00 34.15 C ATOM 1494 CG ARG A 97 10.918 -12.509 2.413 1.00 41.54 C ATOM 1495 CD ARG A 97 11.978 -13.107 3.325 1.00 53.11 C ATOM 1496 NE ARG A 97 12.992 -13.846 2.576 1.00 12.45 N ATOM 1497 CZ ARG A 97 13.910 -14.625 3.143 1.00 62.34 C ATOM 1498 NH1 ARG A 97 13.944 -14.772 4.461 1.00 2.42 N ATOM 1499 NH2 ARG A 97 14.797 -15.260 2.388 1.00 3.34 N ATOM 0 H ARG A 97 9.545 -9.279 4.252 1.00 73.51 H new ATOM 0 HA ARG A 97 8.298 -11.484 3.003 1.00 43.41 H new ATOM 0 HB2 ARG A 97 10.304 -10.483 2.099 1.00 34.15 H new ATOM 0 HB3 ARG A 97 11.185 -10.743 3.592 1.00 34.15 H new ATOM 0 HG2 ARG A 97 10.079 -13.199 2.327 1.00 41.54 H new ATOM 0 HG3 ARG A 97 11.329 -12.380 1.412 1.00 41.54 H new ATOM 0 HD2 ARG A 97 12.457 -12.311 3.895 1.00 53.11 H new ATOM 0 HD3 ARG A 97 11.503 -13.773 4.045 1.00 53.11 H new ATOM 0 HE ARG A 97 12.996 -13.760 1.560 1.00 12.45 H new ATOM 0 HH11 ARG A 97 13.264 -14.287 5.046 1.00 2.42 H new ATOM 0 HH12 ARG A 97 14.650 -15.371 4.889 1.00 2.42 H new ATOM 0 HH21 ARG A 97 14.775 -15.151 1.374 1.00 3.34 H new ATOM 0 HH22 ARG A 97 15.501 -15.857 2.821 1.00 3.34 H new ATOM 1513 N GLU A 98 9.593 -12.016 5.956 1.00 65.24 N ATOM 1514 CA GLU A 98 9.702 -12.984 7.040 1.00 70.10 C ATOM 1515 C GLU A 98 8.334 -13.551 7.408 1.00 4.15 C ATOM 1516 O GLU A 98 8.204 -14.738 7.712 1.00 2.43 O ATOM 1517 CB GLU A 98 10.344 -12.335 8.268 1.00 71.15 C ATOM 1518 CG GLU A 98 11.863 -12.391 8.263 1.00 74.33 C ATOM 1519 CD GLU A 98 12.406 -13.559 9.063 1.00 24.22 C ATOM 1520 OE1 GLU A 98 11.985 -14.705 8.800 1.00 24.25 O ATOM 1521 OE2 GLU A 98 13.251 -13.327 9.952 1.00 71.25 O ATOM 0 H GLU A 98 9.871 -11.068 6.208 1.00 65.24 H new ATOM 0 HA GLU A 98 10.333 -13.804 6.697 1.00 70.10 H new ATOM 0 HB2 GLU A 98 10.028 -11.294 8.325 1.00 71.15 H new ATOM 0 HB3 GLU A 98 9.974 -12.830 9.166 1.00 71.15 H new ATOM 0 HG2 GLU A 98 12.217 -12.464 7.235 1.00 74.33 H new ATOM 0 HG3 GLU A 98 12.259 -11.461 8.671 1.00 74.33 H new ATOM 1528 N GLN A 99 7.317 -12.697 7.378 1.00 42.13 N ATOM 1529 CA GLN A 99 5.957 -13.113 7.709 1.00 0.54 C ATOM 1530 C GLN A 99 5.486 -14.226 6.778 1.00 74.31 C ATOM 1531 O GLN A 99 4.812 -15.163 7.207 1.00 43.42 O ATOM 1532 CB GLN A 99 5.003 -11.920 7.624 1.00 13.12 C ATOM 1533 CG GLN A 99 4.617 -11.353 8.980 1.00 73.05 C ATOM 1534 CD GLN A 99 3.329 -11.947 9.515 1.00 11.30 C ATOM 1535 OE1 GLN A 99 3.288 -13.111 9.913 1.00 73.51 O ATOM 1536 NE2 GLN A 99 2.269 -11.148 9.525 1.00 41.45 N ATOM 0 H GLN A 99 7.407 -11.712 7.128 1.00 42.13 H new ATOM 0 HA GLN A 99 5.958 -13.496 8.729 1.00 0.54 H new ATOM 0 HB2 GLN A 99 5.469 -11.134 7.030 1.00 13.12 H new ATOM 0 HB3 GLN A 99 4.099 -12.225 7.096 1.00 13.12 H new ATOM 0 HG2 GLN A 99 5.422 -11.541 9.691 1.00 73.05 H new ATOM 0 HG3 GLN A 99 4.508 -10.271 8.900 1.00 73.05 H new ATOM 0 HE21 GLN A 99 2.350 -10.190 9.185 1.00 41.45 H new ATOM 0 HE22 GLN A 99 1.374 -11.492 9.873 1.00 41.45 H new ATOM 1545 N ILE A 100 5.844 -14.116 5.503 1.00 22.25 N ATOM 1546 CA ILE A 100 5.457 -15.112 4.512 1.00 43.21 C ATOM 1547 C ILE A 100 6.008 -16.489 4.873 1.00 3.33 C ATOM 1548 O ILE A 100 5.313 -17.498 4.754 1.00 21.51 O ATOM 1549 CB ILE A 100 5.952 -14.719 3.104 1.00 62.00 C ATOM 1550 CG1 ILE A 100 5.394 -13.351 2.707 1.00 11.24 C ATOM 1551 CG2 ILE A 100 5.555 -15.775 2.081 1.00 62.45 C ATOM 1552 CD1 ILE A 100 6.062 -12.753 1.488 1.00 2.41 C ATOM 0 H ILE A 100 6.402 -13.347 5.132 1.00 22.25 H new ATOM 0 HA ILE A 100 4.368 -15.153 4.507 1.00 43.21 H new ATOM 0 HB ILE A 100 7.040 -14.657 3.126 1.00 62.00 H new ATOM 0 HG12 ILE A 100 4.325 -13.446 2.515 1.00 11.24 H new ATOM 0 HG13 ILE A 100 5.507 -12.665 3.546 1.00 11.24 H new ATOM 0 HG21 ILE A 100 5.913 -15.479 1.095 1.00 62.45 H new ATOM 0 HG22 ILE A 100 5.998 -16.732 2.356 1.00 62.45 H new ATOM 0 HG23 ILE A 100 4.469 -15.870 2.059 1.00 62.45 H new ATOM 0 HD11 ILE A 100 5.615 -11.784 1.267 1.00 2.41 H new ATOM 0 HD12 ILE A 100 7.127 -12.625 1.683 1.00 2.41 H new ATOM 0 HD13 ILE A 100 5.926 -13.419 0.636 1.00 2.41 H new ATOM 1564 N LYS A 101 7.261 -16.524 5.315 1.00 22.42 N ATOM 1565 CA LYS A 101 7.908 -17.776 5.691 1.00 11.41 C ATOM 1566 C LYS A 101 7.130 -18.486 6.796 1.00 4.41 C ATOM 1567 O LYS A 101 7.053 -19.714 6.823 1.00 54.12 O ATOM 1568 CB LYS A 101 9.343 -17.514 6.152 1.00 45.45 C ATOM 1569 CG LYS A 101 10.352 -17.481 5.014 1.00 50.43 C ATOM 1570 CD LYS A 101 10.480 -16.086 4.419 1.00 73.25 C ATOM 1571 CE LYS A 101 9.949 -16.032 2.994 1.00 75.32 C ATOM 1572 NZ LYS A 101 11.043 -15.864 1.997 1.00 62.00 N ATOM 0 H LYS A 101 7.850 -15.698 5.422 1.00 22.42 H new ATOM 0 HA LYS A 101 7.925 -18.422 4.813 1.00 11.41 H new ATOM 0 HB2 LYS A 101 9.377 -16.563 6.684 1.00 45.45 H new ATOM 0 HB3 LYS A 101 9.634 -18.288 6.862 1.00 45.45 H new ATOM 0 HG2 LYS A 101 11.324 -17.812 5.379 1.00 50.43 H new ATOM 0 HG3 LYS A 101 10.048 -18.182 4.237 1.00 50.43 H new ATOM 0 HD2 LYS A 101 9.934 -15.375 5.038 1.00 73.25 H new ATOM 0 HD3 LYS A 101 11.526 -15.780 4.430 1.00 73.25 H new ATOM 0 HE2 LYS A 101 9.398 -16.947 2.777 1.00 75.32 H new ATOM 0 HE3 LYS A 101 9.244 -15.206 2.901 1.00 75.32 H new ATOM 0 HZ1 LYS A 101 10.911 -16.542 1.220 1.00 62.00 H new ATOM 0 HZ2 LYS A 101 11.022 -14.895 1.619 1.00 62.00 H new ATOM 0 HZ3 LYS A 101 11.960 -16.037 2.456 1.00 62.00 H new ATOM 1586 N ARG A 102 6.557 -17.707 7.709 1.00 71.14 N ATOM 1587 CA ARG A 102 5.789 -18.265 8.816 1.00 1.14 C ATOM 1588 C ARG A 102 4.490 -18.893 8.322 1.00 73.24 C ATOM 1589 O ARG A 102 4.249 -20.083 8.525 1.00 53.34 O ATOM 1590 CB ARG A 102 5.487 -17.178 9.850 1.00 14.14 C ATOM 1591 CG ARG A 102 5.862 -17.571 11.268 1.00 23.24 C ATOM 1592 CD ARG A 102 5.839 -16.376 12.208 1.00 64.31 C ATOM 1593 NE ARG A 102 5.006 -16.620 13.383 1.00 1.11 N ATOM 1594 CZ ARG A 102 3.678 -16.535 13.381 1.00 14.40 C ATOM 1595 NH1 ARG A 102 3.027 -16.214 12.270 1.00 13.31 N ATOM 1596 NH2 ARG A 102 2.998 -16.773 14.494 1.00 23.12 N ATOM 0 H ARG A 102 6.610 -16.688 7.704 1.00 71.14 H new ATOM 0 HA ARG A 102 6.388 -19.046 9.283 1.00 1.14 H new ATOM 0 HB2 ARG A 102 6.025 -16.270 9.579 1.00 14.14 H new ATOM 0 HB3 ARG A 102 4.424 -16.941 9.816 1.00 14.14 H new ATOM 0 HG2 ARG A 102 5.170 -18.332 11.630 1.00 23.24 H new ATOM 0 HG3 ARG A 102 6.856 -18.017 11.271 1.00 23.24 H new ATOM 0 HD2 ARG A 102 6.856 -16.145 12.526 1.00 64.31 H new ATOM 0 HD3 ARG A 102 5.466 -15.502 11.674 1.00 64.31 H new ATOM 0 HE ARG A 102 5.470 -16.870 14.256 1.00 1.11 H new ATOM 0 HH11 ARG A 102 3.545 -16.031 11.410 1.00 13.31 H new ATOM 0 HH12 ARG A 102 2.009 -16.151 12.276 1.00 13.31 H new ATOM 0 HH21 ARG A 102 3.493 -17.021 15.351 1.00 23.12 H new ATOM 0 HH22 ARG A 102 1.980 -16.708 14.493 1.00 23.12 H new ATOM 1610 N VAL A 103 3.655 -18.087 7.674 1.00 74.44 N ATOM 1611 CA VAL A 103 2.383 -18.566 7.153 1.00 12.33 C ATOM 1612 C VAL A 103 2.590 -19.703 6.158 1.00 21.43 C ATOM 1613 O VAL A 103 2.104 -20.815 6.360 1.00 1.31 O ATOM 1614 CB VAL A 103 1.598 -17.429 6.472 1.00 71.35 C ATOM 1615 CG1 VAL A 103 0.252 -17.928 5.971 1.00 63.32 C ATOM 1616 CG2 VAL A 103 1.420 -16.259 7.429 1.00 51.42 C ATOM 0 H VAL A 103 3.838 -17.099 7.498 1.00 74.44 H new ATOM 0 HA VAL A 103 1.807 -18.936 8.001 1.00 12.33 H new ATOM 0 HB VAL A 103 2.170 -17.083 5.611 1.00 71.35 H new ATOM 0 HG11 VAL A 103 -0.285 -17.108 5.494 1.00 63.32 H new ATOM 0 HG12 VAL A 103 0.407 -18.730 5.249 1.00 63.32 H new ATOM 0 HG13 VAL A 103 -0.332 -18.304 6.811 1.00 63.32 H new ATOM 0 HG21 VAL A 103 0.863 -15.464 6.932 1.00 51.42 H new ATOM 0 HG22 VAL A 103 0.871 -16.590 8.311 1.00 51.42 H new ATOM 0 HG23 VAL A 103 2.398 -15.883 7.730 1.00 51.42 H new ATOM 1626 N LYS A 104 3.318 -19.416 5.083 1.00 63.10 N ATOM 1627 CA LYS A 104 3.592 -20.415 4.058 1.00 41.24 C ATOM 1628 C LYS A 104 4.351 -21.602 4.645 1.00 70.52 C ATOM 1629 O LYS A 104 4.287 -22.713 4.118 1.00 33.11 O ATOM 1630 CB LYS A 104 4.397 -19.795 2.914 1.00 63.22 C ATOM 1631 CG LYS A 104 3.728 -18.584 2.287 1.00 74.42 C ATOM 1632 CD LYS A 104 2.475 -18.975 1.518 1.00 51.41 C ATOM 1633 CE LYS A 104 2.783 -19.261 0.057 1.00 12.32 C ATOM 1634 NZ LYS A 104 2.101 -20.494 -0.424 1.00 62.42 N ATOM 0 H LYS A 104 3.728 -18.500 4.900 1.00 63.10 H new ATOM 0 HA LYS A 104 2.638 -20.772 3.670 1.00 41.24 H new ATOM 0 HB2 LYS A 104 5.379 -19.505 3.287 1.00 63.22 H new ATOM 0 HB3 LYS A 104 4.559 -20.549 2.144 1.00 63.22 H new ATOM 0 HG2 LYS A 104 3.469 -17.866 3.065 1.00 74.42 H new ATOM 0 HG3 LYS A 104 4.428 -18.087 1.615 1.00 74.42 H new ATOM 0 HD2 LYS A 104 2.027 -19.857 1.976 1.00 51.41 H new ATOM 0 HD3 LYS A 104 1.740 -18.173 1.586 1.00 51.41 H new ATOM 0 HE2 LYS A 104 2.471 -18.413 -0.552 1.00 12.32 H new ATOM 0 HE3 LYS A 104 3.860 -19.368 -0.073 1.00 12.32 H new ATOM 0 HZ1 LYS A 104 2.337 -20.653 -1.424 1.00 62.42 H new ATOM 0 HZ2 LYS A 104 2.417 -21.308 0.140 1.00 62.42 H new ATOM 0 HZ3 LYS A 104 1.072 -20.383 -0.325 1.00 62.42 H new ATOM 1648 N ASP A 105 5.070 -21.360 5.736 1.00 62.15 N ATOM 1649 CA ASP A 105 5.841 -22.410 6.392 1.00 52.45 C ATOM 1650 C ASP A 105 6.914 -22.956 5.457 1.00 62.15 C ATOM 1651 O ASP A 105 7.144 -24.164 5.395 1.00 21.43 O ATOM 1652 CB ASP A 105 4.917 -23.541 6.848 1.00 40.25 C ATOM 1653 CG ASP A 105 5.590 -24.478 7.832 1.00 73.21 C ATOM 1654 OD1 ASP A 105 6.838 -24.474 7.897 1.00 30.21 O ATOM 1655 OD2 ASP A 105 4.870 -25.215 8.537 1.00 71.44 O ATOM 0 H ASP A 105 5.135 -20.446 6.185 1.00 62.15 H new ATOM 0 HA ASP A 105 6.330 -21.979 7.265 1.00 52.45 H new ATOM 0 HB2 ASP A 105 4.026 -23.115 7.308 1.00 40.25 H new ATOM 0 HB3 ASP A 105 4.586 -24.109 5.978 1.00 40.25 H new ATOM 1660 N SER A 106 7.568 -22.056 4.729 1.00 12.25 N ATOM 1661 CA SER A 106 8.618 -22.444 3.795 1.00 32.53 C ATOM 1662 C SER A 106 9.542 -21.267 3.498 1.00 14.44 C ATOM 1663 O SER A 106 9.087 -20.182 3.140 1.00 72.04 O ATOM 1664 CB SER A 106 8.004 -22.966 2.495 1.00 42.31 C ATOM 1665 OG SER A 106 7.845 -24.374 2.535 1.00 71.01 O ATOM 0 H SER A 106 7.389 -21.053 4.768 1.00 12.25 H new ATOM 0 HA SER A 106 9.206 -23.238 4.255 1.00 32.53 H new ATOM 0 HB2 SER A 106 7.036 -22.492 2.330 1.00 42.31 H new ATOM 0 HB3 SER A 106 8.640 -22.693 1.653 1.00 42.31 H new ATOM 0 HG SER A 106 7.573 -24.647 3.436 1.00 71.01 H new ATOM 1671 N ASP A 107 10.843 -21.492 3.650 1.00 13.34 N ATOM 1672 CA ASP A 107 11.833 -20.453 3.400 1.00 33.13 C ATOM 1673 C ASP A 107 11.874 -20.076 1.921 1.00 40.10 C ATOM 1674 O ASP A 107 12.275 -18.968 1.565 1.00 22.43 O ATOM 1675 CB ASP A 107 13.217 -20.918 3.857 1.00 5.20 C ATOM 1676 CG ASP A 107 13.696 -22.141 3.099 1.00 15.22 C ATOM 1677 OD1 ASP A 107 13.185 -23.247 3.374 1.00 12.43 O ATOM 1678 OD2 ASP A 107 14.582 -21.992 2.232 1.00 24.54 O ATOM 0 H ASP A 107 11.236 -22.386 3.945 1.00 13.34 H new ATOM 0 HA ASP A 107 11.544 -19.570 3.971 1.00 33.13 H new ATOM 0 HB2 ASP A 107 13.933 -20.107 3.722 1.00 5.20 H new ATOM 0 HB3 ASP A 107 13.188 -21.143 4.923 1.00 5.20 H new ATOM 1683 N ASP A 108 11.460 -21.005 1.063 1.00 75.14 N ATOM 1684 CA ASP A 108 11.454 -20.767 -0.375 1.00 22.34 C ATOM 1685 C ASP A 108 10.030 -20.662 -0.910 1.00 14.32 C ATOM 1686 O ASP A 108 9.394 -21.671 -1.213 1.00 74.42 O ATOM 1687 CB ASP A 108 12.202 -21.888 -1.101 1.00 14.44 C ATOM 1688 CG ASP A 108 11.785 -23.265 -0.624 1.00 2.55 C ATOM 1689 OD1 ASP A 108 10.811 -23.815 -1.178 1.00 71.44 O ATOM 1690 OD2 ASP A 108 12.433 -23.793 0.304 1.00 13.22 O ATOM 0 H ASP A 108 11.125 -21.928 1.340 1.00 75.14 H new ATOM 0 HA ASP A 108 11.960 -19.819 -0.560 1.00 22.34 H new ATOM 0 HB2 ASP A 108 12.020 -21.807 -2.173 1.00 14.44 H new ATOM 0 HB3 ASP A 108 13.274 -21.763 -0.949 1.00 14.44 H new ATOM 1695 N VAL A 109 9.537 -19.433 -1.031 1.00 1.42 N ATOM 1696 CA VAL A 109 8.189 -19.195 -1.535 1.00 55.04 C ATOM 1697 C VAL A 109 8.221 -18.301 -2.774 1.00 1.11 C ATOM 1698 O VAL A 109 9.143 -17.505 -2.951 1.00 24.33 O ATOM 1699 CB VAL A 109 7.288 -18.547 -0.465 1.00 20.02 C ATOM 1700 CG1 VAL A 109 7.197 -19.435 0.767 1.00 12.32 C ATOM 1701 CG2 VAL A 109 7.801 -17.162 -0.094 1.00 72.41 C ATOM 0 H VAL A 109 10.051 -18.587 -0.787 1.00 1.42 H new ATOM 0 HA VAL A 109 7.773 -20.167 -1.799 1.00 55.04 H new ATOM 0 HB VAL A 109 6.287 -18.437 -0.882 1.00 20.02 H new ATOM 0 HG11 VAL A 109 6.557 -18.961 1.511 1.00 12.32 H new ATOM 0 HG12 VAL A 109 6.776 -20.401 0.489 1.00 12.32 H new ATOM 0 HG13 VAL A 109 8.193 -19.580 1.185 1.00 12.32 H new ATOM 0 HG21 VAL A 109 7.150 -16.723 0.662 1.00 72.41 H new ATOM 0 HG22 VAL A 109 8.814 -17.243 0.301 1.00 72.41 H new ATOM 0 HG23 VAL A 109 7.807 -16.527 -0.980 1.00 72.41 H new ATOM 1711 N PRO A 110 7.211 -18.421 -3.652 1.00 54.55 N ATOM 1712 CA PRO A 110 7.131 -17.618 -4.877 1.00 51.30 C ATOM 1713 C PRO A 110 6.818 -16.153 -4.591 1.00 4.24 C ATOM 1714 O PRO A 110 5.674 -15.795 -4.314 1.00 42.34 O ATOM 1715 CB PRO A 110 5.986 -18.269 -5.655 1.00 23.10 C ATOM 1716 CG PRO A 110 5.135 -18.910 -4.615 1.00 70.23 C ATOM 1717 CD PRO A 110 6.071 -19.346 -3.520 1.00 70.43 C ATOM 0 HA PRO A 110 8.077 -17.605 -5.418 1.00 51.30 H new ATOM 0 HB2 PRO A 110 5.424 -17.529 -6.225 1.00 23.10 H new ATOM 0 HB3 PRO A 110 6.360 -19.004 -6.368 1.00 23.10 H new ATOM 0 HG2 PRO A 110 4.390 -18.210 -4.235 1.00 70.23 H new ATOM 0 HG3 PRO A 110 4.592 -19.761 -5.026 1.00 70.23 H new ATOM 0 HD2 PRO A 110 5.604 -19.269 -2.538 1.00 70.43 H new ATOM 0 HD3 PRO A 110 6.380 -20.384 -3.646 1.00 70.43 H new ATOM 1725 N MET A 111 7.845 -15.311 -4.659 1.00 31.25 N ATOM 1726 CA MET A 111 7.682 -13.883 -4.409 1.00 60.33 C ATOM 1727 C MET A 111 8.665 -13.070 -5.247 1.00 11.24 C ATOM 1728 O MET A 111 9.524 -13.629 -5.928 1.00 41.43 O ATOM 1729 CB MET A 111 7.887 -13.577 -2.923 1.00 63.44 C ATOM 1730 CG MET A 111 9.188 -14.128 -2.362 1.00 31.04 C ATOM 1731 SD MET A 111 9.659 -13.346 -0.808 1.00 31.03 S ATOM 1732 CE MET A 111 8.654 -14.267 0.353 1.00 25.32 C ATOM 0 H MET A 111 8.799 -15.593 -4.885 1.00 31.25 H new ATOM 0 HA MET A 111 6.668 -13.602 -4.694 1.00 60.33 H new ATOM 0 HB2 MET A 111 7.867 -12.497 -2.777 1.00 63.44 H new ATOM 0 HB3 MET A 111 7.053 -13.991 -2.357 1.00 63.44 H new ATOM 0 HG2 MET A 111 9.087 -15.202 -2.208 1.00 31.04 H new ATOM 0 HG3 MET A 111 9.984 -13.984 -3.093 1.00 31.04 H new ATOM 0 HE1 MET A 111 8.610 -13.731 1.301 1.00 25.32 H new ATOM 0 HE2 MET A 111 7.646 -14.379 -0.047 1.00 25.32 H new ATOM 0 HE3 MET A 111 9.093 -15.252 0.513 1.00 25.32 H new ATOM 1742 N VAL A 112 8.529 -11.748 -5.197 1.00 61.22 N ATOM 1743 CA VAL A 112 9.404 -10.863 -5.954 1.00 22.34 C ATOM 1744 C VAL A 112 9.646 -9.555 -5.209 1.00 54.22 C ATOM 1745 O VAL A 112 8.839 -9.146 -4.372 1.00 24.12 O ATOM 1746 CB VAL A 112 8.815 -10.546 -7.340 1.00 30.30 C ATOM 1747 CG1 VAL A 112 9.847 -9.844 -8.209 1.00 41.24 C ATOM 1748 CG2 VAL A 112 8.316 -11.817 -8.011 1.00 31.31 C ATOM 0 H VAL A 112 7.822 -11.268 -4.641 1.00 61.22 H new ATOM 0 HA VAL A 112 10.352 -11.387 -6.078 1.00 22.34 H new ATOM 0 HB VAL A 112 7.966 -9.875 -7.211 1.00 30.30 H new ATOM 0 HG11 VAL A 112 9.414 -9.627 -9.185 1.00 41.24 H new ATOM 0 HG12 VAL A 112 10.151 -8.912 -7.732 1.00 41.24 H new ATOM 0 HG13 VAL A 112 10.717 -10.489 -8.333 1.00 41.24 H new ATOM 0 HG21 VAL A 112 7.903 -11.574 -8.990 1.00 31.31 H new ATOM 0 HG22 VAL A 112 9.145 -12.515 -8.130 1.00 31.31 H new ATOM 0 HG23 VAL A 112 7.542 -12.274 -7.394 1.00 31.31 H new ATOM 1758 N LEU A 113 10.760 -8.900 -5.520 1.00 35.33 N ATOM 1759 CA LEU A 113 11.110 -7.637 -4.882 1.00 33.35 C ATOM 1760 C LEU A 113 11.172 -6.510 -5.906 1.00 64.04 C ATOM 1761 O LEU A 113 12.083 -6.457 -6.733 1.00 13.13 O ATOM 1762 CB LEU A 113 12.455 -7.759 -4.158 1.00 31.54 C ATOM 1763 CG LEU A 113 12.902 -6.515 -3.381 1.00 11.24 C ATOM 1764 CD1 LEU A 113 11.710 -5.800 -2.763 1.00 14.15 C ATOM 1765 CD2 LEU A 113 13.908 -6.895 -2.305 1.00 41.23 C ATOM 0 H LEU A 113 11.436 -9.224 -6.211 1.00 35.33 H new ATOM 0 HA LEU A 113 10.334 -7.401 -4.153 1.00 33.35 H new ATOM 0 HB2 LEU A 113 12.400 -8.598 -3.465 1.00 31.54 H new ATOM 0 HB3 LEU A 113 13.223 -8.002 -4.893 1.00 31.54 H new ATOM 0 HG LEU A 113 13.380 -5.832 -4.083 1.00 11.24 H new ATOM 0 HD11 LEU A 113 12.055 -4.922 -2.218 1.00 14.15 H new ATOM 0 HD12 LEU A 113 11.023 -5.491 -3.551 1.00 14.15 H new ATOM 0 HD13 LEU A 113 11.197 -6.474 -2.077 1.00 14.15 H new ATOM 0 HD21 LEU A 113 14.216 -6.001 -1.762 1.00 41.23 H new ATOM 0 HD22 LEU A 113 13.450 -7.601 -1.612 1.00 41.23 H new ATOM 0 HD23 LEU A 113 14.780 -7.356 -2.769 1.00 41.23 H new ATOM 1777 N VAL A 114 10.197 -5.609 -5.847 1.00 1.24 N ATOM 1778 CA VAL A 114 10.141 -4.483 -6.769 1.00 54.12 C ATOM 1779 C VAL A 114 10.585 -3.193 -6.089 1.00 70.14 C ATOM 1780 O VAL A 114 10.324 -2.980 -4.906 1.00 15.54 O ATOM 1781 CB VAL A 114 8.723 -4.289 -7.335 1.00 40.34 C ATOM 1782 CG1 VAL A 114 8.717 -3.206 -8.402 1.00 51.45 C ATOM 1783 CG2 VAL A 114 8.188 -5.601 -7.891 1.00 4.43 C ATOM 0 H VAL A 114 9.435 -5.638 -5.170 1.00 1.24 H new ATOM 0 HA VAL A 114 10.822 -4.712 -7.588 1.00 54.12 H new ATOM 0 HB VAL A 114 8.067 -3.970 -6.525 1.00 40.34 H new ATOM 0 HG11 VAL A 114 7.706 -3.083 -8.790 1.00 51.45 H new ATOM 0 HG12 VAL A 114 9.056 -2.265 -7.968 1.00 51.45 H new ATOM 0 HG13 VAL A 114 9.385 -3.492 -9.214 1.00 51.45 H new ATOM 0 HG21 VAL A 114 7.184 -5.446 -8.287 1.00 4.43 H new ATOM 0 HG22 VAL A 114 8.843 -5.952 -8.689 1.00 4.43 H new ATOM 0 HG23 VAL A 114 8.153 -6.346 -7.096 1.00 4.43 H new ATOM 1793 N GLY A 115 11.259 -2.334 -6.849 1.00 55.14 N ATOM 1794 CA GLY A 115 11.729 -1.073 -6.306 1.00 71.12 C ATOM 1795 C GLY A 115 10.996 0.119 -6.889 1.00 72.30 C ATOM 1796 O GLY A 115 11.478 0.755 -7.826 1.00 23.45 O ATOM 0 H GLY A 115 11.488 -2.489 -7.831 1.00 55.14 H new ATOM 0 HA2 GLY A 115 11.604 -1.078 -5.223 1.00 71.12 H new ATOM 0 HA3 GLY A 115 12.796 -0.971 -6.503 1.00 71.12 H new ATOM 1800 N ASN A 116 9.828 0.423 -6.333 1.00 21.15 N ATOM 1801 CA ASN A 116 9.026 1.547 -6.804 1.00 3.22 C ATOM 1802 C ASN A 116 9.795 2.858 -6.672 1.00 22.13 C ATOM 1803 O ASN A 116 10.863 2.904 -6.062 1.00 32.41 O ATOM 1804 CB ASN A 116 7.716 1.627 -6.017 1.00 72.52 C ATOM 1805 CG ASN A 116 6.596 2.252 -6.824 1.00 45.44 C ATOM 1806 OD1 ASN A 116 6.805 2.701 -7.952 1.00 0.32 O ATOM 1807 ND2 ASN A 116 5.399 2.286 -6.250 1.00 13.44 N ATOM 0 H ASN A 116 9.415 -0.093 -5.556 1.00 21.15 H new ATOM 0 HA ASN A 116 8.800 1.386 -7.858 1.00 3.22 H new ATOM 0 HB2 ASN A 116 7.421 0.625 -5.705 1.00 72.52 H new ATOM 0 HB3 ASN A 116 7.875 2.209 -5.109 1.00 72.52 H new ATOM 0 HD21 ASN A 116 4.607 2.696 -6.746 1.00 13.44 H new ATOM 0 HD22 ASN A 116 5.271 1.902 -5.314 1.00 13.44 H new ATOM 1814 N LYS A 117 9.246 3.924 -7.249 1.00 41.51 N ATOM 1815 CA LYS A 117 9.883 5.236 -7.193 1.00 11.14 C ATOM 1816 C LYS A 117 11.270 5.195 -7.829 1.00 33.31 C ATOM 1817 O LYS A 117 12.278 5.419 -7.159 1.00 2.34 O ATOM 1818 CB LYS A 117 9.989 5.712 -5.744 1.00 14.50 C ATOM 1819 CG LYS A 117 8.715 6.346 -5.212 1.00 32.52 C ATOM 1820 CD LYS A 117 8.835 6.681 -3.734 1.00 44.42 C ATOM 1821 CE LYS A 117 8.153 7.999 -3.401 1.00 4.03 C ATOM 1822 NZ LYS A 117 9.052 8.911 -2.642 1.00 52.44 N ATOM 0 H LYS A 117 8.363 3.905 -7.760 1.00 41.51 H new ATOM 0 HA LYS A 117 9.265 5.937 -7.755 1.00 11.14 H new ATOM 0 HB2 LYS A 117 10.254 4.865 -5.111 1.00 14.50 H new ATOM 0 HB3 LYS A 117 10.802 6.434 -5.667 1.00 14.50 H new ATOM 0 HG2 LYS A 117 8.496 7.253 -5.775 1.00 32.52 H new ATOM 0 HG3 LYS A 117 7.877 5.666 -5.365 1.00 32.52 H new ATOM 0 HD2 LYS A 117 8.391 5.881 -3.142 1.00 44.42 H new ATOM 0 HD3 LYS A 117 9.888 6.735 -3.457 1.00 44.42 H new ATOM 0 HE2 LYS A 117 7.835 8.486 -4.323 1.00 4.03 H new ATOM 0 HE3 LYS A 117 7.254 7.805 -2.816 1.00 4.03 H new ATOM 0 HZ1 LYS A 117 8.551 9.798 -2.434 1.00 52.44 H new ATOM 0 HZ2 LYS A 117 9.336 8.456 -1.751 1.00 52.44 H new ATOM 0 HZ3 LYS A 117 9.898 9.116 -3.210 1.00 52.44 H new ATOM 1836 N CYS A 118 11.316 4.907 -9.126 1.00 22.33 N ATOM 1837 CA CYS A 118 12.582 4.837 -9.846 1.00 72.55 C ATOM 1838 C CYS A 118 12.784 6.072 -10.717 1.00 60.32 C ATOM 1839 O CYS A 118 13.903 6.560 -10.871 1.00 32.53 O ATOM 1840 CB CYS A 118 12.636 3.576 -10.712 1.00 51.31 C ATOM 1841 SG CYS A 118 14.280 3.197 -11.361 1.00 32.23 S ATOM 0 H CYS A 118 10.493 4.719 -9.698 1.00 22.33 H new ATOM 0 HA CYS A 118 13.384 4.798 -9.109 1.00 72.55 H new ATOM 0 HB2 CYS A 118 12.285 2.728 -10.123 1.00 51.31 H new ATOM 0 HB3 CYS A 118 11.945 3.692 -11.547 1.00 51.31 H new ATOM 0 HG CYS A 118 14.891 2.386 -10.549 1.00 32.23 H new ATOM 1847 N ASP A 119 11.691 6.571 -11.284 1.00 44.11 N ATOM 1848 CA ASP A 119 11.743 7.749 -12.143 1.00 74.34 C ATOM 1849 C ASP A 119 12.075 9.004 -11.338 1.00 41.42 C ATOM 1850 O ASP A 119 12.579 9.985 -11.885 1.00 54.13 O ATOM 1851 CB ASP A 119 10.409 7.933 -12.867 1.00 62.42 C ATOM 1852 CG ASP A 119 10.486 8.976 -13.964 1.00 32.21 C ATOM 1853 OD1 ASP A 119 11.190 8.734 -14.967 1.00 51.41 O ATOM 1854 OD2 ASP A 119 9.841 10.036 -13.821 1.00 31.20 O ATOM 0 H ASP A 119 10.757 6.178 -11.164 1.00 44.11 H new ATOM 0 HA ASP A 119 12.533 7.595 -12.878 1.00 74.34 H new ATOM 0 HB2 ASP A 119 10.097 6.981 -13.296 1.00 62.42 H new ATOM 0 HB3 ASP A 119 9.645 8.223 -12.146 1.00 62.42 H new ATOM 1859 N LEU A 120 11.789 8.969 -10.038 1.00 73.00 N ATOM 1860 CA LEU A 120 12.058 10.107 -9.164 1.00 55.40 C ATOM 1861 C LEU A 120 13.516 10.550 -9.274 1.00 12.51 C ATOM 1862 O LEU A 120 14.294 9.969 -10.030 1.00 42.42 O ATOM 1863 CB LEU A 120 11.728 9.752 -7.713 1.00 62.42 C ATOM 1864 CG LEU A 120 10.236 9.611 -7.405 1.00 30.40 C ATOM 1865 CD1 LEU A 120 10.019 9.363 -5.922 1.00 13.21 C ATOM 1866 CD2 LEU A 120 9.479 10.851 -7.856 1.00 1.03 C ATOM 0 H LEU A 120 11.372 8.166 -9.568 1.00 73.00 H new ATOM 0 HA LEU A 120 11.423 10.934 -9.482 1.00 55.40 H new ATOM 0 HB2 LEU A 120 12.226 8.815 -7.462 1.00 62.42 H new ATOM 0 HB3 LEU A 120 12.147 10.520 -7.063 1.00 62.42 H new ATOM 0 HG LEU A 120 9.850 8.753 -7.956 1.00 30.40 H new ATOM 0 HD11 LEU A 120 8.952 9.265 -5.722 1.00 13.21 H new ATOM 0 HD12 LEU A 120 10.529 8.446 -5.628 1.00 13.21 H new ATOM 0 HD13 LEU A 120 10.420 10.200 -5.351 1.00 13.21 H new ATOM 0 HD21 LEU A 120 8.419 10.733 -7.629 1.00 1.03 H new ATOM 0 HD22 LEU A 120 9.867 11.725 -7.333 1.00 1.03 H new ATOM 0 HD23 LEU A 120 9.607 10.985 -8.930 1.00 1.03 H new ATOM 1878 N ALA A 121 13.879 11.580 -8.516 1.00 0.43 N ATOM 1879 CA ALA A 121 15.243 12.097 -8.534 1.00 44.12 C ATOM 1880 C ALA A 121 15.791 12.266 -7.120 1.00 15.31 C ATOM 1881 O ALA A 121 16.642 13.121 -6.873 1.00 1.54 O ATOM 1882 CB ALA A 121 15.296 13.420 -9.282 1.00 13.14 C ATOM 0 H ALA A 121 13.249 12.072 -7.883 1.00 0.43 H new ATOM 0 HA ALA A 121 15.870 11.371 -9.052 1.00 44.12 H new ATOM 0 HB1 ALA A 121 16.320 13.794 -9.287 1.00 13.14 H new ATOM 0 HB2 ALA A 121 14.958 13.272 -10.308 1.00 13.14 H new ATOM 0 HB3 ALA A 121 14.648 14.144 -8.788 1.00 13.14 H new ATOM 1888 N ALA A 122 15.298 11.449 -6.195 1.00 74.31 N ATOM 1889 CA ALA A 122 15.740 11.512 -4.808 1.00 31.14 C ATOM 1890 C ALA A 122 15.789 10.121 -4.182 1.00 11.50 C ATOM 1891 O ALA A 122 15.019 9.811 -3.273 1.00 21.22 O ATOM 1892 CB ALA A 122 14.822 12.422 -4.007 1.00 24.31 C ATOM 0 H ALA A 122 14.593 10.736 -6.381 1.00 74.31 H new ATOM 0 HA ALA A 122 16.749 11.923 -4.791 1.00 31.14 H new ATOM 0 HB1 ALA A 122 15.162 12.462 -2.972 1.00 24.31 H new ATOM 0 HB2 ALA A 122 14.841 13.425 -4.434 1.00 24.31 H new ATOM 0 HB3 ALA A 122 13.804 12.033 -4.040 1.00 24.31 H new ATOM 1898 N ARG A 123 16.698 9.286 -4.675 1.00 64.45 N ATOM 1899 CA ARG A 123 16.842 7.928 -4.162 1.00 30.35 C ATOM 1900 C ARG A 123 17.882 7.871 -3.044 1.00 41.32 C ATOM 1901 O ARG A 123 18.972 8.429 -3.169 1.00 33.31 O ATOM 1902 CB ARG A 123 17.228 6.967 -5.293 1.00 74.34 C ATOM 1903 CG ARG A 123 18.708 6.994 -5.647 1.00 31.33 C ATOM 1904 CD ARG A 123 19.021 6.068 -6.813 1.00 22.34 C ATOM 1905 NE ARG A 123 20.353 5.479 -6.701 1.00 31.15 N ATOM 1906 CZ ARG A 123 21.017 4.948 -7.725 1.00 73.33 C ATOM 1907 NH1 ARG A 123 20.478 4.929 -8.937 1.00 50.31 N ATOM 1908 NH2 ARG A 123 22.225 4.434 -7.537 1.00 44.22 N ATOM 0 H ARG A 123 17.344 9.525 -5.427 1.00 64.45 H new ATOM 0 HA ARG A 123 15.881 7.620 -3.750 1.00 30.35 H new ATOM 0 HB2 ARG A 123 16.952 5.953 -5.005 1.00 74.34 H new ATOM 0 HB3 ARG A 123 16.647 7.215 -6.181 1.00 74.34 H new ATOM 0 HG2 ARG A 123 19.004 8.012 -5.900 1.00 31.33 H new ATOM 0 HG3 ARG A 123 19.296 6.698 -4.778 1.00 31.33 H new ATOM 0 HD2 ARG A 123 18.276 5.274 -6.856 1.00 22.34 H new ATOM 0 HD3 ARG A 123 18.948 6.624 -7.748 1.00 22.34 H new ATOM 0 HE ARG A 123 20.800 5.474 -5.784 1.00 31.15 H new ATOM 0 HH11 ARG A 123 19.549 5.323 -9.088 1.00 50.31 H new ATOM 0 HH12 ARG A 123 20.992 4.521 -9.717 1.00 50.31 H new ATOM 0 HH21 ARG A 123 22.645 4.446 -6.608 1.00 44.22 H new ATOM 0 HH22 ARG A 123 22.734 4.027 -8.322 1.00 44.22 H new ATOM 1922 N THR A 124 17.539 7.188 -1.958 1.00 42.13 N ATOM 1923 CA THR A 124 18.442 7.052 -0.823 1.00 21.13 C ATOM 1924 C THR A 124 19.075 5.665 -0.803 1.00 52.12 C ATOM 1925 O THR A 124 20.218 5.496 -0.382 1.00 24.11 O ATOM 1926 CB THR A 124 17.692 7.303 0.486 1.00 71.05 C ATOM 1927 OG1 THR A 124 16.757 6.269 0.734 1.00 40.10 O ATOM 1928 CG2 THR A 124 16.939 8.615 0.500 1.00 1.00 C ATOM 0 H THR A 124 16.641 6.719 -1.840 1.00 42.13 H new ATOM 0 HA THR A 124 19.233 7.795 -0.925 1.00 21.13 H new ATOM 0 HB THR A 124 18.460 7.334 1.259 1.00 71.05 H new ATOM 0 HG1 THR A 124 16.929 5.877 1.615 1.00 40.10 H new ATOM 0 HG21 THR A 124 16.429 8.732 1.456 1.00 1.00 H new ATOM 0 HG22 THR A 124 17.640 9.438 0.360 1.00 1.00 H new ATOM 0 HG23 THR A 124 16.205 8.622 -0.306 1.00 1.00 H new ATOM 1936 N VAL A 125 18.319 4.674 -1.267 1.00 1.21 N ATOM 1937 CA VAL A 125 18.793 3.301 -1.309 1.00 70.44 C ATOM 1938 C VAL A 125 19.236 2.924 -2.720 1.00 75.10 C ATOM 1939 O VAL A 125 18.419 2.541 -3.556 1.00 74.25 O ATOM 1940 CB VAL A 125 17.696 2.326 -0.845 1.00 13.44 C ATOM 1941 CG1 VAL A 125 18.217 0.901 -0.831 1.00 14.34 C ATOM 1942 CG2 VAL A 125 17.176 2.722 0.529 1.00 35.45 C ATOM 0 H VAL A 125 17.371 4.801 -1.620 1.00 1.21 H new ATOM 0 HA VAL A 125 19.645 3.228 -0.633 1.00 70.44 H new ATOM 0 HB VAL A 125 16.869 2.379 -1.553 1.00 13.44 H new ATOM 0 HG11 VAL A 125 17.426 0.228 -0.500 1.00 14.34 H new ATOM 0 HG12 VAL A 125 18.536 0.620 -1.835 1.00 14.34 H new ATOM 0 HG13 VAL A 125 19.063 0.830 -0.148 1.00 14.34 H new ATOM 0 HG21 VAL A 125 16.401 2.021 0.841 1.00 35.45 H new ATOM 0 HG22 VAL A 125 17.995 2.701 1.248 1.00 35.45 H new ATOM 0 HG23 VAL A 125 16.759 3.728 0.484 1.00 35.45 H new ATOM 1952 N GLU A 126 20.536 3.039 -2.978 1.00 21.02 N ATOM 1953 CA GLU A 126 21.090 2.713 -4.289 1.00 64.44 C ATOM 1954 C GLU A 126 20.629 1.334 -4.755 1.00 50.54 C ATOM 1955 O GLU A 126 20.232 0.495 -3.947 1.00 34.52 O ATOM 1956 CB GLU A 126 22.619 2.772 -4.254 1.00 24.01 C ATOM 1957 CG GLU A 126 23.233 2.060 -3.060 1.00 14.33 C ATOM 1958 CD GLU A 126 24.745 1.978 -3.148 1.00 64.41 C ATOM 1959 OE1 GLU A 126 25.266 1.837 -4.273 1.00 30.02 O ATOM 1960 OE2 GLU A 126 25.406 2.057 -2.092 1.00 13.44 O ATOM 0 H GLU A 126 21.226 3.356 -2.296 1.00 21.02 H new ATOM 0 HA GLU A 126 20.723 3.454 -5.000 1.00 64.44 H new ATOM 0 HB2 GLU A 126 23.011 2.330 -5.170 1.00 24.01 H new ATOM 0 HB3 GLU A 126 22.933 3.816 -4.244 1.00 24.01 H new ATOM 0 HG2 GLU A 126 22.953 2.583 -2.146 1.00 14.33 H new ATOM 0 HG3 GLU A 126 22.821 1.053 -2.990 1.00 14.33 H new ATOM 1967 N SER A 127 20.678 1.114 -6.066 1.00 65.14 N ATOM 1968 CA SER A 127 20.260 -0.159 -6.648 1.00 31.12 C ATOM 1969 C SER A 127 21.002 -1.333 -6.015 1.00 43.43 C ATOM 1970 O SER A 127 20.389 -2.325 -5.620 1.00 41.21 O ATOM 1971 CB SER A 127 20.494 -0.149 -8.159 1.00 61.51 C ATOM 1972 OG SER A 127 20.423 -1.459 -8.695 1.00 12.00 O ATOM 0 H SER A 127 21.003 1.801 -6.746 1.00 65.14 H new ATOM 0 HA SER A 127 19.196 -0.284 -6.447 1.00 31.12 H new ATOM 0 HB2 SER A 127 19.750 0.485 -8.641 1.00 61.51 H new ATOM 0 HB3 SER A 127 21.471 0.284 -8.376 1.00 61.51 H new ATOM 0 HG SER A 127 20.574 -1.425 -9.663 1.00 12.00 H new ATOM 1978 N ARG A 128 22.324 -1.218 -5.924 1.00 45.22 N ATOM 1979 CA ARG A 128 23.144 -2.276 -5.343 1.00 64.33 C ATOM 1980 C ARG A 128 22.666 -2.635 -3.938 1.00 43.32 C ATOM 1981 O ARG A 128 22.728 -3.793 -3.526 1.00 12.33 O ATOM 1982 CB ARG A 128 24.618 -1.853 -5.316 1.00 14.44 C ATOM 1983 CG ARG A 128 25.005 -1.017 -4.105 1.00 23.34 C ATOM 1984 CD ARG A 128 25.510 -1.890 -2.967 1.00 54.32 C ATOM 1985 NE ARG A 128 25.201 -1.321 -1.657 1.00 73.33 N ATOM 1986 CZ ARG A 128 25.955 -0.408 -1.048 1.00 41.53 C ATOM 1987 NH1 ARG A 128 27.057 0.052 -1.629 1.00 13.20 N ATOM 1988 NH2 ARG A 128 25.605 0.049 0.147 1.00 12.01 N ATOM 0 H ARG A 128 22.849 -0.404 -6.245 1.00 45.22 H new ATOM 0 HA ARG A 128 23.044 -3.163 -5.968 1.00 64.33 H new ATOM 0 HB2 ARG A 128 25.241 -2.747 -5.341 1.00 14.44 H new ATOM 0 HB3 ARG A 128 24.838 -1.286 -6.220 1.00 14.44 H new ATOM 0 HG2 ARG A 128 25.777 -0.301 -4.387 1.00 23.34 H new ATOM 0 HG3 ARG A 128 24.143 -0.440 -3.769 1.00 23.34 H new ATOM 0 HD2 ARG A 128 25.063 -2.881 -3.046 1.00 54.32 H new ATOM 0 HD3 ARG A 128 26.588 -2.018 -3.061 1.00 54.32 H new ATOM 0 HE ARG A 128 24.358 -1.642 -1.181 1.00 73.33 H new ATOM 0 HH11 ARG A 128 27.331 -0.294 -2.548 1.00 13.20 H new ATOM 0 HH12 ARG A 128 27.629 0.751 -1.156 1.00 13.20 H new ATOM 0 HH21 ARG A 128 24.759 -0.299 0.598 1.00 12.01 H new ATOM 0 HH22 ARG A 128 26.182 0.748 0.615 1.00 12.01 H new ATOM 2002 N GLN A 129 22.189 -1.633 -3.208 1.00 55.22 N ATOM 2003 CA GLN A 129 21.699 -1.840 -1.850 1.00 51.12 C ATOM 2004 C GLN A 129 20.432 -2.687 -1.855 1.00 25.33 C ATOM 2005 O GLN A 129 20.180 -3.451 -0.923 1.00 23.13 O ATOM 2006 CB GLN A 129 21.418 -0.495 -1.177 1.00 44.51 C ATOM 2007 CG GLN A 129 21.069 -0.614 0.297 1.00 61.20 C ATOM 2008 CD GLN A 129 21.211 0.701 1.038 1.00 62.11 C ATOM 2009 OE1 GLN A 129 21.711 1.684 0.491 1.00 14.44 O ATOM 2010 NE2 GLN A 129 20.771 0.724 2.290 1.00 44.01 N ATOM 0 H GLN A 129 22.131 -0.668 -3.534 1.00 55.22 H new ATOM 0 HA GLN A 129 22.470 -2.368 -1.289 1.00 51.12 H new ATOM 0 HB2 GLN A 129 22.294 0.145 -1.284 1.00 44.51 H new ATOM 0 HB3 GLN A 129 20.597 -0.002 -1.698 1.00 44.51 H new ATOM 0 HG2 GLN A 129 20.045 -0.974 0.396 1.00 61.20 H new ATOM 0 HG3 GLN A 129 21.715 -1.360 0.760 1.00 61.20 H new ATOM 0 HE21 GLN A 129 20.364 -0.115 2.703 1.00 44.01 H new ATOM 0 HE22 GLN A 129 20.840 1.581 2.839 1.00 44.01 H new ATOM 2019 N ALA A 130 19.638 -2.546 -2.910 1.00 72.33 N ATOM 2020 CA ALA A 130 18.396 -3.296 -3.036 1.00 75.05 C ATOM 2021 C ALA A 130 18.657 -4.717 -3.523 1.00 1.42 C ATOM 2022 O ALA A 130 17.913 -5.642 -3.197 1.00 40.24 O ATOM 2023 CB ALA A 130 17.441 -2.580 -3.980 1.00 1.03 C ATOM 0 H ALA A 130 19.833 -1.919 -3.690 1.00 72.33 H new ATOM 0 HA ALA A 130 17.937 -3.358 -2.049 1.00 75.05 H new ATOM 0 HB1 ALA A 130 16.517 -3.152 -4.065 1.00 1.03 H new ATOM 0 HB2 ALA A 130 17.219 -1.587 -3.589 1.00 1.03 H new ATOM 0 HB3 ALA A 130 17.902 -2.488 -4.963 1.00 1.03 H new ATOM 2029 N GLN A 131 19.717 -4.883 -4.308 1.00 54.22 N ATOM 2030 CA GLN A 131 20.075 -6.192 -4.842 1.00 13.11 C ATOM 2031 C GLN A 131 20.679 -7.078 -3.757 1.00 50.25 C ATOM 2032 O GLN A 131 20.537 -8.301 -3.791 1.00 11.13 O ATOM 2033 CB GLN A 131 21.063 -6.039 -6.001 1.00 31.54 C ATOM 2034 CG GLN A 131 20.392 -5.933 -7.361 1.00 63.44 C ATOM 2035 CD GLN A 131 20.874 -6.990 -8.335 1.00 14.43 C ATOM 2036 OE1 GLN A 131 21.707 -6.720 -9.201 1.00 13.34 O ATOM 2037 NE2 GLN A 131 20.352 -8.203 -8.198 1.00 13.35 N ATOM 0 H GLN A 131 20.343 -4.128 -4.588 1.00 54.22 H new ATOM 0 HA GLN A 131 19.165 -6.668 -5.208 1.00 13.11 H new ATOM 0 HB2 GLN A 131 21.671 -5.150 -5.835 1.00 31.54 H new ATOM 0 HB3 GLN A 131 21.741 -6.892 -6.005 1.00 31.54 H new ATOM 0 HG2 GLN A 131 19.313 -6.024 -7.237 1.00 63.44 H new ATOM 0 HG3 GLN A 131 20.583 -4.945 -7.780 1.00 63.44 H new ATOM 0 HE21 GLN A 131 19.664 -8.383 -7.466 1.00 13.35 H new ATOM 0 HE22 GLN A 131 20.639 -8.955 -8.824 1.00 13.35 H new ATOM 2046 N ASP A 132 21.354 -6.455 -2.797 1.00 70.13 N ATOM 2047 CA ASP A 132 21.979 -7.189 -1.702 1.00 4.11 C ATOM 2048 C ASP A 132 20.944 -7.989 -0.919 1.00 41.25 C ATOM 2049 O ASP A 132 21.172 -9.148 -0.570 1.00 41.32 O ATOM 2050 CB ASP A 132 22.711 -6.225 -0.766 1.00 21.12 C ATOM 2051 CG ASP A 132 23.576 -6.948 0.247 1.00 63.43 C ATOM 2052 OD1 ASP A 132 23.068 -7.268 1.343 1.00 43.03 O ATOM 2053 OD2 ASP A 132 24.764 -7.194 -0.053 1.00 12.42 O ATOM 0 H ASP A 132 21.482 -5.444 -2.755 1.00 70.13 H new ATOM 0 HA ASP A 132 22.699 -7.886 -2.131 1.00 4.11 H new ATOM 0 HB2 ASP A 132 23.333 -5.552 -1.356 1.00 21.12 H new ATOM 0 HB3 ASP A 132 21.981 -5.608 -0.242 1.00 21.12 H new ATOM 2058 N LEU A 133 19.805 -7.363 -0.644 1.00 52.10 N ATOM 2059 CA LEU A 133 18.732 -8.015 0.100 1.00 5.32 C ATOM 2060 C LEU A 133 18.053 -9.083 -0.752 1.00 42.41 C ATOM 2061 O LEU A 133 17.851 -10.212 -0.303 1.00 21.30 O ATOM 2062 CB LEU A 133 17.705 -6.980 0.564 1.00 62.33 C ATOM 2063 CG LEU A 133 16.465 -7.552 1.252 1.00 61.42 C ATOM 2064 CD1 LEU A 133 16.733 -7.778 2.731 1.00 5.32 C ATOM 2065 CD2 LEU A 133 15.275 -6.623 1.060 1.00 64.11 C ATOM 0 H LEU A 133 19.600 -6.404 -0.925 1.00 52.10 H new ATOM 0 HA LEU A 133 19.168 -8.499 0.974 1.00 5.32 H new ATOM 0 HB2 LEU A 133 18.195 -6.289 1.250 1.00 62.33 H new ATOM 0 HB3 LEU A 133 17.385 -6.398 -0.300 1.00 62.33 H new ATOM 0 HG LEU A 133 16.229 -8.513 0.796 1.00 61.42 H new ATOM 0 HD11 LEU A 133 15.840 -8.185 3.205 1.00 5.32 H new ATOM 0 HD12 LEU A 133 17.558 -8.481 2.848 1.00 5.32 H new ATOM 0 HD13 LEU A 133 16.994 -6.830 3.202 1.00 5.32 H new ATOM 0 HD21 LEU A 133 14.401 -7.045 1.556 1.00 64.11 H new ATOM 0 HD22 LEU A 133 15.501 -5.648 1.491 1.00 64.11 H new ATOM 0 HD23 LEU A 133 15.069 -6.510 -0.004 1.00 64.11 H new ATOM 2077 N ALA A 134 17.702 -8.720 -1.980 1.00 3.03 N ATOM 2078 CA ALA A 134 17.044 -9.649 -2.891 1.00 41.13 C ATOM 2079 C ALA A 134 17.932 -10.854 -3.181 1.00 45.04 C ATOM 2080 O ALA A 134 17.473 -11.996 -3.152 1.00 1.34 O ATOM 2081 CB ALA A 134 16.672 -8.944 -4.187 1.00 24.14 C ATOM 0 H ALA A 134 17.862 -7.790 -2.368 1.00 3.03 H new ATOM 0 HA ALA A 134 16.134 -10.007 -2.410 1.00 41.13 H new ATOM 0 HB1 ALA A 134 16.182 -9.650 -4.857 1.00 24.14 H new ATOM 0 HB2 ALA A 134 15.994 -8.118 -3.970 1.00 24.14 H new ATOM 0 HB3 ALA A 134 17.573 -8.558 -4.663 1.00 24.14 H new ATOM 2087 N ARG A 135 19.206 -10.592 -3.460 1.00 20.51 N ATOM 2088 CA ARG A 135 20.159 -11.656 -3.755 1.00 34.02 C ATOM 2089 C ARG A 135 20.201 -12.679 -2.623 1.00 33.35 C ATOM 2090 O ARG A 135 20.232 -13.886 -2.866 1.00 10.12 O ATOM 2091 CB ARG A 135 21.555 -11.071 -3.980 1.00 74.33 C ATOM 2092 CG ARG A 135 22.606 -12.119 -4.312 1.00 21.25 C ATOM 2093 CD ARG A 135 23.605 -11.603 -5.336 1.00 3.23 C ATOM 2094 NE ARG A 135 24.368 -12.687 -5.950 1.00 1.33 N ATOM 2095 CZ ARG A 135 25.484 -12.504 -6.651 1.00 12.33 C ATOM 2096 NH1 ARG A 135 25.970 -11.282 -6.831 1.00 62.21 N ATOM 2097 NH2 ARG A 135 26.117 -13.546 -7.172 1.00 61.53 N ATOM 0 H ARG A 135 19.601 -9.652 -3.488 1.00 20.51 H new ATOM 0 HA ARG A 135 19.832 -12.160 -4.665 1.00 34.02 H new ATOM 0 HB2 ARG A 135 21.509 -10.344 -4.791 1.00 74.33 H new ATOM 0 HB3 ARG A 135 21.862 -10.531 -3.085 1.00 74.33 H new ATOM 0 HG2 ARG A 135 23.133 -12.408 -3.403 1.00 21.25 H new ATOM 0 HG3 ARG A 135 22.119 -13.015 -4.697 1.00 21.25 H new ATOM 0 HD2 ARG A 135 23.076 -11.048 -6.111 1.00 3.23 H new ATOM 0 HD3 ARG A 135 24.290 -10.905 -4.855 1.00 3.23 H new ATOM 0 HE ARG A 135 24.025 -13.641 -5.834 1.00 1.33 H new ATOM 0 HH11 ARG A 135 25.488 -10.477 -6.431 1.00 62.21 H new ATOM 0 HH12 ARG A 135 26.826 -11.148 -7.369 1.00 62.21 H new ATOM 0 HH21 ARG A 135 25.748 -14.487 -7.035 1.00 61.53 H new ATOM 0 HH22 ARG A 135 26.973 -13.406 -7.710 1.00 61.53 H new ATOM 2111 N SER A 136 20.194 -12.189 -1.389 1.00 54.13 N ATOM 2112 CA SER A 136 20.226 -13.060 -0.221 1.00 33.04 C ATOM 2113 C SER A 136 18.889 -13.770 -0.044 1.00 25.51 C ATOM 2114 O SER A 136 18.832 -14.897 0.451 1.00 4.03 O ATOM 2115 CB SER A 136 20.561 -12.254 1.036 1.00 11.31 C ATOM 2116 OG SER A 136 21.123 -13.083 2.039 1.00 52.32 O ATOM 0 H SER A 136 20.166 -11.193 -1.172 1.00 54.13 H new ATOM 0 HA SER A 136 21.001 -13.810 -0.376 1.00 33.04 H new ATOM 0 HB2 SER A 136 21.260 -11.457 0.785 1.00 11.31 H new ATOM 0 HB3 SER A 136 19.658 -11.777 1.418 1.00 11.31 H new ATOM 0 HG SER A 136 21.330 -12.544 2.831 1.00 52.32 H new ATOM 2122 N TYR A 137 17.815 -13.104 -0.452 1.00 61.24 N ATOM 2123 CA TYR A 137 16.475 -13.667 -0.344 1.00 2.11 C ATOM 2124 C TYR A 137 16.261 -14.772 -1.374 1.00 13.40 C ATOM 2125 O TYR A 137 15.413 -15.645 -1.195 1.00 72.11 O ATOM 2126 CB TYR A 137 15.426 -12.569 -0.526 1.00 41.20 C ATOM 2127 CG TYR A 137 15.101 -11.824 0.749 1.00 21.51 C ATOM 2128 CD1 TYR A 137 16.046 -11.691 1.760 1.00 42.34 C ATOM 2129 CD2 TYR A 137 13.850 -11.254 0.943 1.00 13.34 C ATOM 2130 CE1 TYR A 137 15.753 -11.012 2.926 1.00 13.43 C ATOM 2131 CE2 TYR A 137 13.550 -10.573 2.106 1.00 60.34 C ATOM 2132 CZ TYR A 137 14.503 -10.455 3.095 1.00 63.11 C ATOM 2133 OH TYR A 137 14.207 -9.777 4.256 1.00 0.42 O ATOM 0 H TYR A 137 17.847 -12.171 -0.862 1.00 61.24 H new ATOM 0 HA TYR A 137 16.368 -14.102 0.650 1.00 2.11 H new ATOM 0 HB2 TYR A 137 15.782 -11.858 -1.271 1.00 41.20 H new ATOM 0 HB3 TYR A 137 14.512 -13.013 -0.920 1.00 41.20 H new ATOM 0 HD1 TYR A 137 17.026 -12.126 1.631 1.00 42.34 H new ATOM 0 HD2 TYR A 137 13.099 -11.345 0.172 1.00 13.34 H new ATOM 0 HE1 TYR A 137 16.499 -10.918 3.701 1.00 13.43 H new ATOM 0 HE2 TYR A 137 12.572 -10.134 2.240 1.00 60.34 H new ATOM 0 HH TYR A 137 13.272 -9.940 4.501 1.00 0.42 H new ATOM 2143 N GLY A 138 17.035 -14.725 -2.456 1.00 0.12 N ATOM 2144 CA GLY A 138 16.912 -15.727 -3.498 1.00 45.02 C ATOM 2145 C GLY A 138 15.839 -15.384 -4.513 1.00 70.24 C ATOM 2146 O GLY A 138 15.401 -16.244 -5.277 1.00 75.22 O ATOM 0 H GLY A 138 17.743 -14.012 -2.628 1.00 0.12 H new ATOM 0 HA2 GLY A 138 17.869 -15.834 -4.009 1.00 45.02 H new ATOM 0 HA3 GLY A 138 16.683 -16.691 -3.044 1.00 45.02 H new ATOM 2150 N ILE A 139 15.410 -14.124 -4.522 1.00 72.42 N ATOM 2151 CA ILE A 139 14.380 -13.675 -5.450 1.00 4.44 C ATOM 2152 C ILE A 139 14.899 -12.566 -6.362 1.00 71.43 C ATOM 2153 O ILE A 139 15.858 -11.872 -6.025 1.00 14.12 O ATOM 2154 CB ILE A 139 13.138 -13.167 -4.709 1.00 71.50 C ATOM 2155 CG1 ILE A 139 13.549 -12.334 -3.499 1.00 13.14 C ATOM 2156 CG2 ILE A 139 12.257 -14.336 -4.288 1.00 3.52 C ATOM 2157 CD1 ILE A 139 12.375 -11.856 -2.688 1.00 73.15 C ATOM 0 H ILE A 139 15.760 -13.398 -3.897 1.00 72.42 H new ATOM 0 HA ILE A 139 14.107 -14.541 -6.054 1.00 4.44 H new ATOM 0 HB ILE A 139 12.562 -12.532 -5.382 1.00 71.50 H new ATOM 0 HG12 ILE A 139 14.206 -12.927 -2.863 1.00 13.14 H new ATOM 0 HG13 ILE A 139 14.125 -11.473 -3.837 1.00 13.14 H new ATOM 0 HG21 ILE A 139 11.379 -13.959 -3.763 1.00 3.52 H new ATOM 0 HG22 ILE A 139 11.941 -14.890 -5.172 1.00 3.52 H new ATOM 0 HG23 ILE A 139 12.819 -14.996 -3.627 1.00 3.52 H new ATOM 0 HD11 ILE A 139 12.732 -11.269 -1.842 1.00 73.15 H new ATOM 0 HD12 ILE A 139 11.730 -11.237 -3.312 1.00 73.15 H new ATOM 0 HD13 ILE A 139 11.812 -12.715 -2.323 1.00 73.15 H new ATOM 2169 N PRO A 140 14.264 -12.382 -7.532 1.00 3.43 N ATOM 2170 CA PRO A 140 14.663 -11.348 -8.490 1.00 74.33 C ATOM 2171 C PRO A 140 14.364 -9.943 -7.979 1.00 44.01 C ATOM 2172 O PRO A 140 13.641 -9.769 -6.998 1.00 3.31 O ATOM 2173 CB PRO A 140 13.816 -11.657 -9.727 1.00 35.23 C ATOM 2174 CG PRO A 140 12.625 -12.380 -9.199 1.00 22.34 C ATOM 2175 CD PRO A 140 13.108 -13.164 -8.010 1.00 55.23 C ATOM 0 HA PRO A 140 15.736 -11.363 -8.680 1.00 74.33 H new ATOM 0 HB2 PRO A 140 13.527 -10.744 -10.247 1.00 35.23 H new ATOM 0 HB3 PRO A 140 14.367 -12.269 -10.441 1.00 35.23 H new ATOM 0 HG2 PRO A 140 11.840 -11.681 -8.912 1.00 22.34 H new ATOM 0 HG3 PRO A 140 12.202 -13.041 -9.956 1.00 22.34 H new ATOM 0 HD2 PRO A 140 12.337 -13.250 -7.245 1.00 55.23 H new ATOM 0 HD3 PRO A 140 13.396 -14.178 -8.287 1.00 55.23 H new ATOM 2183 N TYR A 141 14.922 -8.944 -8.653 1.00 23.31 N ATOM 2184 CA TYR A 141 14.713 -7.553 -8.271 1.00 11.51 C ATOM 2185 C TYR A 141 14.398 -6.702 -9.497 1.00 2.30 C ATOM 2186 O TYR A 141 15.219 -6.575 -10.406 1.00 35.03 O ATOM 2187 CB TYR A 141 15.948 -7.005 -7.551 1.00 1.04 C ATOM 2188 CG TYR A 141 15.875 -5.522 -7.261 1.00 74.22 C ATOM 2189 CD1 TYR A 141 14.932 -5.012 -6.378 1.00 63.13 C ATOM 2190 CD2 TYR A 141 16.747 -4.632 -7.875 1.00 2.12 C ATOM 2191 CE1 TYR A 141 14.859 -3.658 -6.115 1.00 74.15 C ATOM 2192 CE2 TYR A 141 16.681 -3.276 -7.617 1.00 73.11 C ATOM 2193 CZ TYR A 141 15.736 -2.795 -6.736 1.00 25.24 C ATOM 2194 OH TYR A 141 15.666 -1.445 -6.476 1.00 3.22 O ATOM 0 H TYR A 141 15.523 -9.072 -9.467 1.00 23.31 H new ATOM 0 HA TYR A 141 13.863 -7.509 -7.590 1.00 11.51 H new ATOM 0 HB2 TYR A 141 16.079 -7.544 -6.613 1.00 1.04 H new ATOM 0 HB3 TYR A 141 16.830 -7.204 -8.159 1.00 1.04 H new ATOM 0 HD1 TYR A 141 14.244 -5.686 -5.889 1.00 63.13 H new ATOM 0 HD2 TYR A 141 17.489 -5.006 -8.565 1.00 2.12 H new ATOM 0 HE1 TYR A 141 14.119 -3.278 -5.427 1.00 74.15 H new ATOM 0 HE2 TYR A 141 17.366 -2.597 -8.103 1.00 73.11 H new ATOM 0 HH TYR A 141 16.354 -0.976 -6.993 1.00 3.22 H new ATOM 2204 N ILE A 142 13.200 -6.128 -9.520 1.00 61.12 N ATOM 2205 CA ILE A 142 12.772 -5.299 -10.634 1.00 71.52 C ATOM 2206 C ILE A 142 12.511 -3.863 -10.189 1.00 45.10 C ATOM 2207 O ILE A 142 11.921 -3.626 -9.135 1.00 64.10 O ATOM 2208 CB ILE A 142 11.494 -5.864 -11.281 1.00 63.21 C ATOM 2209 CG1 ILE A 142 11.640 -7.369 -11.528 1.00 63.01 C ATOM 2210 CG2 ILE A 142 11.192 -5.133 -12.577 1.00 50.11 C ATOM 2211 CD1 ILE A 142 10.678 -8.211 -10.717 1.00 3.11 C ATOM 0 H ILE A 142 12.509 -6.224 -8.776 1.00 61.12 H new ATOM 0 HA ILE A 142 13.581 -5.303 -11.365 1.00 71.52 H new ATOM 0 HB ILE A 142 10.659 -5.710 -10.597 1.00 63.21 H new ATOM 0 HG12 ILE A 142 11.484 -7.572 -12.587 1.00 63.01 H new ATOM 0 HG13 ILE A 142 12.661 -7.670 -11.293 1.00 63.01 H new ATOM 0 HG21 ILE A 142 10.286 -5.543 -13.023 1.00 50.11 H new ATOM 0 HG22 ILE A 142 11.047 -4.072 -12.371 1.00 50.11 H new ATOM 0 HG23 ILE A 142 12.026 -5.258 -13.268 1.00 50.11 H new ATOM 0 HD11 ILE A 142 10.838 -9.265 -10.943 1.00 3.11 H new ATOM 0 HD12 ILE A 142 10.849 -8.037 -9.655 1.00 3.11 H new ATOM 0 HD13 ILE A 142 9.653 -7.937 -10.969 1.00 3.11 H new ATOM 2223 N GLU A 143 12.953 -2.907 -10.999 1.00 64.32 N ATOM 2224 CA GLU A 143 12.764 -1.494 -10.689 1.00 44.51 C ATOM 2225 C GLU A 143 11.647 -0.904 -11.544 1.00 40.54 C ATOM 2226 O GLU A 143 11.614 -1.102 -12.759 1.00 33.22 O ATOM 2227 CB GLU A 143 14.064 -0.720 -10.917 1.00 33.22 C ATOM 2228 CG GLU A 143 14.886 -0.527 -9.653 1.00 53.01 C ATOM 2229 CD GLU A 143 16.309 -0.090 -9.943 1.00 62.13 C ATOM 2230 OE1 GLU A 143 17.146 -0.963 -10.257 1.00 23.23 O ATOM 2231 OE2 GLU A 143 16.585 1.125 -9.859 1.00 71.11 O ATOM 0 H GLU A 143 13.445 -3.084 -11.875 1.00 64.32 H new ATOM 0 HA GLU A 143 12.483 -1.408 -9.639 1.00 44.51 H new ATOM 0 HB2 GLU A 143 14.667 -1.248 -11.656 1.00 33.22 H new ATOM 0 HB3 GLU A 143 13.827 0.257 -11.339 1.00 33.22 H new ATOM 0 HG2 GLU A 143 14.403 0.218 -9.020 1.00 53.01 H new ATOM 0 HG3 GLU A 143 14.904 -1.460 -9.090 1.00 53.01 H new ATOM 2238 N THR A 144 10.729 -0.184 -10.905 1.00 3.12 N ATOM 2239 CA THR A 144 9.611 0.424 -11.617 1.00 3.23 C ATOM 2240 C THR A 144 9.177 1.732 -10.961 1.00 54.35 C ATOM 2241 O THR A 144 9.665 2.096 -9.891 1.00 51.11 O ATOM 2242 CB THR A 144 8.431 -0.546 -11.668 1.00 11.33 C ATOM 2243 OG1 THR A 144 7.819 -0.658 -10.395 1.00 72.35 O ATOM 2244 CG2 THR A 144 8.819 -1.938 -12.114 1.00 63.42 C ATOM 0 H THR A 144 10.737 -0.008 -9.900 1.00 3.12 H new ATOM 0 HA THR A 144 9.943 0.647 -12.631 1.00 3.23 H new ATOM 0 HB THR A 144 7.743 -0.126 -12.402 1.00 11.33 H new ATOM 0 HG1 THR A 144 7.065 -1.282 -10.448 1.00 72.35 H new ATOM 0 HG21 THR A 144 7.935 -2.575 -12.128 1.00 63.42 H new ATOM 0 HG22 THR A 144 9.250 -1.893 -13.114 1.00 63.42 H new ATOM 0 HG23 THR A 144 9.553 -2.351 -11.422 1.00 63.42 H new ATOM 2252 N SER A 145 8.253 2.431 -11.615 1.00 44.13 N ATOM 2253 CA SER A 145 7.741 3.698 -11.106 1.00 23.24 C ATOM 2254 C SER A 145 6.231 3.793 -11.309 1.00 12.42 C ATOM 2255 O SER A 145 5.718 3.458 -12.376 1.00 22.05 O ATOM 2256 CB SER A 145 8.435 4.870 -11.803 1.00 2.21 C ATOM 2257 OG SER A 145 8.738 5.904 -10.884 1.00 4.55 O ATOM 0 H SER A 145 7.843 2.139 -12.502 1.00 44.13 H new ATOM 0 HA SER A 145 7.951 3.744 -10.037 1.00 23.24 H new ATOM 0 HB2 SER A 145 9.352 4.522 -12.279 1.00 2.21 H new ATOM 0 HB3 SER A 145 7.793 5.259 -12.593 1.00 2.21 H new ATOM 0 HG SER A 145 8.284 6.728 -11.158 1.00 4.55 H new ATOM 2263 N ALA A 146 5.526 4.246 -10.277 1.00 73.02 N ATOM 2264 CA ALA A 146 4.074 4.379 -10.342 1.00 33.11 C ATOM 2265 C ALA A 146 3.652 5.640 -11.096 1.00 70.52 C ATOM 2266 O ALA A 146 2.477 5.808 -11.425 1.00 15.42 O ATOM 2267 CB ALA A 146 3.485 4.383 -8.940 1.00 45.54 C ATOM 0 H ALA A 146 5.936 4.527 -9.386 1.00 73.02 H new ATOM 0 HA ALA A 146 3.688 3.521 -10.893 1.00 33.11 H new ATOM 0 HB1 ALA A 146 2.401 4.483 -9.001 1.00 45.54 H new ATOM 0 HB2 ALA A 146 3.736 3.449 -8.437 1.00 45.54 H new ATOM 0 HB3 ALA A 146 3.895 5.220 -8.375 1.00 45.54 H new ATOM 2273 N LYS A 147 4.608 6.525 -11.367 1.00 21.34 N ATOM 2274 CA LYS A 147 4.316 7.764 -12.078 1.00 32.15 C ATOM 2275 C LYS A 147 4.551 7.604 -13.577 1.00 24.55 C ATOM 2276 O LYS A 147 3.706 7.976 -14.392 1.00 3.10 O ATOM 2277 CB LYS A 147 5.181 8.905 -11.535 1.00 15.21 C ATOM 2278 CG LYS A 147 4.574 10.283 -11.748 1.00 12.14 C ATOM 2279 CD LYS A 147 3.456 10.557 -10.756 1.00 71.34 C ATOM 2280 CE LYS A 147 2.957 11.991 -10.858 1.00 33.11 C ATOM 2281 NZ LYS A 147 1.515 12.052 -11.220 1.00 41.03 N ATOM 0 H LYS A 147 5.587 6.407 -11.106 1.00 21.34 H new ATOM 0 HA LYS A 147 3.265 8.004 -11.918 1.00 32.15 H new ATOM 0 HB2 LYS A 147 5.345 8.750 -10.469 1.00 15.21 H new ATOM 0 HB3 LYS A 147 6.159 8.869 -12.016 1.00 15.21 H new ATOM 0 HG2 LYS A 147 5.348 11.043 -11.644 1.00 12.14 H new ATOM 0 HG3 LYS A 147 4.187 10.358 -12.764 1.00 12.14 H new ATOM 0 HD2 LYS A 147 2.630 9.870 -10.939 1.00 71.34 H new ATOM 0 HD3 LYS A 147 3.812 10.366 -9.744 1.00 71.34 H new ATOM 0 HE2 LYS A 147 3.114 12.499 -9.906 1.00 33.11 H new ATOM 0 HE3 LYS A 147 3.542 12.527 -11.606 1.00 33.11 H new ATOM 0 HZ1 LYS A 147 1.214 13.046 -11.279 1.00 41.03 H new ATOM 0 HZ2 LYS A 147 1.368 11.590 -12.140 1.00 41.03 H new ATOM 0 HZ3 LYS A 147 0.954 11.563 -10.494 1.00 41.03 H new ATOM 2295 N THR A 148 5.706 7.052 -13.933 1.00 63.45 N ATOM 2296 CA THR A 148 6.057 6.847 -15.333 1.00 52.02 C ATOM 2297 C THR A 148 5.702 5.435 -15.802 1.00 43.24 C ATOM 2298 O THR A 148 5.947 5.080 -16.955 1.00 30.12 O ATOM 2299 CB THR A 148 7.550 7.103 -15.541 1.00 54.25 C ATOM 2300 OG1 THR A 148 8.315 6.415 -14.566 1.00 33.11 O ATOM 2301 CG2 THR A 148 7.922 8.568 -15.464 1.00 60.04 C ATOM 0 H THR A 148 6.415 6.738 -13.271 1.00 63.45 H new ATOM 0 HA THR A 148 5.478 7.554 -15.928 1.00 52.02 H new ATOM 0 HB THR A 148 7.769 6.741 -16.546 1.00 54.25 H new ATOM 0 HG1 THR A 148 9.147 6.093 -14.971 1.00 33.11 H new ATOM 0 HG21 THR A 148 8.995 8.680 -15.620 1.00 60.04 H new ATOM 0 HG22 THR A 148 7.384 9.121 -16.234 1.00 60.04 H new ATOM 0 HG23 THR A 148 7.655 8.960 -14.482 1.00 60.04 H new ATOM 2309 N ARG A 149 5.129 4.632 -14.904 1.00 65.31 N ATOM 2310 CA ARG A 149 4.740 3.259 -15.225 1.00 20.01 C ATOM 2311 C ARG A 149 5.817 2.548 -16.046 1.00 63.32 C ATOM 2312 O ARG A 149 5.545 2.023 -17.126 1.00 45.31 O ATOM 2313 CB ARG A 149 3.412 3.247 -15.985 1.00 41.54 C ATOM 2314 CG ARG A 149 3.451 4.018 -17.293 1.00 42.13 C ATOM 2315 CD ARG A 149 2.261 3.678 -18.174 1.00 41.10 C ATOM 2316 NE ARG A 149 2.299 2.293 -18.638 1.00 22.24 N ATOM 2317 CZ ARG A 149 1.651 1.852 -19.714 1.00 22.23 C ATOM 2318 NH1 ARG A 149 0.911 2.682 -20.440 1.00 61.52 N ATOM 2319 NH2 ARG A 149 1.739 0.576 -20.064 1.00 24.33 N ATOM 0 H ARG A 149 4.924 4.911 -13.945 1.00 65.31 H new ATOM 0 HA ARG A 149 4.622 2.721 -14.285 1.00 20.01 H new ATOM 0 HB2 ARG A 149 3.130 2.214 -16.190 1.00 41.54 H new ATOM 0 HB3 ARG A 149 2.635 3.669 -15.348 1.00 41.54 H new ATOM 0 HG2 ARG A 149 3.458 5.088 -17.086 1.00 42.13 H new ATOM 0 HG3 ARG A 149 4.375 3.790 -17.824 1.00 42.13 H new ATOM 0 HD2 ARG A 149 1.339 3.849 -17.619 1.00 41.10 H new ATOM 0 HD3 ARG A 149 2.244 4.348 -19.034 1.00 41.10 H new ATOM 0 HE ARG A 149 2.855 1.624 -18.106 1.00 22.24 H new ATOM 0 HH11 ARG A 149 0.837 3.664 -20.174 1.00 61.52 H new ATOM 0 HH12 ARG A 149 0.417 2.338 -21.263 1.00 61.52 H new ATOM 0 HH21 ARG A 149 2.303 -0.067 -19.509 1.00 24.33 H new ATOM 0 HH22 ARG A 149 1.243 0.238 -20.888 1.00 24.33 H new ATOM 2333 N GLN A 150 7.041 2.538 -15.528 1.00 34.12 N ATOM 2334 CA GLN A 150 8.155 1.895 -16.215 1.00 73.53 C ATOM 2335 C GLN A 150 8.454 0.523 -15.617 1.00 4.22 C ATOM 2336 O GLN A 150 8.755 0.405 -14.430 1.00 35.22 O ATOM 2337 CB GLN A 150 9.401 2.781 -16.140 1.00 73.20 C ATOM 2338 CG GLN A 150 10.637 2.158 -16.773 1.00 21.04 C ATOM 2339 CD GLN A 150 11.220 3.014 -17.880 1.00 41.03 C ATOM 2340 OE1 GLN A 150 11.081 2.701 -19.062 1.00 35.53 O ATOM 2341 NE2 GLN A 150 11.880 4.100 -17.498 1.00 44.35 N ATOM 0 H GLN A 150 7.286 2.967 -14.636 1.00 34.12 H new ATOM 0 HA GLN A 150 7.873 1.757 -17.259 1.00 73.53 H new ATOM 0 HB2 GLN A 150 9.191 3.730 -16.633 1.00 73.20 H new ATOM 0 HB3 GLN A 150 9.613 3.005 -15.095 1.00 73.20 H new ATOM 0 HG2 GLN A 150 11.394 2.000 -16.004 1.00 21.04 H new ATOM 0 HG3 GLN A 150 10.380 1.178 -17.174 1.00 21.04 H new ATOM 0 HE21 GLN A 150 11.970 4.320 -16.506 1.00 44.35 H new ATOM 0 HE22 GLN A 150 12.297 4.715 -18.196 1.00 44.35 H new ATOM 2350 N GLY A 151 8.375 -0.510 -16.449 1.00 23.31 N ATOM 2351 CA GLY A 151 8.648 -1.860 -15.988 1.00 25.13 C ATOM 2352 C GLY A 151 7.669 -2.340 -14.932 1.00 53.04 C ATOM 2353 O GLY A 151 7.913 -3.349 -14.271 1.00 25.13 O ATOM 0 H GLY A 151 8.127 -0.437 -17.436 1.00 23.31 H new ATOM 0 HA2 GLY A 151 8.618 -2.541 -16.839 1.00 25.13 H new ATOM 0 HA3 GLY A 151 9.659 -1.901 -15.583 1.00 25.13 H new ATOM 2357 N VAL A 152 6.556 -1.627 -14.772 1.00 75.13 N ATOM 2358 CA VAL A 152 5.550 -1.994 -13.799 1.00 44.43 C ATOM 2359 C VAL A 152 5.042 -3.411 -14.049 1.00 4.21 C ATOM 2360 O VAL A 152 5.079 -4.260 -13.159 1.00 62.33 O ATOM 2361 CB VAL A 152 4.375 -1.006 -13.852 1.00 44.33 C ATOM 2362 CG1 VAL A 152 3.290 -1.417 -12.883 1.00 11.53 C ATOM 2363 CG2 VAL A 152 4.856 0.405 -13.557 1.00 24.41 C ATOM 0 H VAL A 152 6.335 -0.789 -15.310 1.00 75.13 H new ATOM 0 HA VAL A 152 6.007 -1.958 -12.810 1.00 44.43 H new ATOM 0 HB VAL A 152 3.954 -1.022 -14.857 1.00 44.33 H new ATOM 0 HG11 VAL A 152 2.467 -0.705 -12.935 1.00 11.53 H new ATOM 0 HG12 VAL A 152 2.927 -2.411 -13.144 1.00 11.53 H new ATOM 0 HG13 VAL A 152 3.693 -1.432 -11.870 1.00 11.53 H new ATOM 0 HG21 VAL A 152 4.012 1.093 -13.598 1.00 24.41 H new ATOM 0 HG22 VAL A 152 5.302 0.437 -12.563 1.00 24.41 H new ATOM 0 HG23 VAL A 152 5.600 0.698 -14.298 1.00 24.41 H new ATOM 2373 N GLU A 153 4.576 -3.660 -15.267 1.00 24.24 N ATOM 2374 CA GLU A 153 4.071 -4.976 -15.635 1.00 70.20 C ATOM 2375 C GLU A 153 5.170 -6.025 -15.505 1.00 65.11 C ATOM 2376 O GLU A 153 4.908 -7.179 -15.168 1.00 71.05 O ATOM 2377 CB GLU A 153 3.529 -4.957 -17.065 1.00 61.10 C ATOM 2378 CG GLU A 153 2.627 -3.767 -17.357 1.00 42.10 C ATOM 2379 CD GLU A 153 1.302 -4.177 -17.970 1.00 60.31 C ATOM 2380 OE1 GLU A 153 0.618 -5.041 -17.381 1.00 51.33 O ATOM 2381 OE2 GLU A 153 0.949 -3.636 -19.038 1.00 52.00 O ATOM 0 H GLU A 153 4.538 -2.968 -16.016 1.00 24.24 H new ATOM 0 HA GLU A 153 3.259 -5.235 -14.955 1.00 70.20 H new ATOM 0 HB2 GLU A 153 4.367 -4.947 -17.762 1.00 61.10 H new ATOM 0 HB3 GLU A 153 2.973 -5.877 -17.247 1.00 61.10 H new ATOM 0 HG2 GLU A 153 2.442 -3.220 -16.432 1.00 42.10 H new ATOM 0 HG3 GLU A 153 3.140 -3.084 -18.034 1.00 42.10 H new ATOM 2388 N ASP A 154 6.404 -5.610 -15.772 1.00 70.20 N ATOM 2389 CA ASP A 154 7.550 -6.505 -15.684 1.00 64.31 C ATOM 2390 C ASP A 154 7.748 -6.994 -14.252 1.00 23.01 C ATOM 2391 O ASP A 154 8.238 -8.101 -14.025 1.00 3.10 O ATOM 2392 CB ASP A 154 8.815 -5.793 -16.173 1.00 3.42 C ATOM 2393 CG ASP A 154 9.273 -6.295 -17.528 1.00 62.51 C ATOM 2394 OD1 ASP A 154 9.904 -7.371 -17.581 1.00 12.41 O ATOM 2395 OD2 ASP A 154 8.999 -5.611 -18.538 1.00 23.42 O ATOM 0 H ASP A 154 6.635 -4.657 -16.052 1.00 70.20 H new ATOM 0 HA ASP A 154 7.358 -7.369 -16.320 1.00 64.31 H new ATOM 0 HB2 ASP A 154 8.626 -4.721 -16.230 1.00 3.42 H new ATOM 0 HB3 ASP A 154 9.614 -5.937 -15.446 1.00 3.42 H new ATOM 2400 N ALA A 155 7.363 -6.162 -13.290 1.00 33.21 N ATOM 2401 CA ALA A 155 7.498 -6.507 -11.880 1.00 15.41 C ATOM 2402 C ALA A 155 6.484 -7.571 -11.473 1.00 32.21 C ATOM 2403 O ALA A 155 6.838 -8.582 -10.866 1.00 63.35 O ATOM 2404 CB ALA A 155 7.339 -5.263 -11.017 1.00 45.41 C ATOM 0 H ALA A 155 6.955 -5.243 -13.462 1.00 33.21 H new ATOM 0 HA ALA A 155 8.495 -6.919 -11.726 1.00 15.41 H new ATOM 0 HB1 ALA A 155 7.442 -5.534 -9.966 1.00 45.41 H new ATOM 0 HB2 ALA A 155 8.107 -4.536 -11.281 1.00 45.41 H new ATOM 0 HB3 ALA A 155 6.354 -4.827 -11.185 1.00 45.41 H new ATOM 2410 N PHE A 156 5.220 -7.335 -11.807 1.00 2.04 N ATOM 2411 CA PHE A 156 4.152 -8.270 -11.473 1.00 10.50 C ATOM 2412 C PHE A 156 4.350 -9.606 -12.179 1.00 5.23 C ATOM 2413 O PHE A 156 4.245 -10.667 -11.564 1.00 5.51 O ATOM 2414 CB PHE A 156 2.793 -7.680 -11.852 1.00 21.34 C ATOM 2415 CG PHE A 156 2.309 -6.623 -10.902 1.00 24.40 C ATOM 2416 CD1 PHE A 156 1.754 -6.974 -9.682 1.00 24.42 C ATOM 2417 CD2 PHE A 156 2.409 -5.281 -11.229 1.00 13.34 C ATOM 2418 CE1 PHE A 156 1.306 -6.004 -8.805 1.00 14.30 C ATOM 2419 CE2 PHE A 156 1.963 -4.307 -10.356 1.00 73.35 C ATOM 2420 CZ PHE A 156 1.410 -4.669 -9.142 1.00 34.43 C ATOM 0 H PHE A 156 4.910 -6.503 -12.309 1.00 2.04 H new ATOM 0 HA PHE A 156 4.182 -8.442 -10.397 1.00 10.50 H new ATOM 0 HB2 PHE A 156 2.858 -7.254 -12.853 1.00 21.34 H new ATOM 0 HB3 PHE A 156 2.057 -8.483 -11.894 1.00 21.34 H new ATOM 0 HD1 PHE A 156 1.671 -8.017 -9.413 1.00 24.42 H new ATOM 0 HD2 PHE A 156 2.840 -4.993 -12.176 1.00 13.34 H new ATOM 0 HE1 PHE A 156 0.875 -6.290 -7.857 1.00 14.30 H new ATOM 0 HE2 PHE A 156 2.046 -3.264 -10.622 1.00 73.35 H new ATOM 0 HZ PHE A 156 1.060 -3.909 -8.459 1.00 34.43 H new ATOM 2430 N TYR A 157 4.630 -9.548 -13.478 1.00 64.14 N ATOM 2431 CA TYR A 157 4.833 -10.754 -14.274 1.00 73.25 C ATOM 2432 C TYR A 157 5.867 -11.681 -13.636 1.00 40.31 C ATOM 2433 O TYR A 157 5.828 -12.894 -13.837 1.00 11.23 O ATOM 2434 CB TYR A 157 5.264 -10.387 -15.694 1.00 64.03 C ATOM 2435 CG TYR A 157 4.140 -9.836 -16.541 1.00 62.32 C ATOM 2436 CD1 TYR A 157 2.884 -10.431 -16.533 1.00 45.43 C ATOM 2437 CD2 TYR A 157 4.333 -8.721 -17.346 1.00 61.12 C ATOM 2438 CE1 TYR A 157 1.853 -9.930 -17.304 1.00 70.20 C ATOM 2439 CE2 TYR A 157 3.306 -8.213 -18.119 1.00 21.24 C ATOM 2440 CZ TYR A 157 2.069 -8.821 -18.096 1.00 34.33 C ATOM 2441 OH TYR A 157 1.045 -8.318 -18.864 1.00 20.51 O ATOM 0 H TYR A 157 4.721 -8.678 -14.002 1.00 64.14 H new ATOM 0 HA TYR A 157 3.883 -11.287 -14.313 1.00 73.25 H new ATOM 0 HB2 TYR A 157 6.065 -9.650 -15.643 1.00 64.03 H new ATOM 0 HB3 TYR A 157 5.675 -11.271 -16.181 1.00 64.03 H new ATOM 0 HD1 TYR A 157 2.711 -11.299 -15.914 1.00 45.43 H new ATOM 0 HD2 TYR A 157 5.301 -8.243 -17.368 1.00 61.12 H new ATOM 0 HE1 TYR A 157 0.883 -10.404 -17.287 1.00 70.20 H new ATOM 0 HE2 TYR A 157 3.472 -7.344 -18.738 1.00 21.24 H new ATOM 0 HH TYR A 157 1.363 -7.535 -19.361 1.00 20.51 H new ATOM 2451 N THR A 158 6.790 -11.107 -12.871 1.00 13.00 N ATOM 2452 CA THR A 158 7.824 -11.890 -12.215 1.00 33.25 C ATOM 2453 C THR A 158 7.234 -12.774 -11.120 1.00 1.54 C ATOM 2454 O THR A 158 7.661 -13.913 -10.930 1.00 71.21 O ATOM 2455 CB THR A 158 8.883 -10.962 -11.626 1.00 4.14 C ATOM 2456 OG1 THR A 158 9.304 -10.012 -12.588 1.00 12.25 O ATOM 2457 CG2 THR A 158 10.109 -11.693 -11.138 1.00 2.23 C ATOM 0 H THR A 158 6.841 -10.104 -12.692 1.00 13.00 H new ATOM 0 HA THR A 158 8.286 -12.538 -12.960 1.00 33.25 H new ATOM 0 HB THR A 158 8.405 -10.478 -10.774 1.00 4.14 H new ATOM 0 HG1 THR A 158 8.604 -9.336 -12.709 1.00 12.25 H new ATOM 0 HG21 THR A 158 10.822 -10.976 -10.731 1.00 2.23 H new ATOM 0 HG22 THR A 158 9.824 -12.402 -10.361 1.00 2.23 H new ATOM 0 HG23 THR A 158 10.567 -12.230 -11.969 1.00 2.23 H new ATOM 2465 N LEU A 159 6.245 -12.246 -10.404 1.00 51.01 N ATOM 2466 CA LEU A 159 5.597 -12.992 -9.331 1.00 52.41 C ATOM 2467 C LEU A 159 4.794 -14.161 -9.895 1.00 2.42 C ATOM 2468 O LEU A 159 4.947 -15.301 -9.457 1.00 64.23 O ATOM 2469 CB LEU A 159 4.681 -12.067 -8.521 1.00 41.34 C ATOM 2470 CG LEU A 159 3.781 -12.767 -7.500 1.00 74.03 C ATOM 2471 CD1 LEU A 159 4.594 -13.707 -6.621 1.00 65.30 C ATOM 2472 CD2 LEU A 159 3.048 -11.743 -6.648 1.00 53.34 C ATOM 0 H LEU A 159 5.876 -11.306 -10.548 1.00 51.01 H new ATOM 0 HA LEU A 159 6.371 -13.389 -8.674 1.00 52.41 H new ATOM 0 HB2 LEU A 159 5.300 -11.339 -7.996 1.00 41.34 H new ATOM 0 HB3 LEU A 159 4.051 -11.509 -9.214 1.00 41.34 H new ATOM 0 HG LEU A 159 3.043 -13.359 -8.042 1.00 74.03 H new ATOM 0 HD11 LEU A 159 3.935 -14.194 -5.902 1.00 65.30 H new ATOM 0 HD12 LEU A 159 5.074 -14.462 -7.243 1.00 65.30 H new ATOM 0 HD13 LEU A 159 5.356 -13.138 -6.087 1.00 65.30 H new ATOM 0 HD21 LEU A 159 2.412 -12.257 -5.927 1.00 53.34 H new ATOM 0 HD22 LEU A 159 3.773 -11.126 -6.117 1.00 53.34 H new ATOM 0 HD23 LEU A 159 2.433 -11.111 -7.288 1.00 53.34 H new ATOM 2484 N VAL A 160 3.939 -13.869 -10.868 1.00 3.22 N ATOM 2485 CA VAL A 160 3.113 -14.880 -11.496 1.00 53.24 C ATOM 2486 C VAL A 160 3.968 -15.900 -12.246 1.00 62.23 C ATOM 2487 O VAL A 160 3.633 -17.083 -12.302 1.00 34.10 O ATOM 2488 CB VAL A 160 2.108 -14.233 -12.461 1.00 53.25 C ATOM 2489 CG1 VAL A 160 2.804 -13.222 -13.343 1.00 24.14 C ATOM 2490 CG2 VAL A 160 1.410 -15.279 -13.300 1.00 65.24 C ATOM 0 H VAL A 160 3.803 -12.929 -11.239 1.00 3.22 H new ATOM 0 HA VAL A 160 2.567 -15.399 -10.708 1.00 53.24 H new ATOM 0 HB VAL A 160 1.351 -13.718 -11.869 1.00 53.25 H new ATOM 0 HG11 VAL A 160 2.080 -12.772 -14.022 1.00 24.14 H new ATOM 0 HG12 VAL A 160 3.252 -12.446 -12.723 1.00 24.14 H new ATOM 0 HG13 VAL A 160 3.583 -13.719 -13.921 1.00 24.14 H new ATOM 0 HG21 VAL A 160 0.704 -14.793 -13.974 1.00 65.24 H new ATOM 0 HG22 VAL A 160 2.148 -15.830 -13.883 1.00 65.24 H new ATOM 0 HG23 VAL A 160 0.873 -15.969 -12.649 1.00 65.24 H new ATOM 2500 N ARG A 161 5.070 -15.433 -12.821 1.00 54.33 N ATOM 2501 CA ARG A 161 5.972 -16.305 -13.568 1.00 23.43 C ATOM 2502 C ARG A 161 6.697 -17.267 -12.633 1.00 22.13 C ATOM 2503 O ARG A 161 6.983 -18.407 -13.000 1.00 53.03 O ATOM 2504 CB ARG A 161 6.987 -15.471 -14.350 1.00 13.03 C ATOM 2505 CG ARG A 161 7.950 -16.305 -15.182 1.00 31.45 C ATOM 2506 CD ARG A 161 8.893 -15.428 -15.989 1.00 70.53 C ATOM 2507 NE ARG A 161 8.400 -15.197 -17.345 1.00 62.44 N ATOM 2508 CZ ARG A 161 9.165 -14.778 -18.351 1.00 75.25 C ATOM 2509 NH1 ARG A 161 10.457 -14.544 -18.157 1.00 72.04 N ATOM 2510 NH2 ARG A 161 8.637 -14.593 -19.552 1.00 34.22 N ATOM 0 H ARG A 161 5.361 -14.456 -12.785 1.00 54.33 H new ATOM 0 HA ARG A 161 5.376 -16.890 -14.269 1.00 23.43 H new ATOM 0 HB2 ARG A 161 6.452 -14.786 -15.007 1.00 13.03 H new ATOM 0 HB3 ARG A 161 7.559 -14.861 -13.651 1.00 13.03 H new ATOM 0 HG2 ARG A 161 8.528 -16.956 -14.527 1.00 31.45 H new ATOM 0 HG3 ARG A 161 7.386 -16.950 -15.855 1.00 31.45 H new ATOM 0 HD2 ARG A 161 9.022 -14.472 -15.482 1.00 70.53 H new ATOM 0 HD3 ARG A 161 9.875 -15.899 -16.036 1.00 70.53 H new ATOM 0 HE ARG A 161 7.412 -15.367 -17.532 1.00 62.44 H new ATOM 0 HH11 ARG A 161 10.868 -14.685 -17.234 1.00 72.04 H new ATOM 0 HH12 ARG A 161 11.039 -14.223 -18.931 1.00 72.04 H new ATOM 0 HH21 ARG A 161 7.645 -14.772 -19.706 1.00 34.22 H new ATOM 0 HH22 ARG A 161 9.223 -14.272 -20.323 1.00 34.22 H new ATOM 2524 N GLU A 162 6.995 -16.800 -11.425 1.00 42.13 N ATOM 2525 CA GLU A 162 7.690 -17.619 -10.438 1.00 50.13 C ATOM 2526 C GLU A 162 6.749 -18.652 -9.822 1.00 72.41 C ATOM 2527 O GLU A 162 7.156 -19.774 -9.522 1.00 53.04 O ATOM 2528 CB GLU A 162 8.284 -16.736 -9.340 1.00 34.11 C ATOM 2529 CG GLU A 162 9.354 -15.780 -9.842 1.00 31.04 C ATOM 2530 CD GLU A 162 10.758 -16.266 -9.538 1.00 21.41 C ATOM 2531 OE1 GLU A 162 11.202 -16.113 -8.382 1.00 44.03 O ATOM 2532 OE2 GLU A 162 11.412 -16.801 -10.459 1.00 65.53 O ATOM 0 H GLU A 162 6.766 -15.859 -11.106 1.00 42.13 H new ATOM 0 HA GLU A 162 8.496 -18.148 -10.947 1.00 50.13 H new ATOM 0 HB2 GLU A 162 7.484 -16.161 -8.875 1.00 34.11 H new ATOM 0 HB3 GLU A 162 8.711 -17.372 -8.565 1.00 34.11 H new ATOM 0 HG2 GLU A 162 9.244 -15.650 -10.919 1.00 31.04 H new ATOM 0 HG3 GLU A 162 9.205 -14.801 -9.385 1.00 31.04 H new ATOM 2539 N ILE A 163 5.493 -18.263 -9.634 1.00 70.51 N ATOM 2540 CA ILE A 163 4.498 -19.149 -9.053 1.00 11.05 C ATOM 2541 C ILE A 163 4.230 -20.350 -9.957 1.00 2.14 C ATOM 2542 O ILE A 163 3.948 -21.449 -9.479 1.00 73.11 O ATOM 2543 CB ILE A 163 3.185 -18.396 -8.792 1.00 0.14 C ATOM 2544 CG1 ILE A 163 3.423 -17.287 -7.773 1.00 21.44 C ATOM 2545 CG2 ILE A 163 2.110 -19.347 -8.300 1.00 1.53 C ATOM 2546 CD1 ILE A 163 2.443 -16.149 -7.892 1.00 54.23 C ATOM 0 H ILE A 163 5.142 -17.337 -9.877 1.00 70.51 H new ATOM 0 HA ILE A 163 4.897 -19.510 -8.105 1.00 11.05 H new ATOM 0 HB ILE A 163 2.841 -17.953 -9.727 1.00 0.14 H new ATOM 0 HG12 ILE A 163 3.362 -17.706 -6.769 1.00 21.44 H new ATOM 0 HG13 ILE A 163 4.435 -16.901 -7.896 1.00 21.44 H new ATOM 0 HG21 ILE A 163 1.188 -18.793 -8.121 1.00 1.53 H new ATOM 0 HG22 ILE A 163 1.932 -20.115 -9.052 1.00 1.53 H new ATOM 0 HG23 ILE A 163 2.437 -19.817 -7.372 1.00 1.53 H new ATOM 0 HD11 ILE A 163 2.668 -15.394 -7.138 1.00 54.23 H new ATOM 0 HD12 ILE A 163 2.520 -15.705 -8.884 1.00 54.23 H new ATOM 0 HD13 ILE A 163 1.431 -16.523 -7.739 1.00 54.23 H new ATOM 2558 N ARG A 164 4.320 -20.132 -11.266 1.00 42.13 N ATOM 2559 CA ARG A 164 4.085 -21.196 -12.239 1.00 5.32 C ATOM 2560 C ARG A 164 4.951 -22.416 -11.937 1.00 63.53 C ATOM 2561 O ARG A 164 4.467 -23.548 -11.938 1.00 14.44 O ATOM 2562 CB ARG A 164 4.373 -20.692 -13.654 1.00 65.22 C ATOM 2563 CG ARG A 164 3.436 -19.584 -14.107 1.00 3.23 C ATOM 2564 CD ARG A 164 3.002 -19.775 -15.551 1.00 62.33 C ATOM 2565 NE ARG A 164 4.130 -20.087 -16.426 1.00 21.13 N ATOM 2566 CZ ARG A 164 4.002 -20.617 -17.640 1.00 72.13 C ATOM 2567 NH1 ARG A 164 2.800 -20.896 -18.128 1.00 42.33 N ATOM 2568 NH2 ARG A 164 5.081 -20.868 -18.369 1.00 75.53 N ATOM 0 H ARG A 164 4.554 -19.229 -11.678 1.00 42.13 H new ATOM 0 HA ARG A 164 3.038 -21.491 -12.169 1.00 5.32 H new ATOM 0 HB2 ARG A 164 5.400 -20.329 -13.700 1.00 65.22 H new ATOM 0 HB3 ARG A 164 4.298 -21.527 -14.351 1.00 65.22 H new ATOM 0 HG2 ARG A 164 2.558 -19.563 -13.462 1.00 3.23 H new ATOM 0 HG3 ARG A 164 3.933 -18.620 -14.000 1.00 3.23 H new ATOM 0 HD2 ARG A 164 2.268 -20.579 -15.605 1.00 62.33 H new ATOM 0 HD3 ARG A 164 2.509 -18.869 -15.904 1.00 62.33 H new ATOM 0 HE ARG A 164 5.071 -19.887 -16.086 1.00 21.13 H new ATOM 0 HH11 ARG A 164 1.967 -20.704 -17.572 1.00 42.33 H new ATOM 0 HH12 ARG A 164 2.709 -21.302 -19.059 1.00 42.33 H new ATOM 0 HH21 ARG A 164 6.007 -20.655 -17.999 1.00 75.53 H new ATOM 0 HH22 ARG A 164 4.985 -21.274 -19.300 1.00 75.53 H new ATOM 2582 N GLN A 165 6.233 -22.178 -11.680 1.00 41.24 N ATOM 2583 CA GLN A 165 7.164 -23.258 -11.376 1.00 13.45 C ATOM 2584 C GLN A 165 6.794 -23.942 -10.065 1.00 44.45 C ATOM 2585 O GLN A 165 6.949 -25.154 -9.919 1.00 33.10 O ATOM 2586 CB GLN A 165 8.593 -22.718 -11.298 1.00 74.01 C ATOM 2587 CG GLN A 165 9.191 -22.383 -12.655 1.00 43.52 C ATOM 2588 CD GLN A 165 10.702 -22.502 -12.670 1.00 3.42 C ATOM 2589 OE1 GLN A 165 11.269 -23.264 -13.455 1.00 33.41 O ATOM 2590 NE2 GLN A 165 11.365 -21.749 -11.800 1.00 62.31 N ATOM 0 H GLN A 165 6.650 -21.247 -11.676 1.00 41.24 H new ATOM 0 HA GLN A 165 7.104 -23.994 -12.178 1.00 13.45 H new ATOM 0 HB2 GLN A 165 8.601 -21.823 -10.676 1.00 74.01 H new ATOM 0 HB3 GLN A 165 9.225 -23.456 -10.804 1.00 74.01 H new ATOM 0 HG2 GLN A 165 8.770 -23.049 -13.408 1.00 43.52 H new ATOM 0 HG3 GLN A 165 8.907 -21.368 -12.933 1.00 43.52 H new ATOM 0 HE21 GLN A 165 10.856 -21.132 -11.168 1.00 62.31 H new ATOM 0 HE22 GLN A 165 12.384 -21.788 -11.764 1.00 62.31 H new ATOM 2599 N HIS A 166 6.303 -23.156 -9.111 1.00 22.20 N ATOM 2600 CA HIS A 166 5.909 -23.685 -7.811 1.00 63.33 C ATOM 2601 C HIS A 166 4.779 -24.699 -7.954 1.00 73.03 C ATOM 2602 O HIS A 166 4.399 -25.310 -6.934 1.00 38.33 O ATOM 2603 CB HIS A 166 5.476 -22.549 -6.884 1.00 32.33 C ATOM 2604 CG HIS A 166 5.710 -22.836 -5.433 1.00 60.42 C ATOM 2605 ND1 HIS A 166 4.794 -22.530 -4.447 1.00 53.10 N ATOM 2606 CD2 HIS A 166 6.763 -23.405 -4.801 1.00 33.11 C ATOM 2607 CE1 HIS A 166 5.276 -22.898 -3.273 1.00 70.12 C ATOM 2608 NE2 HIS A 166 6.468 -23.433 -3.460 1.00 53.44 N ATOM 2609 OXT HIS A 166 4.282 -24.873 -9.088 1.00 71.41 O ATOM 0 H HIS A 166 6.169 -22.150 -9.215 1.00 22.20 H new ATOM 0 HA HIS A 166 6.772 -24.190 -7.377 1.00 63.33 H new ATOM 0 HB2 HIS A 166 6.015 -21.642 -7.158 1.00 32.33 H new ATOM 0 HB3 HIS A 166 4.416 -22.348 -7.040 1.00 32.33 H new ATOM 0 HD2 HIS A 166 7.667 -23.769 -5.265 1.00 33.11 H new ATOM 0 HE1 HIS A 166 4.779 -22.781 -2.321 1.00 70.12 H new ATOM 0 HE2 HIS A 166 7.072 -23.806 -2.728 1.00 53.44 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 219 -3.288 6.578 -0.346 1.00 10.12 P HETATM 2620 O1G GNP A 219 -3.802 8.095 -0.502 1.00 44.41 O HETATM 2621 O2G GNP A 219 -3.993 5.748 -1.531 1.00 32.44 O HETATM 2622 O3G GNP A 219 -3.566 6.013 0.994 1.00 62.52 O HETATM 2623 N3B GNP A 219 -1.708 6.599 -0.709 1.00 54.23 N HETATM 2624 PB GNP A 219 -1.059 5.161 -0.331 1.00 43.14 P HETATM 2625 O1B GNP A 219 -1.622 4.748 0.973 1.00 2.25 O HETATM 2626 O2B GNP A 219 -1.229 4.254 -1.489 1.00 10.24 O HETATM 2627 O3A GNP A 219 0.503 5.508 -0.151 1.00 10.11 O HETATM 2628 PA GNP A 219 1.500 5.428 -1.412 1.00 10.12 P HETATM 2629 O1A GNP A 219 0.822 4.686 -2.499 1.00 14.30 O HETATM 2630 O2A GNP A 219 2.801 4.923 -0.920 1.00 31.53 O HETATM 2631 O5' GNP A 219 1.661 6.969 -1.849 1.00 50.34 O HETATM 2632 C5' GNP A 219 0.964 7.467 -2.994 1.00 70.34 C HETATM 2633 C4' GNP A 219 1.322 8.931 -3.262 1.00 45.21 C HETATM 2634 O4' GNP A 219 2.686 9.013 -3.706 1.00 25.42 O HETATM 2635 C3' GNP A 219 0.523 9.416 -4.471 1.00 4.32 C HETATM 2636 O3' GNP A 219 0.735 10.812 -4.693 1.00 71.41 O HETATM 2637 C2' GNP A 219 1.225 8.582 -5.539 1.00 51.34 C HETATM 2638 O2' GNP A 219 0.979 9.148 -6.830 1.00 62.53 O HETATM 2639 C1' GNP A 219 2.678 8.839 -5.136 1.00 22.44 C HETATM 2640 N9 GNP A 219 3.530 7.702 -5.551 1.00 3.13 N HETATM 2641 C8 GNP A 219 3.388 6.439 -5.157 1.00 13.45 C HETATM 2642 N7 GNP A 219 4.331 5.690 -5.724 1.00 23.22 N HETATM 2643 C5 GNP A 219 5.081 6.480 -6.486 1.00 32.50 C HETATM 2644 C6 GNP A 219 6.185 6.246 -7.296 1.00 62.43 C HETATM 2645 O6 GNP A 219 6.657 5.116 -7.403 1.00 21.13 O HETATM 2646 N1 GNP A 219 6.753 7.324 -7.985 1.00 61.43 N HETATM 2647 C2 GNP A 219 6.196 8.601 -7.838 1.00 2.42 C HETATM 2648 N2 GNP A 219 6.728 9.633 -8.486 1.00 42.33 N HETATM 2649 N3 GNP A 219 5.130 8.786 -7.045 1.00 63.41 N HETATM 2650 C4 GNP A 219 4.570 7.767 -6.378 1.00 34.31 C HETATM 0 HO3' GNP A 219 0.871 10.974 -5.650 1.00 71.41 H new HETATM 0 HO2' GNP A 219 0.629 8.456 -7.429 1.00 62.53 H new HETATM 0 HNB3 GNP A 219 -1.203 7.389 -1.110 1.00 54.23 H new HETATM 0 HN22 GNP A 219 6.325 10.564 -8.381 1.00 42.33 H new HETATM 0 HN21 GNP A 219 7.539 9.494 -9.088 1.00 42.33 H new HETATM 0 H5'2 GNP A 219 -0.111 7.375 -2.838 1.00 70.34 H new HETATM 0 H5'1 GNP A 219 1.213 6.863 -3.866 1.00 70.34 H new HETATM 0 HN1 GNP A 219 7.564 7.181 -8.588 1.00 61.43 H new HETATM 0 H8 GNP A 219 2.619 6.074 -4.476 1.00 13.45 H new HETATM 0 H4' GNP A 219 1.133 9.503 -2.353 1.00 45.21 H new HETATM 0 H3' GNP A 219 -0.560 9.308 -4.410 1.00 4.32 H new HETATM 0 H2' GNP A 219 0.925 7.536 -5.597 1.00 51.34 H new HETATM 0 H1' GNP A 219 3.079 9.727 -5.625 1.00 22.44 H new HETATM 2664 MG MG A 246 -3.333 3.980 -2.222 1.00 12.14 MG HETATM 2665 O HOH A 252 -2.883 4.942 -4.183 1.00 71.14 O HETATM 2668 O HOH A 258 -3.701 2.801 -0.285 1.00 72.35 O HETATM 2671 O HOH A 264 -5.251 3.401 -3.157 1.00 61.25 O