USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=45 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 145 SER OG : rot 125:sc= -0.971! USER MOD Set 1.2: A 148 THR OG1 : rot 158:sc= -2.37 USER MOD Set 2.1: A 116 ASN : amide:sc= -3.47 K(o=-3.5,f=-5.3!) USER MOD Set 2.2: A 144 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 94 HIS :FLIP no HD1:sc= -0.462 F(o=-1.8,f=-0.74) USER MOD Set 3.2: A 137 TYR OH : rot -150:sc= -0.276 USER MOD Set 4.1: A 87 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 124 THR OG1 : rot -39:sc= 0.798 USER MOD Set 5.1: A 85 ASN : amide:sc= -0.434 K(o=-0.28,f=-1.7) USER MOD Set 5.2: A 117 LYS NZ :NH3+ 152:sc= 0.157 (180deg=-0.921) USER MOD Set 6.1: A 16 LYS NZ :NH3+ 174:sc= 0.934 (180deg=0) USER MOD Set 6.2: A 58 THR OG1 : rot 180:sc= 0.756 USER MOD Set 7.1: A 1 MET CE :methyl 163:sc= -2.79 (180deg=-0.458) USER MOD Set 7.2: A 43 GLN : amide:sc= -3.52 K(o=-6.3,f=-14!) USER MOD Single : A 1 MET N :NH3+ -164:sc= 1.29 (180deg=0.781) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 154:sc= 0.688 (180deg=-0.499) USER MOD Single : A 20 THR OG1 : rot 74:sc= 0.0981 USER MOD Single : A 22 GLN : amide:sc= -3.75 K(o=-3.8,f=-7.4!) USER MOD Single : A 25 GLN : amide:sc= -0.348 K(o=-0.35,f=-2.9!) USER MOD Single : A 26 ASN : amide:sc= -0.862 X(o=-0.86,f=-1.3) USER MOD Single : A 27 HIS : no HD1:sc= -6.08! C(o=-6.1!,f=-6.3!) USER MOD Single : A 32 TYR OH : rot -9:sc= 0.104 USER MOD Single : A 35 SER OG : rot -170:sc= -0.132 USER MOD Single : A 39 SER OG : rot 123:sc= 0.00246 USER MOD Single : A 40 TYR OH : rot 165:sc= -0.0129 USER MOD Single : A 42 LYS NZ :NH3+ -152:sc= 0.0345 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 15:sc= -0.277 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 170:sc= -0.472 (180deg=-1.02) USER MOD Single : A 70 GLN : amide:sc= -1.65 K(o=-1.7,f=-7!) USER MOD Single : A 71 TYR OH : rot -125:sc= -0.538 USER MOD Single : A 72 MET CE :methyl -155:sc= -0.116 (180deg=-0.719) USER MOD Single : A 74 THR OG1 : rot -11:sc= 0.88 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.414 USER MOD Single : A 86 ASN : amide:sc= -0.0586 X(o=-0.059,f=-0.32) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -72:sc= 2.22 USER MOD Single : A 95 GLN : amide:sc= -3.39! C(o=-3.4!,f=-4.3!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN :FLIP amide:sc= -0.304 F(o=-1.3,f=-0.3) USER MOD Single : A 101 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.261) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -166:sc= -5.27! (180deg=-6.93!) USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.767 K(o=-0.77,f=-2.2!) 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 32:sc= 0.054 USER MOD Single : A 147 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0304) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 148:sc= 0.156 USER MOD Single : A 158 THR OG1 : rot 65:sc= 0.706 USER MOD Single : A 165 GLN : amide:sc= -0.219 X(o=-0.22,f=-0.019) USER MOD Single : A 166 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 219 GNP O2' : rot -137:sc= -0.872! USER MOD Single : A 219 GNP O3' : rot 130:sc= 0.0769 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.209 -20.329 -18.530 1.00 24.02 N ATOM 2 CA MET A 1 -7.100 -19.611 -17.844 1.00 54.12 C ATOM 3 C MET A 1 -7.039 -19.967 -16.360 1.00 54.15 C ATOM 4 O MET A 1 -8.041 -20.360 -15.763 1.00 20.35 O ATOM 5 CB MET A 1 -7.299 -18.103 -18.027 1.00 14.25 C ATOM 6 CG MET A 1 -8.373 -17.502 -17.130 1.00 12.05 C ATOM 7 SD MET A 1 -10.014 -18.181 -17.451 1.00 72.34 S ATOM 8 CE MET A 1 -10.308 -17.590 -19.117 1.00 61.34 C ATOM 0 H1 MET A 1 -8.065 -20.287 -19.559 1.00 24.02 H new ATOM 0 H2 MET A 1 -8.222 -21.322 -18.222 1.00 24.02 H new ATOM 0 H3 MET A 1 -9.115 -19.880 -18.288 1.00 24.02 H new ATOM 0 HA MET A 1 -6.153 -19.916 -18.288 1.00 54.12 H new ATOM 0 HB2 MET A 1 -6.354 -17.597 -17.832 1.00 14.25 H new ATOM 0 HB3 MET A 1 -7.558 -17.906 -19.067 1.00 14.25 H new ATOM 0 HG2 MET A 1 -8.109 -17.679 -16.087 1.00 12.05 H new ATOM 0 HG3 MET A 1 -8.397 -16.422 -17.274 1.00 12.05 H new ATOM 0 HE1 MET A 1 -11.122 -18.159 -19.567 1.00 61.34 H new ATOM 0 HE2 MET A 1 -10.577 -16.534 -19.086 1.00 61.34 H new ATOM 0 HE3 MET A 1 -9.404 -17.717 -19.713 1.00 61.34 H new ATOM 18 N THR A 2 -5.855 -19.829 -15.773 1.00 12.22 N ATOM 19 CA THR A 2 -5.658 -20.136 -14.362 1.00 15.41 C ATOM 20 C THR A 2 -5.788 -18.873 -13.510 1.00 75.12 C ATOM 21 O THR A 2 -5.278 -17.815 -13.870 1.00 33.21 O ATOM 22 CB THR A 2 -4.284 -20.788 -14.157 1.00 52.21 C ATOM 23 OG1 THR A 2 -4.384 -22.198 -14.247 1.00 61.33 O ATOM 24 CG2 THR A 2 -3.639 -20.464 -12.824 1.00 14.53 C ATOM 0 H THR A 2 -5.016 -19.506 -16.254 1.00 12.22 H new ATOM 0 HA THR A 2 -6.431 -20.836 -14.045 1.00 15.41 H new ATOM 0 HB THR A 2 -3.658 -20.374 -14.948 1.00 52.21 H new ATOM 0 HG1 THR A 2 -3.499 -22.598 -14.116 1.00 61.33 H new ATOM 0 HG21 THR A 2 -2.672 -20.962 -12.757 1.00 14.53 H new ATOM 0 HG22 THR A 2 -3.498 -19.386 -12.740 1.00 14.53 H new ATOM 0 HG23 THR A 2 -4.282 -20.810 -12.015 1.00 14.53 H new ATOM 32 N GLU A 3 -6.472 -18.999 -12.379 1.00 53.33 N ATOM 33 CA GLU A 3 -6.666 -17.872 -11.474 1.00 4.43 C ATOM 34 C GLU A 3 -5.583 -17.841 -10.399 1.00 5.33 C ATOM 35 O GLU A 3 -5.426 -18.794 -9.634 1.00 54.11 O ATOM 36 CB GLU A 3 -8.049 -17.949 -10.820 1.00 23.34 C ATOM 37 CG GLU A 3 -8.818 -16.639 -10.865 1.00 63.44 C ATOM 38 CD GLU A 3 -9.679 -16.426 -9.636 1.00 71.42 C ATOM 39 OE1 GLU A 3 -10.399 -17.368 -9.244 1.00 61.13 O ATOM 40 OE2 GLU A 3 -9.631 -15.316 -9.064 1.00 13.51 O ATOM 0 H GLU A 3 -6.902 -19.870 -12.067 1.00 53.33 H new ATOM 0 HA GLU A 3 -6.597 -16.954 -12.058 1.00 4.43 H new ATOM 0 HB2 GLU A 3 -8.635 -18.722 -11.318 1.00 23.34 H new ATOM 0 HB3 GLU A 3 -7.933 -18.257 -9.781 1.00 23.34 H new ATOM 0 HG2 GLU A 3 -8.114 -15.812 -10.959 1.00 63.44 H new ATOM 0 HG3 GLU A 3 -9.449 -16.623 -11.754 1.00 63.44 H new ATOM 47 N TYR A 4 -4.837 -16.742 -10.347 1.00 23.24 N ATOM 48 CA TYR A 4 -3.768 -16.589 -9.365 1.00 70.21 C ATOM 49 C TYR A 4 -4.121 -15.516 -8.338 1.00 11.13 C ATOM 50 O TYR A 4 -4.944 -14.639 -8.600 1.00 5.50 O ATOM 51 CB TYR A 4 -2.454 -16.228 -10.062 1.00 1.10 C ATOM 52 CG TYR A 4 -1.842 -17.376 -10.834 1.00 52.22 C ATOM 53 CD1 TYR A 4 -1.469 -18.551 -10.193 1.00 1.43 C ATOM 54 CD2 TYR A 4 -1.635 -17.283 -12.205 1.00 2.10 C ATOM 55 CE1 TYR A 4 -0.908 -19.600 -10.896 1.00 60.22 C ATOM 56 CE2 TYR A 4 -1.074 -18.328 -12.915 1.00 32.04 C ATOM 57 CZ TYR A 4 -0.713 -19.484 -12.255 1.00 60.43 C ATOM 58 OH TYR A 4 -0.155 -20.526 -12.959 1.00 33.43 O ATOM 0 H TYR A 4 -4.952 -15.945 -10.973 1.00 23.24 H new ATOM 0 HA TYR A 4 -3.648 -17.540 -8.846 1.00 70.21 H new ATOM 0 HB2 TYR A 4 -2.631 -15.396 -10.744 1.00 1.10 H new ATOM 0 HB3 TYR A 4 -1.740 -15.882 -9.315 1.00 1.10 H new ATOM 0 HD1 TYR A 4 -1.620 -18.646 -9.128 1.00 1.43 H new ATOM 0 HD2 TYR A 4 -1.917 -16.379 -12.724 1.00 2.10 H new ATOM 0 HE1 TYR A 4 -0.624 -20.507 -10.383 1.00 60.22 H new ATOM 0 HE2 TYR A 4 -0.919 -18.240 -13.980 1.00 32.04 H new ATOM 0 HH TYR A 4 -0.088 -20.282 -13.906 1.00 33.43 H new ATOM 68 N LYS A 5 -3.493 -15.594 -7.170 1.00 72.10 N ATOM 69 CA LYS A 5 -3.739 -14.630 -6.102 1.00 74.15 C ATOM 70 C LYS A 5 -2.451 -13.910 -5.715 1.00 22.11 C ATOM 71 O LYS A 5 -1.619 -14.453 -4.987 1.00 64.44 O ATOM 72 CB LYS A 5 -4.334 -15.334 -4.879 1.00 12.52 C ATOM 73 CG LYS A 5 -5.827 -15.094 -4.706 1.00 71.13 C ATOM 74 CD LYS A 5 -6.153 -14.581 -3.312 1.00 63.22 C ATOM 75 CE LYS A 5 -7.522 -15.056 -2.849 1.00 63.32 C ATOM 76 NZ LYS A 5 -7.557 -16.529 -2.633 1.00 61.11 N ATOM 0 H LYS A 5 -2.810 -16.315 -6.938 1.00 72.10 H new ATOM 0 HA LYS A 5 -4.451 -13.890 -6.468 1.00 74.15 H new ATOM 0 HB2 LYS A 5 -4.154 -16.406 -4.963 1.00 12.52 H new ATOM 0 HB3 LYS A 5 -3.813 -14.993 -3.984 1.00 12.52 H new ATOM 0 HG2 LYS A 5 -6.169 -14.373 -5.449 1.00 71.13 H new ATOM 0 HG3 LYS A 5 -6.369 -16.022 -4.889 1.00 71.13 H new ATOM 0 HD2 LYS A 5 -5.392 -14.922 -2.610 1.00 63.22 H new ATOM 0 HD3 LYS A 5 -6.124 -13.491 -3.308 1.00 63.22 H new ATOM 0 HE2 LYS A 5 -7.788 -14.547 -1.923 1.00 63.32 H new ATOM 0 HE3 LYS A 5 -8.272 -14.780 -3.591 1.00 63.32 H new ATOM 0 HZ1 LYS A 5 -8.293 -16.760 -1.936 1.00 61.11 H new ATOM 0 HZ2 LYS A 5 -7.769 -17.007 -3.532 1.00 61.11 H new ATOM 0 HZ3 LYS A 5 -6.633 -16.850 -2.280 1.00 61.11 H new ATOM 90 N LEU A 6 -2.292 -12.685 -6.205 1.00 74.20 N ATOM 91 CA LEU A 6 -1.106 -11.890 -5.911 1.00 33.13 C ATOM 92 C LEU A 6 -1.322 -11.026 -4.672 1.00 63.34 C ATOM 93 O LEU A 6 -2.132 -10.100 -4.680 1.00 22.04 O ATOM 94 CB LEU A 6 -0.749 -11.006 -7.107 1.00 53.44 C ATOM 95 CG LEU A 6 -0.844 -11.693 -8.470 1.00 2.43 C ATOM 96 CD1 LEU A 6 -0.371 -10.758 -9.573 1.00 32.51 C ATOM 97 CD2 LEU A 6 -0.033 -12.981 -8.475 1.00 5.54 C ATOM 0 H LEU A 6 -2.971 -12.221 -6.808 1.00 74.20 H new ATOM 0 HA LEU A 6 -0.281 -12.575 -5.715 1.00 33.13 H new ATOM 0 HB2 LEU A 6 -1.408 -10.138 -7.108 1.00 53.44 H new ATOM 0 HB3 LEU A 6 0.267 -10.634 -6.974 1.00 53.44 H new ATOM 0 HG LEU A 6 -1.888 -11.944 -8.658 1.00 2.43 H new ATOM 0 HD11 LEU A 6 -0.446 -11.264 -10.536 1.00 32.51 H new ATOM 0 HD12 LEU A 6 -0.994 -9.864 -9.584 1.00 32.51 H new ATOM 0 HD13 LEU A 6 0.666 -10.476 -9.391 1.00 32.51 H new ATOM 0 HD21 LEU A 6 -0.112 -13.457 -9.452 1.00 5.54 H new ATOM 0 HD22 LEU A 6 1.012 -12.754 -8.265 1.00 5.54 H new ATOM 0 HD23 LEU A 6 -0.418 -13.656 -7.711 1.00 5.54 H new ATOM 109 N VAL A 7 -0.593 -11.339 -3.604 1.00 22.33 N ATOM 110 CA VAL A 7 -0.704 -10.598 -2.357 1.00 45.04 C ATOM 111 C VAL A 7 0.342 -9.489 -2.275 1.00 0.51 C ATOM 112 O VAL A 7 1.510 -9.747 -1.988 1.00 0.12 O ATOM 113 CB VAL A 7 -0.543 -11.536 -1.145 1.00 12.41 C ATOM 114 CG1 VAL A 7 -0.697 -10.766 0.155 1.00 42.04 C ATOM 115 CG2 VAL A 7 -1.544 -12.679 -1.220 1.00 22.40 C ATOM 0 H VAL A 7 0.082 -12.103 -3.580 1.00 22.33 H new ATOM 0 HA VAL A 7 -1.697 -10.149 -2.338 1.00 45.04 H new ATOM 0 HB VAL A 7 0.461 -11.959 -1.168 1.00 12.41 H new ATOM 0 HG11 VAL A 7 -0.580 -11.447 0.998 1.00 42.04 H new ATOM 0 HG12 VAL A 7 0.064 -9.988 0.209 1.00 42.04 H new ATOM 0 HG13 VAL A 7 -1.686 -10.310 0.193 1.00 42.04 H new ATOM 0 HG21 VAL A 7 -1.416 -13.332 -0.356 1.00 22.40 H new ATOM 0 HG22 VAL A 7 -2.557 -12.276 -1.224 1.00 22.40 H new ATOM 0 HG23 VAL A 7 -1.377 -13.249 -2.134 1.00 22.40 H new ATOM 125 N VAL A 8 -0.087 -8.257 -2.524 1.00 43.40 N ATOM 126 CA VAL A 8 0.810 -7.111 -2.471 1.00 25.20 C ATOM 127 C VAL A 8 1.055 -6.680 -1.029 1.00 13.42 C ATOM 128 O VAL A 8 0.139 -6.679 -0.207 1.00 74.12 O ATOM 129 CB VAL A 8 0.243 -5.920 -3.265 1.00 3.51 C ATOM 130 CG1 VAL A 8 1.241 -4.773 -3.294 1.00 31.10 C ATOM 131 CG2 VAL A 8 -0.127 -6.348 -4.677 1.00 53.10 C ATOM 0 H VAL A 8 -1.051 -8.027 -2.765 1.00 43.40 H new ATOM 0 HA VAL A 8 1.753 -7.419 -2.922 1.00 25.20 H new ATOM 0 HB VAL A 8 -0.661 -5.572 -2.766 1.00 3.51 H new ATOM 0 HG11 VAL A 8 0.822 -3.941 -3.860 1.00 31.10 H new ATOM 0 HG12 VAL A 8 1.453 -4.449 -2.275 1.00 31.10 H new ATOM 0 HG13 VAL A 8 2.164 -5.106 -3.768 1.00 31.10 H new ATOM 0 HG21 VAL A 8 -0.526 -5.493 -5.223 1.00 53.10 H new ATOM 0 HG22 VAL A 8 0.760 -6.723 -5.188 1.00 53.10 H new ATOM 0 HG23 VAL A 8 -0.880 -7.134 -4.633 1.00 53.10 H new ATOM 141 N VAL A 9 2.297 -6.314 -0.727 1.00 14.01 N ATOM 142 CA VAL A 9 2.658 -5.883 0.618 1.00 13.40 C ATOM 143 C VAL A 9 3.648 -4.723 0.579 1.00 60.13 C ATOM 144 O VAL A 9 4.026 -4.250 -0.492 1.00 12.42 O ATOM 145 CB VAL A 9 3.267 -7.040 1.432 1.00 2.35 C ATOM 146 CG1 VAL A 9 2.256 -8.161 1.609 1.00 41.40 C ATOM 147 CG2 VAL A 9 4.534 -7.555 0.767 1.00 52.35 C ATOM 0 H VAL A 9 3.068 -6.307 -1.394 1.00 14.01 H new ATOM 0 HA VAL A 9 1.739 -5.553 1.102 1.00 13.40 H new ATOM 0 HB VAL A 9 3.531 -6.662 2.420 1.00 2.35 H new ATOM 0 HG11 VAL A 9 2.706 -8.969 2.187 1.00 41.40 H new ATOM 0 HG12 VAL A 9 1.381 -7.782 2.136 1.00 41.40 H new ATOM 0 HG13 VAL A 9 1.956 -8.538 0.631 1.00 41.40 H new ATOM 0 HG21 VAL A 9 4.949 -8.372 1.358 1.00 52.35 H new ATOM 0 HG22 VAL A 9 4.299 -7.914 -0.235 1.00 52.35 H new ATOM 0 HG23 VAL A 9 5.264 -6.748 0.701 1.00 52.35 H new ATOM 157 N GLY A 10 4.065 -4.270 1.757 1.00 43.15 N ATOM 158 CA GLY A 10 5.008 -3.170 1.840 1.00 3.30 C ATOM 159 C GLY A 10 4.430 -1.961 2.548 1.00 0.42 C ATOM 160 O GLY A 10 3.218 -1.869 2.745 1.00 12.25 O ATOM 0 H GLY A 10 3.766 -4.646 2.657 1.00 43.15 H new ATOM 0 HA2 GLY A 10 5.903 -3.502 2.367 1.00 3.30 H new ATOM 0 HA3 GLY A 10 5.317 -2.885 0.835 1.00 3.30 H new ATOM 164 N ALA A 11 5.298 -1.030 2.931 1.00 41.40 N ATOM 165 CA ALA A 11 4.866 0.181 3.619 1.00 61.22 C ATOM 166 C ALA A 11 3.862 0.961 2.778 1.00 25.51 C ATOM 167 O ALA A 11 3.997 1.047 1.557 1.00 75.31 O ATOM 168 CB ALA A 11 6.067 1.053 3.956 1.00 53.32 C ATOM 0 H ALA A 11 6.304 -1.091 2.777 1.00 41.40 H new ATOM 0 HA ALA A 11 4.373 -0.113 4.546 1.00 61.22 H new ATOM 0 HB1 ALA A 11 5.730 1.954 4.469 1.00 53.32 H new ATOM 0 HB2 ALA A 11 6.748 0.500 4.603 1.00 53.32 H new ATOM 0 HB3 ALA A 11 6.584 1.331 3.038 1.00 53.32 H new ATOM 174 N GLY A 12 2.855 1.526 3.436 1.00 43.23 N ATOM 175 CA GLY A 12 1.840 2.292 2.732 1.00 73.43 C ATOM 176 C GLY A 12 2.431 3.353 1.822 1.00 74.12 C ATOM 177 O GLY A 12 1.801 3.764 0.848 1.00 23.23 O ATOM 0 H GLY A 12 2.723 1.468 4.446 1.00 43.23 H new ATOM 0 HA2 GLY A 12 1.225 1.614 2.141 1.00 73.43 H new ATOM 0 HA3 GLY A 12 1.182 2.768 3.458 1.00 73.43 H new ATOM 181 N GLY A 13 3.643 3.796 2.138 1.00 14.45 N ATOM 182 CA GLY A 13 4.296 4.810 1.331 1.00 52.10 C ATOM 183 C GLY A 13 5.349 4.228 0.409 1.00 44.42 C ATOM 184 O GLY A 13 6.481 4.713 0.364 1.00 34.52 O ATOM 0 H GLY A 13 4.185 3.471 2.939 1.00 14.45 H new ATOM 0 HA2 GLY A 13 3.548 5.335 0.737 1.00 52.10 H new ATOM 0 HA3 GLY A 13 4.759 5.548 1.986 1.00 52.10 H new ATOM 188 N VAL A 14 4.979 3.185 -0.327 1.00 10.41 N ATOM 189 CA VAL A 14 5.902 2.535 -1.252 1.00 43.43 C ATOM 190 C VAL A 14 5.431 2.664 -2.701 1.00 21.11 C ATOM 191 O VAL A 14 6.165 2.326 -3.631 1.00 35.34 O ATOM 192 CB VAL A 14 6.080 1.042 -0.913 1.00 40.33 C ATOM 193 CG1 VAL A 14 6.699 0.879 0.467 1.00 34.23 C ATOM 194 CG2 VAL A 14 4.751 0.307 -0.998 1.00 43.02 C ATOM 0 H VAL A 14 4.047 2.772 -0.301 1.00 10.41 H new ATOM 0 HA VAL A 14 6.859 3.044 -1.143 1.00 43.43 H new ATOM 0 HB VAL A 14 6.756 0.603 -1.646 1.00 40.33 H new ATOM 0 HG11 VAL A 14 6.817 -0.181 0.690 1.00 34.23 H new ATOM 0 HG12 VAL A 14 7.674 1.365 0.488 1.00 34.23 H new ATOM 0 HG13 VAL A 14 6.049 1.336 1.213 1.00 34.23 H new ATOM 0 HG21 VAL A 14 4.901 -0.745 -0.755 1.00 43.02 H new ATOM 0 HG22 VAL A 14 4.047 0.746 -0.291 1.00 43.02 H new ATOM 0 HG23 VAL A 14 4.352 0.392 -2.009 1.00 43.02 H new ATOM 204 N GLY A 15 4.207 3.150 -2.891 1.00 65.44 N ATOM 205 CA GLY A 15 3.672 3.309 -4.232 1.00 22.12 C ATOM 206 C GLY A 15 2.979 2.058 -4.740 1.00 20.31 C ATOM 207 O GLY A 15 2.561 2.003 -5.897 1.00 31.23 O ATOM 0 H GLY A 15 3.577 3.436 -2.141 1.00 65.44 H new ATOM 0 HA2 GLY A 15 2.966 4.139 -4.241 1.00 22.12 H new ATOM 0 HA3 GLY A 15 4.482 3.572 -4.913 1.00 22.12 H new ATOM 211 N LYS A 16 2.855 1.050 -3.880 1.00 43.43 N ATOM 212 CA LYS A 16 2.205 -0.199 -4.259 1.00 14.40 C ATOM 213 C LYS A 16 0.768 0.052 -4.702 1.00 22.34 C ATOM 214 O LYS A 16 0.267 -0.598 -5.620 1.00 75.33 O ATOM 215 CB LYS A 16 2.230 -1.187 -3.092 1.00 64.52 C ATOM 216 CG LYS A 16 1.462 -0.706 -1.870 1.00 51.31 C ATOM 217 CD LYS A 16 1.613 -1.670 -0.704 1.00 13.02 C ATOM 218 CE LYS A 16 0.314 -1.814 0.073 1.00 74.10 C ATOM 219 NZ LYS A 16 0.070 -3.223 0.491 1.00 14.22 N ATOM 0 H LYS A 16 3.195 1.075 -2.919 1.00 43.43 H new ATOM 0 HA LYS A 16 2.755 -0.628 -5.097 1.00 14.40 H new ATOM 0 HB2 LYS A 16 1.812 -2.138 -3.423 1.00 64.52 H new ATOM 0 HB3 LYS A 16 3.266 -1.376 -2.809 1.00 64.52 H new ATOM 0 HG2 LYS A 16 1.822 0.280 -1.577 1.00 51.31 H new ATOM 0 HG3 LYS A 16 0.407 -0.599 -2.121 1.00 51.31 H new ATOM 0 HD2 LYS A 16 1.926 -2.646 -1.076 1.00 13.02 H new ATOM 0 HD3 LYS A 16 2.399 -1.316 -0.037 1.00 13.02 H new ATOM 0 HE2 LYS A 16 0.346 -1.174 0.955 1.00 74.10 H new ATOM 0 HE3 LYS A 16 -0.517 -1.469 -0.542 1.00 74.10 H new ATOM 0 HZ1 LYS A 16 -0.770 -3.263 1.103 1.00 14.22 H new ATOM 0 HZ2 LYS A 16 -0.087 -3.813 -0.351 1.00 14.22 H new ATOM 0 HZ3 LYS A 16 0.896 -3.578 1.013 1.00 14.22 H new ATOM 233 N SER A 17 0.112 1.003 -4.045 1.00 34.13 N ATOM 234 CA SER A 17 -1.268 1.348 -4.372 1.00 12.13 C ATOM 235 C SER A 17 -1.381 1.791 -5.827 1.00 3.21 C ATOM 236 O SER A 17 -2.350 1.467 -6.514 1.00 50.32 O ATOM 237 CB SER A 17 -1.769 2.463 -3.451 1.00 10.32 C ATOM 238 OG SER A 17 -2.267 1.939 -2.231 1.00 62.53 O ATOM 0 H SER A 17 0.513 1.549 -3.283 1.00 34.13 H new ATOM 0 HA SER A 17 -1.885 0.461 -4.227 1.00 12.13 H new ATOM 0 HB2 SER A 17 -0.957 3.160 -3.245 1.00 10.32 H new ATOM 0 HB3 SER A 17 -2.554 3.028 -3.954 1.00 10.32 H new ATOM 244 N ALA A 18 -0.383 2.537 -6.289 1.00 44.51 N ATOM 245 CA ALA A 18 -0.365 3.030 -7.660 1.00 53.13 C ATOM 246 C ALA A 18 -0.158 1.892 -8.655 1.00 22.55 C ATOM 247 O ALA A 18 -0.827 1.825 -9.685 1.00 21.45 O ATOM 248 CB ALA A 18 0.723 4.081 -7.823 1.00 2.24 C ATOM 0 H ALA A 18 0.425 2.814 -5.732 1.00 44.51 H new ATOM 0 HA ALA A 18 -1.333 3.484 -7.870 1.00 53.13 H new ATOM 0 HB1 ALA A 18 0.728 4.443 -8.851 1.00 2.24 H new ATOM 0 HB2 ALA A 18 0.529 4.913 -7.146 1.00 2.24 H new ATOM 0 HB3 ALA A 18 1.692 3.641 -7.589 1.00 2.24 H new ATOM 254 N LEU A 19 0.776 0.999 -8.339 1.00 13.42 N ATOM 255 CA LEU A 19 1.074 -0.135 -9.206 1.00 22.45 C ATOM 256 C LEU A 19 -0.168 -0.990 -9.437 1.00 22.22 C ATOM 257 O LEU A 19 -0.500 -1.323 -10.575 1.00 21.11 O ATOM 258 CB LEU A 19 2.190 -0.989 -8.599 1.00 44.04 C ATOM 259 CG LEU A 19 3.512 -0.255 -8.365 1.00 54.04 C ATOM 260 CD1 LEU A 19 4.462 -1.115 -7.547 1.00 65.41 C ATOM 261 CD2 LEU A 19 4.148 0.132 -9.692 1.00 11.04 C ATOM 0 H LEU A 19 1.339 1.039 -7.489 1.00 13.42 H new ATOM 0 HA LEU A 19 1.406 0.255 -10.168 1.00 22.45 H new ATOM 0 HB2 LEU A 19 1.842 -1.392 -7.648 1.00 44.04 H new ATOM 0 HB3 LEU A 19 2.375 -1.839 -9.256 1.00 44.04 H new ATOM 0 HG LEU A 19 3.306 0.656 -7.804 1.00 54.04 H new ATOM 0 HD11 LEU A 19 5.397 -0.577 -7.391 1.00 65.41 H new ATOM 0 HD12 LEU A 19 4.008 -1.342 -6.582 1.00 65.41 H new ATOM 0 HD13 LEU A 19 4.663 -2.044 -8.081 1.00 65.41 H new ATOM 0 HD21 LEU A 19 5.087 0.653 -9.507 1.00 11.04 H new ATOM 0 HD22 LEU A 19 4.341 -0.766 -10.279 1.00 11.04 H new ATOM 0 HD23 LEU A 19 3.472 0.787 -10.242 1.00 11.04 H new ATOM 273 N THR A 20 -0.851 -1.344 -8.352 1.00 20.03 N ATOM 274 CA THR A 20 -2.057 -2.161 -8.442 1.00 2.45 C ATOM 275 C THR A 20 -3.114 -1.482 -9.309 1.00 43.44 C ATOM 276 O THR A 20 -3.554 -2.036 -10.316 1.00 33.31 O ATOM 277 CB THR A 20 -2.622 -2.434 -7.047 1.00 75.44 C ATOM 278 OG1 THR A 20 -1.656 -3.069 -6.230 1.00 50.42 O ATOM 279 CG2 THR A 20 -3.857 -3.310 -7.064 1.00 14.14 C ATOM 0 H THR A 20 -0.591 -1.079 -7.402 1.00 20.03 H new ATOM 0 HA THR A 20 -1.787 -3.109 -8.907 1.00 2.45 H new ATOM 0 HB THR A 20 -2.894 -1.457 -6.648 1.00 75.44 H new ATOM 0 HG1 THR A 20 -0.978 -2.416 -5.958 1.00 50.42 H new ATOM 0 HG21 THR A 20 -4.207 -3.465 -6.043 1.00 14.14 H new ATOM 0 HG22 THR A 20 -4.640 -2.824 -7.646 1.00 14.14 H new ATOM 0 HG23 THR A 20 -3.614 -4.272 -7.514 1.00 14.14 H new ATOM 287 N ILE A 21 -3.516 -0.280 -8.910 1.00 63.11 N ATOM 288 CA ILE A 21 -4.522 0.474 -9.650 1.00 34.21 C ATOM 289 C ILE A 21 -4.069 0.729 -11.085 1.00 4.20 C ATOM 290 O ILE A 21 -4.893 0.853 -11.992 1.00 35.30 O ATOM 291 CB ILE A 21 -4.828 1.824 -8.969 1.00 11.00 C ATOM 292 CG1 ILE A 21 -5.261 1.607 -7.522 1.00 62.43 C ATOM 293 CG2 ILE A 21 -5.908 2.576 -9.729 1.00 75.35 C ATOM 294 CD1 ILE A 21 -6.533 0.801 -7.384 1.00 71.11 C ATOM 0 H ILE A 21 -3.161 0.193 -8.079 1.00 63.11 H new ATOM 0 HA ILE A 21 -5.429 -0.131 -9.660 1.00 34.21 H new ATOM 0 HB ILE A 21 -3.917 2.422 -8.977 1.00 11.00 H new ATOM 0 HG12 ILE A 21 -4.460 1.100 -6.984 1.00 62.43 H new ATOM 0 HG13 ILE A 21 -5.402 2.577 -7.045 1.00 62.43 H new ATOM 0 HG21 ILE A 21 -6.109 3.525 -9.232 1.00 75.35 H new ATOM 0 HG22 ILE A 21 -5.572 2.764 -10.749 1.00 75.35 H new ATOM 0 HG23 ILE A 21 -6.820 1.979 -9.752 1.00 75.35 H new ATOM 0 HD11 ILE A 21 -6.779 0.687 -6.328 1.00 71.11 H new ATOM 0 HD12 ILE A 21 -7.347 1.317 -7.893 1.00 71.11 H new ATOM 0 HD13 ILE A 21 -6.391 -0.183 -7.831 1.00 71.11 H new ATOM 306 N GLN A 22 -2.758 0.809 -11.285 1.00 4.01 N ATOM 307 CA GLN A 22 -2.200 1.051 -12.610 1.00 24.20 C ATOM 308 C GLN A 22 -2.322 -0.192 -13.488 1.00 34.23 C ATOM 309 O GLN A 22 -2.659 -0.100 -14.668 1.00 42.43 O ATOM 310 CB GLN A 22 -0.735 1.475 -12.501 1.00 33.41 C ATOM 311 CG GLN A 22 -0.551 2.967 -12.272 1.00 14.23 C ATOM 312 CD GLN A 22 -1.057 3.801 -13.433 1.00 54.51 C ATOM 313 OE1 GLN A 22 -1.350 3.277 -14.508 1.00 40.32 O ATOM 314 NE2 GLN A 22 -1.163 5.107 -13.221 1.00 71.45 N ATOM 0 H GLN A 22 -2.062 0.710 -10.546 1.00 4.01 H new ATOM 0 HA GLN A 22 -2.768 1.857 -13.074 1.00 24.20 H new ATOM 0 HB2 GLN A 22 -0.267 0.929 -11.682 1.00 33.41 H new ATOM 0 HB3 GLN A 22 -0.213 1.188 -13.414 1.00 33.41 H new ATOM 0 HG2 GLN A 22 -1.077 3.259 -11.363 1.00 14.23 H new ATOM 0 HG3 GLN A 22 0.506 3.179 -12.111 1.00 14.23 H new ATOM 0 HE21 GLN A 22 -0.909 5.499 -12.314 1.00 71.45 H new ATOM 0 HE22 GLN A 22 -1.499 5.719 -13.965 1.00 71.45 H new ATOM 323 N LEU A 23 -2.045 -1.352 -12.903 1.00 22.31 N ATOM 324 CA LEU A 23 -2.126 -2.612 -13.633 1.00 75.41 C ATOM 325 C LEU A 23 -3.578 -3.056 -13.818 1.00 70.41 C ATOM 326 O LEU A 23 -3.853 -4.011 -14.545 1.00 22.14 O ATOM 327 CB LEU A 23 -1.337 -3.699 -12.901 1.00 45.21 C ATOM 328 CG LEU A 23 -1.040 -4.952 -13.733 1.00 21.51 C ATOM 329 CD1 LEU A 23 0.460 -5.200 -13.817 1.00 42.51 C ATOM 330 CD2 LEU A 23 -1.750 -6.163 -13.147 1.00 53.23 C ATOM 0 H LEU A 23 -1.763 -1.446 -11.927 1.00 22.31 H new ATOM 0 HA LEU A 23 -1.691 -2.454 -14.620 1.00 75.41 H new ATOM 0 HB2 LEU A 23 -0.393 -3.275 -12.560 1.00 45.21 H new ATOM 0 HB3 LEU A 23 -1.893 -3.995 -12.011 1.00 45.21 H new ATOM 0 HG LEU A 23 -1.416 -4.788 -14.743 1.00 21.51 H new ATOM 0 HD11 LEU A 23 0.648 -6.094 -14.412 1.00 42.51 H new ATOM 0 HD12 LEU A 23 0.945 -4.344 -14.286 1.00 42.51 H new ATOM 0 HD13 LEU A 23 0.862 -5.340 -12.814 1.00 42.51 H new ATOM 0 HD21 LEU A 23 -1.527 -7.043 -13.751 1.00 53.23 H new ATOM 0 HD22 LEU A 23 -1.406 -6.327 -12.126 1.00 53.23 H new ATOM 0 HD23 LEU A 23 -2.826 -5.988 -13.144 1.00 53.23 H new ATOM 342 N ILE A 24 -4.503 -2.364 -13.157 1.00 32.24 N ATOM 343 CA ILE A 24 -5.921 -2.696 -13.255 1.00 43.54 C ATOM 344 C ILE A 24 -6.706 -1.574 -13.929 1.00 61.11 C ATOM 345 O ILE A 24 -7.200 -1.732 -15.045 1.00 32.10 O ATOM 346 CB ILE A 24 -6.530 -2.976 -11.866 1.00 32.12 C ATOM 347 CG1 ILE A 24 -5.741 -4.074 -11.150 1.00 60.43 C ATOM 348 CG2 ILE A 24 -7.996 -3.366 -11.990 1.00 33.31 C ATOM 349 CD1 ILE A 24 -5.934 -5.451 -11.752 1.00 63.53 C ATOM 0 H ILE A 24 -4.296 -1.572 -12.549 1.00 32.24 H new ATOM 0 HA ILE A 24 -5.993 -3.598 -13.863 1.00 43.54 H new ATOM 0 HB ILE A 24 -6.469 -2.063 -11.274 1.00 32.12 H new ATOM 0 HG12 ILE A 24 -4.681 -3.822 -11.173 1.00 60.43 H new ATOM 0 HG13 ILE A 24 -6.040 -4.100 -10.102 1.00 60.43 H new ATOM 0 HG21 ILE A 24 -8.406 -3.559 -10.999 1.00 33.31 H new ATOM 0 HG22 ILE A 24 -8.550 -2.554 -12.460 1.00 33.31 H new ATOM 0 HG23 ILE A 24 -8.083 -4.265 -12.600 1.00 33.31 H new ATOM 0 HD11 ILE A 24 -5.345 -6.178 -11.193 1.00 63.53 H new ATOM 0 HD12 ILE A 24 -6.988 -5.724 -11.704 1.00 63.53 H new ATOM 0 HD13 ILE A 24 -5.608 -5.442 -12.792 1.00 63.53 H new ATOM 361 N GLN A 25 -6.821 -0.443 -13.241 1.00 44.13 N ATOM 362 CA GLN A 25 -7.552 0.704 -13.769 1.00 1.11 C ATOM 363 C GLN A 25 -6.668 1.551 -14.683 1.00 12.04 C ATOM 364 O GLN A 25 -7.165 2.244 -15.570 1.00 0.22 O ATOM 365 CB GLN A 25 -8.090 1.559 -12.621 1.00 41.14 C ATOM 366 CG GLN A 25 -8.882 0.767 -11.592 1.00 52.52 C ATOM 367 CD GLN A 25 -10.270 1.332 -11.355 1.00 32.43 C ATOM 368 OE1 GLN A 25 -10.629 2.379 -11.895 1.00 13.35 O ATOM 369 NE2 GLN A 25 -11.060 0.640 -10.543 1.00 42.34 N ATOM 0 H GLN A 25 -6.417 -0.296 -12.316 1.00 44.13 H new ATOM 0 HA GLN A 25 -8.388 0.328 -14.360 1.00 1.11 H new ATOM 0 HB2 GLN A 25 -7.255 2.052 -12.124 1.00 41.14 H new ATOM 0 HB3 GLN A 25 -8.725 2.344 -13.031 1.00 41.14 H new ATOM 0 HG2 GLN A 25 -8.968 -0.268 -11.924 1.00 52.52 H new ATOM 0 HG3 GLN A 25 -8.334 0.755 -10.650 1.00 52.52 H new ATOM 0 HE21 GLN A 25 -10.723 -0.223 -10.116 1.00 42.34 H new ATOM 0 HE22 GLN A 25 -12.004 0.971 -10.346 1.00 42.34 H new ATOM 378 N ASN A 26 -5.359 1.491 -14.460 1.00 35.02 N ATOM 379 CA ASN A 26 -4.406 2.254 -15.262 1.00 23.33 C ATOM 380 C ASN A 26 -4.563 3.750 -15.016 1.00 65.22 C ATOM 381 O ASN A 26 -4.991 4.497 -15.896 1.00 33.52 O ATOM 382 CB ASN A 26 -4.588 1.949 -16.752 1.00 62.11 C ATOM 383 CG ASN A 26 -4.746 0.467 -17.026 1.00 65.53 C ATOM 384 OD1 ASN A 26 -3.781 -0.294 -16.963 1.00 1.31 O ATOM 385 ND2 ASN A 26 -5.968 0.049 -17.334 1.00 65.23 N ATOM 0 H ASN A 26 -4.932 0.921 -13.729 1.00 35.02 H new ATOM 0 HA ASN A 26 -3.402 1.955 -14.961 1.00 23.33 H new ATOM 0 HB2 ASN A 26 -5.465 2.479 -17.124 1.00 62.11 H new ATOM 0 HB3 ASN A 26 -3.728 2.328 -17.305 1.00 62.11 H new ATOM 0 HD21 ASN A 26 -6.135 -0.938 -17.530 1.00 65.23 H new ATOM 0 HD22 ASN A 26 -6.740 0.715 -17.375 1.00 65.23 H new ATOM 392 N HIS A 27 -4.207 4.181 -13.812 1.00 61.41 N ATOM 393 CA HIS A 27 -4.302 5.587 -13.443 1.00 11.25 C ATOM 394 C HIS A 27 -3.749 5.811 -12.041 1.00 13.52 C ATOM 395 O HIS A 27 -3.983 5.009 -11.136 1.00 53.43 O ATOM 396 CB HIS A 27 -5.755 6.065 -13.519 1.00 4.42 C ATOM 397 CG HIS A 27 -6.625 5.523 -12.427 1.00 32.05 C ATOM 398 ND1 HIS A 27 -6.461 5.860 -11.100 1.00 52.04 N ATOM 399 CD2 HIS A 27 -7.668 4.659 -12.469 1.00 63.40 C ATOM 400 CE1 HIS A 27 -7.363 5.227 -10.371 1.00 71.12 C ATOM 401 NE2 HIS A 27 -8.108 4.493 -11.178 1.00 53.52 N ATOM 0 H HIS A 27 -3.849 3.575 -13.074 1.00 61.41 H new ATOM 0 HA HIS A 27 -3.707 6.166 -14.149 1.00 11.25 H new ATOM 0 HB2 HIS A 27 -5.772 7.154 -13.479 1.00 4.42 H new ATOM 0 HB3 HIS A 27 -6.174 5.775 -14.483 1.00 4.42 H new ATOM 0 HD2 HIS A 27 -8.077 4.189 -13.351 1.00 63.40 H new ATOM 0 HE1 HIS A 27 -7.472 5.298 -9.299 1.00 71.12 H new ATOM 0 HE2 HIS A 27 -8.885 3.899 -10.889 1.00 53.52 H new ATOM 410 N PHE A 28 -3.018 6.902 -11.867 1.00 51.04 N ATOM 411 CA PHE A 28 -2.436 7.228 -10.574 1.00 72.32 C ATOM 412 C PHE A 28 -3.528 7.449 -9.531 1.00 42.32 C ATOM 413 O PHE A 28 -4.520 8.128 -9.793 1.00 31.44 O ATOM 414 CB PHE A 28 -1.558 8.472 -10.692 1.00 72.23 C ATOM 415 CG PHE A 28 -0.465 8.529 -9.667 1.00 54.21 C ATOM 416 CD1 PHE A 28 -0.711 9.041 -8.406 1.00 11.30 C ATOM 417 CD2 PHE A 28 0.808 8.073 -9.968 1.00 51.22 C ATOM 418 CE1 PHE A 28 0.294 9.098 -7.460 1.00 3.50 C ATOM 419 CE2 PHE A 28 1.817 8.126 -9.026 1.00 20.33 C ATOM 420 CZ PHE A 28 1.559 8.638 -7.771 1.00 11.30 C ATOM 0 H PHE A 28 -2.814 7.576 -12.605 1.00 51.04 H new ATOM 0 HA PHE A 28 -1.819 6.389 -10.252 1.00 72.32 H new ATOM 0 HB2 PHE A 28 -1.114 8.502 -11.687 1.00 72.23 H new ATOM 0 HB3 PHE A 28 -2.183 9.360 -10.595 1.00 72.23 H new ATOM 0 HD1 PHE A 28 -1.699 9.400 -8.158 1.00 11.30 H new ATOM 0 HD2 PHE A 28 1.014 7.672 -10.949 1.00 51.22 H new ATOM 0 HE1 PHE A 28 0.091 9.501 -6.479 1.00 3.50 H new ATOM 0 HE2 PHE A 28 2.806 7.767 -9.271 1.00 20.33 H new ATOM 0 HZ PHE A 28 2.346 8.679 -7.032 1.00 11.30 H new ATOM 430 N VAL A 29 -3.342 6.866 -8.351 1.00 73.54 N ATOM 431 CA VAL A 29 -4.317 6.997 -7.275 1.00 44.41 C ATOM 432 C VAL A 29 -4.514 8.462 -6.888 1.00 5.45 C ATOM 433 O VAL A 29 -3.608 9.282 -7.031 1.00 53.22 O ATOM 434 CB VAL A 29 -3.897 6.174 -6.033 1.00 21.35 C ATOM 435 CG1 VAL A 29 -4.591 6.675 -4.772 1.00 22.21 C ATOM 436 CG2 VAL A 29 -4.197 4.699 -6.255 1.00 75.53 C ATOM 0 H VAL A 29 -2.527 6.300 -8.116 1.00 73.54 H new ATOM 0 HA VAL A 29 -5.264 6.603 -7.646 1.00 44.41 H new ATOM 0 HB VAL A 29 -2.824 6.301 -5.893 1.00 21.35 H new ATOM 0 HG11 VAL A 29 -4.273 6.075 -3.919 1.00 22.21 H new ATOM 0 HG12 VAL A 29 -4.326 7.718 -4.601 1.00 22.21 H new ATOM 0 HG13 VAL A 29 -5.671 6.590 -4.893 1.00 22.21 H new ATOM 0 HG21 VAL A 29 -3.897 4.130 -5.375 1.00 75.53 H new ATOM 0 HG22 VAL A 29 -5.265 4.567 -6.426 1.00 75.53 H new ATOM 0 HG23 VAL A 29 -3.644 4.342 -7.123 1.00 75.53 H new ATOM 446 N ASP A 30 -5.710 8.778 -6.401 1.00 2.12 N ATOM 447 CA ASP A 30 -6.038 10.141 -5.995 1.00 45.04 C ATOM 448 C ASP A 30 -7.308 10.161 -5.148 1.00 35.51 C ATOM 449 O ASP A 30 -7.372 10.842 -4.124 1.00 5.03 O ATOM 450 CB ASP A 30 -6.214 11.031 -7.228 1.00 34.23 C ATOM 451 CG ASP A 30 -6.599 12.455 -6.871 1.00 52.02 C ATOM 452 OD1 ASP A 30 -5.951 13.039 -5.977 1.00 71.24 O ATOM 453 OD2 ASP A 30 -7.548 12.984 -7.485 1.00 25.10 O ATOM 0 H ASP A 30 -6.469 8.108 -6.278 1.00 2.12 H new ATOM 0 HA ASP A 30 -5.216 10.527 -5.393 1.00 45.04 H new ATOM 0 HB2 ASP A 30 -5.285 11.042 -7.799 1.00 34.23 H new ATOM 0 HB3 ASP A 30 -6.980 10.603 -7.874 1.00 34.23 H new ATOM 458 N GLU A 31 -8.315 9.412 -5.583 1.00 2.21 N ATOM 459 CA GLU A 31 -9.582 9.342 -4.866 1.00 14.14 C ATOM 460 C GLU A 31 -10.152 7.928 -4.909 1.00 41.13 C ATOM 461 O GLU A 31 -11.180 7.679 -5.541 1.00 44.04 O ATOM 462 CB GLU A 31 -10.583 10.334 -5.463 1.00 0.21 C ATOM 463 CG GLU A 31 -10.649 10.294 -6.981 1.00 23.11 C ATOM 464 CD GLU A 31 -12.067 10.394 -7.507 1.00 74.13 C ATOM 465 OE1 GLU A 31 -12.623 11.513 -7.504 1.00 53.35 O ATOM 466 OE2 GLU A 31 -12.622 9.355 -7.920 1.00 73.50 O ATOM 0 H GLU A 31 -8.278 8.844 -6.430 1.00 2.21 H new ATOM 0 HA GLU A 31 -9.401 9.606 -3.824 1.00 14.14 H new ATOM 0 HB2 GLU A 31 -11.574 10.125 -5.059 1.00 0.21 H new ATOM 0 HB3 GLU A 31 -10.316 11.342 -5.146 1.00 0.21 H new ATOM 0 HG2 GLU A 31 -10.056 11.113 -7.388 1.00 23.11 H new ATOM 0 HG3 GLU A 31 -10.199 9.367 -7.336 1.00 23.11 H new ATOM 473 N TYR A 32 -9.476 7.004 -4.234 1.00 55.22 N ATOM 474 CA TYR A 32 -9.912 5.612 -4.195 1.00 1.31 C ATOM 475 C TYR A 32 -9.849 5.063 -2.770 1.00 21.45 C ATOM 476 O TYR A 32 -9.190 5.635 -1.902 1.00 14.23 O ATOM 477 CB TYR A 32 -9.051 4.763 -5.145 1.00 75.11 C ATOM 478 CG TYR A 32 -7.899 4.043 -4.473 1.00 73.41 C ATOM 479 CD1 TYR A 32 -6.905 4.750 -3.809 1.00 51.32 C ATOM 480 CD2 TYR A 32 -7.809 2.657 -4.505 1.00 1.02 C ATOM 481 CE1 TYR A 32 -5.854 4.097 -3.195 1.00 72.14 C ATOM 482 CE2 TYR A 32 -6.761 1.997 -3.893 1.00 23.22 C ATOM 483 CZ TYR A 32 -5.786 2.721 -3.240 1.00 44.32 C ATOM 484 OH TYR A 32 -4.741 2.067 -2.632 1.00 23.10 O ATOM 0 H TYR A 32 -8.624 7.194 -3.706 1.00 55.22 H new ATOM 0 HA TYR A 32 -10.949 5.563 -4.527 1.00 1.31 H new ATOM 0 HB2 TYR A 32 -9.689 4.026 -5.633 1.00 75.11 H new ATOM 0 HB3 TYR A 32 -8.653 5.408 -5.928 1.00 75.11 H new ATOM 0 HD1 TYR A 32 -6.955 5.828 -3.772 1.00 51.32 H new ATOM 0 HD2 TYR A 32 -8.570 2.087 -5.016 1.00 1.02 H new ATOM 0 HE1 TYR A 32 -5.089 4.662 -2.682 1.00 72.14 H new ATOM 0 HE2 TYR A 32 -6.706 0.919 -3.926 1.00 23.22 H new ATOM 0 HH TYR A 32 -4.069 2.720 -2.344 1.00 23.10 H new ATOM 494 N ASP A 33 -10.538 3.950 -2.539 1.00 53.32 N ATOM 495 CA ASP A 33 -10.561 3.321 -1.222 1.00 45.23 C ATOM 496 C ASP A 33 -9.144 2.975 -0.756 1.00 35.51 C ATOM 497 O ASP A 33 -8.439 2.211 -1.414 1.00 75.10 O ATOM 498 CB ASP A 33 -11.426 2.057 -1.251 1.00 20.13 C ATOM 499 CG ASP A 33 -11.182 1.211 -2.487 1.00 3.21 C ATOM 500 OD1 ASP A 33 -10.011 0.872 -2.754 1.00 14.34 O ATOM 501 OD2 ASP A 33 -12.165 0.888 -3.187 1.00 61.31 O ATOM 0 H ASP A 33 -11.088 3.464 -3.247 1.00 53.32 H new ATOM 0 HA ASP A 33 -10.992 4.031 -0.516 1.00 45.23 H new ATOM 0 HB2 ASP A 33 -11.222 1.461 -0.361 1.00 20.13 H new ATOM 0 HB3 ASP A 33 -12.478 2.340 -1.211 1.00 20.13 H new ATOM 506 N PRO A 34 -8.702 3.538 0.386 1.00 4.05 N ATOM 507 CA PRO A 34 -7.361 3.281 0.920 1.00 74.30 C ATOM 508 C PRO A 34 -7.221 1.881 1.513 1.00 70.21 C ATOM 509 O PRO A 34 -6.280 1.154 1.196 1.00 63.14 O ATOM 510 CB PRO A 34 -7.203 4.342 2.009 1.00 30.11 C ATOM 511 CG PRO A 34 -8.592 4.649 2.450 1.00 64.22 C ATOM 512 CD PRO A 34 -9.466 4.470 1.237 1.00 33.21 C ATOM 0 HA PRO A 34 -6.600 3.331 0.141 1.00 74.30 H new ATOM 0 HB2 PRO A 34 -6.599 3.971 2.837 1.00 30.11 H new ATOM 0 HB3 PRO A 34 -6.705 5.232 1.624 1.00 30.11 H new ATOM 0 HG2 PRO A 34 -8.901 3.982 3.255 1.00 64.22 H new ATOM 0 HG3 PRO A 34 -8.663 5.667 2.834 1.00 64.22 H new ATOM 0 HD2 PRO A 34 -10.441 4.061 1.503 1.00 33.21 H new ATOM 0 HD3 PRO A 34 -9.646 5.418 0.730 1.00 33.21 H new ATOM 520 N SER A 35 -8.159 1.507 2.378 1.00 54.42 N ATOM 521 CA SER A 35 -8.133 0.195 3.014 1.00 34.24 C ATOM 522 C SER A 35 -9.407 -0.586 2.710 1.00 74.15 C ATOM 523 O SER A 35 -10.494 -0.217 3.154 1.00 13.55 O ATOM 524 CB SER A 35 -7.959 0.340 4.527 1.00 55.25 C ATOM 525 OG SER A 35 -6.669 0.831 4.848 1.00 42.24 O ATOM 0 H SER A 35 -8.946 2.094 2.654 1.00 54.42 H new ATOM 0 HA SER A 35 -7.285 -0.358 2.609 1.00 34.24 H new ATOM 0 HB2 SER A 35 -8.717 1.017 4.920 1.00 55.25 H new ATOM 0 HB3 SER A 35 -8.114 -0.626 5.008 1.00 55.25 H new ATOM 0 HG SER A 35 -6.526 0.766 5.815 1.00 42.24 H new ATOM 531 N ILE A 36 -9.264 -1.666 1.949 1.00 14.31 N ATOM 532 CA ILE A 36 -10.401 -2.500 1.581 1.00 21.44 C ATOM 533 C ILE A 36 -9.948 -3.881 1.140 1.00 64.32 C ATOM 534 O ILE A 36 -8.754 -4.178 1.110 1.00 44.15 O ATOM 535 CB ILE A 36 -11.230 -1.859 0.451 1.00 65.34 C ATOM 536 CG1 ILE A 36 -10.314 -1.344 -0.657 1.00 42.22 C ATOM 537 CG2 ILE A 36 -12.081 -0.728 0.998 1.00 2.31 C ATOM 538 CD1 ILE A 36 -10.675 -1.863 -2.031 1.00 63.12 C ATOM 0 H ILE A 36 -8.370 -1.984 1.575 1.00 14.31 H new ATOM 0 HA ILE A 36 -11.024 -2.591 2.470 1.00 21.44 H new ATOM 0 HB ILE A 36 -11.888 -2.620 0.031 1.00 65.34 H new ATOM 0 HG12 ILE A 36 -10.349 -0.255 -0.669 1.00 42.22 H new ATOM 0 HG13 ILE A 36 -9.287 -1.628 -0.429 1.00 42.22 H new ATOM 0 HG21 ILE A 36 -12.661 -0.285 0.189 1.00 2.31 H new ATOM 0 HG22 ILE A 36 -12.758 -1.117 1.759 1.00 2.31 H new ATOM 0 HG23 ILE A 36 -11.436 0.031 1.440 1.00 2.31 H new ATOM 0 HD11 ILE A 36 -9.982 -1.456 -2.767 1.00 63.12 H new ATOM 0 HD12 ILE A 36 -10.612 -2.951 -2.037 1.00 63.12 H new ATOM 0 HD13 ILE A 36 -11.691 -1.557 -2.280 1.00 63.12 H new ATOM 550 N GLU A 37 -10.914 -4.726 0.811 1.00 52.14 N ATOM 551 CA GLU A 37 -10.625 -6.085 0.383 1.00 1.44 C ATOM 552 C GLU A 37 -11.185 -6.362 -1.011 1.00 74.11 C ATOM 553 O GLU A 37 -11.176 -7.502 -1.474 1.00 25.22 O ATOM 554 CB GLU A 37 -11.213 -7.072 1.385 1.00 14.04 C ATOM 555 CG GLU A 37 -10.246 -7.466 2.490 1.00 65.33 C ATOM 556 CD GLU A 37 -10.954 -7.991 3.724 1.00 43.11 C ATOM 557 OE1 GLU A 37 -11.713 -7.220 4.346 1.00 1.35 O ATOM 558 OE2 GLU A 37 -10.749 -9.175 4.066 1.00 31.54 O ATOM 0 H GLU A 37 -11.907 -4.493 0.833 1.00 52.14 H new ATOM 0 HA GLU A 37 -9.543 -6.206 0.338 1.00 1.44 H new ATOM 0 HB2 GLU A 37 -12.105 -6.634 1.833 1.00 14.04 H new ATOM 0 HB3 GLU A 37 -11.531 -7.970 0.855 1.00 14.04 H new ATOM 0 HG2 GLU A 37 -9.563 -8.228 2.115 1.00 65.33 H new ATOM 0 HG3 GLU A 37 -9.640 -6.602 2.763 1.00 65.33 H new ATOM 565 N ASP A 38 -11.668 -5.319 -1.680 1.00 32.21 N ATOM 566 CA ASP A 38 -12.223 -5.466 -3.019 1.00 1.50 C ATOM 567 C ASP A 38 -11.113 -5.728 -4.033 1.00 62.50 C ATOM 568 O ASP A 38 -10.877 -4.924 -4.935 1.00 60.21 O ATOM 569 CB ASP A 38 -13.010 -4.214 -3.411 1.00 72.11 C ATOM 570 CG ASP A 38 -14.405 -4.200 -2.818 1.00 51.21 C ATOM 571 OD1 ASP A 38 -14.546 -4.534 -1.622 1.00 31.32 O ATOM 572 OD2 ASP A 38 -15.358 -3.856 -3.549 1.00 1.24 O ATOM 0 H ASP A 38 -11.686 -4.366 -1.317 1.00 32.21 H new ATOM 0 HA ASP A 38 -12.901 -6.319 -3.017 1.00 1.50 H new ATOM 0 HB2 ASP A 38 -12.468 -3.329 -3.079 1.00 72.11 H new ATOM 0 HB3 ASP A 38 -13.079 -4.157 -4.497 1.00 72.11 H new ATOM 577 N SER A 39 -10.433 -6.859 -3.874 1.00 5.31 N ATOM 578 CA SER A 39 -9.342 -7.232 -4.771 1.00 71.33 C ATOM 579 C SER A 39 -9.798 -7.215 -6.226 1.00 54.44 C ATOM 580 O SER A 39 -10.955 -7.507 -6.529 1.00 40.42 O ATOM 581 CB SER A 39 -8.809 -8.618 -4.408 1.00 22.53 C ATOM 582 OG SER A 39 -9.808 -9.610 -4.580 1.00 45.41 O ATOM 0 H SER A 39 -10.618 -7.534 -3.132 1.00 5.31 H new ATOM 0 HA SER A 39 -8.544 -6.499 -4.653 1.00 71.33 H new ATOM 0 HB2 SER A 39 -7.946 -8.854 -5.031 1.00 22.53 H new ATOM 0 HB3 SER A 39 -8.465 -8.619 -3.374 1.00 22.53 H new ATOM 0 HG SER A 39 -9.488 -10.291 -5.208 1.00 45.41 H new ATOM 588 N TYR A 40 -8.880 -6.870 -7.124 1.00 44.44 N ATOM 589 CA TYR A 40 -9.186 -6.815 -8.548 1.00 72.13 C ATOM 590 C TYR A 40 -8.756 -8.100 -9.246 1.00 54.22 C ATOM 591 O TYR A 40 -7.958 -8.871 -8.712 1.00 73.15 O ATOM 592 CB TYR A 40 -8.492 -5.614 -9.195 1.00 14.54 C ATOM 593 CG TYR A 40 -8.563 -4.352 -8.364 1.00 34.34 C ATOM 594 CD1 TYR A 40 -9.675 -3.521 -8.421 1.00 12.24 C ATOM 595 CD2 TYR A 40 -7.518 -3.992 -7.522 1.00 34.00 C ATOM 596 CE1 TYR A 40 -9.744 -2.368 -7.663 1.00 14.45 C ATOM 597 CE2 TYR A 40 -7.580 -2.842 -6.760 1.00 2.43 C ATOM 598 CZ TYR A 40 -8.694 -2.033 -6.834 1.00 12.13 C ATOM 599 OH TYR A 40 -8.759 -0.886 -6.076 1.00 60.43 O ATOM 0 H TYR A 40 -7.918 -6.624 -6.890 1.00 44.44 H new ATOM 0 HA TYR A 40 -10.265 -6.705 -8.658 1.00 72.13 H new ATOM 0 HB2 TYR A 40 -7.446 -5.863 -9.374 1.00 14.54 H new ATOM 0 HB3 TYR A 40 -8.945 -5.424 -10.168 1.00 14.54 H new ATOM 0 HD1 TYR A 40 -10.499 -3.781 -9.069 1.00 12.24 H new ATOM 0 HD2 TYR A 40 -6.643 -4.622 -7.462 1.00 34.00 H new ATOM 0 HE1 TYR A 40 -10.615 -1.733 -7.719 1.00 14.45 H new ATOM 0 HE2 TYR A 40 -6.760 -2.578 -6.109 1.00 2.43 H new ATOM 0 HH TYR A 40 -8.069 -0.914 -5.381 1.00 60.43 H new ATOM 609 N ARG A 41 -9.290 -8.327 -10.442 1.00 23.34 N ATOM 610 CA ARG A 41 -8.961 -9.521 -11.212 1.00 1.23 C ATOM 611 C ARG A 41 -8.932 -9.215 -12.707 1.00 12.41 C ATOM 612 O ARG A 41 -9.965 -8.922 -13.310 1.00 74.43 O ATOM 613 CB ARG A 41 -9.972 -10.633 -10.928 1.00 34.21 C ATOM 614 CG ARG A 41 -9.863 -11.212 -9.528 1.00 45.45 C ATOM 615 CD ARG A 41 -11.183 -11.806 -9.065 1.00 63.34 C ATOM 616 NE ARG A 41 -12.259 -10.818 -9.068 1.00 61.24 N ATOM 617 CZ ARG A 41 -13.493 -11.064 -8.630 1.00 31.43 C ATOM 618 NH1 ARG A 41 -13.809 -12.262 -8.153 1.00 54.43 N ATOM 619 NH2 ARG A 41 -14.411 -10.108 -8.667 1.00 21.42 N ATOM 0 H ARG A 41 -9.952 -7.700 -10.899 1.00 23.34 H new ATOM 0 HA ARG A 41 -7.969 -9.855 -10.908 1.00 1.23 H new ATOM 0 HB2 ARG A 41 -10.979 -10.242 -11.073 1.00 34.21 H new ATOM 0 HB3 ARG A 41 -9.833 -11.433 -11.655 1.00 34.21 H new ATOM 0 HG2 ARG A 41 -9.091 -11.981 -9.511 1.00 45.45 H new ATOM 0 HG3 ARG A 41 -9.551 -10.432 -8.834 1.00 45.45 H new ATOM 0 HD2 ARG A 41 -11.454 -12.639 -9.715 1.00 63.34 H new ATOM 0 HD3 ARG A 41 -11.066 -12.211 -8.060 1.00 63.34 H new ATOM 0 HE ARG A 41 -12.054 -9.885 -9.426 1.00 61.24 H new ATOM 0 HH11 ARG A 41 -13.105 -13.000 -8.120 1.00 54.43 H new ATOM 0 HH12 ARG A 41 -14.755 -12.445 -7.819 1.00 54.43 H new ATOM 0 HH21 ARG A 41 -14.172 -9.185 -9.031 1.00 21.42 H new ATOM 0 HH22 ARG A 41 -15.356 -10.295 -8.332 1.00 21.42 H new ATOM 633 N LYS A 42 -7.743 -9.283 -13.298 1.00 41.33 N ATOM 634 CA LYS A 42 -7.582 -9.013 -14.722 1.00 31.33 C ATOM 635 C LYS A 42 -6.877 -10.173 -15.419 1.00 54.42 C ATOM 636 O LYS A 42 -5.857 -10.669 -14.941 1.00 11.14 O ATOM 637 CB LYS A 42 -6.790 -7.721 -14.931 1.00 3.30 C ATOM 638 CG LYS A 42 -6.824 -7.211 -16.362 1.00 23.53 C ATOM 639 CD LYS A 42 -5.983 -5.956 -16.526 1.00 44.12 C ATOM 640 CE LYS A 42 -4.501 -6.254 -16.365 1.00 42.32 C ATOM 641 NZ LYS A 42 -3.663 -5.386 -17.238 1.00 62.11 N ATOM 0 H LYS A 42 -6.878 -9.522 -12.813 1.00 41.33 H new ATOM 0 HA LYS A 42 -8.574 -8.898 -15.159 1.00 31.33 H new ATOM 0 HB2 LYS A 42 -7.187 -6.950 -14.270 1.00 3.30 H new ATOM 0 HB3 LYS A 42 -5.753 -7.889 -14.639 1.00 3.30 H new ATOM 0 HG2 LYS A 42 -6.457 -7.986 -17.035 1.00 23.53 H new ATOM 0 HG3 LYS A 42 -7.854 -7.000 -16.650 1.00 23.53 H new ATOM 0 HD2 LYS A 42 -6.163 -5.522 -17.509 1.00 44.12 H new ATOM 0 HD3 LYS A 42 -6.288 -5.213 -15.789 1.00 44.12 H new ATOM 0 HE2 LYS A 42 -4.212 -6.109 -15.324 1.00 42.32 H new ATOM 0 HE3 LYS A 42 -4.313 -7.300 -16.605 1.00 42.32 H new ATOM 0 HZ1 LYS A 42 -2.780 -5.882 -17.476 1.00 62.11 H new ATOM 0 HZ2 LYS A 42 -4.183 -5.167 -18.112 1.00 62.11 H new ATOM 0 HZ3 LYS A 42 -3.440 -4.502 -16.737 1.00 62.11 H new ATOM 655 N GLN A 43 -7.429 -10.600 -16.551 1.00 64.14 N ATOM 656 CA GLN A 43 -6.852 -11.702 -17.313 1.00 2.43 C ATOM 657 C GLN A 43 -5.800 -11.194 -18.294 1.00 52.44 C ATOM 658 O GLN A 43 -6.005 -10.189 -18.975 1.00 52.21 O ATOM 659 CB GLN A 43 -7.949 -12.454 -18.069 1.00 31.13 C ATOM 660 CG GLN A 43 -7.432 -13.637 -18.873 1.00 74.31 C ATOM 661 CD GLN A 43 -8.478 -14.207 -19.812 1.00 71.30 C ATOM 662 OE1 GLN A 43 -8.764 -15.403 -19.787 1.00 45.15 O ATOM 663 NE2 GLN A 43 -9.056 -13.349 -20.646 1.00 60.32 N ATOM 0 H GLN A 43 -8.274 -10.200 -16.960 1.00 64.14 H new ATOM 0 HA GLN A 43 -6.370 -12.383 -16.612 1.00 2.43 H new ATOM 0 HB2 GLN A 43 -8.693 -12.808 -17.356 1.00 31.13 H new ATOM 0 HB3 GLN A 43 -8.455 -11.762 -18.742 1.00 31.13 H new ATOM 0 HG2 GLN A 43 -6.562 -13.326 -19.451 1.00 74.31 H new ATOM 0 HG3 GLN A 43 -7.099 -14.418 -18.190 1.00 74.31 H new ATOM 0 HE21 GLN A 43 -8.788 -12.365 -20.632 1.00 60.32 H new ATOM 0 HE22 GLN A 43 -9.768 -13.674 -21.300 1.00 60.32 H new ATOM 672 N VAL A 44 -4.673 -11.896 -18.361 1.00 45.12 N ATOM 673 CA VAL A 44 -3.590 -11.516 -19.260 1.00 3.00 C ATOM 674 C VAL A 44 -2.972 -12.742 -19.924 1.00 20.34 C ATOM 675 O VAL A 44 -3.345 -13.877 -19.623 1.00 52.11 O ATOM 676 CB VAL A 44 -2.487 -10.741 -18.514 1.00 43.35 C ATOM 677 CG1 VAL A 44 -3.030 -9.427 -17.974 1.00 42.53 C ATOM 678 CG2 VAL A 44 -1.903 -11.586 -17.392 1.00 71.42 C ATOM 0 H VAL A 44 -4.487 -12.730 -17.804 1.00 45.12 H new ATOM 0 HA VAL A 44 -4.024 -10.871 -20.024 1.00 3.00 H new ATOM 0 HB VAL A 44 -1.688 -10.515 -19.220 1.00 43.35 H new ATOM 0 HG11 VAL A 44 -2.237 -8.893 -17.450 1.00 42.53 H new ATOM 0 HG12 VAL A 44 -3.394 -8.816 -18.801 1.00 42.53 H new ATOM 0 HG13 VAL A 44 -3.849 -9.628 -17.284 1.00 42.53 H new ATOM 0 HG21 VAL A 44 -1.126 -11.021 -16.878 1.00 71.42 H new ATOM 0 HG22 VAL A 44 -2.691 -11.846 -16.685 1.00 71.42 H new ATOM 0 HG23 VAL A 44 -1.473 -12.497 -17.808 1.00 71.42 H new ATOM 688 N VAL A 45 -2.026 -12.507 -20.827 1.00 0.41 N ATOM 689 CA VAL A 45 -1.357 -13.593 -21.532 1.00 12.44 C ATOM 690 C VAL A 45 0.118 -13.668 -21.154 1.00 12.32 C ATOM 691 O VAL A 45 0.938 -12.896 -21.653 1.00 21.43 O ATOM 692 CB VAL A 45 -1.476 -13.431 -23.059 1.00 42.00 C ATOM 693 CG1 VAL A 45 -0.949 -14.668 -23.770 1.00 74.12 C ATOM 694 CG2 VAL A 45 -2.918 -13.153 -23.456 1.00 1.22 C ATOM 0 H VAL A 45 -1.706 -11.574 -21.088 1.00 0.41 H new ATOM 0 HA VAL A 45 -1.854 -14.516 -21.233 1.00 12.44 H new ATOM 0 HB VAL A 45 -0.869 -12.579 -23.364 1.00 42.00 H new ATOM 0 HG11 VAL A 45 -1.041 -14.535 -24.848 1.00 74.12 H new ATOM 0 HG12 VAL A 45 0.099 -14.818 -23.511 1.00 74.12 H new ATOM 0 HG13 VAL A 45 -1.527 -15.539 -23.461 1.00 74.12 H new ATOM 0 HG21 VAL A 45 -2.982 -13.041 -24.538 1.00 1.22 H new ATOM 0 HG22 VAL A 45 -3.549 -13.983 -23.139 1.00 1.22 H new ATOM 0 HG23 VAL A 45 -3.257 -12.235 -22.976 1.00 1.22 H new ATOM 704 N ILE A 46 0.449 -14.603 -20.269 1.00 12.54 N ATOM 705 CA ILE A 46 1.823 -14.783 -19.821 1.00 1.43 C ATOM 706 C ILE A 46 2.562 -15.782 -20.706 1.00 21.03 C ATOM 707 O ILE A 46 2.365 -16.992 -20.591 1.00 25.23 O ATOM 708 CB ILE A 46 1.873 -15.269 -18.359 1.00 62.12 C ATOM 709 CG1 ILE A 46 1.039 -14.343 -17.465 1.00 54.31 C ATOM 710 CG2 ILE A 46 3.315 -15.350 -17.871 1.00 50.43 C ATOM 711 CD1 ILE A 46 1.764 -13.085 -17.031 1.00 62.32 C ATOM 0 H ILE A 46 -0.219 -15.249 -19.848 1.00 12.54 H new ATOM 0 HA ILE A 46 2.313 -13.812 -19.891 1.00 1.43 H new ATOM 0 HB ILE A 46 1.446 -16.270 -18.306 1.00 62.12 H new ATOM 0 HG12 ILE A 46 0.132 -14.061 -17.999 1.00 54.31 H new ATOM 0 HG13 ILE A 46 0.728 -14.895 -16.578 1.00 54.31 H new ATOM 0 HG21 ILE A 46 3.330 -15.695 -16.837 1.00 50.43 H new ATOM 0 HG22 ILE A 46 3.872 -16.049 -18.495 1.00 50.43 H new ATOM 0 HG23 ILE A 46 3.776 -14.364 -17.931 1.00 50.43 H new ATOM 0 HD11 ILE A 46 1.106 -12.485 -16.402 1.00 62.32 H new ATOM 0 HD12 ILE A 46 2.657 -13.356 -16.468 1.00 62.32 H new ATOM 0 HD13 ILE A 46 2.051 -12.509 -17.911 1.00 62.32 H new ATOM 723 N ASP A 47 3.412 -15.268 -21.589 1.00 22.52 N ATOM 724 CA ASP A 47 4.180 -16.116 -22.495 1.00 73.43 C ATOM 725 C ASP A 47 3.256 -16.934 -23.390 1.00 34.11 C ATOM 726 O ASP A 47 3.559 -18.078 -23.730 1.00 23.11 O ATOM 727 CB ASP A 47 5.097 -17.048 -21.701 1.00 34.13 C ATOM 728 CG ASP A 47 6.285 -16.320 -21.103 1.00 43.14 C ATOM 729 OD1 ASP A 47 6.876 -15.473 -21.804 1.00 22.20 O ATOM 730 OD2 ASP A 47 6.624 -16.598 -19.933 1.00 43.42 O ATOM 0 H ASP A 47 3.587 -14.269 -21.697 1.00 22.52 H new ATOM 0 HA ASP A 47 4.789 -15.470 -23.127 1.00 73.43 H new ATOM 0 HB2 ASP A 47 4.526 -17.522 -20.903 1.00 34.13 H new ATOM 0 HB3 ASP A 47 5.454 -17.845 -22.354 1.00 34.13 H new ATOM 735 N GLY A 48 2.128 -16.341 -23.768 1.00 50.32 N ATOM 736 CA GLY A 48 1.178 -17.031 -24.620 1.00 71.04 C ATOM 737 C GLY A 48 0.047 -17.668 -23.836 1.00 71.22 C ATOM 738 O GLY A 48 -1.093 -17.706 -24.299 1.00 74.14 O ATOM 0 H GLY A 48 1.855 -15.396 -23.499 1.00 50.32 H new ATOM 0 HA2 GLY A 48 0.764 -16.326 -25.341 1.00 71.04 H new ATOM 0 HA3 GLY A 48 1.699 -17.801 -25.190 1.00 71.04 H new ATOM 742 N GLU A 49 0.363 -18.168 -22.647 1.00 53.14 N ATOM 743 CA GLU A 49 -0.635 -18.807 -21.797 1.00 2.34 C ATOM 744 C GLU A 49 -1.457 -17.764 -21.046 1.00 3.23 C ATOM 745 O GLU A 49 -0.911 -16.931 -20.323 1.00 33.21 O ATOM 746 CB GLU A 49 0.040 -19.754 -20.803 1.00 21.32 C ATOM 747 CG GLU A 49 -0.938 -20.480 -19.893 1.00 60.32 C ATOM 748 CD GLU A 49 -1.583 -21.676 -20.566 1.00 21.55 C ATOM 749 OE1 GLU A 49 -0.854 -22.459 -21.211 1.00 43.35 O ATOM 750 OE2 GLU A 49 -2.817 -21.830 -20.448 1.00 54.02 O ATOM 0 H GLU A 49 1.302 -18.143 -22.250 1.00 53.14 H new ATOM 0 HA GLU A 49 -1.306 -19.382 -22.436 1.00 2.34 H new ATOM 0 HB2 GLU A 49 0.625 -20.490 -21.355 1.00 21.32 H new ATOM 0 HB3 GLU A 49 0.740 -19.186 -20.190 1.00 21.32 H new ATOM 0 HG2 GLU A 49 -0.416 -20.811 -18.995 1.00 60.32 H new ATOM 0 HG3 GLU A 49 -1.715 -19.785 -19.573 1.00 60.32 H new ATOM 757 N THR A 50 -2.773 -17.817 -21.223 1.00 51.23 N ATOM 758 CA THR A 50 -3.672 -16.877 -20.562 1.00 14.30 C ATOM 759 C THR A 50 -3.891 -17.267 -19.103 1.00 42.21 C ATOM 760 O THR A 50 -4.258 -18.403 -18.801 1.00 0.35 O ATOM 761 CB THR A 50 -5.012 -16.821 -21.295 1.00 23.15 C ATOM 762 OG1 THR A 50 -4.827 -16.460 -22.652 1.00 54.34 O ATOM 763 CG2 THR A 50 -5.987 -15.835 -20.687 1.00 1.25 C ATOM 0 H THR A 50 -3.241 -18.500 -21.818 1.00 51.23 H new ATOM 0 HA THR A 50 -3.210 -15.890 -20.589 1.00 14.30 H new ATOM 0 HB THR A 50 -5.431 -17.823 -21.206 1.00 23.15 H new ATOM 0 HG1 THR A 50 -5.696 -16.431 -23.104 1.00 54.34 H new ATOM 0 HG21 THR A 50 -6.917 -15.845 -21.255 1.00 1.25 H new ATOM 0 HG22 THR A 50 -6.190 -16.115 -19.653 1.00 1.25 H new ATOM 0 HG23 THR A 50 -5.557 -14.834 -20.714 1.00 1.25 H new ATOM 771 N CYS A 51 -3.664 -16.316 -18.202 1.00 75.35 N ATOM 772 CA CYS A 51 -3.836 -16.556 -16.775 1.00 41.52 C ATOM 773 C CYS A 51 -4.426 -15.328 -16.087 1.00 1.11 C ATOM 774 O CYS A 51 -4.144 -14.193 -16.473 1.00 23.33 O ATOM 775 CB CYS A 51 -2.497 -16.919 -16.132 1.00 60.24 C ATOM 776 SG CYS A 51 -1.987 -18.632 -16.410 1.00 3.03 S ATOM 0 H CYS A 51 -3.360 -15.371 -18.436 1.00 75.35 H new ATOM 0 HA CYS A 51 -4.527 -17.390 -16.652 1.00 41.52 H new ATOM 0 HB2 CYS A 51 -1.726 -16.254 -16.522 1.00 60.24 H new ATOM 0 HB3 CYS A 51 -2.561 -16.739 -15.059 1.00 60.24 H new ATOM 0 HG CYS A 51 -2.695 -19.145 -17.372 1.00 3.03 H new ATOM 782 N LEU A 52 -5.243 -15.563 -15.067 1.00 23.54 N ATOM 783 CA LEU A 52 -5.871 -14.476 -14.324 1.00 42.25 C ATOM 784 C LEU A 52 -4.887 -13.852 -13.341 1.00 10.12 C ATOM 785 O LEU A 52 -3.999 -14.529 -12.822 1.00 63.14 O ATOM 786 CB LEU A 52 -7.105 -14.986 -13.581 1.00 33.44 C ATOM 787 CG LEU A 52 -8.419 -14.340 -14.017 1.00 32.31 C ATOM 788 CD1 LEU A 52 -9.104 -15.190 -15.075 1.00 2.02 C ATOM 789 CD2 LEU A 52 -9.331 -14.127 -12.819 1.00 33.31 C ATOM 0 H LEU A 52 -5.486 -16.496 -14.735 1.00 23.54 H new ATOM 0 HA LEU A 52 -6.178 -13.710 -15.036 1.00 42.25 H new ATOM 0 HB2 LEU A 52 -7.180 -16.064 -13.724 1.00 33.44 H new ATOM 0 HB3 LEU A 52 -6.967 -14.815 -12.513 1.00 33.44 H new ATOM 0 HG LEU A 52 -8.199 -13.366 -14.454 1.00 32.31 H new ATOM 0 HD11 LEU A 52 -10.038 -14.715 -15.374 1.00 2.02 H new ATOM 0 HD12 LEU A 52 -8.452 -15.286 -15.943 1.00 2.02 H new ATOM 0 HD13 LEU A 52 -9.314 -16.179 -14.667 1.00 2.02 H new ATOM 0 HD21 LEU A 52 -10.262 -13.666 -13.148 1.00 33.31 H new ATOM 0 HD22 LEU A 52 -9.547 -15.087 -12.351 1.00 33.31 H new ATOM 0 HD23 LEU A 52 -8.838 -13.475 -12.098 1.00 33.31 H new ATOM 801 N LEU A 53 -5.050 -12.558 -13.087 1.00 1.33 N ATOM 802 CA LEU A 53 -4.175 -11.845 -12.165 1.00 5.31 C ATOM 803 C LEU A 53 -4.984 -11.144 -11.078 1.00 15.12 C ATOM 804 O LEU A 53 -5.413 -10.003 -11.248 1.00 24.31 O ATOM 805 CB LEU A 53 -3.326 -10.824 -12.923 1.00 43.13 C ATOM 806 CG LEU A 53 -2.293 -11.423 -13.880 1.00 42.22 C ATOM 807 CD1 LEU A 53 -1.444 -10.326 -14.503 1.00 54.31 C ATOM 808 CD2 LEU A 53 -1.415 -12.430 -13.153 1.00 44.32 C ATOM 0 H LEU A 53 -5.780 -11.982 -13.507 1.00 1.33 H new ATOM 0 HA LEU A 53 -3.518 -12.574 -11.690 1.00 5.31 H new ATOM 0 HB2 LEU A 53 -3.990 -10.172 -13.491 1.00 43.13 H new ATOM 0 HB3 LEU A 53 -2.807 -10.197 -12.199 1.00 43.13 H new ATOM 0 HG LEU A 53 -2.823 -11.942 -14.679 1.00 42.22 H new ATOM 0 HD11 LEU A 53 -0.715 -10.771 -15.181 1.00 54.31 H new ATOM 0 HD12 LEU A 53 -2.085 -9.641 -15.058 1.00 54.31 H new ATOM 0 HD13 LEU A 53 -0.923 -9.779 -13.717 1.00 54.31 H new ATOM 0 HD21 LEU A 53 -0.686 -12.846 -13.848 1.00 44.32 H new ATOM 0 HD22 LEU A 53 -0.893 -11.934 -12.334 1.00 44.32 H new ATOM 0 HD23 LEU A 53 -2.035 -13.233 -12.754 1.00 44.32 H new ATOM 820 N ASP A 54 -5.188 -11.837 -9.963 1.00 60.55 N ATOM 821 CA ASP A 54 -5.946 -11.281 -8.847 1.00 73.34 C ATOM 822 C ASP A 54 -5.043 -10.458 -7.934 1.00 41.05 C ATOM 823 O ASP A 54 -4.347 -11.003 -7.077 1.00 42.23 O ATOM 824 CB ASP A 54 -6.614 -12.401 -8.048 1.00 71.52 C ATOM 825 CG ASP A 54 -7.760 -11.896 -7.193 1.00 12.41 C ATOM 826 OD1 ASP A 54 -7.576 -10.876 -6.496 1.00 23.24 O ATOM 827 OD2 ASP A 54 -8.841 -12.520 -7.220 1.00 71.24 O ATOM 0 H ASP A 54 -4.840 -12.783 -9.808 1.00 60.55 H new ATOM 0 HA ASP A 54 -6.716 -10.626 -9.254 1.00 73.34 H new ATOM 0 HB2 ASP A 54 -6.984 -13.162 -8.734 1.00 71.52 H new ATOM 0 HB3 ASP A 54 -5.872 -12.881 -7.410 1.00 71.52 H new ATOM 832 N ILE A 55 -5.058 -9.143 -8.125 1.00 30.51 N ATOM 833 CA ILE A 55 -4.239 -8.245 -7.320 1.00 5.31 C ATOM 834 C ILE A 55 -4.926 -7.910 -6.000 1.00 5.31 C ATOM 835 O ILE A 55 -5.930 -7.199 -5.974 1.00 2.21 O ATOM 836 CB ILE A 55 -3.931 -6.935 -8.071 1.00 22.12 C ATOM 837 CG1 ILE A 55 -3.553 -7.225 -9.525 1.00 4.01 C ATOM 838 CG2 ILE A 55 -2.815 -6.174 -7.370 1.00 4.20 C ATOM 839 CD1 ILE A 55 -2.401 -8.197 -9.668 1.00 72.23 C ATOM 0 H ILE A 55 -5.628 -8.676 -8.830 1.00 30.51 H new ATOM 0 HA ILE A 55 -3.304 -8.767 -7.119 1.00 5.31 H new ATOM 0 HB ILE A 55 -4.828 -6.315 -8.068 1.00 22.12 H new ATOM 0 HG12 ILE A 55 -4.423 -7.626 -10.045 1.00 4.01 H new ATOM 0 HG13 ILE A 55 -3.291 -6.289 -10.018 1.00 4.01 H new ATOM 0 HG21 ILE A 55 -2.608 -5.251 -7.912 1.00 4.20 H new ATOM 0 HG22 ILE A 55 -3.121 -5.936 -6.351 1.00 4.20 H new ATOM 0 HG23 ILE A 55 -1.915 -6.789 -7.344 1.00 4.20 H new ATOM 0 HD11 ILE A 55 -2.188 -8.356 -10.725 1.00 72.23 H new ATOM 0 HD12 ILE A 55 -1.518 -7.789 -9.177 1.00 72.23 H new ATOM 0 HD13 ILE A 55 -2.667 -9.147 -9.205 1.00 72.23 H new ATOM 851 N LEU A 56 -4.376 -8.426 -4.907 1.00 73.43 N ATOM 852 CA LEU A 56 -4.933 -8.182 -3.581 1.00 72.35 C ATOM 853 C LEU A 56 -4.437 -6.852 -3.021 1.00 12.13 C ATOM 854 O LEU A 56 -3.236 -6.585 -2.999 1.00 33.31 O ATOM 855 CB LEU A 56 -4.561 -9.328 -2.634 1.00 44.35 C ATOM 856 CG LEU A 56 -4.808 -9.062 -1.145 1.00 32.35 C ATOM 857 CD1 LEU A 56 -6.296 -9.101 -0.834 1.00 71.23 C ATOM 858 CD2 LEU A 56 -4.058 -10.075 -0.295 1.00 54.42 C ATOM 0 H LEU A 56 -3.544 -9.016 -4.912 1.00 73.43 H new ATOM 0 HA LEU A 56 -6.018 -8.132 -3.668 1.00 72.35 H new ATOM 0 HB2 LEU A 56 -5.125 -10.214 -2.925 1.00 44.35 H new ATOM 0 HB3 LEU A 56 -3.506 -9.562 -2.773 1.00 44.35 H new ATOM 0 HG LEU A 56 -4.435 -8.066 -0.906 1.00 32.35 H new ATOM 0 HD11 LEU A 56 -6.451 -8.910 0.228 1.00 71.23 H new ATOM 0 HD12 LEU A 56 -6.810 -8.338 -1.419 1.00 71.23 H new ATOM 0 HD13 LEU A 56 -6.695 -10.083 -1.088 1.00 71.23 H new ATOM 0 HD21 LEU A 56 -4.243 -9.873 0.760 1.00 54.42 H new ATOM 0 HD22 LEU A 56 -4.403 -11.080 -0.538 1.00 54.42 H new ATOM 0 HD23 LEU A 56 -2.990 -9.999 -0.497 1.00 54.42 H new ATOM 870 N ASP A 57 -5.372 -6.025 -2.564 1.00 73.11 N ATOM 871 CA ASP A 57 -5.034 -4.725 -1.999 1.00 51.42 C ATOM 872 C ASP A 57 -5.185 -4.742 -0.481 1.00 1.20 C ATOM 873 O ASP A 57 -6.295 -4.650 0.042 1.00 1.11 O ATOM 874 CB ASP A 57 -5.925 -3.636 -2.600 1.00 61.53 C ATOM 875 CG ASP A 57 -7.398 -3.890 -2.346 1.00 61.13 C ATOM 876 OD1 ASP A 57 -7.962 -4.805 -2.984 1.00 14.40 O ATOM 877 OD2 ASP A 57 -7.987 -3.175 -1.508 1.00 1.51 O ATOM 0 H ASP A 57 -6.370 -6.233 -2.574 1.00 73.11 H new ATOM 0 HA ASP A 57 -3.994 -4.507 -2.243 1.00 51.42 H new ATOM 0 HB2 ASP A 57 -5.648 -2.670 -2.179 1.00 61.53 H new ATOM 0 HB3 ASP A 57 -5.749 -3.578 -3.674 1.00 61.53 H new ATOM 882 N THR A 58 -4.063 -4.862 0.220 1.00 20.44 N ATOM 883 CA THR A 58 -4.075 -4.894 1.677 1.00 71.21 C ATOM 884 C THR A 58 -4.309 -3.501 2.252 1.00 14.04 C ATOM 885 O THR A 58 -4.519 -2.541 1.511 1.00 54.30 O ATOM 886 CB THR A 58 -2.756 -5.461 2.206 1.00 34.22 C ATOM 887 OG1 THR A 58 -1.717 -4.507 2.088 1.00 15.31 O ATOM 888 CG2 THR A 58 -2.313 -6.716 1.486 1.00 53.22 C ATOM 0 H THR A 58 -3.135 -4.939 -0.197 1.00 20.44 H new ATOM 0 HA THR A 58 -4.894 -5.539 1.994 1.00 71.21 H new ATOM 0 HB THR A 58 -2.946 -5.709 3.250 1.00 34.22 H new ATOM 0 HG1 THR A 58 -0.883 -4.888 2.433 1.00 15.31 H new ATOM 0 HG21 THR A 58 -1.372 -7.066 1.910 1.00 53.22 H new ATOM 0 HG22 THR A 58 -3.072 -7.489 1.602 1.00 53.22 H new ATOM 0 HG23 THR A 58 -2.175 -6.498 0.427 1.00 53.22 H new ATOM 896 N ALA A 59 -4.275 -3.400 3.576 1.00 73.12 N ATOM 897 CA ALA A 59 -4.486 -2.126 4.252 1.00 3.51 C ATOM 898 C ALA A 59 -3.221 -1.666 4.967 1.00 23.10 C ATOM 899 O ALA A 59 -2.372 -2.479 5.334 1.00 22.34 O ATOM 900 CB ALA A 59 -5.640 -2.237 5.236 1.00 53.45 C ATOM 0 H ALA A 59 -4.103 -4.186 4.203 1.00 73.12 H new ATOM 0 HA ALA A 59 -4.736 -1.380 3.498 1.00 3.51 H new ATOM 0 HB1 ALA A 59 -5.787 -1.279 5.734 1.00 53.45 H new ATOM 0 HB2 ALA A 59 -6.549 -2.511 4.701 1.00 53.45 H new ATOM 0 HB3 ALA A 59 -5.412 -3.001 5.979 1.00 53.45 H new ATOM 906 N GLY A 60 -3.101 -0.356 5.162 1.00 23.13 N ATOM 907 CA GLY A 60 -1.936 0.191 5.833 1.00 52.12 C ATOM 908 C GLY A 60 -2.284 0.915 7.122 1.00 61.24 C ATOM 909 O GLY A 60 -1.395 1.283 7.890 1.00 11.30 O ATOM 0 H GLY A 60 -3.790 0.336 4.867 1.00 23.13 H new ATOM 0 HA2 GLY A 60 -1.237 -0.616 6.052 1.00 52.12 H new ATOM 0 HA3 GLY A 60 -1.426 0.881 5.161 1.00 52.12 H new ATOM 913 N GLN A 61 -3.577 1.126 7.362 1.00 51.44 N ATOM 914 CA GLN A 61 -4.025 1.813 8.566 1.00 34.22 C ATOM 915 C GLN A 61 -5.266 1.147 9.154 1.00 35.35 C ATOM 916 O GLN A 61 -6.092 1.803 9.789 1.00 24.11 O ATOM 917 CB GLN A 61 -4.322 3.281 8.256 1.00 54.51 C ATOM 918 CG GLN A 61 -5.132 3.482 6.986 1.00 32.21 C ATOM 919 CD GLN A 61 -5.955 4.755 7.014 1.00 73.24 C ATOM 920 OE1 GLN A 61 -5.608 5.748 6.373 1.00 43.51 O ATOM 921 NE2 GLN A 61 -7.054 4.733 7.761 1.00 55.14 N ATOM 0 H GLN A 61 -4.329 0.831 6.739 1.00 51.44 H new ATOM 0 HA GLN A 61 -3.224 1.754 9.303 1.00 34.22 H new ATOM 0 HB2 GLN A 61 -4.863 3.719 9.095 1.00 54.51 H new ATOM 0 HB3 GLN A 61 -3.380 3.823 8.166 1.00 54.51 H new ATOM 0 HG2 GLN A 61 -4.458 3.509 6.130 1.00 32.21 H new ATOM 0 HG3 GLN A 61 -5.795 2.628 6.843 1.00 32.21 H new ATOM 0 HE21 GLN A 61 -7.304 3.889 8.276 1.00 55.14 H new ATOM 0 HE22 GLN A 61 -7.648 5.560 7.820 1.00 55.14 H new ATOM 930 N GLU A 62 -5.393 -0.159 8.941 1.00 75.13 N ATOM 931 CA GLU A 62 -6.535 -0.907 9.454 1.00 45.24 C ATOM 932 C GLU A 62 -6.308 -2.412 9.328 1.00 43.00 C ATOM 933 O GLU A 62 -5.925 -3.073 10.294 1.00 4.22 O ATOM 934 CB GLU A 62 -7.813 -0.502 8.714 1.00 54.55 C ATOM 935 CG GLU A 62 -8.698 0.448 9.506 1.00 65.33 C ATOM 936 CD GLU A 62 -10.158 0.036 9.490 1.00 33.41 C ATOM 937 OE1 GLU A 62 -10.708 -0.157 8.386 1.00 41.54 O ATOM 938 OE2 GLU A 62 -10.749 -0.093 10.583 1.00 22.23 O ATOM 0 H GLU A 62 -4.721 -0.720 8.418 1.00 75.13 H new ATOM 0 HA GLU A 62 -6.647 -0.667 10.511 1.00 45.24 H new ATOM 0 HB2 GLU A 62 -7.542 -0.031 7.769 1.00 54.55 H new ATOM 0 HB3 GLU A 62 -8.383 -1.399 8.471 1.00 54.55 H new ATOM 0 HG2 GLU A 62 -8.348 0.490 10.537 1.00 65.33 H new ATOM 0 HG3 GLU A 62 -8.604 1.453 9.096 1.00 65.33 H new ATOM 945 N GLU A 63 -6.546 -2.948 8.135 1.00 71.51 N ATOM 946 CA GLU A 63 -6.368 -4.374 7.889 1.00 2.44 C ATOM 947 C GLU A 63 -4.893 -4.715 7.705 1.00 24.43 C ATOM 948 O GLU A 63 -4.409 -4.836 6.579 1.00 52.04 O ATOM 949 CB GLU A 63 -7.163 -4.803 6.654 1.00 33.21 C ATOM 950 CG GLU A 63 -8.582 -4.260 6.625 1.00 44.02 C ATOM 951 CD GLU A 63 -9.556 -5.208 5.953 1.00 74.24 C ATOM 952 OE1 GLU A 63 -9.394 -5.465 4.741 1.00 41.12 O ATOM 953 OE2 GLU A 63 -10.481 -5.693 6.639 1.00 34.24 O ATOM 0 H GLU A 63 -6.862 -2.416 7.324 1.00 71.51 H new ATOM 0 HA GLU A 63 -6.741 -4.917 8.758 1.00 2.44 H new ATOM 0 HB2 GLU A 63 -6.637 -4.469 5.760 1.00 33.21 H new ATOM 0 HB3 GLU A 63 -7.199 -5.892 6.615 1.00 33.21 H new ATOM 0 HG2 GLU A 63 -8.914 -4.067 7.645 1.00 44.02 H new ATOM 0 HG3 GLU A 63 -8.591 -3.304 6.101 1.00 44.02 H new ATOM 960 N TYR A 64 -4.185 -4.870 8.818 1.00 1.50 N ATOM 961 CA TYR A 64 -2.764 -5.198 8.781 1.00 74.11 C ATOM 962 C TYR A 64 -2.417 -6.235 9.845 1.00 14.13 C ATOM 963 O TYR A 64 -3.045 -6.287 10.902 1.00 12.31 O ATOM 964 CB TYR A 64 -1.922 -3.938 8.989 1.00 4.52 C ATOM 965 CG TYR A 64 -2.276 -3.173 10.245 1.00 14.51 C ATOM 966 CD1 TYR A 64 -2.005 -3.700 11.502 1.00 74.32 C ATOM 967 CD2 TYR A 64 -2.881 -1.925 10.174 1.00 44.33 C ATOM 968 CE1 TYR A 64 -2.328 -3.005 12.652 1.00 13.24 C ATOM 969 CE2 TYR A 64 -3.206 -1.223 11.320 1.00 21.22 C ATOM 970 CZ TYR A 64 -2.928 -1.767 12.555 1.00 63.22 C ATOM 971 OH TYR A 64 -3.250 -1.072 13.699 1.00 40.03 O ATOM 0 H TYR A 64 -4.571 -4.774 9.757 1.00 1.50 H new ATOM 0 HA TYR A 64 -2.540 -5.619 7.801 1.00 74.11 H new ATOM 0 HB2 TYR A 64 -0.869 -4.217 9.028 1.00 4.52 H new ATOM 0 HB3 TYR A 64 -2.046 -3.282 8.127 1.00 4.52 H new ATOM 0 HD1 TYR A 64 -1.534 -4.669 11.581 1.00 74.32 H new ATOM 0 HD2 TYR A 64 -3.101 -1.496 9.208 1.00 44.33 H new ATOM 0 HE1 TYR A 64 -2.112 -3.429 13.621 1.00 13.24 H new ATOM 0 HE2 TYR A 64 -3.675 -0.253 11.247 1.00 21.22 H new ATOM 0 HH TYR A 64 -3.665 -0.218 13.457 1.00 40.03 H new ATOM 981 N SER A 65 -1.412 -7.057 9.555 1.00 13.53 N ATOM 982 CA SER A 65 -0.975 -8.095 10.484 1.00 3.14 C ATOM 983 C SER A 65 -2.082 -9.118 10.725 1.00 20.10 C ATOM 984 O SER A 65 -2.062 -10.212 10.159 1.00 1.54 O ATOM 985 CB SER A 65 -0.537 -7.473 11.812 1.00 5.42 C ATOM 986 OG SER A 65 -0.260 -8.472 12.777 1.00 0.34 O ATOM 0 H SER A 65 -0.884 -7.024 8.683 1.00 13.53 H new ATOM 0 HA SER A 65 -0.125 -8.610 10.036 1.00 3.14 H new ATOM 0 HB2 SER A 65 0.350 -6.859 11.655 1.00 5.42 H new ATOM 0 HB3 SER A 65 -1.320 -6.812 12.183 1.00 5.42 H new ATOM 0 HG SER A 65 0.019 -8.048 13.615 1.00 0.34 H new ATOM 992 N ALA A 66 -3.045 -8.759 11.569 1.00 72.52 N ATOM 993 CA ALA A 66 -4.158 -9.646 11.886 1.00 12.14 C ATOM 994 C ALA A 66 -4.874 -10.107 10.620 1.00 4.03 C ATOM 995 O ALA A 66 -4.957 -11.304 10.343 1.00 53.31 O ATOM 996 CB ALA A 66 -5.135 -8.952 12.822 1.00 13.32 C ATOM 0 H ALA A 66 -3.076 -7.858 12.046 1.00 72.52 H new ATOM 0 HA ALA A 66 -3.755 -10.527 12.385 1.00 12.14 H new ATOM 0 HB1 ALA A 66 -5.961 -9.626 13.050 1.00 13.32 H new ATOM 0 HB2 ALA A 66 -4.623 -8.679 13.745 1.00 13.32 H new ATOM 0 HB3 ALA A 66 -5.522 -8.053 12.342 1.00 13.32 H new ATOM 1002 N MET A 67 -5.390 -9.151 9.856 1.00 64.52 N ATOM 1003 CA MET A 67 -6.098 -9.458 8.620 1.00 51.04 C ATOM 1004 C MET A 67 -5.117 -9.808 7.505 1.00 13.55 C ATOM 1005 O MET A 67 -5.413 -10.633 6.642 1.00 34.14 O ATOM 1006 CB MET A 67 -6.968 -8.273 8.198 1.00 11.52 C ATOM 1007 CG MET A 67 -8.365 -8.299 8.798 1.00 71.02 C ATOM 1008 SD MET A 67 -8.352 -8.131 10.593 1.00 45.45 S ATOM 1009 CE MET A 67 -7.722 -6.464 10.772 1.00 1.23 C ATOM 0 H MET A 67 -5.331 -8.156 10.072 1.00 64.52 H new ATOM 0 HA MET A 67 -6.738 -10.322 8.801 1.00 51.04 H new ATOM 0 HB2 MET A 67 -6.473 -7.347 8.491 1.00 11.52 H new ATOM 0 HB3 MET A 67 -7.049 -8.261 7.111 1.00 11.52 H new ATOM 0 HG2 MET A 67 -8.957 -7.492 8.366 1.00 71.02 H new ATOM 0 HG3 MET A 67 -8.855 -9.234 8.528 1.00 71.02 H new ATOM 0 HE1 MET A 67 -7.822 -6.147 11.810 1.00 1.23 H new ATOM 0 HE2 MET A 67 -6.671 -6.439 10.484 1.00 1.23 H new ATOM 0 HE3 MET A 67 -8.290 -5.790 10.131 1.00 1.23 H new ATOM 1019 N ARG A 68 -3.951 -9.174 7.529 1.00 52.42 N ATOM 1020 CA ARG A 68 -2.927 -9.419 6.521 1.00 30.11 C ATOM 1021 C ARG A 68 -2.485 -10.879 6.537 1.00 42.13 C ATOM 1022 O ARG A 68 -2.079 -11.425 5.511 1.00 33.44 O ATOM 1023 CB ARG A 68 -1.727 -8.504 6.765 1.00 2.41 C ATOM 1024 CG ARG A 68 -0.576 -8.731 5.800 1.00 20.50 C ATOM 1025 CD ARG A 68 0.659 -7.960 6.228 1.00 45.13 C ATOM 1026 NE ARG A 68 1.203 -8.455 7.490 1.00 14.20 N ATOM 1027 CZ ARG A 68 2.010 -7.748 8.280 1.00 12.52 C ATOM 1028 NH1 ARG A 68 2.373 -6.518 7.939 1.00 63.12 N ATOM 1029 NH2 ARG A 68 2.453 -8.273 9.414 1.00 22.24 N ATOM 0 H ARG A 68 -3.691 -8.486 8.236 1.00 52.42 H new ATOM 0 HA ARG A 68 -3.351 -9.202 5.540 1.00 30.11 H new ATOM 0 HB2 ARG A 68 -2.052 -7.466 6.690 1.00 2.41 H new ATOM 0 HB3 ARG A 68 -1.369 -8.653 7.784 1.00 2.41 H new ATOM 0 HG2 ARG A 68 -0.344 -9.795 5.750 1.00 20.50 H new ATOM 0 HG3 ARG A 68 -0.872 -8.422 4.798 1.00 20.50 H new ATOM 0 HD2 ARG A 68 1.420 -8.034 5.451 1.00 45.13 H new ATOM 0 HD3 ARG A 68 0.410 -6.904 6.330 1.00 45.13 H new ATOM 0 HE ARG A 68 0.950 -9.398 7.784 1.00 14.20 H new ATOM 0 HH11 ARG A 68 2.034 -6.109 7.068 1.00 63.12 H new ATOM 0 HH12 ARG A 68 2.991 -5.981 8.548 1.00 63.12 H new ATOM 0 HH21 ARG A 68 2.176 -9.218 9.681 1.00 22.24 H new ATOM 0 HH22 ARG A 68 3.071 -7.732 10.019 1.00 22.24 H new ATOM 1043 N ASP A 69 -2.564 -11.504 7.708 1.00 12.22 N ATOM 1044 CA ASP A 69 -2.169 -12.900 7.857 1.00 13.12 C ATOM 1045 C ASP A 69 -3.197 -13.835 7.223 1.00 62.30 C ATOM 1046 O ASP A 69 -2.862 -14.935 6.787 1.00 72.32 O ATOM 1047 CB ASP A 69 -1.991 -13.244 9.338 1.00 21.21 C ATOM 1048 CG ASP A 69 -0.540 -13.480 9.707 1.00 73.51 C ATOM 1049 OD1 ASP A 69 0.345 -12.932 9.016 1.00 63.04 O ATOM 1050 OD2 ASP A 69 -0.287 -14.213 10.686 1.00 23.14 O ATOM 0 H ASP A 69 -2.898 -11.066 8.567 1.00 12.22 H new ATOM 0 HA ASP A 69 -1.219 -13.038 7.340 1.00 13.12 H new ATOM 0 HB2 ASP A 69 -2.390 -12.433 9.947 1.00 21.21 H new ATOM 0 HB3 ASP A 69 -2.572 -14.135 9.573 1.00 21.21 H new ATOM 1055 N GLN A 70 -4.450 -13.391 7.179 1.00 21.11 N ATOM 1056 CA GLN A 70 -5.521 -14.195 6.602 1.00 33.22 C ATOM 1057 C GLN A 70 -5.363 -14.309 5.086 1.00 15.02 C ATOM 1058 O GLN A 70 -5.712 -15.329 4.491 1.00 12.04 O ATOM 1059 CB GLN A 70 -6.889 -13.597 6.962 1.00 74.43 C ATOM 1060 CG GLN A 70 -7.472 -12.672 5.903 1.00 31.03 C ATOM 1061 CD GLN A 70 -8.578 -11.787 6.445 1.00 34.13 C ATOM 1062 OE1 GLN A 70 -8.438 -11.179 7.507 1.00 54.31 O ATOM 1063 NE2 GLN A 70 -9.686 -11.712 5.718 1.00 3.41 N ATOM 0 H GLN A 70 -4.747 -12.482 7.535 1.00 21.11 H new ATOM 0 HA GLN A 70 -5.460 -15.199 7.021 1.00 33.22 H new ATOM 0 HB2 GLN A 70 -7.591 -14.411 7.142 1.00 74.43 H new ATOM 0 HB3 GLN A 70 -6.795 -13.045 7.897 1.00 74.43 H new ATOM 0 HG2 GLN A 70 -6.678 -12.046 5.496 1.00 31.03 H new ATOM 0 HG3 GLN A 70 -7.861 -13.270 5.079 1.00 31.03 H new ATOM 0 HE21 GLN A 70 -9.759 -12.233 4.844 1.00 3.41 H new ATOM 0 HE22 GLN A 70 -10.465 -11.133 6.033 1.00 3.41 H new ATOM 1072 N TYR A 71 -4.838 -13.256 4.469 1.00 73.31 N ATOM 1073 CA TYR A 71 -4.637 -13.240 3.025 1.00 13.15 C ATOM 1074 C TYR A 71 -3.485 -14.155 2.622 1.00 25.43 C ATOM 1075 O TYR A 71 -3.530 -14.801 1.577 1.00 73.51 O ATOM 1076 CB TYR A 71 -4.363 -11.815 2.538 1.00 33.53 C ATOM 1077 CG TYR A 71 -5.360 -10.796 3.044 1.00 55.34 C ATOM 1078 CD1 TYR A 71 -6.726 -11.047 2.995 1.00 41.31 C ATOM 1079 CD2 TYR A 71 -4.935 -9.581 3.569 1.00 1.34 C ATOM 1080 CE1 TYR A 71 -7.639 -10.117 3.455 1.00 21.40 C ATOM 1081 CE2 TYR A 71 -5.842 -8.647 4.031 1.00 41.31 C ATOM 1082 CZ TYR A 71 -7.193 -8.920 3.971 1.00 53.30 C ATOM 1083 OH TYR A 71 -8.099 -7.992 4.430 1.00 43.01 O ATOM 0 H TYR A 71 -4.544 -12.403 4.946 1.00 73.31 H new ATOM 0 HA TYR A 71 -5.550 -13.607 2.557 1.00 13.15 H new ATOM 0 HB2 TYR A 71 -3.363 -11.519 2.854 1.00 33.53 H new ATOM 0 HB3 TYR A 71 -4.369 -11.806 1.448 1.00 33.53 H new ATOM 0 HD1 TYR A 71 -7.080 -11.984 2.591 1.00 41.31 H new ATOM 0 HD2 TYR A 71 -3.878 -9.364 3.616 1.00 1.34 H new ATOM 0 HE1 TYR A 71 -8.697 -10.328 3.410 1.00 21.40 H new ATOM 0 HE2 TYR A 71 -5.495 -7.708 4.437 1.00 41.31 H new ATOM 0 HH TYR A 71 -7.947 -7.136 3.979 1.00 43.01 H new ATOM 1093 N MET A 72 -2.452 -14.207 3.460 1.00 74.12 N ATOM 1094 CA MET A 72 -1.289 -15.046 3.188 1.00 51.31 C ATOM 1095 C MET A 72 -1.695 -16.509 3.039 1.00 13.32 C ATOM 1096 O MET A 72 -1.127 -17.241 2.229 1.00 62.43 O ATOM 1097 CB MET A 72 -0.257 -14.907 4.309 1.00 51.32 C ATOM 1098 CG MET A 72 0.034 -13.466 4.699 1.00 62.22 C ATOM 1099 SD MET A 72 1.691 -13.255 5.376 1.00 65.32 S ATOM 1100 CE MET A 72 2.053 -11.574 4.873 1.00 44.40 C ATOM 0 H MET A 72 -2.397 -13.679 4.331 1.00 74.12 H new ATOM 0 HA MET A 72 -0.846 -14.711 2.250 1.00 51.31 H new ATOM 0 HB2 MET A 72 -0.613 -15.447 5.187 1.00 51.32 H new ATOM 0 HB3 MET A 72 0.672 -15.384 3.996 1.00 51.32 H new ATOM 0 HG2 MET A 72 -0.082 -12.826 3.824 1.00 62.22 H new ATOM 0 HG3 MET A 72 -0.700 -13.137 5.434 1.00 62.22 H new ATOM 0 HE1 MET A 72 3.133 -11.439 4.807 1.00 44.40 H new ATOM 0 HE2 MET A 72 1.602 -11.380 3.900 1.00 44.40 H new ATOM 0 HE3 MET A 72 1.645 -10.879 5.606 1.00 44.40 H new ATOM 1110 N ARG A 73 -2.679 -16.926 3.827 1.00 2.53 N ATOM 1111 CA ARG A 73 -3.163 -18.301 3.786 1.00 64.32 C ATOM 1112 C ARG A 73 -4.032 -18.548 2.555 1.00 24.22 C ATOM 1113 O ARG A 73 -4.290 -19.694 2.189 1.00 71.13 O ATOM 1114 CB ARG A 73 -3.951 -18.617 5.054 1.00 12.25 C ATOM 1115 CG ARG A 73 -3.068 -18.821 6.273 1.00 3.32 C ATOM 1116 CD ARG A 73 -3.850 -19.407 7.433 1.00 34.20 C ATOM 1117 NE ARG A 73 -4.656 -20.555 7.027 1.00 64.55 N ATOM 1118 CZ ARG A 73 -5.735 -20.974 7.683 1.00 70.14 C ATOM 1119 NH1 ARG A 73 -6.141 -20.348 8.781 1.00 13.35 N ATOM 1120 NH2 ARG A 73 -6.411 -22.026 7.239 1.00 53.32 N ATOM 0 H ARG A 73 -3.158 -16.331 4.503 1.00 2.53 H new ATOM 0 HA ARG A 73 -2.297 -18.960 3.725 1.00 64.32 H new ATOM 0 HB2 ARG A 73 -4.650 -17.804 5.252 1.00 12.25 H new ATOM 0 HB3 ARG A 73 -4.546 -19.516 4.890 1.00 12.25 H new ATOM 0 HG2 ARG A 73 -2.241 -19.484 6.018 1.00 3.32 H new ATOM 0 HG3 ARG A 73 -2.632 -17.868 6.571 1.00 3.32 H new ATOM 0 HD2 ARG A 73 -3.159 -19.710 8.220 1.00 34.20 H new ATOM 0 HD3 ARG A 73 -4.499 -18.640 7.856 1.00 34.20 H new ATOM 0 HE ARG A 73 -4.375 -21.066 6.190 1.00 64.55 H new ATOM 0 HH11 ARG A 73 -5.625 -19.539 9.128 1.00 13.35 H new ATOM 0 HH12 ARG A 73 -6.969 -20.676 9.278 1.00 13.35 H new ATOM 0 HH21 ARG A 73 -6.103 -22.512 6.396 1.00 53.32 H new ATOM 0 HH22 ARG A 73 -7.239 -22.349 7.740 1.00 53.32 H new ATOM 1134 N THR A 74 -4.483 -17.470 1.921 1.00 15.11 N ATOM 1135 CA THR A 74 -5.324 -17.577 0.734 1.00 52.23 C ATOM 1136 C THR A 74 -4.552 -17.201 -0.529 1.00 55.12 C ATOM 1137 O THR A 74 -4.960 -17.543 -1.639 1.00 40.23 O ATOM 1138 CB THR A 74 -6.555 -16.681 0.879 1.00 62.41 C ATOM 1139 OG1 THR A 74 -6.176 -15.319 0.964 1.00 44.50 O ATOM 1140 CG2 THR A 74 -7.386 -17.005 2.100 1.00 13.14 C ATOM 0 H THR A 74 -4.280 -16.513 2.209 1.00 15.11 H new ATOM 0 HA THR A 74 -5.642 -18.615 0.640 1.00 52.23 H new ATOM 0 HB THR A 74 -7.157 -16.867 -0.010 1.00 62.41 H new ATOM 0 HG1 THR A 74 -5.206 -15.257 1.091 1.00 44.50 H new ATOM 0 HG21 THR A 74 -8.244 -16.334 2.145 1.00 13.14 H new ATOM 0 HG22 THR A 74 -7.734 -18.036 2.040 1.00 13.14 H new ATOM 0 HG23 THR A 74 -6.780 -16.879 2.997 1.00 13.14 H new ATOM 1148 N GLY A 75 -3.438 -16.494 -0.357 1.00 1.23 N ATOM 1149 CA GLY A 75 -2.637 -16.085 -1.496 1.00 31.14 C ATOM 1150 C GLY A 75 -1.579 -17.108 -1.862 1.00 15.42 C ATOM 1151 O GLY A 75 -1.007 -17.761 -0.989 1.00 4.22 O ATOM 0 H GLY A 75 -3.077 -16.198 0.550 1.00 1.23 H new ATOM 0 HA2 GLY A 75 -3.289 -15.919 -2.354 1.00 31.14 H new ATOM 0 HA3 GLY A 75 -2.155 -15.133 -1.274 1.00 31.14 H new ATOM 1155 N GLU A 76 -1.320 -17.246 -3.159 1.00 55.41 N ATOM 1156 CA GLU A 76 -0.323 -18.193 -3.642 1.00 62.53 C ATOM 1157 C GLU A 76 1.062 -17.550 -3.709 1.00 43.35 C ATOM 1158 O GLU A 76 2.074 -18.246 -3.780 1.00 31.11 O ATOM 1159 CB GLU A 76 -0.721 -18.722 -5.022 1.00 44.40 C ATOM 1160 CG GLU A 76 -2.140 -19.266 -5.078 1.00 43.50 C ATOM 1161 CD GLU A 76 -2.203 -20.692 -5.588 1.00 12.12 C ATOM 1162 OE1 GLU A 76 -2.292 -20.879 -6.820 1.00 54.22 O ATOM 1163 OE2 GLU A 76 -2.161 -21.623 -4.756 1.00 62.14 O ATOM 0 H GLU A 76 -1.787 -16.714 -3.893 1.00 55.41 H new ATOM 0 HA GLU A 76 -0.279 -19.024 -2.938 1.00 62.53 H new ATOM 0 HB2 GLU A 76 -0.619 -17.920 -5.753 1.00 44.40 H new ATOM 0 HB3 GLU A 76 -0.027 -19.510 -5.314 1.00 44.40 H new ATOM 0 HG2 GLU A 76 -2.581 -19.221 -4.082 1.00 43.50 H new ATOM 0 HG3 GLU A 76 -2.744 -18.627 -5.723 1.00 43.50 H new ATOM 1170 N GLY A 77 1.101 -16.219 -3.683 1.00 61.15 N ATOM 1171 CA GLY A 77 2.368 -15.512 -3.741 1.00 71.31 C ATOM 1172 C GLY A 77 2.309 -14.162 -3.050 1.00 2.34 C ATOM 1173 O GLY A 77 1.274 -13.786 -2.500 1.00 71.10 O ATOM 0 H GLY A 77 0.278 -15.619 -3.623 1.00 61.15 H new ATOM 0 HA2 GLY A 77 3.143 -16.122 -3.276 1.00 71.31 H new ATOM 0 HA3 GLY A 77 2.655 -15.372 -4.783 1.00 71.31 H new ATOM 1177 N PHE A 78 3.421 -13.433 -3.075 1.00 41.31 N ATOM 1178 CA PHE A 78 3.487 -12.119 -2.445 1.00 15.00 C ATOM 1179 C PHE A 78 4.449 -11.198 -3.188 1.00 44.41 C ATOM 1180 O PHE A 78 5.479 -11.639 -3.697 1.00 53.21 O ATOM 1181 CB PHE A 78 3.921 -12.252 -0.984 1.00 14.30 C ATOM 1182 CG PHE A 78 3.094 -13.227 -0.196 1.00 24.31 C ATOM 1183 CD1 PHE A 78 3.339 -14.589 -0.278 1.00 14.14 C ATOM 1184 CD2 PHE A 78 2.072 -12.782 0.624 1.00 72.12 C ATOM 1185 CE1 PHE A 78 2.578 -15.488 0.446 1.00 53.13 C ATOM 1186 CE2 PHE A 78 1.308 -13.675 1.350 1.00 71.44 C ATOM 1187 CZ PHE A 78 1.561 -15.030 1.261 1.00 71.12 C ATOM 0 H PHE A 78 4.287 -13.730 -3.524 1.00 41.31 H new ATOM 0 HA PHE A 78 2.491 -11.679 -2.486 1.00 15.00 H new ATOM 0 HB2 PHE A 78 4.965 -12.564 -0.951 1.00 14.30 H new ATOM 0 HB3 PHE A 78 3.866 -11.273 -0.507 1.00 14.30 H new ATOM 0 HD1 PHE A 78 4.133 -14.952 -0.914 1.00 14.14 H new ATOM 0 HD2 PHE A 78 1.869 -11.724 0.697 1.00 72.12 H new ATOM 0 HE1 PHE A 78 2.778 -16.547 0.374 1.00 53.13 H new ATOM 0 HE2 PHE A 78 0.514 -13.314 1.987 1.00 71.44 H new ATOM 0 HZ PHE A 78 0.965 -15.730 1.828 1.00 71.12 H new ATOM 1197 N LEU A 79 4.107 -9.914 -3.241 1.00 21.34 N ATOM 1198 CA LEU A 79 4.939 -8.925 -3.916 1.00 0.40 C ATOM 1199 C LEU A 79 5.353 -7.818 -2.951 1.00 63.31 C ATOM 1200 O LEU A 79 4.505 -7.141 -2.369 1.00 1.35 O ATOM 1201 CB LEU A 79 4.191 -8.326 -5.110 1.00 63.43 C ATOM 1202 CG LEU A 79 5.005 -8.232 -6.402 1.00 62.21 C ATOM 1203 CD1 LEU A 79 4.688 -9.403 -7.318 1.00 75.53 C ATOM 1204 CD2 LEU A 79 4.735 -6.912 -7.110 1.00 0.23 C ATOM 0 H LEU A 79 3.257 -9.534 -2.823 1.00 21.34 H new ATOM 0 HA LEU A 79 5.838 -9.425 -4.276 1.00 0.40 H new ATOM 0 HB2 LEU A 79 3.302 -8.927 -5.301 1.00 63.43 H new ATOM 0 HB3 LEU A 79 3.848 -7.327 -4.841 1.00 63.43 H new ATOM 0 HG LEU A 79 6.063 -8.273 -6.145 1.00 62.21 H new ATOM 0 HD11 LEU A 79 5.276 -9.320 -8.232 1.00 75.53 H new ATOM 0 HD12 LEU A 79 4.933 -10.337 -6.813 1.00 75.53 H new ATOM 0 HD13 LEU A 79 3.627 -9.393 -7.567 1.00 75.53 H new ATOM 0 HD21 LEU A 79 5.323 -6.864 -8.027 1.00 0.23 H new ATOM 0 HD22 LEU A 79 3.675 -6.840 -7.355 1.00 0.23 H new ATOM 0 HD23 LEU A 79 5.013 -6.085 -6.457 1.00 0.23 H new ATOM 1216 N CYS A 80 6.659 -7.639 -2.784 1.00 21.23 N ATOM 1217 CA CYS A 80 7.179 -6.613 -1.887 1.00 33.44 C ATOM 1218 C CYS A 80 7.521 -5.340 -2.654 1.00 60.24 C ATOM 1219 O CYS A 80 8.454 -5.318 -3.457 1.00 53.21 O ATOM 1220 CB CYS A 80 8.419 -7.127 -1.151 1.00 12.45 C ATOM 1221 SG CYS A 80 8.096 -8.520 -0.046 1.00 10.43 S ATOM 0 H CYS A 80 7.376 -8.190 -3.257 1.00 21.23 H new ATOM 0 HA CYS A 80 6.403 -6.379 -1.158 1.00 33.44 H new ATOM 0 HB2 CYS A 80 9.167 -7.426 -1.886 1.00 12.45 H new ATOM 0 HB3 CYS A 80 8.850 -6.310 -0.572 1.00 12.45 H new ATOM 0 HG CYS A 80 9.204 -8.885 0.528 1.00 10.43 H new ATOM 1227 N VAL A 81 6.759 -4.281 -2.400 1.00 74.04 N ATOM 1228 CA VAL A 81 6.981 -3.003 -3.064 1.00 31.20 C ATOM 1229 C VAL A 81 7.756 -2.047 -2.165 1.00 0.53 C ATOM 1230 O VAL A 81 7.240 -1.575 -1.152 1.00 11.53 O ATOM 1231 CB VAL A 81 5.650 -2.343 -3.472 1.00 63.32 C ATOM 1232 CG1 VAL A 81 5.903 -1.060 -4.253 1.00 31.02 C ATOM 1233 CG2 VAL A 81 4.800 -3.309 -4.283 1.00 35.10 C ATOM 0 H VAL A 81 5.982 -4.283 -1.739 1.00 74.04 H new ATOM 0 HA VAL A 81 7.565 -3.208 -3.961 1.00 31.20 H new ATOM 0 HB VAL A 81 5.103 -2.086 -2.565 1.00 63.32 H new ATOM 0 HG11 VAL A 81 4.950 -0.610 -4.532 1.00 31.02 H new ATOM 0 HG12 VAL A 81 6.467 -0.362 -3.634 1.00 31.02 H new ATOM 0 HG13 VAL A 81 6.473 -1.289 -5.153 1.00 31.02 H new ATOM 0 HG21 VAL A 81 3.864 -2.824 -4.562 1.00 35.10 H new ATOM 0 HG22 VAL A 81 5.340 -3.601 -5.184 1.00 35.10 H new ATOM 0 HG23 VAL A 81 4.586 -4.195 -3.685 1.00 35.10 H new ATOM 1243 N PHE A 82 8.998 -1.764 -2.542 1.00 65.52 N ATOM 1244 CA PHE A 82 9.843 -0.862 -1.769 1.00 71.24 C ATOM 1245 C PHE A 82 10.186 0.384 -2.583 1.00 14.12 C ATOM 1246 O PHE A 82 10.099 0.379 -3.810 1.00 50.32 O ATOM 1247 CB PHE A 82 11.118 -1.590 -1.312 1.00 0.14 C ATOM 1248 CG PHE A 82 12.384 -1.111 -1.974 1.00 63.32 C ATOM 1249 CD1 PHE A 82 12.671 -1.455 -3.284 1.00 23.43 C ATOM 1250 CD2 PHE A 82 13.282 -0.317 -1.280 1.00 34.12 C ATOM 1251 CE1 PHE A 82 13.832 -1.015 -3.892 1.00 33.44 C ATOM 1252 CE2 PHE A 82 14.445 0.126 -1.881 1.00 4.13 C ATOM 1253 CZ PHE A 82 14.720 -0.224 -3.190 1.00 41.21 C ATOM 0 H PHE A 82 9.441 -2.146 -3.377 1.00 65.52 H new ATOM 0 HA PHE A 82 9.295 -0.542 -0.883 1.00 71.24 H new ATOM 0 HB2 PHE A 82 11.221 -1.473 -0.233 1.00 0.14 H new ATOM 0 HB3 PHE A 82 11.002 -2.656 -1.507 1.00 0.14 H new ATOM 0 HD1 PHE A 82 11.980 -2.074 -3.837 1.00 23.43 H new ATOM 0 HD2 PHE A 82 13.071 -0.041 -0.257 1.00 34.12 H new ATOM 0 HE1 PHE A 82 14.044 -1.290 -4.915 1.00 33.44 H new ATOM 0 HE2 PHE A 82 15.138 0.744 -1.329 1.00 4.13 H new ATOM 0 HZ PHE A 82 15.628 0.121 -3.663 1.00 41.21 H new ATOM 1263 N ALA A 83 10.576 1.448 -1.890 1.00 4.33 N ATOM 1264 CA ALA A 83 10.932 2.697 -2.549 1.00 21.51 C ATOM 1265 C ALA A 83 12.436 2.936 -2.490 1.00 4.23 C ATOM 1266 O ALA A 83 13.030 2.953 -1.411 1.00 10.11 O ATOM 1267 CB ALA A 83 10.184 3.859 -1.915 1.00 61.21 C ATOM 0 H ALA A 83 10.653 1.470 -0.873 1.00 4.33 H new ATOM 0 HA ALA A 83 10.643 2.624 -3.597 1.00 21.51 H new ATOM 0 HB1 ALA A 83 10.459 4.786 -2.417 1.00 61.21 H new ATOM 0 HB2 ALA A 83 9.110 3.698 -2.014 1.00 61.21 H new ATOM 0 HB3 ALA A 83 10.445 3.927 -0.859 1.00 61.21 H new ATOM 1273 N ILE A 84 13.047 3.123 -3.654 1.00 32.25 N ATOM 1274 CA ILE A 84 14.482 3.363 -3.732 1.00 54.21 C ATOM 1275 C ILE A 84 14.848 4.687 -3.076 1.00 21.01 C ATOM 1276 O ILE A 84 15.958 4.859 -2.571 1.00 15.11 O ATOM 1277 CB ILE A 84 14.965 3.370 -5.193 1.00 10.14 C ATOM 1278 CG1 ILE A 84 14.138 4.353 -6.024 1.00 73.41 C ATOM 1279 CG2 ILE A 84 14.875 1.971 -5.779 1.00 73.10 C ATOM 1280 CD1 ILE A 84 14.976 5.242 -6.914 1.00 10.42 C ATOM 0 H ILE A 84 12.571 3.113 -4.556 1.00 32.25 H new ATOM 0 HA ILE A 84 14.975 2.550 -3.199 1.00 54.21 H new ATOM 0 HB ILE A 84 16.006 3.692 -5.217 1.00 10.14 H new ATOM 0 HG12 ILE A 84 13.435 3.793 -6.641 1.00 73.41 H new ATOM 0 HG13 ILE A 84 13.547 4.977 -5.353 1.00 73.41 H new ATOM 0 HG21 ILE A 84 15.219 1.987 -6.813 1.00 73.10 H new ATOM 0 HG22 ILE A 84 15.500 1.293 -5.199 1.00 73.10 H new ATOM 0 HG23 ILE A 84 13.841 1.629 -5.746 1.00 73.10 H new ATOM 0 HD11 ILE A 84 14.325 5.913 -7.474 1.00 10.42 H new ATOM 0 HD12 ILE A 84 15.661 5.828 -6.301 1.00 10.42 H new ATOM 0 HD13 ILE A 84 15.547 4.626 -7.609 1.00 10.42 H new ATOM 1292 N ASN A 85 13.904 5.620 -3.083 1.00 52.25 N ATOM 1293 CA ASN A 85 14.121 6.932 -2.483 1.00 12.12 C ATOM 1294 C ASN A 85 13.884 6.893 -0.972 1.00 34.45 C ATOM 1295 O ASN A 85 14.172 7.861 -0.267 1.00 61.43 O ATOM 1296 CB ASN A 85 13.208 7.973 -3.141 1.00 0.11 C ATOM 1297 CG ASN A 85 11.763 7.855 -2.696 1.00 3.10 C ATOM 1298 OD1 ASN A 85 11.039 6.954 -3.122 1.00 73.22 O ATOM 1299 ND2 ASN A 85 11.340 8.768 -1.833 1.00 72.54 N ATOM 0 H ASN A 85 12.981 5.493 -3.497 1.00 52.25 H new ATOM 0 HA ASN A 85 15.160 7.216 -2.653 1.00 12.12 H new ATOM 0 HB2 ASN A 85 13.575 8.972 -2.905 1.00 0.11 H new ATOM 0 HB3 ASN A 85 13.260 7.862 -4.224 1.00 0.11 H new ATOM 0 HD21 ASN A 85 10.378 8.743 -1.494 1.00 72.54 H new ATOM 0 HD22 ASN A 85 11.976 9.496 -1.508 1.00 72.54 H new ATOM 1306 N ASN A 86 13.361 5.771 -0.480 1.00 75.41 N ATOM 1307 CA ASN A 86 13.092 5.612 0.945 1.00 72.02 C ATOM 1308 C ASN A 86 13.810 4.383 1.496 1.00 31.34 C ATOM 1309 O ASN A 86 13.412 3.249 1.229 1.00 30.11 O ATOM 1310 CB ASN A 86 11.586 5.495 1.194 1.00 51.34 C ATOM 1311 CG ASN A 86 11.127 6.347 2.361 1.00 55.34 C ATOM 1312 OD1 ASN A 86 11.474 7.524 2.460 1.00 13.00 O ATOM 1313 ND2 ASN A 86 10.345 5.754 3.255 1.00 73.24 N ATOM 0 H ASN A 86 13.116 4.960 -1.048 1.00 75.41 H new ATOM 0 HA ASN A 86 13.468 6.495 1.463 1.00 72.02 H new ATOM 0 HB2 ASN A 86 11.047 5.794 0.295 1.00 51.34 H new ATOM 0 HB3 ASN A 86 11.332 4.453 1.386 1.00 51.34 H new ATOM 0 HD21 ASN A 86 10.007 6.276 4.063 1.00 73.24 H new ATOM 0 HD22 ASN A 86 10.082 4.776 3.133 1.00 73.24 H new ATOM 1320 N THR A 87 14.870 4.617 2.262 1.00 62.20 N ATOM 1321 CA THR A 87 15.646 3.529 2.848 1.00 14.14 C ATOM 1322 C THR A 87 14.806 2.727 3.836 1.00 55.03 C ATOM 1323 O THR A 87 15.024 1.529 4.022 1.00 70.12 O ATOM 1324 CB THR A 87 16.889 4.082 3.548 1.00 55.43 C ATOM 1325 OG1 THR A 87 17.590 4.970 2.697 1.00 23.23 O ATOM 1326 CG2 THR A 87 17.857 3.004 3.984 1.00 33.21 C ATOM 0 H THR A 87 15.212 5.550 2.492 1.00 62.20 H new ATOM 0 HA THR A 87 15.955 2.864 2.042 1.00 14.14 H new ATOM 0 HB THR A 87 16.518 4.596 4.435 1.00 55.43 H new ATOM 0 HG1 THR A 87 18.380 5.314 3.163 1.00 23.23 H new ATOM 0 HG21 THR A 87 18.716 3.463 4.473 1.00 33.21 H new ATOM 0 HG22 THR A 87 17.360 2.329 4.681 1.00 33.21 H new ATOM 0 HG23 THR A 87 18.193 2.443 3.112 1.00 33.21 H new ATOM 1334 N LYS A 88 13.847 3.394 4.471 1.00 72.22 N ATOM 1335 CA LYS A 88 12.977 2.742 5.443 1.00 23.21 C ATOM 1336 C LYS A 88 12.213 1.585 4.806 1.00 51.25 C ATOM 1337 O LYS A 88 12.157 0.487 5.359 1.00 53.22 O ATOM 1338 CB LYS A 88 11.995 3.753 6.036 1.00 1.41 C ATOM 1339 CG LYS A 88 12.614 4.657 7.090 1.00 42.30 C ATOM 1340 CD LYS A 88 11.568 5.170 8.068 1.00 10.34 C ATOM 1341 CE LYS A 88 11.083 4.068 8.996 1.00 2.52 C ATOM 1342 NZ LYS A 88 9.599 3.955 8.998 1.00 33.31 N ATOM 0 H LYS A 88 13.653 4.385 4.330 1.00 72.22 H new ATOM 0 HA LYS A 88 13.603 2.341 6.240 1.00 23.21 H new ATOM 0 HB2 LYS A 88 11.592 4.369 5.233 1.00 1.41 H new ATOM 0 HB3 LYS A 88 11.156 3.216 6.478 1.00 1.41 H new ATOM 0 HG2 LYS A 88 13.384 4.110 7.633 1.00 42.30 H new ATOM 0 HG3 LYS A 88 13.105 5.501 6.605 1.00 42.30 H new ATOM 0 HD2 LYS A 88 11.989 5.984 8.658 1.00 10.34 H new ATOM 0 HD3 LYS A 88 10.722 5.580 7.516 1.00 10.34 H new ATOM 0 HE2 LYS A 88 11.519 3.117 8.689 1.00 2.52 H new ATOM 0 HE3 LYS A 88 11.433 4.267 10.009 1.00 2.52 H new ATOM 0 HZ1 LYS A 88 9.310 3.192 9.643 1.00 33.31 H new ATOM 0 HZ2 LYS A 88 9.183 4.854 9.316 1.00 33.31 H new ATOM 0 HZ3 LYS A 88 9.266 3.740 8.037 1.00 33.31 H new ATOM 1356 N SER A 89 11.623 1.839 3.641 1.00 22.20 N ATOM 1357 CA SER A 89 10.861 0.818 2.929 1.00 52.35 C ATOM 1358 C SER A 89 11.704 -0.431 2.689 1.00 75.34 C ATOM 1359 O SER A 89 11.245 -1.552 2.903 1.00 4.12 O ATOM 1360 CB SER A 89 10.354 1.370 1.595 1.00 43.33 C ATOM 1361 OG SER A 89 11.429 1.626 0.709 1.00 2.13 O ATOM 0 H SER A 89 11.658 2.743 3.170 1.00 22.20 H new ATOM 0 HA SER A 89 10.009 0.541 3.550 1.00 52.35 H new ATOM 0 HB2 SER A 89 9.666 0.657 1.141 1.00 43.33 H new ATOM 0 HB3 SER A 89 9.794 2.289 1.767 1.00 43.33 H new ATOM 0 HG SER A 89 11.921 2.418 1.012 1.00 2.13 H new ATOM 1367 N PHE A 90 12.940 -0.229 2.242 1.00 32.53 N ATOM 1368 CA PHE A 90 13.847 -1.340 1.973 1.00 51.01 C ATOM 1369 C PHE A 90 14.079 -2.171 3.231 1.00 63.44 C ATOM 1370 O PHE A 90 14.188 -3.396 3.167 1.00 31.12 O ATOM 1371 CB PHE A 90 15.182 -0.818 1.439 1.00 12.44 C ATOM 1372 CG PHE A 90 16.182 -1.902 1.154 1.00 4.14 C ATOM 1373 CD1 PHE A 90 15.839 -2.989 0.368 1.00 72.13 C ATOM 1374 CD2 PHE A 90 17.464 -1.833 1.675 1.00 63.13 C ATOM 1375 CE1 PHE A 90 16.757 -3.989 0.105 1.00 34.00 C ATOM 1376 CE2 PHE A 90 18.386 -2.829 1.416 1.00 40.42 C ATOM 1377 CZ PHE A 90 18.032 -3.908 0.630 1.00 5.02 C ATOM 0 H PHE A 90 13.336 0.693 2.059 1.00 32.53 H new ATOM 0 HA PHE A 90 13.386 -1.978 1.219 1.00 51.01 H new ATOM 0 HB2 PHE A 90 15.002 -0.252 0.525 1.00 12.44 H new ATOM 0 HB3 PHE A 90 15.608 -0.124 2.164 1.00 12.44 H new ATOM 0 HD1 PHE A 90 14.843 -3.057 -0.044 1.00 72.13 H new ATOM 0 HD2 PHE A 90 17.746 -0.991 2.290 1.00 63.13 H new ATOM 0 HE1 PHE A 90 16.478 -4.832 -0.510 1.00 34.00 H new ATOM 0 HE2 PHE A 90 19.382 -2.764 1.828 1.00 40.42 H new ATOM 0 HZ PHE A 90 18.751 -4.687 0.426 1.00 5.02 H new ATOM 1387 N GLU A 91 14.157 -1.498 4.374 1.00 13.51 N ATOM 1388 CA GLU A 91 14.379 -2.172 5.647 1.00 3.55 C ATOM 1389 C GLU A 91 13.125 -2.912 6.103 1.00 52.45 C ATOM 1390 O GLU A 91 13.208 -3.906 6.825 1.00 32.15 O ATOM 1391 CB GLU A 91 14.801 -1.161 6.715 1.00 72.31 C ATOM 1392 CG GLU A 91 16.021 -0.339 6.328 1.00 64.55 C ATOM 1393 CD GLU A 91 17.233 -0.654 7.184 1.00 3.14 C ATOM 1394 OE1 GLU A 91 17.405 0.001 8.234 1.00 13.43 O ATOM 1395 OE2 GLU A 91 18.008 -1.557 6.805 1.00 43.43 O ATOM 0 H GLU A 91 14.069 -0.484 4.444 1.00 13.51 H new ATOM 0 HA GLU A 91 15.177 -2.901 5.506 1.00 3.55 H new ATOM 0 HB2 GLU A 91 13.968 -0.487 6.915 1.00 72.31 H new ATOM 0 HB3 GLU A 91 15.011 -1.692 7.643 1.00 72.31 H new ATOM 0 HG2 GLU A 91 16.262 -0.524 5.281 1.00 64.55 H new ATOM 0 HG3 GLU A 91 15.783 0.721 6.417 1.00 64.55 H new ATOM 1402 N ASP A 92 11.965 -2.419 5.683 1.00 11.22 N ATOM 1403 CA ASP A 92 10.695 -3.034 6.053 1.00 32.22 C ATOM 1404 C ASP A 92 10.444 -4.305 5.248 1.00 5.13 C ATOM 1405 O ASP A 92 10.046 -5.330 5.800 1.00 12.42 O ATOM 1406 CB ASP A 92 9.547 -2.047 5.845 1.00 32.51 C ATOM 1407 CG ASP A 92 9.633 -0.856 6.779 1.00 50.45 C ATOM 1408 OD1 ASP A 92 9.735 -1.070 8.006 1.00 14.43 O ATOM 1409 OD2 ASP A 92 9.599 0.291 6.285 1.00 62.35 O ATOM 0 H ASP A 92 11.878 -1.596 5.087 1.00 11.22 H new ATOM 0 HA ASP A 92 10.747 -3.303 7.108 1.00 32.22 H new ATOM 0 HB2 ASP A 92 9.555 -1.697 4.813 1.00 32.51 H new ATOM 0 HB3 ASP A 92 8.598 -2.560 6.001 1.00 32.51 H new ATOM 1414 N ILE A 93 10.680 -4.232 3.941 1.00 60.34 N ATOM 1415 CA ILE A 93 10.481 -5.380 3.061 1.00 74.02 C ATOM 1416 C ILE A 93 11.125 -6.637 3.646 1.00 13.53 C ATOM 1417 O ILE A 93 10.670 -7.752 3.399 1.00 53.30 O ATOM 1418 CB ILE A 93 11.062 -5.114 1.652 1.00 54.12 C ATOM 1419 CG1 ILE A 93 10.269 -4.023 0.941 1.00 41.12 C ATOM 1420 CG2 ILE A 93 11.060 -6.376 0.812 1.00 61.54 C ATOM 1421 CD1 ILE A 93 8.780 -4.288 0.894 1.00 1.13 C ATOM 0 H ILE A 93 11.009 -3.390 3.468 1.00 60.34 H new ATOM 0 HA ILE A 93 9.406 -5.537 2.975 1.00 74.02 H new ATOM 0 HB ILE A 93 12.093 -4.782 1.778 1.00 54.12 H new ATOM 0 HG12 ILE A 93 10.444 -3.072 1.444 1.00 41.12 H new ATOM 0 HG13 ILE A 93 10.643 -3.919 -0.077 1.00 41.12 H new ATOM 0 HG21 ILE A 93 11.474 -6.158 -0.173 1.00 61.54 H new ATOM 0 HG22 ILE A 93 11.667 -7.139 1.300 1.00 61.54 H new ATOM 0 HG23 ILE A 93 10.038 -6.739 0.704 1.00 61.54 H new ATOM 0 HD11 ILE A 93 8.281 -3.470 0.374 1.00 1.13 H new ATOM 0 HD12 ILE A 93 8.593 -5.222 0.365 1.00 1.13 H new ATOM 0 HD13 ILE A 93 8.391 -4.362 1.910 1.00 1.13 H new ATOM 1433 N HIS A 94 12.185 -6.441 4.421 1.00 55.25 N ATOM 1434 CA HIS A 94 12.895 -7.550 5.043 1.00 21.23 C ATOM 1435 C HIS A 94 11.997 -8.280 6.041 1.00 22.32 C ATOM 1436 O HIS A 94 11.828 -9.498 5.966 1.00 41.03 O ATOM 1437 CB HIS A 94 14.161 -7.036 5.742 1.00 22.13 C ATOM 1438 CG HIS A 94 14.618 -7.889 6.886 1.00 54.32 C ATOM 1439 ND1 HIS A 94 14.112 -8.041 8.134 1.00 21.42 N flip ATOM 1440 CD2 HIS A 94 15.714 -8.721 6.814 1.00 42.24 C flip ATOM 1441 CE1 HIS A 94 14.906 -8.955 8.785 1.00 23.41 C flip ATOM 1442 NE2 HIS A 94 15.864 -9.349 7.966 1.00 63.33 N flip ATOM 0 H HIS A 94 12.572 -5.522 4.634 1.00 55.25 H new ATOM 0 HA HIS A 94 13.181 -8.257 4.264 1.00 21.23 H new ATOM 0 HB2 HIS A 94 14.965 -6.968 5.009 1.00 22.13 H new ATOM 0 HB3 HIS A 94 13.977 -6.026 6.107 1.00 22.13 H new ATOM 0 HD2 HIS A 94 16.351 -8.841 5.950 1.00 42.24 H new ATOM 0 HE1 HIS A 94 14.769 -9.295 9.801 1.00 23.41 H new ATOM 0 HE2 HIS A 94 16.596 -10.024 8.186 1.00 63.33 H new ATOM 1451 N GLN A 95 11.432 -7.531 6.982 1.00 42.03 N ATOM 1452 CA GLN A 95 10.566 -8.103 7.999 1.00 12.23 C ATOM 1453 C GLN A 95 9.259 -8.602 7.386 1.00 73.35 C ATOM 1454 O GLN A 95 8.647 -9.547 7.883 1.00 63.32 O ATOM 1455 CB GLN A 95 10.290 -7.058 9.088 1.00 0.45 C ATOM 1456 CG GLN A 95 9.174 -6.085 8.745 1.00 24.03 C ATOM 1457 CD GLN A 95 9.600 -4.636 8.825 1.00 13.13 C ATOM 1458 OE1 GLN A 95 10.617 -4.305 9.436 1.00 23.03 O ATOM 1459 NE2 GLN A 95 8.817 -3.762 8.204 1.00 22.03 N ATOM 0 H GLN A 95 11.561 -6.522 7.059 1.00 42.03 H new ATOM 0 HA GLN A 95 11.069 -8.960 8.447 1.00 12.23 H new ATOM 0 HB2 GLN A 95 10.037 -7.573 10.015 1.00 0.45 H new ATOM 0 HB3 GLN A 95 11.204 -6.495 9.276 1.00 0.45 H new ATOM 0 HG2 GLN A 95 8.814 -6.296 7.738 1.00 24.03 H new ATOM 0 HG3 GLN A 95 8.337 -6.249 9.424 1.00 24.03 H new ATOM 0 HE21 GLN A 95 7.984 -4.084 7.711 1.00 22.03 H new ATOM 0 HE22 GLN A 95 9.048 -2.769 8.220 1.00 22.03 H new ATOM 1468 N TYR A 96 8.837 -7.951 6.307 1.00 61.20 N ATOM 1469 CA TYR A 96 7.602 -8.313 5.624 1.00 33.50 C ATOM 1470 C TYR A 96 7.654 -9.757 5.134 1.00 60.34 C ATOM 1471 O TYR A 96 6.625 -10.427 5.041 1.00 73.54 O ATOM 1472 CB TYR A 96 7.354 -7.362 4.453 1.00 73.23 C ATOM 1473 CG TYR A 96 6.547 -6.139 4.827 1.00 60.20 C ATOM 1474 CD1 TYR A 96 5.255 -6.259 5.324 1.00 30.43 C ATOM 1475 CD2 TYR A 96 7.077 -4.863 4.680 1.00 43.41 C ATOM 1476 CE1 TYR A 96 4.515 -5.142 5.666 1.00 73.31 C ATOM 1477 CE2 TYR A 96 6.343 -3.742 5.018 1.00 61.14 C ATOM 1478 CZ TYR A 96 5.064 -3.886 5.511 1.00 61.45 C ATOM 1479 OH TYR A 96 4.331 -2.772 5.849 1.00 30.11 O ATOM 0 H TYR A 96 9.335 -7.167 5.886 1.00 61.20 H new ATOM 0 HA TYR A 96 6.778 -8.226 6.332 1.00 33.50 H new ATOM 0 HB2 TYR A 96 8.313 -7.043 4.045 1.00 73.23 H new ATOM 0 HB3 TYR A 96 6.834 -7.902 3.661 1.00 73.23 H new ATOM 0 HD1 TYR A 96 4.822 -7.241 5.445 1.00 30.43 H new ATOM 0 HD2 TYR A 96 8.079 -4.745 4.295 1.00 43.41 H new ATOM 0 HE1 TYR A 96 3.513 -5.252 6.052 1.00 73.31 H new ATOM 0 HE2 TYR A 96 6.770 -2.757 4.896 1.00 61.14 H new ATOM 0 HH TYR A 96 4.863 -1.967 5.680 1.00 30.11 H new ATOM 1489 N ARG A 97 8.857 -10.234 4.828 1.00 4.14 N ATOM 1490 CA ARG A 97 9.036 -11.602 4.356 1.00 63.31 C ATOM 1491 C ARG A 97 8.855 -12.589 5.506 1.00 32.23 C ATOM 1492 O ARG A 97 8.282 -13.664 5.332 1.00 44.24 O ATOM 1493 CB ARG A 97 10.421 -11.774 3.725 1.00 0.20 C ATOM 1494 CG ARG A 97 10.785 -13.223 3.428 1.00 52.21 C ATOM 1495 CD ARG A 97 11.415 -13.378 2.053 1.00 71.33 C ATOM 1496 NE ARG A 97 12.649 -14.158 2.104 1.00 24.53 N ATOM 1497 CZ ARG A 97 13.160 -14.811 1.062 1.00 71.10 C ATOM 1498 NH1 ARG A 97 12.557 -14.767 -0.121 1.00 64.41 N ATOM 1499 NH2 ARG A 97 14.279 -15.507 1.201 1.00 33.41 N ATOM 0 H ARG A 97 9.720 -9.695 4.898 1.00 4.14 H new ATOM 0 HA ARG A 97 8.280 -11.806 3.598 1.00 63.31 H new ATOM 0 HB2 ARG A 97 10.462 -11.202 2.798 1.00 0.20 H new ATOM 0 HB3 ARG A 97 11.170 -11.351 4.394 1.00 0.20 H new ATOM 0 HG2 ARG A 97 11.477 -13.587 4.188 1.00 52.21 H new ATOM 0 HG3 ARG A 97 9.890 -13.842 3.489 1.00 52.21 H new ATOM 0 HD2 ARG A 97 10.706 -13.863 1.382 1.00 71.33 H new ATOM 0 HD3 ARG A 97 11.625 -12.393 1.637 1.00 71.33 H new ATOM 0 HE ARG A 97 13.150 -14.205 2.991 1.00 24.53 H new ATOM 0 HH11 ARG A 97 11.697 -14.231 -0.235 1.00 64.41 H new ATOM 0 HH12 ARG A 97 12.954 -15.270 -0.915 1.00 64.41 H new ATOM 0 HH21 ARG A 97 14.749 -15.542 2.106 1.00 33.41 H new ATOM 0 HH22 ARG A 97 14.671 -16.007 0.403 1.00 33.41 H new ATOM 1513 N GLU A 98 9.348 -12.213 6.683 1.00 45.03 N ATOM 1514 CA GLU A 98 9.239 -13.060 7.865 1.00 1.34 C ATOM 1515 C GLU A 98 7.783 -13.426 8.139 1.00 75.23 C ATOM 1516 O GLU A 98 7.494 -14.473 8.719 1.00 73.22 O ATOM 1517 CB GLU A 98 9.838 -12.352 9.081 1.00 32.24 C ATOM 1518 CG GLU A 98 11.355 -12.267 9.052 1.00 43.14 C ATOM 1519 CD GLU A 98 12.011 -13.220 10.033 1.00 70.52 C ATOM 1520 OE1 GLU A 98 11.447 -13.424 11.128 1.00 54.35 O ATOM 1521 OE2 GLU A 98 13.090 -13.758 9.707 1.00 75.34 O ATOM 0 H GLU A 98 9.827 -11.327 6.843 1.00 45.03 H new ATOM 0 HA GLU A 98 9.796 -13.978 7.678 1.00 1.34 H new ATOM 0 HB2 GLU A 98 9.427 -11.344 9.142 1.00 32.24 H new ATOM 0 HB3 GLU A 98 9.529 -12.877 9.985 1.00 32.24 H new ATOM 0 HG2 GLU A 98 11.708 -12.488 8.045 1.00 43.14 H new ATOM 0 HG3 GLU A 98 11.663 -11.247 9.281 1.00 43.14 H new ATOM 1528 N GLN A 99 6.870 -12.557 7.714 1.00 42.35 N ATOM 1529 CA GLN A 99 5.444 -12.787 7.910 1.00 32.12 C ATOM 1530 C GLN A 99 4.920 -13.821 6.917 1.00 41.31 C ATOM 1531 O GLN A 99 4.014 -14.594 7.230 1.00 52.31 O ATOM 1532 CB GLN A 99 4.670 -11.476 7.757 1.00 22.11 C ATOM 1533 CG GLN A 99 4.623 -10.647 9.029 1.00 73.15 C ATOM 1534 CD GLN A 99 3.752 -11.271 10.101 1.00 1.03 C ATOM 1535 OE1 GLN A 99 2.492 -11.526 9.765 1.00 73.42 O flip ATOM 1536 NE2 GLN A 99 4.205 -11.523 11.217 1.00 62.44 N flip ATOM 0 H GLN A 99 7.094 -11.687 7.231 1.00 42.35 H new ATOM 0 HA GLN A 99 5.297 -13.171 8.919 1.00 32.12 H new ATOM 0 HB2 GLN A 99 5.127 -10.884 6.964 1.00 22.11 H new ATOM 0 HB3 GLN A 99 3.651 -11.700 7.441 1.00 22.11 H new ATOM 0 HG2 GLN A 99 5.635 -10.523 9.415 1.00 73.15 H new ATOM 0 HG3 GLN A 99 4.247 -9.651 8.795 1.00 73.15 H new ATOM 0 HE21 GLN A 99 5.179 -11.310 11.432 1.00 62.44 H new ATOM 0 HE22 GLN A 99 3.606 -11.945 11.927 1.00 62.44 H new ATOM 1545 N ILE A 100 5.499 -13.830 5.720 1.00 14.54 N ATOM 1546 CA ILE A 100 5.094 -14.770 4.682 1.00 61.35 C ATOM 1547 C ILE A 100 5.580 -16.180 5.004 1.00 25.40 C ATOM 1548 O ILE A 100 4.813 -17.141 4.948 1.00 33.23 O ATOM 1549 CB ILE A 100 5.635 -14.344 3.300 1.00 3.31 C ATOM 1550 CG1 ILE A 100 5.040 -12.996 2.892 1.00 31.33 C ATOM 1551 CG2 ILE A 100 5.330 -15.404 2.247 1.00 61.13 C ATOM 1552 CD1 ILE A 100 5.864 -12.258 1.860 1.00 10.34 C ATOM 0 H ILE A 100 6.250 -13.197 5.446 1.00 14.54 H new ATOM 0 HA ILE A 100 4.004 -14.766 4.650 1.00 61.35 H new ATOM 0 HB ILE A 100 6.718 -14.241 3.372 1.00 3.31 H new ATOM 0 HG12 ILE A 100 4.037 -13.156 2.497 1.00 31.33 H new ATOM 0 HG13 ILE A 100 4.938 -12.370 3.778 1.00 31.33 H new ATOM 0 HG21 ILE A 100 5.721 -15.081 1.282 1.00 61.13 H new ATOM 0 HG22 ILE A 100 5.799 -16.346 2.532 1.00 61.13 H new ATOM 0 HG23 ILE A 100 4.252 -15.544 2.173 1.00 61.13 H new ATOM 0 HD11 ILE A 100 5.381 -11.311 1.619 1.00 10.34 H new ATOM 0 HD12 ILE A 100 6.860 -12.066 2.259 1.00 10.34 H new ATOM 0 HD13 ILE A 100 5.945 -12.864 0.958 1.00 10.34 H new ATOM 1564 N LYS A 101 6.862 -16.296 5.339 1.00 23.41 N ATOM 1565 CA LYS A 101 7.454 -17.588 5.668 1.00 73.13 C ATOM 1566 C LYS A 101 6.684 -18.274 6.794 1.00 71.15 C ATOM 1567 O LYS A 101 6.499 -19.491 6.780 1.00 25.44 O ATOM 1568 CB LYS A 101 8.919 -17.411 6.072 1.00 72.51 C ATOM 1569 CG LYS A 101 9.737 -16.616 5.067 1.00 64.40 C ATOM 1570 CD LYS A 101 11.224 -16.699 5.368 1.00 21.55 C ATOM 1571 CE LYS A 101 11.563 -16.060 6.707 1.00 54.02 C ATOM 1572 NZ LYS A 101 12.552 -14.958 6.561 1.00 0.15 N ATOM 0 H LYS A 101 7.511 -15.510 5.390 1.00 23.41 H new ATOM 0 HA LYS A 101 7.400 -18.219 4.781 1.00 73.13 H new ATOM 0 HB2 LYS A 101 8.962 -16.911 7.039 1.00 72.51 H new ATOM 0 HB3 LYS A 101 9.373 -18.394 6.201 1.00 72.51 H new ATOM 0 HG2 LYS A 101 9.547 -16.993 4.062 1.00 64.40 H new ATOM 0 HG3 LYS A 101 9.420 -15.573 5.082 1.00 64.40 H new ATOM 0 HD2 LYS A 101 11.537 -17.743 5.373 1.00 21.55 H new ATOM 0 HD3 LYS A 101 11.784 -16.203 4.576 1.00 21.55 H new ATOM 0 HE2 LYS A 101 10.653 -15.673 7.165 1.00 54.02 H new ATOM 0 HE3 LYS A 101 11.961 -16.819 7.381 1.00 54.02 H new ATOM 0 HZ1 LYS A 101 12.972 -14.743 7.488 1.00 0.15 H new ATOM 0 HZ2 LYS A 101 13.301 -15.249 5.901 1.00 0.15 H new ATOM 0 HZ3 LYS A 101 12.075 -14.111 6.192 1.00 0.15 H new ATOM 1586 N ARG A 102 6.241 -17.487 7.769 1.00 11.43 N ATOM 1587 CA ARG A 102 5.495 -18.021 8.903 1.00 52.31 C ATOM 1588 C ARG A 102 4.194 -18.674 8.444 1.00 3.14 C ATOM 1589 O ARG A 102 3.969 -19.861 8.676 1.00 73.15 O ATOM 1590 CB ARG A 102 5.197 -16.908 9.909 1.00 20.00 C ATOM 1591 CG ARG A 102 5.493 -17.298 11.347 1.00 72.32 C ATOM 1592 CD ARG A 102 5.433 -16.096 12.277 1.00 4.12 C ATOM 1593 NE ARG A 102 4.626 -16.363 13.464 1.00 75.44 N ATOM 1594 CZ ARG A 102 4.948 -17.259 14.394 1.00 34.12 C ATOM 1595 NH1 ARG A 102 6.061 -17.973 14.279 1.00 21.45 N ATOM 1596 NH2 ARG A 102 4.156 -17.441 15.442 1.00 5.20 N ATOM 0 H ARG A 102 6.386 -16.478 7.797 1.00 11.43 H new ATOM 0 HA ARG A 102 6.108 -18.783 9.384 1.00 52.31 H new ATOM 0 HB2 ARG A 102 5.786 -16.028 9.651 1.00 20.00 H new ATOM 0 HB3 ARG A 102 4.148 -16.625 9.826 1.00 20.00 H new ATOM 0 HG2 ARG A 102 4.775 -18.049 11.676 1.00 72.32 H new ATOM 0 HG3 ARG A 102 6.481 -17.754 11.405 1.00 72.32 H new ATOM 0 HD2 ARG A 102 6.443 -15.821 12.580 1.00 4.12 H new ATOM 0 HD3 ARG A 102 5.018 -15.243 11.741 1.00 4.12 H new ATOM 0 HE ARG A 102 3.764 -15.831 13.588 1.00 75.44 H new ATOM 0 HH11 ARG A 102 6.674 -17.836 13.475 1.00 21.45 H new ATOM 0 HH12 ARG A 102 6.303 -18.658 14.994 1.00 21.45 H new ATOM 0 HH21 ARG A 102 3.300 -16.894 15.535 1.00 5.20 H new ATOM 0 HH22 ARG A 102 4.403 -18.128 16.155 1.00 5.20 H new ATOM 1610 N VAL A 103 3.343 -17.891 7.789 1.00 52.30 N ATOM 1611 CA VAL A 103 2.067 -18.394 7.296 1.00 23.01 C ATOM 1612 C VAL A 103 2.279 -19.518 6.288 1.00 71.00 C ATOM 1613 O VAL A 103 1.719 -20.606 6.427 1.00 52.41 O ATOM 1614 CB VAL A 103 1.245 -17.274 6.633 1.00 34.34 C ATOM 1615 CG1 VAL A 103 -0.127 -17.786 6.223 1.00 61.41 C ATOM 1616 CG2 VAL A 103 1.121 -16.080 7.568 1.00 64.50 C ATOM 0 H VAL A 103 3.514 -16.906 7.588 1.00 52.30 H new ATOM 0 HA VAL A 103 1.518 -18.777 8.156 1.00 23.01 H new ATOM 0 HB VAL A 103 1.767 -16.950 5.733 1.00 34.34 H new ATOM 0 HG11 VAL A 103 -0.692 -16.979 5.756 1.00 61.41 H new ATOM 0 HG12 VAL A 103 -0.012 -18.606 5.514 1.00 61.41 H new ATOM 0 HG13 VAL A 103 -0.661 -18.141 7.104 1.00 61.41 H new ATOM 0 HG21 VAL A 103 0.537 -15.298 7.083 1.00 64.50 H new ATOM 0 HG22 VAL A 103 0.623 -16.388 8.487 1.00 64.50 H new ATOM 0 HG23 VAL A 103 2.114 -15.698 7.804 1.00 64.50 H new ATOM 1626 N LYS A 104 3.094 -19.247 5.275 1.00 14.32 N ATOM 1627 CA LYS A 104 3.386 -20.232 4.244 1.00 14.11 C ATOM 1628 C LYS A 104 4.087 -21.446 4.840 1.00 3.51 C ATOM 1629 O LYS A 104 4.021 -22.545 4.289 1.00 72.44 O ATOM 1630 CB LYS A 104 4.257 -19.609 3.151 1.00 21.42 C ATOM 1631 CG LYS A 104 3.606 -18.423 2.458 1.00 44.45 C ATOM 1632 CD LYS A 104 2.416 -18.855 1.616 1.00 31.51 C ATOM 1633 CE LYS A 104 2.806 -19.062 0.162 1.00 41.33 C ATOM 1634 NZ LYS A 104 2.423 -20.415 -0.328 1.00 64.11 N ATOM 0 H LYS A 104 3.564 -18.351 5.147 1.00 14.32 H new ATOM 0 HA LYS A 104 2.443 -20.558 3.806 1.00 14.11 H new ATOM 0 HB2 LYS A 104 5.202 -19.289 3.589 1.00 21.42 H new ATOM 0 HB3 LYS A 104 4.492 -20.370 2.407 1.00 21.42 H new ATOM 0 HG2 LYS A 104 3.281 -17.698 3.204 1.00 44.45 H new ATOM 0 HG3 LYS A 104 4.339 -17.923 1.825 1.00 44.45 H new ATOM 0 HD2 LYS A 104 2.002 -19.780 2.018 1.00 31.51 H new ATOM 0 HD3 LYS A 104 1.632 -18.101 1.679 1.00 31.51 H new ATOM 0 HE2 LYS A 104 2.325 -18.303 -0.455 1.00 41.33 H new ATOM 0 HE3 LYS A 104 3.882 -18.927 0.052 1.00 41.33 H new ATOM 0 HZ1 LYS A 104 2.706 -20.517 -1.324 1.00 64.11 H new ATOM 0 HZ2 LYS A 104 2.902 -21.140 0.244 1.00 64.11 H new ATOM 0 HZ3 LYS A 104 1.393 -20.535 -0.247 1.00 64.11 H new ATOM 1648 N ASP A 105 4.756 -21.243 5.972 1.00 1.42 N ATOM 1649 CA ASP A 105 5.467 -22.324 6.642 1.00 4.23 C ATOM 1650 C ASP A 105 6.619 -22.828 5.779 1.00 73.54 C ATOM 1651 O ASP A 105 6.921 -24.021 5.762 1.00 14.23 O ATOM 1652 CB ASP A 105 4.506 -23.470 6.960 1.00 31.03 C ATOM 1653 CG ASP A 105 4.988 -24.331 8.111 1.00 71.24 C ATOM 1654 OD1 ASP A 105 5.297 -23.767 9.183 1.00 43.31 O ATOM 1655 OD2 ASP A 105 5.056 -25.566 7.942 1.00 4.43 O ATOM 0 H ASP A 105 4.820 -20.340 6.443 1.00 1.42 H new ATOM 0 HA ASP A 105 5.879 -21.938 7.575 1.00 4.23 H new ATOM 0 HB2 ASP A 105 3.525 -23.061 7.203 1.00 31.03 H new ATOM 0 HB3 ASP A 105 4.381 -24.092 6.073 1.00 31.03 H new ATOM 1660 N SER A 106 7.256 -21.907 5.065 1.00 51.41 N ATOM 1661 CA SER A 106 8.375 -22.249 4.196 1.00 32.02 C ATOM 1662 C SER A 106 9.234 -21.022 3.915 1.00 63.14 C ATOM 1663 O SER A 106 8.719 -19.919 3.732 1.00 14.44 O ATOM 1664 CB SER A 106 7.862 -22.842 2.882 1.00 43.33 C ATOM 1665 OG SER A 106 8.877 -22.846 1.893 1.00 33.41 O ATOM 0 H SER A 106 7.016 -20.916 5.071 1.00 51.41 H new ATOM 0 HA SER A 106 8.989 -22.992 4.705 1.00 32.02 H new ATOM 0 HB2 SER A 106 7.511 -23.860 3.051 1.00 43.33 H new ATOM 0 HB3 SER A 106 7.008 -22.265 2.528 1.00 43.33 H new ATOM 0 HG SER A 106 8.524 -23.231 1.064 1.00 33.41 H new ATOM 1671 N ASP A 107 10.547 -21.220 3.888 1.00 1.14 N ATOM 1672 CA ASP A 107 11.478 -20.129 3.635 1.00 61.24 C ATOM 1673 C ASP A 107 11.473 -19.730 2.163 1.00 51.25 C ATOM 1674 O ASP A 107 11.485 -18.544 1.831 1.00 35.33 O ATOM 1675 CB ASP A 107 12.891 -20.531 4.061 1.00 70.31 C ATOM 1676 CG ASP A 107 13.880 -19.389 3.935 1.00 3.11 C ATOM 1677 OD1 ASP A 107 13.802 -18.443 4.747 1.00 31.45 O ATOM 1678 OD2 ASP A 107 14.734 -19.440 3.024 1.00 21.21 O ATOM 0 H ASP A 107 10.990 -22.126 4.038 1.00 1.14 H new ATOM 0 HA ASP A 107 11.156 -19.269 4.223 1.00 61.24 H new ATOM 0 HB2 ASP A 107 12.871 -20.878 5.094 1.00 70.31 H new ATOM 0 HB3 ASP A 107 13.227 -21.368 3.450 1.00 70.31 H new ATOM 1683 N ASP A 108 11.457 -20.726 1.283 1.00 55.44 N ATOM 1684 CA ASP A 108 11.454 -20.476 -0.152 1.00 72.34 C ATOM 1685 C ASP A 108 10.030 -20.364 -0.689 1.00 32.32 C ATOM 1686 O ASP A 108 9.480 -21.331 -1.216 1.00 50.34 O ATOM 1687 CB ASP A 108 12.202 -21.589 -0.888 1.00 1.21 C ATOM 1688 CG ASP A 108 12.315 -21.325 -2.377 1.00 31.52 C ATOM 1689 OD1 ASP A 108 12.316 -20.140 -2.771 1.00 61.42 O ATOM 1690 OD2 ASP A 108 12.401 -22.303 -3.148 1.00 61.32 O ATOM 0 H ASP A 108 11.446 -21.713 1.539 1.00 55.44 H new ATOM 0 HA ASP A 108 11.962 -19.527 -0.327 1.00 72.34 H new ATOM 0 HB2 ASP A 108 13.201 -21.694 -0.464 1.00 1.21 H new ATOM 0 HB3 ASP A 108 11.687 -22.536 -0.728 1.00 1.21 H new ATOM 1695 N VAL A 109 9.442 -19.179 -0.559 1.00 44.54 N ATOM 1696 CA VAL A 109 8.086 -18.944 -1.039 1.00 72.24 C ATOM 1697 C VAL A 109 8.098 -18.104 -2.316 1.00 70.23 C ATOM 1698 O VAL A 109 9.016 -17.316 -2.540 1.00 71.13 O ATOM 1699 CB VAL A 109 7.219 -18.237 0.024 1.00 44.42 C ATOM 1700 CG1 VAL A 109 7.166 -19.056 1.304 1.00 65.34 C ATOM 1701 CG2 VAL A 109 7.742 -16.834 0.304 1.00 54.34 C ATOM 0 H VAL A 109 9.883 -18.368 -0.126 1.00 44.54 H new ATOM 0 HA VAL A 109 7.651 -19.921 -1.250 1.00 72.24 H new ATOM 0 HB VAL A 109 6.206 -18.149 -0.368 1.00 44.42 H new ATOM 0 HG11 VAL A 109 6.550 -18.540 2.041 1.00 65.34 H new ATOM 0 HG12 VAL A 109 6.735 -20.035 1.092 1.00 65.34 H new ATOM 0 HG13 VAL A 109 8.175 -19.181 1.698 1.00 65.34 H new ATOM 0 HG21 VAL A 109 7.115 -16.355 1.056 1.00 54.34 H new ATOM 0 HG22 VAL A 109 8.767 -16.894 0.671 1.00 54.34 H new ATOM 0 HG23 VAL A 109 7.719 -16.247 -0.614 1.00 54.34 H new ATOM 1711 N PRO A 110 7.075 -18.264 -3.170 1.00 74.31 N ATOM 1712 CA PRO A 110 6.974 -17.516 -4.427 1.00 72.13 C ATOM 1713 C PRO A 110 6.632 -16.047 -4.201 1.00 64.21 C ATOM 1714 O PRO A 110 5.516 -15.714 -3.802 1.00 31.12 O ATOM 1715 CB PRO A 110 5.836 -18.222 -5.168 1.00 30.24 C ATOM 1716 CG PRO A 110 4.994 -18.810 -4.090 1.00 71.43 C ATOM 1717 CD PRO A 110 5.937 -19.182 -2.978 1.00 32.55 C ATOM 0 HA PRO A 110 7.917 -17.507 -4.974 1.00 72.13 H new ATOM 0 HB2 PRO A 110 5.266 -17.522 -5.779 1.00 30.24 H new ATOM 0 HB3 PRO A 110 6.217 -18.993 -5.838 1.00 30.24 H new ATOM 0 HG2 PRO A 110 4.248 -18.094 -3.745 1.00 71.43 H new ATOM 0 HG3 PRO A 110 4.454 -19.685 -4.451 1.00 71.43 H new ATOM 0 HD2 PRO A 110 5.476 -19.050 -1.999 1.00 32.55 H new ATOM 0 HD3 PRO A 110 6.247 -20.225 -3.046 1.00 32.55 H new ATOM 1725 N MET A 111 7.600 -15.173 -4.456 1.00 43.34 N ATOM 1726 CA MET A 111 7.399 -13.740 -4.279 1.00 52.21 C ATOM 1727 C MET A 111 8.380 -12.940 -5.131 1.00 53.35 C ATOM 1728 O MET A 111 9.304 -13.498 -5.721 1.00 3.51 O ATOM 1729 CB MET A 111 7.561 -13.361 -2.806 1.00 62.34 C ATOM 1730 CG MET A 111 8.944 -13.661 -2.250 1.00 0.11 C ATOM 1731 SD MET A 111 9.282 -12.777 -0.716 1.00 33.30 S ATOM 1732 CE MET A 111 8.397 -13.798 0.459 1.00 12.23 C ATOM 0 H MET A 111 8.530 -15.432 -4.785 1.00 43.34 H new ATOM 0 HA MET A 111 6.386 -13.499 -4.602 1.00 52.21 H new ATOM 0 HB2 MET A 111 7.354 -12.297 -2.688 1.00 62.34 H new ATOM 0 HB3 MET A 111 6.817 -13.898 -2.217 1.00 62.34 H new ATOM 0 HG2 MET A 111 9.036 -14.733 -2.075 1.00 0.11 H new ATOM 0 HG3 MET A 111 9.696 -13.393 -2.992 1.00 0.11 H new ATOM 0 HE1 MET A 111 8.297 -13.263 1.403 1.00 12.23 H new ATOM 0 HE2 MET A 111 7.407 -14.030 0.066 1.00 12.23 H new ATOM 0 HE3 MET A 111 8.948 -14.724 0.624 1.00 12.23 H new ATOM 1742 N VAL A 112 8.169 -11.629 -5.190 1.00 42.44 N ATOM 1743 CA VAL A 112 9.029 -10.748 -5.969 1.00 23.31 C ATOM 1744 C VAL A 112 9.229 -9.410 -5.263 1.00 23.22 C ATOM 1745 O VAL A 112 8.358 -8.950 -4.526 1.00 31.14 O ATOM 1746 CB VAL A 112 8.444 -10.494 -7.370 1.00 54.31 C ATOM 1747 CG1 VAL A 112 9.388 -9.638 -8.201 1.00 52.52 C ATOM 1748 CG2 VAL A 112 8.151 -11.814 -8.069 1.00 62.31 C ATOM 0 H VAL A 112 7.408 -11.153 -4.706 1.00 42.44 H new ATOM 0 HA VAL A 112 9.992 -11.249 -6.069 1.00 23.31 H new ATOM 0 HB VAL A 112 7.506 -9.949 -7.259 1.00 54.31 H new ATOM 0 HG11 VAL A 112 8.955 -9.471 -9.187 1.00 52.52 H new ATOM 0 HG12 VAL A 112 9.542 -8.680 -7.705 1.00 52.52 H new ATOM 0 HG13 VAL A 112 10.345 -10.149 -8.307 1.00 52.52 H new ATOM 0 HG21 VAL A 112 7.738 -11.618 -9.058 1.00 62.31 H new ATOM 0 HG22 VAL A 112 9.074 -12.386 -8.168 1.00 62.31 H new ATOM 0 HG23 VAL A 112 7.431 -12.385 -7.482 1.00 62.31 H new ATOM 1758 N LEU A 113 10.382 -8.791 -5.497 1.00 11.04 N ATOM 1759 CA LEU A 113 10.697 -7.505 -4.888 1.00 32.11 C ATOM 1760 C LEU A 113 10.794 -6.414 -5.950 1.00 24.14 C ATOM 1761 O LEU A 113 11.707 -6.418 -6.776 1.00 31.40 O ATOM 1762 CB LEU A 113 12.010 -7.594 -4.107 1.00 14.22 C ATOM 1763 CG LEU A 113 12.469 -6.289 -3.449 1.00 74.52 C ATOM 1764 CD1 LEU A 113 11.287 -5.546 -2.844 1.00 75.23 C ATOM 1765 CD2 LEU A 113 13.520 -6.573 -2.386 1.00 25.11 C ATOM 0 H LEU A 113 11.114 -9.160 -6.104 1.00 11.04 H new ATOM 0 HA LEU A 113 9.892 -7.248 -4.199 1.00 32.11 H new ATOM 0 HB2 LEU A 113 11.903 -8.354 -3.333 1.00 14.22 H new ATOM 0 HB3 LEU A 113 12.794 -7.936 -4.783 1.00 14.22 H new ATOM 0 HG LEU A 113 12.913 -5.655 -4.217 1.00 74.52 H new ATOM 0 HD11 LEU A 113 11.636 -4.622 -2.382 1.00 75.23 H new ATOM 0 HD12 LEU A 113 10.566 -5.311 -3.627 1.00 75.23 H new ATOM 0 HD13 LEU A 113 10.811 -6.172 -2.089 1.00 75.23 H new ATOM 0 HD21 LEU A 113 13.836 -5.636 -1.928 1.00 25.11 H new ATOM 0 HD22 LEU A 113 13.098 -7.226 -1.622 1.00 25.11 H new ATOM 0 HD23 LEU A 113 14.380 -7.060 -2.846 1.00 25.11 H new ATOM 1777 N VAL A 114 9.846 -5.482 -5.925 1.00 75.23 N ATOM 1778 CA VAL A 114 9.824 -4.390 -6.887 1.00 61.11 C ATOM 1779 C VAL A 114 10.277 -3.079 -6.251 1.00 34.24 C ATOM 1780 O VAL A 114 9.961 -2.797 -5.095 1.00 13.42 O ATOM 1781 CB VAL A 114 8.416 -4.196 -7.479 1.00 25.14 C ATOM 1782 CG1 VAL A 114 8.453 -3.201 -8.627 1.00 53.24 C ATOM 1783 CG2 VAL A 114 7.841 -5.529 -7.938 1.00 72.23 C ATOM 0 H VAL A 114 9.083 -5.463 -5.248 1.00 75.23 H new ATOM 0 HA VAL A 114 10.517 -4.660 -7.684 1.00 61.11 H new ATOM 0 HB VAL A 114 7.767 -3.795 -6.701 1.00 25.14 H new ATOM 0 HG11 VAL A 114 7.449 -3.076 -9.033 1.00 53.24 H new ATOM 0 HG12 VAL A 114 8.819 -2.241 -8.264 1.00 53.24 H new ATOM 0 HG13 VAL A 114 9.117 -3.571 -9.408 1.00 53.24 H new ATOM 0 HG21 VAL A 114 6.846 -5.372 -8.353 1.00 72.23 H new ATOM 0 HG22 VAL A 114 8.489 -5.961 -8.701 1.00 72.23 H new ATOM 0 HG23 VAL A 114 7.777 -6.209 -7.089 1.00 72.23 H new ATOM 1793 N GLY A 115 11.016 -2.281 -7.015 1.00 40.14 N ATOM 1794 CA GLY A 115 11.498 -1.007 -6.514 1.00 70.21 C ATOM 1795 C GLY A 115 10.820 0.171 -7.186 1.00 22.43 C ATOM 1796 O GLY A 115 11.357 0.747 -8.133 1.00 45.31 O ATOM 0 H GLY A 115 11.290 -2.495 -7.974 1.00 40.14 H new ATOM 0 HA2 GLY A 115 11.329 -0.955 -5.438 1.00 70.21 H new ATOM 0 HA3 GLY A 115 12.575 -0.941 -6.671 1.00 70.21 H new ATOM 1800 N ASN A 116 9.636 0.528 -6.699 1.00 42.03 N ATOM 1801 CA ASN A 116 8.882 1.642 -7.261 1.00 74.41 C ATOM 1802 C ASN A 116 9.632 2.956 -7.081 1.00 22.32 C ATOM 1803 O ASN A 116 10.702 2.995 -6.474 1.00 50.31 O ATOM 1804 CB ASN A 116 7.504 1.734 -6.601 1.00 73.41 C ATOM 1805 CG ASN A 116 6.405 2.048 -7.598 1.00 31.42 C ATOM 1806 OD1 ASN A 116 6.661 2.212 -8.791 1.00 31.34 O ATOM 1807 ND2 ASN A 116 5.173 2.131 -7.112 1.00 52.23 N ATOM 0 H ASN A 116 9.178 0.062 -5.916 1.00 42.03 H new ATOM 0 HA ASN A 116 8.757 1.461 -8.329 1.00 74.41 H new ATOM 0 HB2 ASN A 116 7.280 0.791 -6.102 1.00 73.41 H new ATOM 0 HB3 ASN A 116 7.524 2.505 -5.831 1.00 73.41 H new ATOM 0 HD21 ASN A 116 4.392 2.338 -7.735 1.00 52.23 H new ATOM 0 HD22 ASN A 116 5.007 1.988 -6.116 1.00 52.23 H new ATOM 1814 N LYS A 117 9.064 4.033 -7.615 1.00 3.34 N ATOM 1815 CA LYS A 117 9.680 5.351 -7.515 1.00 10.51 C ATOM 1816 C LYS A 117 11.053 5.360 -8.181 1.00 20.22 C ATOM 1817 O LYS A 117 12.082 5.351 -7.506 1.00 22.44 O ATOM 1818 CB LYS A 117 9.805 5.766 -6.047 1.00 22.44 C ATOM 1819 CG LYS A 117 8.486 6.198 -5.425 1.00 72.20 C ATOM 1820 CD LYS A 117 8.041 5.242 -4.328 1.00 32.44 C ATOM 1821 CE LYS A 117 7.105 5.922 -3.340 1.00 32.32 C ATOM 1822 NZ LYS A 117 7.661 5.923 -1.959 1.00 44.42 N ATOM 0 H LYS A 117 8.179 4.019 -8.121 1.00 3.34 H new ATOM 0 HA LYS A 117 9.042 6.067 -8.033 1.00 10.51 H new ATOM 0 HB2 LYS A 117 10.212 4.932 -5.475 1.00 22.44 H new ATOM 0 HB3 LYS A 117 10.520 6.585 -5.969 1.00 22.44 H new ATOM 0 HG2 LYS A 117 8.590 7.202 -5.013 1.00 72.20 H new ATOM 0 HG3 LYS A 117 7.719 6.248 -6.197 1.00 72.20 H new ATOM 0 HD2 LYS A 117 7.539 4.383 -4.774 1.00 32.44 H new ATOM 0 HD3 LYS A 117 8.915 4.861 -3.800 1.00 32.44 H new ATOM 0 HE2 LYS A 117 6.924 6.948 -3.659 1.00 32.32 H new ATOM 0 HE3 LYS A 117 6.141 5.412 -3.343 1.00 32.32 H new ATOM 0 HZ1 LYS A 117 7.292 6.743 -1.437 1.00 44.42 H new ATOM 0 HZ2 LYS A 117 7.381 5.048 -1.471 1.00 44.42 H new ATOM 0 HZ3 LYS A 117 8.699 5.978 -2.003 1.00 44.42 H new ATOM 1836 N CYS A 118 11.057 5.374 -9.511 1.00 51.21 N ATOM 1837 CA CYS A 118 12.303 5.382 -10.270 1.00 51.34 C ATOM 1838 C CYS A 118 12.581 6.762 -10.859 1.00 70.30 C ATOM 1839 O CYS A 118 13.733 7.114 -11.121 1.00 4.31 O ATOM 1840 CB CYS A 118 12.250 4.339 -11.391 1.00 32.04 C ATOM 1841 SG CYS A 118 13.869 3.694 -11.873 1.00 75.11 S ATOM 0 H CYS A 118 10.213 5.380 -10.084 1.00 51.21 H new ATOM 0 HA CYS A 118 13.113 5.132 -9.585 1.00 51.34 H new ATOM 0 HB2 CYS A 118 11.620 3.509 -11.071 1.00 32.04 H new ATOM 0 HB3 CYS A 118 11.773 4.783 -12.264 1.00 32.04 H new ATOM 0 HG CYS A 118 13.722 2.819 -12.823 1.00 75.11 H new ATOM 1847 N ASP A 119 11.523 7.539 -11.070 1.00 22.43 N ATOM 1848 CA ASP A 119 11.661 8.879 -11.632 1.00 32.40 C ATOM 1849 C ASP A 119 11.615 9.950 -10.543 1.00 3.10 C ATOM 1850 O ASP A 119 11.431 11.132 -10.833 1.00 54.34 O ATOM 1851 CB ASP A 119 10.557 9.133 -12.661 1.00 12.10 C ATOM 1852 CG ASP A 119 10.826 10.361 -13.508 1.00 40.22 C ATOM 1853 OD1 ASP A 119 11.831 10.361 -14.249 1.00 25.23 O ATOM 1854 OD2 ASP A 119 10.031 11.321 -13.431 1.00 33.44 O ATOM 0 H ASP A 119 10.563 7.265 -10.861 1.00 22.43 H new ATOM 0 HA ASP A 119 12.633 8.938 -12.121 1.00 32.40 H new ATOM 0 HB2 ASP A 119 10.461 8.262 -13.309 1.00 12.10 H new ATOM 0 HB3 ASP A 119 9.604 9.253 -12.145 1.00 12.10 H new ATOM 1859 N LEU A 120 11.786 9.534 -9.290 1.00 21.30 N ATOM 1860 CA LEU A 120 11.765 10.465 -8.168 1.00 63.50 C ATOM 1861 C LEU A 120 12.936 11.442 -8.242 1.00 25.05 C ATOM 1862 O LEU A 120 12.903 12.512 -7.632 1.00 61.45 O ATOM 1863 CB LEU A 120 11.818 9.697 -6.846 1.00 61.51 C ATOM 1864 CG LEU A 120 10.464 9.229 -6.310 1.00 14.24 C ATOM 1865 CD1 LEU A 120 9.687 10.399 -5.727 1.00 32.13 C ATOM 1866 CD2 LEU A 120 9.660 8.546 -7.407 1.00 72.25 C ATOM 0 H LEU A 120 11.940 8.560 -9.028 1.00 21.30 H new ATOM 0 HA LEU A 120 10.837 11.034 -8.221 1.00 63.50 H new ATOM 0 HB2 LEU A 120 12.460 8.826 -6.976 1.00 61.51 H new ATOM 0 HB3 LEU A 120 12.289 10.331 -6.095 1.00 61.51 H new ATOM 0 HG LEU A 120 10.642 8.505 -5.515 1.00 14.24 H new ATOM 0 HD11 LEU A 120 8.727 10.047 -5.351 1.00 32.13 H new ATOM 0 HD12 LEU A 120 10.256 10.843 -4.910 1.00 32.13 H new ATOM 0 HD13 LEU A 120 9.521 11.147 -6.502 1.00 32.13 H new ATOM 0 HD21 LEU A 120 8.700 8.220 -7.006 1.00 72.25 H new ATOM 0 HD22 LEU A 120 9.492 9.247 -8.225 1.00 72.25 H new ATOM 0 HD23 LEU A 120 10.211 7.681 -7.777 1.00 72.25 H new ATOM 1878 N ALA A 121 13.972 11.068 -8.989 1.00 34.10 N ATOM 1879 CA ALA A 121 15.150 11.909 -9.138 1.00 21.33 C ATOM 1880 C ALA A 121 15.810 12.183 -7.788 1.00 20.15 C ATOM 1881 O ALA A 121 16.580 13.133 -7.647 1.00 22.13 O ATOM 1882 CB ALA A 121 14.778 13.213 -9.821 1.00 2.33 C ATOM 0 H ALA A 121 14.017 10.186 -9.500 1.00 34.10 H new ATOM 0 HA ALA A 121 15.870 11.376 -9.759 1.00 21.33 H new ATOM 0 HB1 ALA A 121 15.667 13.835 -9.927 1.00 2.33 H new ATOM 0 HB2 ALA A 121 14.363 13.002 -10.806 1.00 2.33 H new ATOM 0 HB3 ALA A 121 14.037 13.740 -9.220 1.00 2.33 H new ATOM 1888 N ALA A 122 15.504 11.348 -6.798 1.00 53.52 N ATOM 1889 CA ALA A 122 16.065 11.505 -5.466 1.00 74.42 C ATOM 1890 C ALA A 122 16.183 10.157 -4.757 1.00 64.32 C ATOM 1891 O ALA A 122 15.759 10.008 -3.611 1.00 73.33 O ATOM 1892 CB ALA A 122 15.205 12.459 -4.653 1.00 64.41 C ATOM 0 H ALA A 122 14.869 10.556 -6.897 1.00 53.52 H new ATOM 0 HA ALA A 122 17.068 11.921 -5.561 1.00 74.42 H new ATOM 0 HB1 ALA A 122 15.630 12.573 -3.656 1.00 64.41 H new ATOM 0 HB2 ALA A 122 15.173 13.430 -5.147 1.00 64.41 H new ATOM 0 HB3 ALA A 122 14.194 12.059 -4.573 1.00 64.41 H new ATOM 1898 N ARG A 123 16.759 9.177 -5.448 1.00 31.25 N ATOM 1899 CA ARG A 123 16.928 7.842 -4.883 1.00 61.22 C ATOM 1900 C ARG A 123 17.906 7.862 -3.713 1.00 54.51 C ATOM 1901 O ARG A 123 18.722 8.775 -3.587 1.00 33.43 O ATOM 1902 CB ARG A 123 17.411 6.860 -5.957 1.00 12.33 C ATOM 1903 CG ARG A 123 18.857 7.071 -6.382 1.00 21.24 C ATOM 1904 CD ARG A 123 19.370 5.898 -7.204 1.00 61.42 C ATOM 1905 NE ARG A 123 18.463 5.558 -8.296 1.00 43.41 N ATOM 1906 CZ ARG A 123 18.309 6.300 -9.390 1.00 21.24 C ATOM 1907 NH1 ARG A 123 18.997 7.425 -9.540 1.00 23.33 N ATOM 1908 NH2 ARG A 123 17.464 5.917 -10.337 1.00 50.44 N ATOM 0 H ARG A 123 17.116 9.282 -6.398 1.00 31.25 H new ATOM 0 HA ARG A 123 15.958 7.510 -4.513 1.00 61.22 H new ATOM 0 HB2 ARG A 123 17.298 5.843 -5.582 1.00 12.33 H new ATOM 0 HB3 ARG A 123 16.769 6.950 -6.833 1.00 12.33 H new ATOM 0 HG2 ARG A 123 18.936 7.988 -6.965 1.00 21.24 H new ATOM 0 HG3 ARG A 123 19.483 7.200 -5.499 1.00 21.24 H new ATOM 0 HD2 ARG A 123 20.352 6.142 -7.610 1.00 61.42 H new ATOM 0 HD3 ARG A 123 19.499 5.031 -6.557 1.00 61.42 H new ATOM 0 HE ARG A 123 17.915 4.701 -8.216 1.00 43.41 H new ATOM 0 HH11 ARG A 123 19.648 7.725 -8.815 1.00 23.33 H new ATOM 0 HH12 ARG A 123 18.875 7.989 -10.381 1.00 23.33 H new ATOM 0 HH21 ARG A 123 16.932 5.054 -10.227 1.00 50.44 H new ATOM 0 HH22 ARG A 123 17.346 6.486 -11.176 1.00 50.44 H new ATOM 1922 N THR A 124 17.818 6.846 -2.862 1.00 14.13 N ATOM 1923 CA THR A 124 18.696 6.740 -1.702 1.00 51.42 C ATOM 1924 C THR A 124 19.361 5.370 -1.653 1.00 2.35 C ATOM 1925 O THR A 124 20.573 5.262 -1.463 1.00 3.54 O ATOM 1926 CB THR A 124 17.908 6.985 -0.414 1.00 24.44 C ATOM 1927 OG1 THR A 124 16.942 5.967 -0.216 1.00 1.53 O ATOM 1928 CG2 THR A 124 17.185 8.314 -0.396 1.00 33.24 C ATOM 0 H THR A 124 17.147 6.083 -2.953 1.00 14.13 H new ATOM 0 HA THR A 124 19.472 7.500 -1.792 1.00 51.42 H new ATOM 0 HB THR A 124 18.652 6.985 0.383 1.00 24.44 H new ATOM 0 HG1 THR A 124 16.538 5.728 -1.076 1.00 1.53 H new ATOM 0 HG21 THR A 124 16.647 8.423 0.546 1.00 33.24 H new ATOM 0 HG22 THR A 124 17.908 9.123 -0.496 1.00 33.24 H new ATOM 0 HG23 THR A 124 16.478 8.355 -1.225 1.00 33.24 H new ATOM 1936 N VAL A 125 18.560 4.324 -1.829 1.00 40.35 N ATOM 1937 CA VAL A 125 19.062 2.960 -1.809 1.00 0.34 C ATOM 1938 C VAL A 125 19.460 2.503 -3.209 1.00 14.01 C ATOM 1939 O VAL A 125 18.606 2.160 -4.026 1.00 0.31 O ATOM 1940 CB VAL A 125 18.008 1.991 -1.244 1.00 24.23 C ATOM 1941 CG1 VAL A 125 18.595 0.600 -1.081 1.00 32.41 C ATOM 1942 CG2 VAL A 125 17.464 2.507 0.080 1.00 3.52 C ATOM 0 H VAL A 125 17.555 4.399 -1.988 1.00 40.35 H new ATOM 0 HA VAL A 125 19.941 2.949 -1.164 1.00 0.34 H new ATOM 0 HB VAL A 125 17.181 1.930 -1.951 1.00 24.23 H new ATOM 0 HG11 VAL A 125 17.835 -0.071 -0.680 1.00 32.41 H new ATOM 0 HG12 VAL A 125 18.931 0.231 -2.050 1.00 32.41 H new ATOM 0 HG13 VAL A 125 19.441 0.640 -0.395 1.00 32.41 H new ATOM 0 HG21 VAL A 125 16.720 1.809 0.464 1.00 3.52 H new ATOM 0 HG22 VAL A 125 18.280 2.600 0.797 1.00 3.52 H new ATOM 0 HG23 VAL A 125 17.002 3.482 -0.072 1.00 3.52 H new ATOM 1952 N GLU A 126 20.762 2.500 -3.479 1.00 63.33 N ATOM 1953 CA GLU A 126 21.272 2.087 -4.783 1.00 15.52 C ATOM 1954 C GLU A 126 20.796 0.680 -5.134 1.00 1.42 C ATOM 1955 O GLU A 126 20.349 -0.071 -4.269 1.00 73.33 O ATOM 1956 CB GLU A 126 22.801 2.141 -4.799 1.00 72.15 C ATOM 1957 CG GLU A 126 23.445 1.598 -3.534 1.00 42.42 C ATOM 1958 CD GLU A 126 24.918 1.290 -3.717 1.00 74.02 C ATOM 1959 OE1 GLU A 126 25.642 2.152 -4.259 1.00 12.11 O ATOM 1960 OE2 GLU A 126 25.348 0.189 -3.315 1.00 33.14 O ATOM 0 H GLU A 126 21.483 2.779 -2.813 1.00 63.33 H new ATOM 0 HA GLU A 126 20.885 2.779 -5.531 1.00 15.52 H new ATOM 0 HB2 GLU A 126 23.167 1.573 -5.655 1.00 72.15 H new ATOM 0 HB3 GLU A 126 23.118 3.174 -4.943 1.00 72.15 H new ATOM 0 HG2 GLU A 126 23.326 2.324 -2.730 1.00 42.42 H new ATOM 0 HG3 GLU A 126 22.924 0.692 -3.225 1.00 42.42 H new ATOM 1967 N SER A 127 20.892 0.335 -6.413 1.00 12.43 N ATOM 1968 CA SER A 127 20.469 -0.980 -6.887 1.00 61.00 C ATOM 1969 C SER A 127 21.230 -2.094 -6.175 1.00 65.12 C ATOM 1970 O SER A 127 20.646 -3.101 -5.774 1.00 31.51 O ATOM 1971 CB SER A 127 20.676 -1.092 -8.398 1.00 55.54 C ATOM 1972 OG SER A 127 19.828 -0.195 -9.098 1.00 1.43 O ATOM 0 H SER A 127 21.259 0.947 -7.142 1.00 12.43 H new ATOM 0 HA SER A 127 19.408 -1.091 -6.661 1.00 61.00 H new ATOM 0 HB2 SER A 127 21.717 -0.879 -8.642 1.00 55.54 H new ATOM 0 HB3 SER A 127 20.476 -2.114 -8.721 1.00 55.54 H new ATOM 0 HG SER A 127 19.981 -0.285 -10.062 1.00 1.43 H new ATOM 1978 N ARG A 128 22.539 -1.909 -6.022 1.00 71.44 N ATOM 1979 CA ARG A 128 23.380 -2.901 -5.361 1.00 10.11 C ATOM 1980 C ARG A 128 22.855 -3.223 -3.964 1.00 3.43 C ATOM 1981 O ARG A 128 22.683 -4.389 -3.608 1.00 22.51 O ATOM 1982 CB ARG A 128 24.825 -2.398 -5.274 1.00 41.31 C ATOM 1983 CG ARG A 128 25.748 -3.320 -4.493 1.00 51.22 C ATOM 1984 CD ARG A 128 27.059 -3.556 -5.228 1.00 3.14 C ATOM 1985 NE ARG A 128 28.167 -3.795 -4.305 1.00 5.30 N ATOM 1986 CZ ARG A 128 28.822 -2.828 -3.667 1.00 42.34 C ATOM 1987 NH1 ARG A 128 28.487 -1.556 -3.848 1.00 33.13 N ATOM 1988 NH2 ARG A 128 29.817 -3.133 -2.844 1.00 14.53 N ATOM 0 H ARG A 128 23.039 -1.082 -6.347 1.00 71.44 H new ATOM 0 HA ARG A 128 23.354 -3.814 -5.955 1.00 10.11 H new ATOM 0 HB2 ARG A 128 25.219 -2.274 -6.283 1.00 41.31 H new ATOM 0 HB3 ARG A 128 24.830 -1.413 -4.807 1.00 41.31 H new ATOM 0 HG2 ARG A 128 25.952 -2.887 -3.514 1.00 51.22 H new ATOM 0 HG3 ARG A 128 25.250 -4.274 -4.322 1.00 51.22 H new ATOM 0 HD2 ARG A 128 26.952 -4.411 -5.896 1.00 3.14 H new ATOM 0 HD3 ARG A 128 27.286 -2.691 -5.852 1.00 3.14 H new ATOM 0 HE ARG A 128 28.455 -4.760 -4.140 1.00 5.30 H new ATOM 0 HH11 ARG A 128 27.723 -1.315 -4.479 1.00 33.13 H new ATOM 0 HH12 ARG A 128 28.993 -0.820 -3.356 1.00 33.13 H new ATOM 0 HH21 ARG A 128 30.080 -4.108 -2.701 1.00 14.53 H new ATOM 0 HH22 ARG A 128 30.319 -2.392 -2.355 1.00 14.53 H new ATOM 2002 N GLN A 129 22.602 -2.182 -3.176 1.00 72.21 N ATOM 2003 CA GLN A 129 22.097 -2.354 -1.818 1.00 4.44 C ATOM 2004 C GLN A 129 20.790 -3.140 -1.816 1.00 3.55 C ATOM 2005 O GLN A 129 20.578 -4.011 -0.972 1.00 1.11 O ATOM 2006 CB GLN A 129 21.889 -0.993 -1.153 1.00 24.12 C ATOM 2007 CG GLN A 129 22.022 -1.028 0.360 1.00 31.31 C ATOM 2008 CD GLN A 129 21.995 0.357 0.980 1.00 64.42 C ATOM 2009 OE1 GLN A 129 20.931 0.881 1.308 1.00 73.01 O ATOM 2010 NE2 GLN A 129 23.169 0.955 1.141 1.00 14.24 N ATOM 0 H GLN A 129 22.739 -1.210 -3.455 1.00 72.21 H new ATOM 0 HA GLN A 129 22.838 -2.918 -1.252 1.00 4.44 H new ATOM 0 HB2 GLN A 129 22.614 -0.286 -1.557 1.00 24.12 H new ATOM 0 HB3 GLN A 129 20.899 -0.618 -1.414 1.00 24.12 H new ATOM 0 HG2 GLN A 129 21.212 -1.625 0.779 1.00 31.31 H new ATOM 0 HG3 GLN A 129 22.955 -1.524 0.628 1.00 31.31 H new ATOM 0 HE21 GLN A 129 24.026 0.482 0.854 1.00 14.24 H new ATOM 0 HE22 GLN A 129 23.214 1.888 1.552 1.00 14.24 H new ATOM 2019 N ALA A 130 19.916 -2.827 -2.767 1.00 12.25 N ATOM 2020 CA ALA A 130 18.631 -3.506 -2.875 1.00 53.33 C ATOM 2021 C ALA A 130 18.807 -4.942 -3.355 1.00 11.23 C ATOM 2022 O ALA A 130 18.015 -5.822 -3.016 1.00 25.23 O ATOM 2023 CB ALA A 130 17.710 -2.743 -3.816 1.00 44.31 C ATOM 0 H ALA A 130 20.074 -2.108 -3.473 1.00 12.25 H new ATOM 0 HA ALA A 130 18.179 -3.535 -1.884 1.00 53.33 H new ATOM 0 HB1 ALA A 130 16.753 -3.261 -3.888 1.00 44.31 H new ATOM 0 HB2 ALA A 130 17.550 -1.736 -3.431 1.00 44.31 H new ATOM 0 HB3 ALA A 130 18.166 -2.685 -4.804 1.00 44.31 H new ATOM 2029 N GLN A 131 19.850 -5.174 -4.145 1.00 73.41 N ATOM 2030 CA GLN A 131 20.131 -6.504 -4.672 1.00 74.41 C ATOM 2031 C GLN A 131 20.709 -7.409 -3.589 1.00 52.12 C ATOM 2032 O GLN A 131 20.522 -8.626 -3.617 1.00 41.31 O ATOM 2033 CB GLN A 131 21.103 -6.414 -5.850 1.00 4.55 C ATOM 2034 CG GLN A 131 20.414 -6.309 -7.201 1.00 21.33 C ATOM 2035 CD GLN A 131 20.902 -7.350 -8.189 1.00 3.35 C ATOM 2036 OE1 GLN A 131 21.749 -7.069 -9.037 1.00 14.43 O ATOM 2037 NE2 GLN A 131 20.369 -8.561 -8.084 1.00 31.05 N ATOM 0 H GLN A 131 20.515 -4.457 -4.435 1.00 73.41 H new ATOM 0 HA GLN A 131 19.192 -6.936 -5.017 1.00 74.41 H new ATOM 0 HB2 GLN A 131 21.748 -5.546 -5.712 1.00 4.55 H new ATOM 0 HB3 GLN A 131 21.747 -7.294 -5.847 1.00 4.55 H new ATOM 0 HG2 GLN A 131 19.338 -6.419 -7.065 1.00 21.33 H new ATOM 0 HG3 GLN A 131 20.583 -5.315 -7.614 1.00 21.33 H new ATOM 0 HE21 GLN A 131 19.670 -8.750 -7.366 1.00 31.05 H new ATOM 0 HE22 GLN A 131 20.659 -9.303 -8.721 1.00 31.05 H new ATOM 2046 N ASP A 132 21.414 -6.809 -2.633 1.00 11.11 N ATOM 2047 CA ASP A 132 22.021 -7.562 -1.541 1.00 4.34 C ATOM 2048 C ASP A 132 20.971 -8.373 -0.789 1.00 71.35 C ATOM 2049 O ASP A 132 21.185 -9.544 -0.473 1.00 3.21 O ATOM 2050 CB ASP A 132 22.737 -6.616 -0.576 1.00 12.43 C ATOM 2051 CG ASP A 132 23.512 -7.359 0.493 1.00 71.41 C ATOM 2052 OD1 ASP A 132 22.913 -7.692 1.538 1.00 72.42 O ATOM 2053 OD2 ASP A 132 24.718 -7.608 0.288 1.00 61.25 O ATOM 0 H ASP A 132 21.578 -5.803 -2.593 1.00 11.11 H new ATOM 0 HA ASP A 132 22.748 -8.251 -1.970 1.00 4.34 H new ATOM 0 HB2 ASP A 132 23.419 -5.977 -1.137 1.00 12.43 H new ATOM 0 HB3 ASP A 132 22.005 -5.962 -0.102 1.00 12.43 H new ATOM 2058 N LEU A 133 19.834 -7.744 -0.508 1.00 31.02 N ATOM 2059 CA LEU A 133 18.750 -8.408 0.205 1.00 62.12 C ATOM 2060 C LEU A 133 18.070 -9.444 -0.683 1.00 64.44 C ATOM 2061 O LEU A 133 17.866 -10.588 -0.278 1.00 60.14 O ATOM 2062 CB LEU A 133 17.724 -7.380 0.689 1.00 13.50 C ATOM 2063 CG LEU A 133 16.474 -7.968 1.345 1.00 53.03 C ATOM 2064 CD1 LEU A 133 16.772 -8.404 2.770 1.00 22.31 C ATOM 2065 CD2 LEU A 133 15.336 -6.958 1.320 1.00 4.22 C ATOM 0 H LEU A 133 19.640 -6.776 -0.763 1.00 31.02 H new ATOM 0 HA LEU A 133 19.176 -8.919 1.068 1.00 62.12 H new ATOM 0 HB2 LEU A 133 18.210 -6.713 1.402 1.00 13.50 H new ATOM 0 HB3 LEU A 133 17.416 -6.770 -0.160 1.00 13.50 H new ATOM 0 HG LEU A 133 16.167 -8.846 0.777 1.00 53.03 H new ATOM 0 HD11 LEU A 133 15.870 -8.820 3.219 1.00 22.31 H new ATOM 0 HD12 LEU A 133 17.556 -9.161 2.762 1.00 22.31 H new ATOM 0 HD13 LEU A 133 17.104 -7.544 3.352 1.00 22.31 H new ATOM 0 HD21 LEU A 133 14.454 -7.392 1.791 1.00 4.22 H new ATOM 0 HD22 LEU A 133 15.633 -6.061 1.864 1.00 4.22 H new ATOM 0 HD23 LEU A 133 15.105 -6.696 0.288 1.00 4.22 H new ATOM 2077 N ALA A 134 17.718 -9.034 -1.898 1.00 33.51 N ATOM 2078 CA ALA A 134 17.058 -9.925 -2.844 1.00 20.11 C ATOM 2079 C ALA A 134 17.908 -11.161 -3.121 1.00 14.42 C ATOM 2080 O ALA A 134 17.413 -12.287 -3.088 1.00 70.31 O ATOM 2081 CB ALA A 134 16.758 -9.190 -4.140 1.00 72.44 C ATOM 0 H ALA A 134 17.879 -8.090 -2.250 1.00 33.51 H new ATOM 0 HA ALA A 134 16.119 -10.254 -2.399 1.00 20.11 H new ATOM 0 HB1 ALA A 134 16.265 -9.868 -4.837 1.00 72.44 H new ATOM 0 HB2 ALA A 134 16.104 -8.342 -3.935 1.00 72.44 H new ATOM 0 HB3 ALA A 134 17.689 -8.832 -4.579 1.00 72.44 H new ATOM 2087 N ARG A 135 19.191 -10.942 -3.393 1.00 41.01 N ATOM 2088 CA ARG A 135 20.113 -12.038 -3.676 1.00 40.22 C ATOM 2089 C ARG A 135 20.112 -13.056 -2.540 1.00 52.31 C ATOM 2090 O ARG A 135 20.089 -14.264 -2.776 1.00 10.44 O ATOM 2091 CB ARG A 135 21.528 -11.500 -3.894 1.00 33.51 C ATOM 2092 CG ARG A 135 22.566 -12.588 -4.129 1.00 34.40 C ATOM 2093 CD ARG A 135 23.355 -12.888 -2.865 1.00 55.42 C ATOM 2094 NE ARG A 135 24.583 -13.628 -3.151 1.00 71.44 N ATOM 2095 CZ ARG A 135 25.273 -14.300 -2.232 1.00 40.22 C ATOM 2096 NH1 ARG A 135 24.862 -14.327 -0.971 1.00 53.41 N ATOM 2097 NH2 ARG A 135 26.380 -14.946 -2.576 1.00 1.42 N ATOM 0 H ARG A 135 19.616 -10.015 -3.424 1.00 41.01 H new ATOM 0 HA ARG A 135 19.778 -12.535 -4.586 1.00 40.22 H new ATOM 0 HB2 ARG A 135 21.523 -10.824 -4.749 1.00 33.51 H new ATOM 0 HB3 ARG A 135 21.822 -10.912 -3.025 1.00 33.51 H new ATOM 0 HG2 ARG A 135 22.071 -13.496 -4.474 1.00 34.40 H new ATOM 0 HG3 ARG A 135 23.248 -12.276 -4.920 1.00 34.40 H new ATOM 0 HD2 ARG A 135 23.603 -11.954 -2.362 1.00 55.42 H new ATOM 0 HD3 ARG A 135 22.735 -13.465 -2.179 1.00 55.42 H new ATOM 0 HE ARG A 135 24.931 -13.629 -4.110 1.00 71.44 H new ATOM 0 HH11 ARG A 135 24.013 -13.831 -0.701 1.00 53.41 H new ATOM 0 HH12 ARG A 135 25.395 -14.844 -0.272 1.00 53.41 H new ATOM 0 HH21 ARG A 135 26.702 -14.927 -3.544 1.00 1.42 H new ATOM 0 HH22 ARG A 135 26.909 -15.461 -1.873 1.00 1.42 H new ATOM 2111 N SER A 136 20.135 -12.560 -1.308 1.00 15.03 N ATOM 2112 CA SER A 136 20.135 -13.427 -0.137 1.00 70.02 C ATOM 2113 C SER A 136 18.779 -14.102 0.031 1.00 43.44 C ATOM 2114 O SER A 136 18.692 -15.240 0.494 1.00 43.51 O ATOM 2115 CB SER A 136 20.480 -12.626 1.120 1.00 32.32 C ATOM 2116 OG SER A 136 20.838 -13.482 2.189 1.00 62.01 O ATOM 0 H SER A 136 20.154 -11.563 -1.095 1.00 15.03 H new ATOM 0 HA SER A 136 20.892 -14.197 -0.283 1.00 70.02 H new ATOM 0 HB2 SER A 136 21.303 -11.944 0.906 1.00 32.32 H new ATOM 0 HB3 SER A 136 19.626 -12.014 1.411 1.00 32.32 H new ATOM 0 HG SER A 136 21.055 -12.945 2.979 1.00 62.01 H new ATOM 2122 N TYR A 137 17.724 -13.391 -0.349 1.00 4.00 N ATOM 2123 CA TYR A 137 16.368 -13.915 -0.246 1.00 13.44 C ATOM 2124 C TYR A 137 16.100 -14.954 -1.330 1.00 4.05 C ATOM 2125 O TYR A 137 15.266 -15.844 -1.158 1.00 14.01 O ATOM 2126 CB TYR A 137 15.353 -12.776 -0.346 1.00 75.42 C ATOM 2127 CG TYR A 137 15.067 -12.100 0.978 1.00 21.53 C ATOM 2128 CD1 TYR A 137 15.995 -12.131 2.014 1.00 40.11 C ATOM 2129 CD2 TYR A 137 13.869 -11.433 1.192 1.00 24.35 C ATOM 2130 CE1 TYR A 137 15.735 -11.518 3.223 1.00 24.34 C ATOM 2131 CE2 TYR A 137 13.601 -10.816 2.399 1.00 54.31 C ATOM 2132 CZ TYR A 137 14.538 -10.861 3.411 1.00 41.03 C ATOM 2133 OH TYR A 137 14.274 -10.248 4.615 1.00 34.04 O ATOM 0 H TYR A 137 17.782 -12.448 -0.732 1.00 4.00 H new ATOM 0 HA TYR A 137 16.264 -14.400 0.724 1.00 13.44 H new ATOM 0 HB2 TYR A 137 15.723 -12.032 -1.052 1.00 75.42 H new ATOM 0 HB3 TYR A 137 14.421 -13.166 -0.754 1.00 75.42 H new ATOM 0 HD1 TYR A 137 16.935 -12.643 1.870 1.00 40.11 H new ATOM 0 HD2 TYR A 137 13.134 -11.396 0.402 1.00 24.35 H new ATOM 0 HE1 TYR A 137 16.466 -11.553 4.018 1.00 24.34 H new ATOM 0 HE2 TYR A 137 12.663 -10.301 2.549 1.00 54.31 H new ATOM 0 HH TYR A 137 13.309 -10.258 4.783 1.00 34.04 H new ATOM 2143 N GLY A 138 16.811 -14.837 -2.446 1.00 62.30 N ATOM 2144 CA GLY A 138 16.635 -15.772 -3.540 1.00 34.22 C ATOM 2145 C GLY A 138 15.537 -15.352 -4.498 1.00 34.41 C ATOM 2146 O GLY A 138 15.077 -16.153 -5.313 1.00 14.11 O ATOM 0 H GLY A 138 17.507 -14.110 -2.612 1.00 62.30 H new ATOM 0 HA2 GLY A 138 17.573 -15.865 -4.087 1.00 34.22 H new ATOM 0 HA3 GLY A 138 16.402 -16.757 -3.136 1.00 34.22 H new ATOM 2150 N ILE A 139 15.115 -14.093 -4.405 1.00 54.40 N ATOM 2151 CA ILE A 139 14.065 -13.576 -5.274 1.00 51.44 C ATOM 2152 C ILE A 139 14.602 -12.507 -6.221 1.00 41.12 C ATOM 2153 O ILE A 139 15.619 -11.872 -5.942 1.00 71.24 O ATOM 2154 CB ILE A 139 12.901 -12.984 -4.469 1.00 71.20 C ATOM 2155 CG1 ILE A 139 13.426 -12.163 -3.299 1.00 74.43 C ATOM 2156 CG2 ILE A 139 11.983 -14.094 -3.978 1.00 13.23 C ATOM 2157 CD1 ILE A 139 12.328 -11.514 -2.502 1.00 62.22 C ATOM 0 H ILE A 139 15.484 -13.415 -3.738 1.00 54.40 H new ATOM 0 HA ILE A 139 13.702 -14.424 -5.854 1.00 51.44 H new ATOM 0 HB ILE A 139 12.327 -12.323 -5.119 1.00 71.20 H new ATOM 0 HG12 ILE A 139 14.012 -12.807 -2.644 1.00 74.43 H new ATOM 0 HG13 ILE A 139 14.100 -11.393 -3.675 1.00 74.43 H new ATOM 0 HG21 ILE A 139 11.161 -13.661 -3.408 1.00 13.23 H new ATOM 0 HG22 ILE A 139 11.584 -14.641 -4.832 1.00 13.23 H new ATOM 0 HG23 ILE A 139 12.546 -14.777 -3.341 1.00 13.23 H new ATOM 0 HD11 ILE A 139 12.763 -10.943 -1.682 1.00 62.22 H new ATOM 0 HD12 ILE A 139 11.756 -10.846 -3.147 1.00 62.22 H new ATOM 0 HD13 ILE A 139 11.668 -12.282 -2.099 1.00 62.22 H new ATOM 2169 N PRO A 140 13.919 -12.294 -7.359 1.00 41.54 N ATOM 2170 CA PRO A 140 14.329 -11.294 -8.349 1.00 11.02 C ATOM 2171 C PRO A 140 14.125 -9.869 -7.845 1.00 73.02 C ATOM 2172 O PRO A 140 13.400 -9.641 -6.877 1.00 70.34 O ATOM 2173 CB PRO A 140 13.416 -11.577 -9.544 1.00 22.14 C ATOM 2174 CG PRO A 140 12.210 -12.227 -8.957 1.00 65.24 C ATOM 2175 CD PRO A 140 12.694 -13.007 -7.765 1.00 12.52 C ATOM 0 HA PRO A 140 15.391 -11.365 -8.585 1.00 11.02 H new ATOM 0 HB2 PRO A 140 13.154 -10.658 -10.068 1.00 22.14 H new ATOM 0 HB3 PRO A 140 13.904 -12.229 -10.269 1.00 22.14 H new ATOM 0 HG2 PRO A 140 11.471 -11.482 -8.661 1.00 65.24 H new ATOM 0 HG3 PRO A 140 11.729 -12.883 -9.683 1.00 65.24 H new ATOM 0 HD2 PRO A 140 11.953 -13.019 -6.966 1.00 12.52 H new ATOM 0 HD3 PRO A 140 12.901 -14.046 -8.023 1.00 12.52 H new ATOM 2183 N TYR A 141 14.770 -8.914 -8.506 1.00 72.20 N ATOM 2184 CA TYR A 141 14.660 -7.512 -8.123 1.00 43.33 C ATOM 2185 C TYR A 141 14.366 -6.639 -9.340 1.00 24.15 C ATOM 2186 O TYR A 141 15.249 -6.379 -10.159 1.00 13.15 O ATOM 2187 CB TYR A 141 15.949 -7.048 -7.437 1.00 33.14 C ATOM 2188 CG TYR A 141 15.995 -5.561 -7.159 1.00 43.44 C ATOM 2189 CD1 TYR A 141 15.135 -4.980 -6.236 1.00 53.21 C ATOM 2190 CD2 TYR A 141 16.900 -4.740 -7.821 1.00 5.34 C ATOM 2191 CE1 TYR A 141 15.174 -3.622 -5.981 1.00 30.51 C ATOM 2192 CE2 TYR A 141 16.946 -3.382 -7.570 1.00 53.31 C ATOM 2193 CZ TYR A 141 16.082 -2.828 -6.649 1.00 30.33 C ATOM 2194 OH TYR A 141 16.123 -1.476 -6.398 1.00 22.42 O ATOM 0 H TYR A 141 15.374 -9.086 -9.310 1.00 72.20 H new ATOM 0 HA TYR A 141 13.831 -7.412 -7.422 1.00 43.33 H new ATOM 0 HB2 TYR A 141 16.063 -7.587 -6.497 1.00 33.14 H new ATOM 0 HB3 TYR A 141 16.799 -7.317 -8.063 1.00 33.14 H new ATOM 0 HD1 TYR A 141 14.424 -5.599 -5.709 1.00 53.21 H new ATOM 0 HD2 TYR A 141 17.578 -5.170 -8.543 1.00 5.34 H new ATOM 0 HE1 TYR A 141 14.497 -3.185 -5.262 1.00 30.51 H new ATOM 0 HE2 TYR A 141 17.655 -2.757 -8.093 1.00 53.31 H new ATOM 0 HH TYR A 141 15.878 -1.309 -5.464 1.00 22.42 H new ATOM 2204 N ILE A 142 13.119 -6.191 -9.452 1.00 30.44 N ATOM 2205 CA ILE A 142 12.706 -5.348 -10.566 1.00 12.33 C ATOM 2206 C ILE A 142 12.464 -3.913 -10.107 1.00 52.43 C ATOM 2207 O ILE A 142 12.064 -3.674 -8.968 1.00 54.20 O ATOM 2208 CB ILE A 142 11.421 -5.886 -11.226 1.00 52.13 C ATOM 2209 CG1 ILE A 142 11.555 -7.385 -11.516 1.00 52.12 C ATOM 2210 CG2 ILE A 142 11.122 -5.116 -12.502 1.00 65.41 C ATOM 2211 CD1 ILE A 142 10.574 -8.241 -10.744 1.00 64.04 C ATOM 0 H ILE A 142 12.377 -6.399 -8.783 1.00 30.44 H new ATOM 0 HA ILE A 142 13.516 -5.363 -11.295 1.00 12.33 H new ATOM 0 HB ILE A 142 10.589 -5.745 -10.536 1.00 52.13 H new ATOM 0 HG12 ILE A 142 11.411 -7.555 -12.583 1.00 52.12 H new ATOM 0 HG13 ILE A 142 12.569 -7.704 -11.277 1.00 52.12 H new ATOM 0 HG21 ILE A 142 10.212 -5.506 -12.958 1.00 65.41 H new ATOM 0 HG22 ILE A 142 10.986 -4.060 -12.267 1.00 65.41 H new ATOM 0 HG23 ILE A 142 11.953 -5.228 -13.198 1.00 65.41 H new ATOM 0 HD11 ILE A 142 10.727 -9.290 -10.999 1.00 64.04 H new ATOM 0 HD12 ILE A 142 10.732 -8.101 -9.675 1.00 64.04 H new ATOM 0 HD13 ILE A 142 9.556 -7.950 -11.001 1.00 64.04 H new ATOM 2223 N GLU A 143 12.709 -2.961 -11.001 1.00 31.22 N ATOM 2224 CA GLU A 143 12.516 -1.550 -10.690 1.00 13.41 C ATOM 2225 C GLU A 143 11.463 -0.935 -11.606 1.00 2.41 C ATOM 2226 O GLU A 143 11.501 -1.117 -12.822 1.00 62.32 O ATOM 2227 CB GLU A 143 13.836 -0.789 -10.827 1.00 21.31 C ATOM 2228 CG GLU A 143 14.985 -1.418 -10.055 1.00 25.03 C ATOM 2229 CD GLU A 143 15.994 -2.097 -10.961 1.00 52.34 C ATOM 2230 OE1 GLU A 143 15.684 -3.189 -11.482 1.00 21.34 O ATOM 2231 OE2 GLU A 143 17.094 -1.536 -11.151 1.00 53.34 O ATOM 0 H GLU A 143 13.042 -3.142 -11.948 1.00 31.22 H new ATOM 0 HA GLU A 143 12.168 -1.473 -9.660 1.00 13.41 H new ATOM 0 HB2 GLU A 143 14.106 -0.733 -11.882 1.00 21.31 H new ATOM 0 HB3 GLU A 143 13.693 0.234 -10.480 1.00 21.31 H new ATOM 0 HG2 GLU A 143 15.488 -0.649 -9.469 1.00 25.03 H new ATOM 0 HG3 GLU A 143 14.587 -2.147 -9.349 1.00 25.03 H new ATOM 2238 N THR A 144 10.520 -0.207 -11.014 1.00 12.23 N ATOM 2239 CA THR A 144 9.457 0.430 -11.782 1.00 41.05 C ATOM 2240 C THR A 144 9.135 1.814 -11.227 1.00 2.11 C ATOM 2241 O THR A 144 9.763 2.274 -10.274 1.00 31.24 O ATOM 2242 CB THR A 144 8.197 -0.440 -11.770 1.00 23.52 C ATOM 2243 OG1 THR A 144 7.510 -0.310 -10.537 1.00 55.02 O ATOM 2244 CG2 THR A 144 8.483 -1.911 -11.983 1.00 64.02 C ATOM 0 H THR A 144 10.471 -0.044 -10.008 1.00 12.23 H new ATOM 0 HA THR A 144 9.805 0.542 -12.809 1.00 41.05 H new ATOM 0 HB THR A 144 7.590 -0.081 -12.601 1.00 23.52 H new ATOM 0 HG1 THR A 144 6.707 -0.872 -10.549 1.00 55.02 H new ATOM 0 HG21 THR A 144 7.548 -2.470 -11.963 1.00 64.02 H new ATOM 0 HG22 THR A 144 8.969 -2.051 -12.949 1.00 64.02 H new ATOM 0 HG23 THR A 144 9.139 -2.273 -11.191 1.00 64.02 H new ATOM 2252 N SER A 145 8.150 2.469 -11.831 1.00 33.42 N ATOM 2253 CA SER A 145 7.738 3.800 -11.399 1.00 63.23 C ATOM 2254 C SER A 145 6.241 3.998 -11.619 1.00 62.25 C ATOM 2255 O SER A 145 5.743 3.839 -12.733 1.00 34.25 O ATOM 2256 CB SER A 145 8.522 4.873 -12.157 1.00 52.02 C ATOM 2257 OG SER A 145 8.467 4.654 -13.555 1.00 72.01 O ATOM 0 H SER A 145 7.622 2.100 -12.622 1.00 33.42 H new ATOM 0 HA SER A 145 7.950 3.893 -10.334 1.00 63.23 H new ATOM 0 HB2 SER A 145 8.116 5.857 -11.924 1.00 52.02 H new ATOM 0 HB3 SER A 145 9.561 4.870 -11.826 1.00 52.02 H new ATOM 0 HG SER A 145 8.133 5.461 -14.000 1.00 72.01 H new ATOM 2263 N ALA A 146 5.529 4.338 -10.552 1.00 74.12 N ATOM 2264 CA ALA A 146 4.090 4.554 -10.631 1.00 41.22 C ATOM 2265 C ALA A 146 3.763 5.850 -11.369 1.00 23.43 C ATOM 2266 O ALA A 146 2.746 5.944 -12.056 1.00 62.11 O ATOM 2267 CB ALA A 146 3.483 4.567 -9.237 1.00 54.33 C ATOM 0 H ALA A 146 5.925 4.470 -9.621 1.00 74.12 H new ATOM 0 HA ALA A 146 3.656 3.730 -11.197 1.00 41.22 H new ATOM 0 HB1 ALA A 146 2.408 4.729 -9.310 1.00 54.33 H new ATOM 0 HB2 ALA A 146 3.674 3.612 -8.748 1.00 54.33 H new ATOM 0 HB3 ALA A 146 3.932 5.370 -8.652 1.00 54.33 H new ATOM 2273 N LYS A 147 4.628 6.848 -11.217 1.00 33.14 N ATOM 2274 CA LYS A 147 4.427 8.140 -11.865 1.00 25.34 C ATOM 2275 C LYS A 147 4.827 8.086 -13.336 1.00 2.21 C ATOM 2276 O LYS A 147 4.071 8.509 -14.209 1.00 52.24 O ATOM 2277 CB LYS A 147 5.229 9.226 -11.145 1.00 13.10 C ATOM 2278 CG LYS A 147 4.836 10.639 -11.545 1.00 14.30 C ATOM 2279 CD LYS A 147 3.635 11.126 -10.752 1.00 40.52 C ATOM 2280 CE LYS A 147 3.622 12.641 -10.636 1.00 45.32 C ATOM 2281 NZ LYS A 147 3.555 13.301 -11.969 1.00 2.42 N ATOM 0 H LYS A 147 5.474 6.787 -10.651 1.00 33.14 H new ATOM 0 HA LYS A 147 3.366 8.382 -11.808 1.00 25.34 H new ATOM 0 HB2 LYS A 147 5.096 9.111 -10.069 1.00 13.10 H new ATOM 0 HB3 LYS A 147 6.289 9.080 -11.352 1.00 13.10 H new ATOM 0 HG2 LYS A 147 5.678 11.312 -11.383 1.00 14.30 H new ATOM 0 HG3 LYS A 147 4.606 10.667 -12.610 1.00 14.30 H new ATOM 0 HD2 LYS A 147 2.718 10.789 -11.235 1.00 40.52 H new ATOM 0 HD3 LYS A 147 3.652 10.684 -9.756 1.00 40.52 H new ATOM 0 HE2 LYS A 147 2.768 12.951 -10.034 1.00 45.32 H new ATOM 0 HE3 LYS A 147 4.518 12.972 -10.112 1.00 45.32 H new ATOM 0 HZ1 LYS A 147 3.429 14.326 -11.843 1.00 2.42 H new ATOM 0 HZ2 LYS A 147 4.437 13.122 -12.490 1.00 2.42 H new ATOM 0 HZ3 LYS A 147 2.752 12.917 -12.507 1.00 2.42 H new ATOM 2295 N THR A 148 6.021 7.566 -13.604 1.00 12.14 N ATOM 2296 CA THR A 148 6.520 7.463 -14.972 1.00 21.52 C ATOM 2297 C THR A 148 5.949 6.235 -15.678 1.00 11.42 C ATOM 2298 O THR A 148 5.891 6.188 -16.907 1.00 35.20 O ATOM 2299 CB THR A 148 8.050 7.406 -14.980 1.00 13.42 C ATOM 2300 OG1 THR A 148 8.554 7.183 -13.675 1.00 72.13 O ATOM 2301 CG2 THR A 148 8.692 8.671 -15.509 1.00 63.24 C ATOM 0 H THR A 148 6.660 7.210 -12.894 1.00 12.14 H new ATOM 0 HA THR A 148 6.193 8.351 -15.513 1.00 21.52 H new ATOM 0 HB THR A 148 8.303 6.581 -15.646 1.00 13.42 H new ATOM 0 HG1 THR A 148 9.457 6.806 -13.733 1.00 72.13 H new ATOM 0 HG21 THR A 148 9.777 8.565 -15.488 1.00 63.24 H new ATOM 0 HG22 THR A 148 8.364 8.844 -16.534 1.00 63.24 H new ATOM 0 HG23 THR A 148 8.398 9.516 -14.886 1.00 63.24 H new ATOM 2309 N ARG A 149 5.534 5.241 -14.898 1.00 61.22 N ATOM 2310 CA ARG A 149 4.976 4.015 -15.460 1.00 71.15 C ATOM 2311 C ARG A 149 6.008 3.305 -16.331 1.00 73.30 C ATOM 2312 O ARG A 149 5.840 3.191 -17.545 1.00 72.13 O ATOM 2313 CB ARG A 149 3.722 4.329 -16.279 1.00 60.31 C ATOM 2314 CG ARG A 149 2.447 4.362 -15.452 1.00 62.34 C ATOM 2315 CD ARG A 149 1.914 2.962 -15.194 1.00 25.34 C ATOM 2316 NE ARG A 149 1.720 2.213 -16.432 1.00 74.01 N ATOM 2317 CZ ARG A 149 0.686 2.391 -17.251 1.00 11.00 C ATOM 2318 NH1 ARG A 149 -0.247 3.293 -16.968 1.00 41.23 N ATOM 2319 NH2 ARG A 149 0.584 1.666 -18.357 1.00 32.11 N ATOM 0 H ARG A 149 5.573 5.260 -13.879 1.00 61.22 H new ATOM 0 HA ARG A 149 4.703 3.354 -14.638 1.00 71.15 H new ATOM 0 HB2 ARG A 149 3.851 5.293 -16.770 1.00 60.31 H new ATOM 0 HB3 ARG A 149 3.616 3.582 -17.066 1.00 60.31 H new ATOM 0 HG2 ARG A 149 2.641 4.859 -14.502 1.00 62.34 H new ATOM 0 HG3 ARG A 149 1.691 4.951 -15.971 1.00 62.34 H new ATOM 0 HD2 ARG A 149 2.608 2.423 -14.549 1.00 25.34 H new ATOM 0 HD3 ARG A 149 0.967 3.028 -14.658 1.00 25.34 H new ATOM 0 HE ARG A 149 2.417 1.513 -16.684 1.00 74.01 H new ATOM 0 HH11 ARG A 149 -0.173 3.854 -16.119 1.00 41.23 H new ATOM 0 HH12 ARG A 149 -1.037 3.425 -17.600 1.00 41.23 H new ATOM 0 HH21 ARG A 149 1.298 0.972 -18.580 1.00 32.11 H new ATOM 0 HH22 ARG A 149 -0.208 1.802 -18.985 1.00 32.11 H new ATOM 2333 N GLN A 150 7.078 2.830 -15.700 1.00 30.12 N ATOM 2334 CA GLN A 150 8.142 2.135 -16.416 1.00 25.43 C ATOM 2335 C GLN A 150 8.348 0.730 -15.861 1.00 31.11 C ATOM 2336 O GLN A 150 8.576 0.550 -14.665 1.00 34.51 O ATOM 2337 CB GLN A 150 9.446 2.930 -16.322 1.00 52.50 C ATOM 2338 CG GLN A 150 10.611 2.282 -17.054 1.00 21.04 C ATOM 2339 CD GLN A 150 11.331 3.248 -17.973 1.00 40.35 C ATOM 2340 OE1 GLN A 150 11.222 3.160 -19.197 1.00 61.15 O ATOM 2341 NE2 GLN A 150 12.074 4.176 -17.385 1.00 13.34 N ATOM 0 H GLN A 150 7.231 2.914 -14.695 1.00 30.12 H new ATOM 0 HA GLN A 150 7.848 2.050 -17.462 1.00 25.43 H new ATOM 0 HB2 GLN A 150 9.283 3.928 -16.729 1.00 52.50 H new ATOM 0 HB3 GLN A 150 9.711 3.053 -15.272 1.00 52.50 H new ATOM 0 HG2 GLN A 150 11.317 1.885 -16.325 1.00 21.04 H new ATOM 0 HG3 GLN A 150 10.244 1.437 -17.636 1.00 21.04 H new ATOM 0 HE21 GLN A 150 12.135 4.211 -16.367 1.00 13.34 H new ATOM 0 HE22 GLN A 150 12.584 4.854 -17.950 1.00 13.34 H new ATOM 2350 N GLY A 151 8.269 -0.265 -16.740 1.00 61.44 N ATOM 2351 CA GLY A 151 8.453 -1.644 -16.324 1.00 50.24 C ATOM 2352 C GLY A 151 7.535 -2.042 -15.183 1.00 54.04 C ATOM 2353 O GLY A 151 7.839 -2.966 -14.429 1.00 71.21 O ATOM 0 H GLY A 151 8.080 -0.140 -17.735 1.00 61.44 H new ATOM 0 HA2 GLY A 151 8.274 -2.302 -17.174 1.00 50.24 H new ATOM 0 HA3 GLY A 151 9.489 -1.791 -16.019 1.00 50.24 H new ATOM 2357 N VAL A 152 6.411 -1.345 -15.056 1.00 24.40 N ATOM 2358 CA VAL A 152 5.450 -1.633 -13.998 1.00 21.44 C ATOM 2359 C VAL A 152 4.954 -3.074 -14.085 1.00 41.31 C ATOM 2360 O VAL A 152 5.049 -3.833 -13.121 1.00 51.12 O ATOM 2361 CB VAL A 152 4.240 -0.682 -14.063 1.00 42.43 C ATOM 2362 CG1 VAL A 152 3.346 -0.870 -12.847 1.00 0.22 C ATOM 2363 CG2 VAL A 152 4.704 0.762 -14.177 1.00 62.24 C ATOM 0 H VAL A 152 6.143 -0.577 -15.672 1.00 24.40 H new ATOM 0 HA VAL A 152 5.968 -1.485 -13.051 1.00 21.44 H new ATOM 0 HB VAL A 152 3.657 -0.924 -14.952 1.00 42.43 H new ATOM 0 HG11 VAL A 152 2.497 -0.190 -12.911 1.00 0.22 H new ATOM 0 HG12 VAL A 152 2.986 -1.898 -12.816 1.00 0.22 H new ATOM 0 HG13 VAL A 152 3.914 -0.657 -11.941 1.00 0.22 H new ATOM 0 HG21 VAL A 152 3.837 1.420 -14.222 1.00 62.24 H new ATOM 0 HG22 VAL A 152 5.310 1.019 -13.308 1.00 62.24 H new ATOM 0 HG23 VAL A 152 5.298 0.883 -15.083 1.00 62.24 H new ATOM 2373 N GLU A 153 4.425 -3.443 -15.246 1.00 43.32 N ATOM 2374 CA GLU A 153 3.914 -4.791 -15.460 1.00 31.22 C ATOM 2375 C GLU A 153 5.037 -5.821 -15.370 1.00 24.23 C ATOM 2376 O GLU A 153 4.813 -6.966 -14.978 1.00 22.43 O ATOM 2377 CB GLU A 153 3.225 -4.888 -16.822 1.00 44.32 C ATOM 2378 CG GLU A 153 2.202 -3.791 -17.067 1.00 20.51 C ATOM 2379 CD GLU A 153 1.065 -4.244 -17.963 1.00 30.54 C ATOM 2380 OE1 GLU A 153 1.345 -4.720 -19.082 1.00 64.14 O ATOM 2381 OE2 GLU A 153 -0.105 -4.122 -17.544 1.00 1.24 O ATOM 0 H GLU A 153 4.339 -2.827 -16.054 1.00 43.32 H new ATOM 0 HA GLU A 153 3.187 -5.005 -14.677 1.00 31.22 H new ATOM 0 HB2 GLU A 153 3.981 -4.849 -17.606 1.00 44.32 H new ATOM 0 HB3 GLU A 153 2.732 -5.857 -16.902 1.00 44.32 H new ATOM 0 HG2 GLU A 153 1.796 -3.458 -16.112 1.00 20.51 H new ATOM 0 HG3 GLU A 153 2.697 -2.932 -17.520 1.00 20.51 H new ATOM 2388 N ASP A 154 6.247 -5.406 -15.736 1.00 54.01 N ATOM 2389 CA ASP A 154 7.405 -6.292 -15.696 1.00 54.41 C ATOM 2390 C ASP A 154 7.638 -6.820 -14.285 1.00 13.22 C ATOM 2391 O ASP A 154 8.094 -7.948 -14.100 1.00 73.33 O ATOM 2392 CB ASP A 154 8.653 -5.557 -16.188 1.00 71.44 C ATOM 2393 CG ASP A 154 8.570 -5.191 -17.657 1.00 1.12 C ATOM 2394 OD1 ASP A 154 7.649 -5.684 -18.342 1.00 52.10 O ATOM 2395 OD2 ASP A 154 9.428 -4.412 -18.123 1.00 42.34 O ATOM 0 H ASP A 154 6.450 -4.462 -16.063 1.00 54.01 H new ATOM 0 HA ASP A 154 7.206 -7.138 -16.354 1.00 54.41 H new ATOM 0 HB2 ASP A 154 8.793 -4.651 -15.599 1.00 71.44 H new ATOM 0 HB3 ASP A 154 9.529 -6.184 -16.022 1.00 71.44 H new ATOM 2400 N ALA A 155 7.325 -5.995 -13.292 1.00 50.03 N ATOM 2401 CA ALA A 155 7.502 -6.376 -11.897 1.00 21.42 C ATOM 2402 C ALA A 155 6.473 -7.420 -11.475 1.00 25.00 C ATOM 2403 O ALA A 155 6.787 -8.350 -10.732 1.00 53.44 O ATOM 2404 CB ALA A 155 7.410 -5.147 -11.002 1.00 62.25 C ATOM 0 H ALA A 155 6.947 -5.057 -13.428 1.00 50.03 H new ATOM 0 HA ALA A 155 8.492 -6.820 -11.789 1.00 21.42 H new ATOM 0 HB1 ALA A 155 7.544 -5.444 -9.962 1.00 62.25 H new ATOM 0 HB2 ALA A 155 8.188 -4.436 -11.279 1.00 62.25 H new ATOM 0 HB3 ALA A 155 6.432 -4.681 -11.124 1.00 62.25 H new ATOM 2410 N PHE A 156 5.244 -7.257 -11.952 1.00 24.03 N ATOM 2411 CA PHE A 156 4.166 -8.185 -11.624 1.00 52.45 C ATOM 2412 C PHE A 156 4.343 -9.515 -12.347 1.00 32.42 C ATOM 2413 O PHE A 156 4.268 -10.580 -11.735 1.00 55.44 O ATOM 2414 CB PHE A 156 2.814 -7.571 -11.987 1.00 73.53 C ATOM 2415 CG PHE A 156 2.328 -6.558 -10.990 1.00 53.03 C ATOM 2416 CD1 PHE A 156 1.944 -6.950 -9.718 1.00 25.15 C ATOM 2417 CD2 PHE A 156 2.255 -5.216 -11.326 1.00 52.23 C ATOM 2418 CE1 PHE A 156 1.497 -6.021 -8.797 1.00 14.42 C ATOM 2419 CE2 PHE A 156 1.810 -4.283 -10.410 1.00 14.32 C ATOM 2420 CZ PHE A 156 1.429 -4.686 -9.144 1.00 32.44 C ATOM 0 H PHE A 156 4.969 -6.491 -12.567 1.00 24.03 H new ATOM 0 HA PHE A 156 4.200 -8.374 -10.551 1.00 52.45 H new ATOM 0 HB2 PHE A 156 2.890 -7.098 -12.966 1.00 73.53 H new ATOM 0 HB3 PHE A 156 2.074 -8.367 -12.074 1.00 73.53 H new ATOM 0 HD1 PHE A 156 1.994 -7.993 -9.443 1.00 25.15 H new ATOM 0 HD2 PHE A 156 2.549 -4.896 -12.315 1.00 52.23 H new ATOM 0 HE1 PHE A 156 1.202 -6.339 -7.808 1.00 14.42 H new ATOM 0 HE2 PHE A 156 1.760 -3.239 -10.683 1.00 14.32 H new ATOM 0 HZ PHE A 156 1.079 -3.958 -8.427 1.00 32.44 H new ATOM 2430 N TYR A 157 4.576 -9.447 -13.655 1.00 72.42 N ATOM 2431 CA TYR A 157 4.759 -10.648 -14.464 1.00 32.24 C ATOM 2432 C TYR A 157 5.848 -11.546 -13.881 1.00 45.14 C ATOM 2433 O TYR A 157 5.794 -12.767 -14.017 1.00 30.11 O ATOM 2434 CB TYR A 157 5.108 -10.272 -15.905 1.00 21.54 C ATOM 2435 CG TYR A 157 3.968 -9.620 -16.657 1.00 73.51 C ATOM 2436 CD1 TYR A 157 2.667 -10.095 -16.536 1.00 24.33 C ATOM 2437 CD2 TYR A 157 4.194 -8.531 -17.488 1.00 54.05 C ATOM 2438 CE1 TYR A 157 1.624 -9.502 -17.222 1.00 61.13 C ATOM 2439 CE2 TYR A 157 3.156 -7.933 -18.178 1.00 22.03 C ATOM 2440 CZ TYR A 157 1.874 -8.420 -18.041 1.00 33.52 C ATOM 2441 OH TYR A 157 0.838 -7.828 -18.726 1.00 0.03 O ATOM 0 H TYR A 157 4.642 -8.573 -14.177 1.00 72.42 H new ATOM 0 HA TYR A 157 3.820 -11.201 -14.457 1.00 32.24 H new ATOM 0 HB2 TYR A 157 5.961 -9.594 -15.898 1.00 21.54 H new ATOM 0 HB3 TYR A 157 5.418 -11.169 -16.440 1.00 21.54 H new ATOM 0 HD1 TYR A 157 2.468 -10.941 -15.895 1.00 24.33 H new ATOM 0 HD2 TYR A 157 5.197 -8.145 -17.597 1.00 54.05 H new ATOM 0 HE1 TYR A 157 0.619 -9.883 -17.118 1.00 61.13 H new ATOM 0 HE2 TYR A 157 3.349 -7.088 -18.822 1.00 22.03 H new ATOM 0 HH TYR A 157 1.017 -6.870 -18.826 1.00 0.03 H new ATOM 2451 N THR A 158 6.835 -10.935 -13.229 1.00 32.11 N ATOM 2452 CA THR A 158 7.926 -11.683 -12.628 1.00 25.30 C ATOM 2453 C THR A 158 7.398 -12.689 -11.609 1.00 53.31 C ATOM 2454 O THR A 158 7.869 -13.823 -11.538 1.00 11.01 O ATOM 2455 CB THR A 158 8.910 -10.723 -11.963 1.00 73.43 C ATOM 2456 OG1 THR A 158 9.498 -9.863 -12.923 1.00 32.33 O ATOM 2457 CG2 THR A 158 10.031 -11.426 -11.234 1.00 62.15 C ATOM 0 H THR A 158 6.898 -9.924 -13.106 1.00 32.11 H new ATOM 0 HA THR A 158 8.442 -12.235 -13.414 1.00 25.30 H new ATOM 0 HB THR A 158 8.320 -10.163 -11.238 1.00 73.43 H new ATOM 0 HG1 THR A 158 8.807 -9.289 -13.315 1.00 32.33 H new ATOM 0 HG21 THR A 158 10.693 -10.686 -10.785 1.00 62.15 H new ATOM 0 HG22 THR A 158 9.615 -12.062 -10.453 1.00 62.15 H new ATOM 0 HG23 THR A 158 10.595 -12.038 -11.938 1.00 62.15 H new ATOM 2465 N LEU A 159 6.411 -12.265 -10.824 1.00 1.00 N ATOM 2466 CA LEU A 159 5.816 -13.131 -9.814 1.00 21.55 C ATOM 2467 C LEU A 159 5.181 -14.355 -10.466 1.00 22.21 C ATOM 2468 O LEU A 159 5.293 -15.470 -9.960 1.00 14.20 O ATOM 2469 CB LEU A 159 4.767 -12.364 -9.006 1.00 42.21 C ATOM 2470 CG LEU A 159 4.127 -13.153 -7.861 1.00 15.43 C ATOM 2471 CD1 LEU A 159 5.186 -13.621 -6.876 1.00 54.44 C ATOM 2472 CD2 LEU A 159 3.077 -12.308 -7.156 1.00 1.14 C ATOM 0 H LEU A 159 6.008 -11.329 -10.869 1.00 1.00 H new ATOM 0 HA LEU A 159 6.605 -13.464 -9.140 1.00 21.55 H new ATOM 0 HB2 LEU A 159 5.231 -11.468 -8.594 1.00 42.21 H new ATOM 0 HB3 LEU A 159 3.980 -12.033 -9.683 1.00 42.21 H new ATOM 0 HG LEU A 159 3.638 -14.032 -8.280 1.00 15.43 H new ATOM 0 HD11 LEU A 159 4.711 -14.180 -6.070 1.00 54.44 H new ATOM 0 HD12 LEU A 159 5.902 -14.263 -7.389 1.00 54.44 H new ATOM 0 HD13 LEU A 159 5.705 -12.757 -6.462 1.00 54.44 H new ATOM 0 HD21 LEU A 159 2.632 -12.884 -6.345 1.00 1.14 H new ATOM 0 HD22 LEU A 159 3.544 -11.411 -6.750 1.00 1.14 H new ATOM 0 HD23 LEU A 159 2.302 -12.023 -7.867 1.00 1.14 H new ATOM 2484 N VAL A 160 4.520 -14.134 -11.599 1.00 11.11 N ATOM 2485 CA VAL A 160 3.869 -15.213 -12.333 1.00 42.41 C ATOM 2486 C VAL A 160 4.834 -16.369 -12.583 1.00 75.43 C ATOM 2487 O VAL A 160 4.502 -17.531 -12.344 1.00 64.54 O ATOM 2488 CB VAL A 160 3.319 -14.721 -13.687 1.00 30.22 C ATOM 2489 CG1 VAL A 160 2.505 -15.812 -14.362 1.00 70.23 C ATOM 2490 CG2 VAL A 160 2.487 -13.461 -13.502 1.00 31.04 C ATOM 0 H VAL A 160 4.421 -13.214 -12.029 1.00 11.11 H new ATOM 0 HA VAL A 160 3.041 -15.559 -11.715 1.00 42.41 H new ATOM 0 HB VAL A 160 4.163 -14.478 -14.333 1.00 30.22 H new ATOM 0 HG11 VAL A 160 2.126 -15.445 -15.316 1.00 70.23 H new ATOM 0 HG12 VAL A 160 3.136 -16.684 -14.533 1.00 70.23 H new ATOM 0 HG13 VAL A 160 1.668 -16.091 -13.722 1.00 70.23 H new ATOM 0 HG21 VAL A 160 2.108 -13.130 -14.469 1.00 31.04 H new ATOM 0 HG22 VAL A 160 1.650 -13.672 -12.837 1.00 31.04 H new ATOM 0 HG23 VAL A 160 3.106 -12.677 -13.067 1.00 31.04 H new ATOM 2500 N ARG A 161 6.029 -16.041 -13.060 1.00 73.13 N ATOM 2501 CA ARG A 161 7.045 -17.050 -13.338 1.00 3.20 C ATOM 2502 C ARG A 161 7.545 -17.685 -12.044 1.00 11.21 C ATOM 2503 O ARG A 161 7.965 -18.842 -12.030 1.00 55.13 O ATOM 2504 CB ARG A 161 8.215 -16.428 -14.101 1.00 42.14 C ATOM 2505 CG ARG A 161 7.815 -15.817 -15.434 1.00 70.12 C ATOM 2506 CD ARG A 161 9.016 -15.242 -16.167 1.00 1.01 C ATOM 2507 NE ARG A 161 8.685 -14.007 -16.874 1.00 70.43 N ATOM 2508 CZ ARG A 161 9.593 -13.134 -17.307 1.00 4.25 C ATOM 2509 NH1 ARG A 161 10.886 -13.358 -17.110 1.00 45.12 N ATOM 2510 NH2 ARG A 161 9.205 -12.037 -17.941 1.00 64.24 N ATOM 0 H ARG A 161 6.319 -15.084 -13.262 1.00 73.13 H new ATOM 0 HA ARG A 161 6.593 -17.828 -13.953 1.00 3.20 H new ATOM 0 HB2 ARG A 161 8.674 -15.658 -13.481 1.00 42.14 H new ATOM 0 HB3 ARG A 161 8.973 -17.192 -14.274 1.00 42.14 H new ATOM 0 HG2 ARG A 161 7.338 -16.576 -16.054 1.00 70.12 H new ATOM 0 HG3 ARG A 161 7.078 -15.031 -15.269 1.00 70.12 H new ATOM 0 HD2 ARG A 161 9.817 -15.048 -15.454 1.00 1.01 H new ATOM 0 HD3 ARG A 161 9.393 -15.977 -16.878 1.00 1.01 H new ATOM 0 HE ARG A 161 7.701 -13.801 -17.046 1.00 70.43 H new ATOM 0 HH11 ARG A 161 11.189 -14.202 -16.625 1.00 45.12 H new ATOM 0 HH12 ARG A 161 11.577 -12.686 -17.444 1.00 45.12 H new ATOM 0 HH21 ARG A 161 8.212 -11.862 -18.097 1.00 64.24 H new ATOM 0 HH22 ARG A 161 9.899 -11.367 -18.273 1.00 64.24 H new ATOM 2524 N GLU A 162 7.496 -16.920 -10.957 1.00 61.42 N ATOM 2525 CA GLU A 162 7.944 -17.407 -9.658 1.00 41.44 C ATOM 2526 C GLU A 162 6.952 -18.415 -9.085 1.00 4.13 C ATOM 2527 O GLU A 162 7.330 -19.521 -8.699 1.00 3.44 O ATOM 2528 CB GLU A 162 8.124 -16.240 -8.686 1.00 72.41 C ATOM 2529 CG GLU A 162 9.515 -15.631 -8.721 1.00 2.41 C ATOM 2530 CD GLU A 162 10.555 -16.514 -8.058 1.00 64.34 C ATOM 2531 OE1 GLU A 162 10.413 -16.793 -6.849 1.00 52.31 O ATOM 2532 OE2 GLU A 162 11.511 -16.926 -8.748 1.00 71.01 O ATOM 0 H GLU A 162 7.150 -15.960 -10.951 1.00 61.42 H new ATOM 0 HA GLU A 162 8.903 -17.906 -9.795 1.00 41.44 H new ATOM 0 HB2 GLU A 162 7.392 -15.467 -8.919 1.00 72.41 H new ATOM 0 HB3 GLU A 162 7.912 -16.585 -7.674 1.00 72.41 H new ATOM 0 HG2 GLU A 162 9.803 -15.452 -9.757 1.00 2.41 H new ATOM 0 HG3 GLU A 162 9.496 -14.662 -8.223 1.00 2.41 H new ATOM 2539 N ILE A 163 5.681 -18.026 -9.032 1.00 53.51 N ATOM 2540 CA ILE A 163 4.637 -18.890 -8.511 1.00 71.23 C ATOM 2541 C ILE A 163 4.577 -20.206 -9.281 1.00 21.33 C ATOM 2542 O ILE A 163 4.540 -21.284 -8.689 1.00 54.43 O ATOM 2543 CB ILE A 163 3.267 -18.196 -8.580 1.00 5.23 C ATOM 2544 CG1 ILE A 163 3.314 -16.866 -7.828 1.00 24.43 C ATOM 2545 CG2 ILE A 163 2.189 -19.098 -8.007 1.00 32.20 C ATOM 2546 CD1 ILE A 163 1.969 -16.183 -7.722 1.00 31.43 C ATOM 0 H ILE A 163 5.353 -17.113 -9.346 1.00 53.51 H new ATOM 0 HA ILE A 163 4.879 -19.101 -7.469 1.00 71.23 H new ATOM 0 HB ILE A 163 3.025 -17.996 -9.624 1.00 5.23 H new ATOM 0 HG12 ILE A 163 3.704 -17.039 -6.825 1.00 24.43 H new ATOM 0 HG13 ILE A 163 4.013 -16.198 -8.331 1.00 24.43 H new ATOM 0 HG21 ILE A 163 1.225 -18.593 -8.063 1.00 32.20 H new ATOM 0 HG22 ILE A 163 2.147 -20.024 -8.580 1.00 32.20 H new ATOM 0 HG23 ILE A 163 2.420 -19.325 -6.966 1.00 32.20 H new ATOM 0 HD11 ILE A 163 2.079 -15.246 -7.176 1.00 31.43 H new ATOM 0 HD12 ILE A 163 1.585 -15.978 -8.721 1.00 31.43 H new ATOM 0 HD13 ILE A 163 1.272 -16.832 -7.192 1.00 31.43 H new ATOM 2558 N ARG A 164 4.571 -20.109 -10.608 1.00 61.22 N ATOM 2559 CA ARG A 164 4.518 -21.291 -11.462 1.00 1.21 C ATOM 2560 C ARG A 164 5.681 -22.231 -11.159 1.00 74.21 C ATOM 2561 O ARG A 164 5.525 -23.451 -11.167 1.00 43.35 O ATOM 2562 CB ARG A 164 4.549 -20.881 -12.937 1.00 73.42 C ATOM 2563 CG ARG A 164 3.169 -20.702 -13.547 1.00 1.22 C ATOM 2564 CD ARG A 164 3.230 -19.897 -14.836 1.00 13.24 C ATOM 2565 NE ARG A 164 3.880 -20.639 -15.914 1.00 71.42 N ATOM 2566 CZ ARG A 164 3.992 -20.188 -17.162 1.00 64.12 C ATOM 2567 NH1 ARG A 164 3.501 -18.999 -17.491 1.00 62.30 N ATOM 2568 NH2 ARG A 164 4.598 -20.926 -18.081 1.00 3.25 N ATOM 0 H ARG A 164 4.602 -19.224 -11.115 1.00 61.22 H new ATOM 0 HA ARG A 164 3.585 -21.817 -11.258 1.00 1.21 H new ATOM 0 HB2 ARG A 164 5.104 -19.948 -13.035 1.00 73.42 H new ATOM 0 HB3 ARG A 164 5.093 -21.636 -13.504 1.00 73.42 H new ATOM 0 HG2 ARG A 164 2.729 -21.679 -13.747 1.00 1.22 H new ATOM 0 HG3 ARG A 164 2.517 -20.199 -12.833 1.00 1.22 H new ATOM 0 HD2 ARG A 164 2.220 -19.624 -15.141 1.00 13.24 H new ATOM 0 HD3 ARG A 164 3.771 -18.968 -14.658 1.00 13.24 H new ATOM 0 HE ARG A 164 4.271 -21.556 -15.698 1.00 71.42 H new ATOM 0 HH11 ARG A 164 3.036 -18.427 -16.787 1.00 62.30 H new ATOM 0 HH12 ARG A 164 3.589 -18.658 -18.448 1.00 62.30 H new ATOM 0 HH21 ARG A 164 4.978 -21.839 -17.832 1.00 3.25 H new ATOM 0 HH22 ARG A 164 4.684 -20.581 -19.037 1.00 3.25 H new ATOM 2582 N GLN A 165 6.846 -21.651 -10.889 1.00 4.25 N ATOM 2583 CA GLN A 165 8.036 -22.433 -10.578 1.00 51.01 C ATOM 2584 C GLN A 165 7.841 -23.227 -9.290 1.00 10.45 C ATOM 2585 O GLN A 165 8.397 -24.313 -9.127 1.00 14.02 O ATOM 2586 CB GLN A 165 9.254 -21.517 -10.450 1.00 24.15 C ATOM 2587 CG GLN A 165 10.094 -21.442 -11.716 1.00 75.32 C ATOM 2588 CD GLN A 165 11.582 -21.486 -11.431 1.00 23.41 C ATOM 2589 OE1 GLN A 165 12.345 -22.132 -12.149 1.00 65.23 O ATOM 2590 NE2 GLN A 165 12.003 -20.796 -10.376 1.00 40.54 N ATOM 0 H GLN A 165 6.991 -20.641 -10.879 1.00 4.25 H new ATOM 0 HA GLN A 165 8.205 -23.135 -11.394 1.00 51.01 H new ATOM 0 HB2 GLN A 165 8.918 -20.514 -10.187 1.00 24.15 H new ATOM 0 HB3 GLN A 165 9.879 -21.870 -9.629 1.00 24.15 H new ATOM 0 HG2 GLN A 165 9.829 -22.270 -12.373 1.00 75.32 H new ATOM 0 HG3 GLN A 165 9.857 -20.522 -12.251 1.00 75.32 H new ATOM 0 HE21 GLN A 165 11.335 -20.274 -9.808 1.00 40.54 H new ATOM 0 HE22 GLN A 165 12.994 -20.788 -10.134 1.00 40.54 H new ATOM 2599 N HIS A 166 7.048 -22.675 -8.377 1.00 4.20 N ATOM 2600 CA HIS A 166 6.778 -23.329 -7.102 1.00 4.25 C ATOM 2601 C HIS A 166 5.634 -24.327 -7.235 1.00 33.10 C ATOM 2602 O HIS A 166 4.601 -23.966 -7.838 1.00 38.02 O ATOM 2603 CB HIS A 166 6.441 -22.288 -6.034 1.00 61.22 C ATOM 2604 CG HIS A 166 6.195 -22.876 -4.679 1.00 5.21 C ATOM 2605 ND1 HIS A 166 4.947 -23.268 -4.244 1.00 21.13 N ATOM 2606 CD2 HIS A 166 7.047 -23.140 -3.659 1.00 4.33 C ATOM 2607 CE1 HIS A 166 5.041 -23.746 -3.016 1.00 51.31 C ATOM 2608 NE2 HIS A 166 6.304 -23.680 -2.638 1.00 62.43 N ATOM 2609 OXT HIS A 166 5.779 -25.464 -6.737 1.00 11.01 O ATOM 0 H HIS A 166 6.581 -21.776 -8.497 1.00 4.20 H new ATOM 0 HA HIS A 166 7.675 -23.871 -6.802 1.00 4.25 H new ATOM 0 HB2 HIS A 166 7.259 -21.571 -5.966 1.00 61.22 H new ATOM 0 HB3 HIS A 166 5.556 -21.733 -6.346 1.00 61.22 H new ATOM 0 HD2 HIS A 166 8.112 -22.959 -3.651 1.00 4.33 H new ATOM 0 HE1 HIS A 166 4.223 -24.126 -2.422 1.00 51.31 H new ATOM 0 HE2 HIS A 166 6.669 -23.981 -1.734 1.00 62.43 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 219 -1.648 4.259 2.398 1.00 61.42 P HETATM 2620 O1G GNP A 219 -2.864 3.907 3.393 1.00 45.23 O HETATM 2621 O2G GNP A 219 -1.166 2.855 1.776 1.00 60.04 O HETATM 2622 O3G GNP A 219 -0.554 5.001 3.065 1.00 72.35 O HETATM 2623 N3B GNP A 219 -2.304 5.075 1.161 1.00 44.33 N HETATM 2624 PB GNP A 219 -1.126 5.515 0.138 1.00 61.33 P HETATM 2625 O1B GNP A 219 0.090 5.766 0.945 1.00 74.45 O HETATM 2626 O2B GNP A 219 -1.055 4.510 -0.946 1.00 4.14 O HETATM 2627 O3A GNP A 219 -1.668 6.913 -0.450 1.00 63.34 O HETATM 2628 PA GNP A 219 -1.643 7.196 -2.035 1.00 2.42 P HETATM 2629 O1A GNP A 219 -2.920 7.839 -2.417 1.00 25.53 O HETATM 2630 O2A GNP A 219 -1.259 5.936 -2.708 1.00 71.20 O HETATM 2631 O5' GNP A 219 -0.446 8.262 -2.180 1.00 33.15 O HETATM 2632 C5' GNP A 219 0.878 7.828 -2.505 1.00 23.02 C HETATM 2633 C4' GNP A 219 1.854 9.005 -2.462 1.00 60.25 C HETATM 2634 O4' GNP A 219 3.140 8.575 -2.947 1.00 43.23 O HETATM 2635 C3' GNP A 219 1.384 10.058 -3.467 1.00 74.30 C HETATM 2636 O3' GNP A 219 2.061 11.299 -3.252 1.00 31.32 O HETATM 2637 C2' GNP A 219 1.872 9.395 -4.752 1.00 55.13 C HETATM 2638 O2' GNP A 219 1.903 10.357 -5.810 1.00 32.43 O HETATM 2639 C1' GNP A 219 3.294 9.084 -4.284 1.00 31.13 C HETATM 2640 N9 GNP A 219 3.946 8.094 -5.169 1.00 15.30 N HETATM 2641 C8 GNP A 219 3.822 6.772 -5.077 1.00 72.02 C HETATM 2642 N7 GNP A 219 4.558 6.194 -6.022 1.00 72.35 N HETATM 2643 C5 GNP A 219 5.154 7.152 -6.726 1.00 4.54 C HETATM 2644 C6 GNP A 219 6.019 7.132 -7.814 1.00 65.51 C HETATM 2645 O6 GNP A 219 6.376 6.065 -8.311 1.00 51.42 O HETATM 2646 N1 GNP A 219 6.471 8.349 -8.336 1.00 12.12 N HETATM 2647 C2 GNP A 219 6.041 9.546 -7.749 1.00 3.43 C HETATM 2648 N2 GNP A 219 6.455 10.710 -8.240 1.00 51.43 N HETATM 2649 N3 GNP A 219 5.208 9.524 -6.698 1.00 32.53 N HETATM 2650 C4 GNP A 219 4.763 8.369 -6.182 1.00 45.42 C HETATM 0 HO3' GNP A 219 2.430 11.622 -4.101 1.00 31.32 H new HETATM 0 HO2' GNP A 219 1.544 9.955 -6.629 1.00 32.43 H new HETATM 0 HNB3 GNP A 219 -3.297 5.279 1.045 1.00 44.33 H new HETATM 0 HN22 GNP A 219 6.143 11.583 -7.814 1.00 51.43 H new HETATM 0 HN21 GNP A 219 7.084 10.730 -9.042 1.00 51.43 H new HETATM 0 H5'2 GNP A 219 0.886 7.378 -3.498 1.00 23.02 H new HETATM 0 H5'1 GNP A 219 1.197 7.058 -1.803 1.00 23.02 H new HETATM 0 HN1 GNP A 219 7.106 8.364 -9.134 1.00 12.12 H new HETATM 0 H8 GNP A 219 3.213 6.246 -4.342 1.00 72.02 H new HETATM 0 H4' GNP A 219 1.906 9.384 -1.441 1.00 60.25 H new HETATM 0 H3' GNP A 219 0.323 10.304 -3.434 1.00 74.30 H new HETATM 0 H2' GNP A 219 1.286 8.557 -5.131 1.00 55.13 H new HETATM 0 H1' GNP A 219 3.935 9.965 -4.311 1.00 31.13 H new HETATM 2664 MG MG A 246 -1.726 2.573 -0.142 1.00 12.52 MG HETATM 2665 O HOH A 252 0.205 1.502 -0.420 1.00 62.42 O HETATM 2668 O HOH A 258 -3.818 3.520 0.101 1.00 50.55 O HETATM 2671 O HOH A 264 -2.558 0.515 0.275 1.00 24.44 O