USER MOD reduce.3.24.130724 H: found=0, std=0, add=1332, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1332 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 77 HIS : no HD1:sc= -2.4! C(o=-4.7!,f=-6!) USER MOD Set 1.2: A 104 SER OG : rot 155:sc= -2.26! USER MOD Set 2.1: A 97 THR OG1 : rot 132:sc= -3.33 USER MOD Set 2.2: A 134 THR OG1 : rot 180:sc= 0.763 USER MOD Set 3.1: A 74 THR OG1 : rot 180:sc= -0.235 USER MOD Set 3.2: A 75 HIS : no HD1:sc= -0.401 K(o=-0.64,f=0.11) USER MOD Set 4.1: A 65 THR OG1 : rot -100:sc= 1.01 USER MOD Set 4.2: A 68 GLN : amide:sc= -0.0481 K(o=0.96,f=-2.6) USER MOD Set 5.1: A 23 ASN : amide:sc= -5.51! C(o=-13!,f=-9.5!) USER MOD Set 5.2: A 26 GLN : amide:sc= -7.67! C(o=-13!,f=-18!) USER MOD Single : A 1 MET CE :methyl -178:sc= 0 (180deg=-0.00193) USER MOD Single : A 1 MET N :NH3+ 169:sc= 0.295 (180deg=-0.171!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0142 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.695 K(o=-0.69,f=-5.7!) USER MOD Single : A 11 GLN : amide:sc= -2.22 K(o=-2.2,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= -7.77! C(o=-7.8!,f=-4.9!) USER MOD Single : A 15 LYS NZ :NH3+ 151:sc= 0.367 (180deg=0.1) USER MOD Single : A 18 HIS : no HD1:sc= -2.49! C(o=-2.5!,f=-1.3!) USER MOD Single : A 19 MET CE :methyl -144:sc= -0.306 (180deg=-1.34!) USER MOD Single : A 20 TYR OH : rot -15:sc= -1.9 USER MOD Single : A 29 LYS NZ :NH3+ -103:sc= -3.89 (180deg=-5.88!) USER MOD Single : A 30 THR OG1 : rot 83:sc= 0.948 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 169:sc= 0 (180deg=-0.237) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -0.04 X(o=-0.04,f=-0.036) USER MOD Single : A 44 ASN : amide:sc= -11.2! C(o=-11!,f=-8!) USER MOD Single : A 46 MET CE :methyl 148:sc= -0.242 (180deg=-1.33!) USER MOD Single : A 51 SER OG : rot 76:sc= 0.463 USER MOD Single : A 55 ASN : amide:sc= -9.96! C(o=-10!,f=-9.6!) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -9.53! C(o=-9.5!,f=-6.7!) USER MOD Single : A 83 SER OG : rot 8:sc= 0.17 USER MOD Single : A 86 ASN : amide:sc= -6.34! C(o=-6.3!,f=-7.3!) USER MOD Single : A 89 SER OG : rot -29:sc= 0.213 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 158:sc= -0.0285 (180deg=-0.597) USER MOD Single : A 96 GLN : amide:sc= -6.3! C(o=-6.3!,f=-6!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.0112 X(o=-0.011,f=-0.46) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ -134:sc= -3.7! (180deg=-6.49!) USER MOD Single : A 117 ASN : amide:sc= -2.86 K(o=-2.9,f=-1) USER MOD Single : A 118 ASN : amide:sc= -3.31! C(o=-3.3!,f=-4.3!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 165:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl -158:sc= -1.73 (180deg=-2.19) USER MOD Single : A 135 TYR OH : rot 150:sc= 0 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc=0.000991 USER MOD Single : A 149 ASN : amide:sc= -0.481 K(o=-0.48,f=-1.1!) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 30.749 -4.660 19.750 1.00 7.42 N ATOM 2 CA MET A 1 30.218 -5.217 18.473 1.00 6.88 C ATOM 3 C MET A 1 30.361 -4.171 17.365 1.00 6.08 C ATOM 4 O MET A 1 31.314 -4.177 16.612 1.00 5.93 O ATOM 5 CB MET A 1 28.740 -5.582 18.650 1.00 7.42 C ATOM 6 CG MET A 1 28.621 -6.905 19.412 1.00 8.20 C ATOM 7 SD MET A 1 29.495 -6.772 20.998 1.00 8.61 S ATOM 8 CE MET A 1 30.805 -7.982 20.675 1.00 8.84 C ATOM 0 H1 MET A 1 30.487 -5.287 20.538 1.00 7.42 H new ATOM 0 H2 MET A 1 31.785 -4.589 19.694 1.00 7.42 H new ATOM 0 H3 MET A 1 30.346 -3.715 19.911 1.00 7.42 H new ATOM 0 HA MET A 1 30.780 -6.111 18.202 1.00 6.88 H new ATOM 0 HB2 MET A 1 28.223 -4.791 19.193 1.00 7.42 H new ATOM 0 HB3 MET A 1 28.258 -5.668 17.676 1.00 7.42 H new ATOM 0 HG2 MET A 1 27.572 -7.146 19.582 1.00 8.20 H new ATOM 0 HG3 MET A 1 29.042 -7.717 18.820 1.00 8.20 H new ATOM 0 HE1 MET A 1 31.439 -8.076 21.557 1.00 8.84 H new ATOM 0 HE2 MET A 1 30.358 -8.949 20.445 1.00 8.84 H new ATOM 0 HE3 MET A 1 31.407 -7.650 19.829 1.00 8.84 H new ATOM 20 N LYS A 2 29.419 -3.274 17.256 1.00 5.82 N ATOM 21 CA LYS A 2 29.502 -2.232 16.194 1.00 5.21 C ATOM 22 C LYS A 2 29.791 -2.902 14.848 1.00 4.23 C ATOM 23 O LYS A 2 30.828 -2.696 14.251 1.00 4.16 O ATOM 24 CB LYS A 2 30.626 -1.250 16.528 1.00 5.54 C ATOM 25 CG LYS A 2 30.558 -0.051 15.579 1.00 6.03 C ATOM 26 CD LYS A 2 31.517 1.037 16.063 1.00 6.58 C ATOM 27 CE LYS A 2 31.325 2.299 15.221 1.00 7.24 C ATOM 28 NZ LYS A 2 32.385 3.290 15.562 1.00 7.51 N ATOM 0 H LYS A 2 28.596 -3.218 17.856 1.00 5.82 H new ATOM 0 HA LYS A 2 28.556 -1.693 16.137 1.00 5.21 H new ATOM 0 HB2 LYS A 2 30.535 -0.915 17.561 1.00 5.54 H new ATOM 0 HB3 LYS A 2 31.593 -1.744 16.437 1.00 5.54 H new ATOM 0 HG2 LYS A 2 30.821 -0.359 14.567 1.00 6.03 H new ATOM 0 HG3 LYS A 2 29.540 0.338 15.539 1.00 6.03 H new ATOM 0 HD2 LYS A 2 31.333 1.257 17.114 1.00 6.58 H new ATOM 0 HD3 LYS A 2 32.547 0.689 15.986 1.00 6.58 H new ATOM 0 HE2 LYS A 2 31.371 2.052 14.160 1.00 7.24 H new ATOM 0 HE3 LYS A 2 30.340 2.726 15.406 1.00 7.24 H new ATOM 0 HZ1 LYS A 2 32.255 4.148 14.990 1.00 7.51 H new ATOM 0 HZ2 LYS A 2 32.321 3.534 16.571 1.00 7.51 H new ATOM 0 HZ3 LYS A 2 33.320 2.880 15.364 1.00 7.51 H new ATOM 42 N LEU A 3 28.881 -3.706 14.369 1.00 3.66 N ATOM 43 CA LEU A 3 29.103 -4.390 13.065 1.00 2.91 C ATOM 44 C LEU A 3 29.441 -3.357 11.990 1.00 2.80 C ATOM 45 O LEU A 3 29.506 -2.172 12.253 1.00 3.35 O ATOM 46 CB LEU A 3 27.843 -5.146 12.667 1.00 2.80 C ATOM 47 CG LEU A 3 27.368 -6.007 13.835 1.00 2.89 C ATOM 48 CD1 LEU A 3 26.239 -6.903 13.349 1.00 3.42 C ATOM 49 CD2 LEU A 3 28.516 -6.879 14.361 1.00 3.02 C ATOM 0 H LEU A 3 27.994 -3.918 14.825 1.00 3.66 H new ATOM 0 HA LEU A 3 29.932 -5.091 13.163 1.00 2.91 H new ATOM 0 HB2 LEU A 3 27.061 -4.443 12.380 1.00 2.80 H new ATOM 0 HB3 LEU A 3 28.043 -5.773 11.798 1.00 2.80 H new ATOM 0 HG LEU A 3 27.023 -5.361 14.642 1.00 2.89 H new ATOM 0 HD11 LEU A 3 25.888 -7.525 14.172 1.00 3.42 H new ATOM 0 HD12 LEU A 3 25.417 -6.287 12.984 1.00 3.42 H new ATOM 0 HD13 LEU A 3 26.602 -7.540 12.542 1.00 3.42 H new ATOM 0 HD21 LEU A 3 28.160 -7.486 15.193 1.00 3.02 H new ATOM 0 HD22 LEU A 3 28.873 -7.530 13.563 1.00 3.02 H new ATOM 0 HD23 LEU A 3 29.332 -6.241 14.701 1.00 3.02 H new ATOM 61 N SER A 4 29.657 -3.795 10.780 1.00 2.40 N ATOM 62 CA SER A 4 29.991 -2.837 9.688 1.00 2.30 C ATOM 63 C SER A 4 28.707 -2.182 9.174 1.00 2.02 C ATOM 64 O SER A 4 27.613 -2.607 9.488 1.00 1.96 O ATOM 65 CB SER A 4 30.673 -3.586 8.543 1.00 2.43 C ATOM 66 OG SER A 4 31.219 -2.645 7.627 1.00 3.00 O ATOM 0 H SER A 4 29.617 -4.775 10.500 1.00 2.40 H new ATOM 0 HA SER A 4 30.663 -2.069 10.072 1.00 2.30 H new ATOM 0 HB2 SER A 4 31.461 -4.231 8.933 1.00 2.43 H new ATOM 0 HB3 SER A 4 29.955 -4.231 8.036 1.00 2.43 H new ATOM 0 HG SER A 4 31.659 -3.121 6.892 1.00 3.00 H new ATOM 72 N GLU A 5 28.833 -1.150 8.386 1.00 1.94 N ATOM 73 CA GLU A 5 27.621 -0.468 7.851 1.00 1.75 C ATOM 74 C GLU A 5 26.844 -1.436 6.957 1.00 1.75 C ATOM 75 O GLU A 5 25.638 -1.354 6.837 1.00 1.68 O ATOM 76 CB GLU A 5 28.044 0.754 7.034 1.00 1.75 C ATOM 77 CG GLU A 5 26.810 1.581 6.670 1.00 1.64 C ATOM 78 CD GLU A 5 27.221 2.731 5.748 1.00 2.19 C ATOM 79 OE1 GLU A 5 27.879 2.462 4.756 1.00 2.85 O ATOM 80 OE2 GLU A 5 26.871 3.860 6.049 1.00 2.57 O ATOM 0 H GLU A 5 29.723 -0.749 8.089 1.00 1.94 H new ATOM 0 HA GLU A 5 26.987 -0.150 8.679 1.00 1.75 H new ATOM 0 HB2 GLU A 5 28.745 1.361 7.606 1.00 1.75 H new ATOM 0 HB3 GLU A 5 28.562 0.437 6.129 1.00 1.75 H new ATOM 0 HG2 GLU A 5 26.070 0.951 6.176 1.00 1.64 H new ATOM 0 HG3 GLU A 5 26.343 1.974 7.573 1.00 1.64 H new ATOM 87 N TYR A 6 27.526 -2.354 6.330 1.00 1.86 N ATOM 88 CA TYR A 6 26.828 -3.328 5.444 1.00 1.91 C ATOM 89 C TYR A 6 25.642 -3.939 6.193 1.00 1.85 C ATOM 90 O TYR A 6 24.576 -4.126 5.640 1.00 1.88 O ATOM 91 CB TYR A 6 27.801 -4.439 5.040 1.00 2.08 C ATOM 92 CG TYR A 6 28.785 -3.906 4.026 1.00 2.35 C ATOM 93 CD1 TYR A 6 29.905 -3.181 4.450 1.00 3.27 C ATOM 94 CD2 TYR A 6 28.577 -4.137 2.660 1.00 2.28 C ATOM 95 CE1 TYR A 6 30.816 -2.687 3.510 1.00 3.69 C ATOM 96 CE2 TYR A 6 29.488 -3.643 1.720 1.00 2.77 C ATOM 97 CZ TYR A 6 30.608 -2.918 2.145 1.00 3.31 C ATOM 98 OH TYR A 6 31.507 -2.431 1.218 1.00 3.89 O ATOM 0 H TYR A 6 28.537 -2.472 6.393 1.00 1.86 H new ATOM 0 HA TYR A 6 26.470 -2.815 4.551 1.00 1.91 H new ATOM 0 HB2 TYR A 6 28.332 -4.808 5.917 1.00 2.08 H new ATOM 0 HB3 TYR A 6 27.252 -5.282 4.621 1.00 2.08 H new ATOM 0 HD1 TYR A 6 30.066 -3.003 5.503 1.00 3.27 H new ATOM 0 HD2 TYR A 6 27.713 -4.697 2.332 1.00 2.28 H new ATOM 0 HE1 TYR A 6 31.680 -2.127 3.837 1.00 3.69 H new ATOM 0 HE2 TYR A 6 29.327 -3.821 0.667 1.00 2.77 H new ATOM 0 HH TYR A 6 31.215 -2.681 0.316 1.00 3.89 H new ATOM 108 N GLY A 7 25.819 -4.254 7.447 1.00 1.81 N ATOM 109 CA GLY A 7 24.703 -4.855 8.230 1.00 1.78 C ATOM 110 C GLY A 7 23.559 -3.847 8.352 1.00 1.60 C ATOM 111 O GLY A 7 22.399 -4.195 8.258 1.00 1.57 O ATOM 0 H GLY A 7 26.689 -4.121 7.963 1.00 1.81 H new ATOM 0 HA2 GLY A 7 24.350 -5.763 7.741 1.00 1.78 H new ATOM 0 HA3 GLY A 7 25.055 -5.143 9.221 1.00 1.78 H new ATOM 115 N LEU A 8 23.876 -2.598 8.564 1.00 1.51 N ATOM 116 CA LEU A 8 22.804 -1.572 8.694 1.00 1.36 C ATOM 117 C LEU A 8 22.114 -1.378 7.343 1.00 1.25 C ATOM 118 O LEU A 8 20.933 -1.104 7.274 1.00 1.18 O ATOM 119 CB LEU A 8 23.415 -0.247 9.157 1.00 1.36 C ATOM 120 CG LEU A 8 24.374 -0.500 10.325 1.00 1.50 C ATOM 121 CD1 LEU A 8 24.825 0.841 10.909 1.00 1.58 C ATOM 122 CD2 LEU A 8 23.663 -1.317 11.413 1.00 1.55 C ATOM 0 H LEU A 8 24.829 -2.245 8.652 1.00 1.51 H new ATOM 0 HA LEU A 8 22.071 -1.906 9.428 1.00 1.36 H new ATOM 0 HB2 LEU A 8 23.948 0.226 8.332 1.00 1.36 H new ATOM 0 HB3 LEU A 8 22.627 0.440 9.464 1.00 1.36 H new ATOM 0 HG LEU A 8 25.241 -1.056 9.967 1.00 1.50 H new ATOM 0 HD11 LEU A 8 25.508 0.665 11.740 1.00 1.58 H new ATOM 0 HD12 LEU A 8 25.334 1.421 10.139 1.00 1.58 H new ATOM 0 HD13 LEU A 8 23.955 1.394 11.264 1.00 1.58 H new ATOM 0 HD21 LEU A 8 24.349 -1.494 12.241 1.00 1.55 H new ATOM 0 HD22 LEU A 8 22.794 -0.766 11.773 1.00 1.55 H new ATOM 0 HD23 LEU A 8 23.340 -2.272 10.998 1.00 1.55 H new ATOM 134 N GLN A 9 22.837 -1.523 6.267 1.00 1.30 N ATOM 135 CA GLN A 9 22.207 -1.353 4.928 1.00 1.24 C ATOM 136 C GLN A 9 21.151 -2.441 4.737 1.00 1.25 C ATOM 137 O GLN A 9 19.968 -2.170 4.665 1.00 1.17 O ATOM 138 CB GLN A 9 23.270 -1.491 3.826 1.00 1.39 C ATOM 139 CG GLN A 9 24.348 -0.392 3.966 1.00 1.39 C ATOM 140 CD GLN A 9 24.928 -0.042 2.589 1.00 1.56 C ATOM 141 OE1 GLN A 9 24.220 -0.036 1.602 1.00 1.97 O ATOM 142 NE2 GLN A 9 26.195 0.251 2.484 1.00 1.91 N ATOM 0 H GLN A 9 23.831 -1.751 6.257 1.00 1.30 H new ATOM 0 HA GLN A 9 21.750 -0.365 4.866 1.00 1.24 H new ATOM 0 HB2 GLN A 9 23.736 -2.474 3.885 1.00 1.39 H new ATOM 0 HB3 GLN A 9 22.797 -1.421 2.847 1.00 1.39 H new ATOM 0 HG2 GLN A 9 23.914 0.497 4.423 1.00 1.39 H new ATOM 0 HG3 GLN A 9 25.144 -0.735 4.628 1.00 1.39 H new ATOM 0 HE21 GLN A 9 26.790 0.246 3.313 1.00 1.91 H new ATOM 0 HE22 GLN A 9 26.591 0.485 1.573 1.00 1.91 H new ATOM 151 N LEU A 10 21.571 -3.674 4.659 1.00 1.40 N ATOM 152 CA LEU A 10 20.597 -4.785 4.477 1.00 1.46 C ATOM 153 C LEU A 10 19.480 -4.651 5.514 1.00 1.38 C ATOM 154 O LEU A 10 18.317 -4.837 5.217 1.00 1.34 O ATOM 155 CB LEU A 10 21.320 -6.121 4.661 1.00 1.70 C ATOM 156 CG LEU A 10 20.316 -7.280 4.634 1.00 1.74 C ATOM 157 CD1 LEU A 10 19.425 -7.191 3.386 1.00 1.94 C ATOM 158 CD2 LEU A 10 21.093 -8.593 4.606 1.00 2.17 C ATOM 0 H LEU A 10 22.549 -3.960 4.714 1.00 1.40 H new ATOM 0 HA LEU A 10 20.166 -4.742 3.477 1.00 1.46 H new ATOM 0 HB2 LEU A 10 22.059 -6.253 3.871 1.00 1.70 H new ATOM 0 HB3 LEU A 10 21.861 -6.122 5.607 1.00 1.70 H new ATOM 0 HG LEU A 10 19.681 -7.229 5.519 1.00 1.74 H new ATOM 0 HD11 LEU A 10 18.719 -8.021 3.383 1.00 1.94 H new ATOM 0 HD12 LEU A 10 18.877 -6.249 3.396 1.00 1.94 H new ATOM 0 HD13 LEU A 10 20.046 -7.240 2.491 1.00 1.94 H new ATOM 0 HD21 LEU A 10 20.394 -9.429 4.587 1.00 2.17 H new ATOM 0 HD22 LEU A 10 21.722 -8.625 3.716 1.00 2.17 H new ATOM 0 HD23 LEU A 10 21.719 -8.664 5.495 1.00 2.17 H new ATOM 170 N GLN A 11 19.827 -4.325 6.731 1.00 1.41 N ATOM 171 CA GLN A 11 18.791 -4.174 7.794 1.00 1.38 C ATOM 172 C GLN A 11 17.621 -3.342 7.262 1.00 1.21 C ATOM 173 O GLN A 11 16.468 -3.656 7.489 1.00 1.20 O ATOM 174 CB GLN A 11 19.409 -3.470 9.005 1.00 1.41 C ATOM 175 CG GLN A 11 18.400 -3.444 10.154 1.00 1.67 C ATOM 176 CD GLN A 11 19.047 -2.806 11.385 1.00 1.75 C ATOM 177 OE1 GLN A 11 18.569 -2.970 12.490 1.00 1.90 O ATOM 178 NE2 GLN A 11 20.122 -2.081 11.240 1.00 1.75 N ATOM 0 H GLN A 11 20.786 -4.156 7.035 1.00 1.41 H new ATOM 0 HA GLN A 11 18.427 -5.158 8.088 1.00 1.38 H new ATOM 0 HB2 GLN A 11 20.316 -3.988 9.316 1.00 1.41 H new ATOM 0 HB3 GLN A 11 19.698 -2.453 8.739 1.00 1.41 H new ATOM 0 HG2 GLN A 11 17.514 -2.880 9.862 1.00 1.67 H new ATOM 0 HG3 GLN A 11 18.071 -4.457 10.386 1.00 1.67 H new ATOM 0 HE21 GLN A 11 20.523 -1.943 10.312 1.00 1.75 H new ATOM 0 HE22 GLN A 11 20.561 -1.652 12.054 1.00 1.75 H new ATOM 187 N GLU A 12 17.908 -2.281 6.556 1.00 1.09 N ATOM 188 CA GLU A 12 16.813 -1.427 6.009 1.00 0.94 C ATOM 189 C GLU A 12 15.763 -2.315 5.336 1.00 0.93 C ATOM 190 O GLU A 12 14.575 -2.127 5.506 1.00 0.91 O ATOM 191 CB GLU A 12 17.390 -0.442 4.981 1.00 0.83 C ATOM 192 CG GLU A 12 16.417 0.736 4.778 1.00 1.14 C ATOM 193 CD GLU A 12 16.671 1.809 5.842 1.00 1.75 C ATOM 194 OE1 GLU A 12 16.862 1.444 6.990 1.00 2.26 O ATOM 195 OE2 GLU A 12 16.675 2.977 5.488 1.00 2.47 O ATOM 0 H GLU A 12 18.853 -1.968 6.334 1.00 1.09 H new ATOM 0 HA GLU A 12 16.349 -0.868 6.822 1.00 0.94 H new ATOM 0 HB2 GLU A 12 18.357 -0.072 5.322 1.00 0.83 H new ATOM 0 HB3 GLU A 12 17.561 -0.951 4.033 1.00 0.83 H new ATOM 0 HG2 GLU A 12 16.548 1.160 3.782 1.00 1.14 H new ATOM 0 HG3 GLU A 12 15.387 0.384 4.842 1.00 1.14 H new ATOM 202 N LYS A 13 16.195 -3.282 4.574 1.00 1.00 N ATOM 203 CA LYS A 13 15.226 -4.182 3.892 1.00 1.04 C ATOM 204 C LYS A 13 14.278 -4.792 4.927 1.00 1.07 C ATOM 205 O LYS A 13 13.094 -4.917 4.698 1.00 1.01 O ATOM 206 CB LYS A 13 15.984 -5.307 3.183 1.00 1.19 C ATOM 207 CG LYS A 13 15.028 -6.058 2.249 1.00 1.40 C ATOM 208 CD LYS A 13 15.791 -7.145 1.474 1.00 1.50 C ATOM 209 CE LYS A 13 15.931 -8.407 2.334 1.00 1.81 C ATOM 210 NZ LYS A 13 16.570 -9.487 1.529 1.00 2.31 N ATOM 0 H LYS A 13 17.178 -3.487 4.395 1.00 1.00 H new ATOM 0 HA LYS A 13 14.654 -3.608 3.163 1.00 1.04 H new ATOM 0 HB2 LYS A 13 16.817 -4.896 2.614 1.00 1.19 H new ATOM 0 HB3 LYS A 13 16.407 -5.993 3.916 1.00 1.19 H new ATOM 0 HG2 LYS A 13 14.223 -6.511 2.828 1.00 1.40 H new ATOM 0 HG3 LYS A 13 14.566 -5.360 1.551 1.00 1.40 H new ATOM 0 HD2 LYS A 13 15.263 -7.382 0.550 1.00 1.50 H new ATOM 0 HD3 LYS A 13 16.777 -6.777 1.192 1.00 1.50 H new ATOM 0 HE2 LYS A 13 16.532 -8.193 3.218 1.00 1.81 H new ATOM 0 HE3 LYS A 13 14.952 -8.731 2.685 1.00 1.81 H new ATOM 0 HZ1 LYS A 13 16.666 -10.344 2.111 1.00 2.31 H new ATOM 0 HZ2 LYS A 13 15.980 -9.697 0.699 1.00 2.31 H new ATOM 0 HZ3 LYS A 13 17.511 -9.175 1.215 1.00 2.31 H new ATOM 224 N GLN A 14 14.795 -5.182 6.060 1.00 1.23 N ATOM 225 CA GLN A 14 13.929 -5.800 7.106 1.00 1.31 C ATOM 226 C GLN A 14 12.952 -4.765 7.672 1.00 1.24 C ATOM 227 O GLN A 14 11.759 -4.842 7.454 1.00 1.26 O ATOM 228 CB GLN A 14 14.810 -6.348 8.239 1.00 1.48 C ATOM 229 CG GLN A 14 15.416 -7.692 7.821 1.00 1.51 C ATOM 230 CD GLN A 14 16.214 -7.514 6.529 1.00 1.81 C ATOM 231 OE1 GLN A 14 16.128 -8.326 5.631 1.00 2.53 O ATOM 232 NE2 GLN A 14 16.993 -6.476 6.398 1.00 1.95 N ATOM 0 H GLN A 14 15.781 -5.100 6.308 1.00 1.23 H new ATOM 0 HA GLN A 14 13.357 -6.612 6.656 1.00 1.31 H new ATOM 0 HB2 GLN A 14 15.603 -5.637 8.471 1.00 1.48 H new ATOM 0 HB3 GLN A 14 14.217 -6.472 9.145 1.00 1.48 H new ATOM 0 HG2 GLN A 14 16.064 -8.072 8.611 1.00 1.51 H new ATOM 0 HG3 GLN A 14 14.626 -8.429 7.674 1.00 1.51 H new ATOM 0 HE21 GLN A 14 17.065 -5.794 7.153 1.00 1.95 H new ATOM 0 HE22 GLN A 14 17.530 -6.346 5.541 1.00 1.95 H new ATOM 241 N LYS A 15 13.440 -3.813 8.416 1.00 1.20 N ATOM 242 CA LYS A 15 12.524 -2.797 9.012 1.00 1.17 C ATOM 243 C LYS A 15 11.599 -2.224 7.936 1.00 1.08 C ATOM 244 O LYS A 15 10.493 -1.809 8.219 1.00 1.14 O ATOM 245 CB LYS A 15 13.333 -1.663 9.654 1.00 1.11 C ATOM 246 CG LYS A 15 14.476 -1.238 8.726 1.00 1.30 C ATOM 247 CD LYS A 15 15.209 -0.016 9.318 1.00 1.41 C ATOM 248 CE LYS A 15 14.524 1.281 8.870 1.00 1.30 C ATOM 249 NZ LYS A 15 15.135 2.437 9.586 1.00 1.94 N ATOM 0 H LYS A 15 14.428 -3.693 8.638 1.00 1.20 H new ATOM 0 HA LYS A 15 11.922 -3.283 9.780 1.00 1.17 H new ATOM 0 HB2 LYS A 15 12.683 -0.812 9.856 1.00 1.11 H new ATOM 0 HB3 LYS A 15 13.736 -1.991 10.612 1.00 1.11 H new ATOM 0 HG2 LYS A 15 15.175 -2.064 8.595 1.00 1.30 H new ATOM 0 HG3 LYS A 15 14.083 -0.994 7.739 1.00 1.30 H new ATOM 0 HD2 LYS A 15 15.212 -0.077 10.406 1.00 1.41 H new ATOM 0 HD3 LYS A 15 16.250 -0.016 8.996 1.00 1.41 H new ATOM 0 HE2 LYS A 15 14.631 1.408 7.793 1.00 1.30 H new ATOM 0 HE3 LYS A 15 13.456 1.232 9.080 1.00 1.30 H new ATOM 0 HZ1 LYS A 15 15.066 3.288 8.993 1.00 1.94 H new ATOM 0 HZ2 LYS A 15 14.630 2.597 10.481 1.00 1.94 H new ATOM 0 HZ3 LYS A 15 16.135 2.233 9.784 1.00 1.94 H new ATOM 263 N LEU A 16 12.031 -2.195 6.704 1.00 0.97 N ATOM 264 CA LEU A 16 11.157 -1.643 5.628 1.00 0.93 C ATOM 265 C LEU A 16 10.176 -2.725 5.167 1.00 1.02 C ATOM 266 O LEU A 16 9.135 -2.435 4.612 1.00 1.14 O ATOM 267 CB LEU A 16 12.023 -1.183 4.447 1.00 0.81 C ATOM 268 CG LEU A 16 11.136 -0.713 3.280 1.00 0.78 C ATOM 269 CD1 LEU A 16 10.144 0.358 3.761 1.00 0.81 C ATOM 270 CD2 LEU A 16 12.025 -0.125 2.179 1.00 0.72 C ATOM 0 H LEU A 16 12.945 -2.527 6.397 1.00 0.97 H new ATOM 0 HA LEU A 16 10.598 -0.790 6.012 1.00 0.93 H new ATOM 0 HB2 LEU A 16 12.678 -0.372 4.763 1.00 0.81 H new ATOM 0 HB3 LEU A 16 12.664 -2.001 4.118 1.00 0.81 H new ATOM 0 HG LEU A 16 10.575 -1.564 2.893 1.00 0.78 H new ATOM 0 HD11 LEU A 16 9.523 0.681 2.925 1.00 0.81 H new ATOM 0 HD12 LEU A 16 9.510 -0.059 4.544 1.00 0.81 H new ATOM 0 HD13 LEU A 16 10.694 1.212 4.156 1.00 0.81 H new ATOM 0 HD21 LEU A 16 11.403 0.210 1.349 1.00 0.72 H new ATOM 0 HD22 LEU A 16 12.585 0.721 2.577 1.00 0.72 H new ATOM 0 HD23 LEU A 16 12.720 -0.887 1.827 1.00 0.72 H new ATOM 282 N ARG A 17 10.495 -3.971 5.396 1.00 1.06 N ATOM 283 CA ARG A 17 9.572 -5.063 4.973 1.00 1.19 C ATOM 284 C ARG A 17 8.430 -5.181 5.984 1.00 1.35 C ATOM 285 O ARG A 17 7.280 -4.946 5.668 1.00 1.71 O ATOM 286 CB ARG A 17 10.333 -6.390 4.909 1.00 1.29 C ATOM 287 CG ARG A 17 9.447 -7.454 4.259 1.00 1.36 C ATOM 288 CD ARG A 17 10.166 -8.804 4.277 1.00 1.41 C ATOM 289 NE ARG A 17 10.113 -9.378 5.651 1.00 2.00 N ATOM 290 CZ ARG A 17 10.386 -10.640 5.842 1.00 2.65 C ATOM 291 NH1 ARG A 17 10.704 -11.399 4.829 1.00 3.02 N ATOM 292 NH2 ARG A 17 10.341 -11.143 7.045 1.00 3.41 N ATOM 0 H ARG A 17 11.352 -4.279 5.856 1.00 1.06 H new ATOM 0 HA ARG A 17 9.168 -4.832 3.987 1.00 1.19 H new ATOM 0 HB2 ARG A 17 11.252 -6.267 4.336 1.00 1.29 H new ATOM 0 HB3 ARG A 17 10.622 -6.705 5.912 1.00 1.29 H new ATOM 0 HG2 ARG A 17 8.500 -7.528 4.793 1.00 1.36 H new ATOM 0 HG3 ARG A 17 9.213 -7.169 3.233 1.00 1.36 H new ATOM 0 HD2 ARG A 17 9.698 -9.487 3.568 1.00 1.41 H new ATOM 0 HD3 ARG A 17 11.202 -8.680 3.963 1.00 1.41 H new ATOM 0 HE ARG A 17 9.863 -8.785 6.442 1.00 2.00 H new ATOM 0 HH11 ARG A 17 10.739 -11.006 3.888 1.00 3.02 H new ATOM 0 HH12 ARG A 17 10.917 -12.385 4.978 1.00 3.02 H new ATOM 0 HH21 ARG A 17 10.092 -10.550 7.837 1.00 3.41 H new ATOM 0 HH22 ARG A 17 10.554 -12.129 7.194 1.00 3.41 H new ATOM 306 N HIS A 18 8.738 -5.542 7.200 1.00 1.32 N ATOM 307 CA HIS A 18 7.672 -5.673 8.233 1.00 1.46 C ATOM 308 C HIS A 18 6.920 -4.346 8.360 1.00 1.41 C ATOM 309 O HIS A 18 5.954 -4.236 9.088 1.00 1.58 O ATOM 310 CB HIS A 18 8.307 -6.028 9.579 1.00 1.56 C ATOM 311 CG HIS A 18 8.847 -7.431 9.525 1.00 1.74 C ATOM 312 ND1 HIS A 18 10.160 -7.705 9.168 1.00 1.79 N ATOM 313 CD2 HIS A 18 8.265 -8.648 9.781 1.00 1.97 C ATOM 314 CE1 HIS A 18 10.323 -9.041 9.218 1.00 2.01 C ATOM 315 NE2 HIS A 18 9.200 -9.659 9.586 1.00 2.12 N ATOM 0 H HIS A 18 9.683 -5.752 7.523 1.00 1.32 H new ATOM 0 HA HIS A 18 6.977 -6.460 7.940 1.00 1.46 H new ATOM 0 HB2 HIS A 18 9.109 -5.327 9.811 1.00 1.56 H new ATOM 0 HB3 HIS A 18 7.568 -5.942 10.376 1.00 1.56 H new ATOM 0 HD2 HIS A 18 7.240 -8.797 10.086 1.00 1.97 H new ATOM 0 HE1 HIS A 18 11.248 -9.549 8.989 1.00 2.01 H new ATOM 0 HE2 HIS A 18 9.057 -10.662 9.700 1.00 2.12 H new ATOM 324 N MET A 19 7.359 -3.338 7.658 1.00 1.30 N ATOM 325 CA MET A 19 6.673 -2.018 7.737 1.00 1.30 C ATOM 326 C MET A 19 5.198 -2.181 7.369 1.00 1.38 C ATOM 327 O MET A 19 4.370 -2.492 8.201 1.00 1.62 O ATOM 328 CB MET A 19 7.338 -1.042 6.762 1.00 1.25 C ATOM 329 CG MET A 19 6.589 0.308 6.766 1.00 1.97 C ATOM 330 SD MET A 19 7.772 1.660 6.524 1.00 2.14 S ATOM 331 CE MET A 19 8.679 1.479 8.083 1.00 1.24 C ATOM 0 H MET A 19 8.164 -3.372 7.032 1.00 1.30 H new ATOM 0 HA MET A 19 6.749 -1.630 8.753 1.00 1.30 H new ATOM 0 HB2 MET A 19 8.380 -0.889 7.043 1.00 1.25 H new ATOM 0 HB3 MET A 19 7.338 -1.464 5.757 1.00 1.25 H new ATOM 0 HG2 MET A 19 5.839 0.322 5.975 1.00 1.97 H new ATOM 0 HG3 MET A 19 6.060 0.439 7.710 1.00 1.97 H new ATOM 0 HE1 MET A 19 8.968 2.463 8.452 1.00 1.24 H new ATOM 0 HE2 MET A 19 8.043 0.988 8.819 1.00 1.24 H new ATOM 0 HE3 MET A 19 9.572 0.877 7.916 1.00 1.24 H new ATOM 341 N TYR A 20 4.863 -1.969 6.125 1.00 1.33 N ATOM 342 CA TYR A 20 3.441 -2.106 5.701 1.00 1.40 C ATOM 343 C TYR A 20 3.035 -3.581 5.735 1.00 1.44 C ATOM 344 O TYR A 20 1.944 -3.921 6.149 1.00 1.61 O ATOM 345 CB TYR A 20 3.279 -1.565 4.280 1.00 1.38 C ATOM 346 CG TYR A 20 3.746 -0.127 4.234 1.00 1.33 C ATOM 347 CD1 TYR A 20 3.040 0.858 4.937 1.00 1.58 C ATOM 348 CD2 TYR A 20 4.882 0.224 3.492 1.00 1.96 C ATOM 349 CE1 TYR A 20 3.468 2.190 4.898 1.00 1.66 C ATOM 350 CE2 TYR A 20 5.310 1.556 3.454 1.00 1.92 C ATOM 351 CZ TYR A 20 4.603 2.539 4.156 1.00 1.36 C ATOM 352 OH TYR A 20 5.025 3.852 4.118 1.00 1.43 O ATOM 0 H TYR A 20 5.513 -1.707 5.384 1.00 1.33 H new ATOM 0 HA TYR A 20 2.804 -1.540 6.381 1.00 1.40 H new ATOM 0 HB2 TYR A 20 3.857 -2.169 3.581 1.00 1.38 H new ATOM 0 HB3 TYR A 20 2.236 -1.630 3.971 1.00 1.38 H new ATOM 0 HD1 TYR A 20 2.165 0.589 5.510 1.00 1.58 H new ATOM 0 HD2 TYR A 20 5.427 -0.534 2.949 1.00 1.96 H new ATOM 0 HE1 TYR A 20 2.923 2.949 5.440 1.00 1.66 H new ATOM 0 HE2 TYR A 20 6.186 1.825 2.883 1.00 1.92 H new ATOM 0 HH TYR A 20 4.310 4.435 4.448 1.00 1.43 H new ATOM 362 N GLY A 21 3.907 -4.459 5.304 1.00 1.41 N ATOM 363 CA GLY A 21 3.588 -5.924 5.306 1.00 1.50 C ATOM 364 C GLY A 21 3.892 -6.513 3.927 1.00 1.35 C ATOM 365 O GLY A 21 3.024 -7.056 3.272 1.00 1.43 O ATOM 0 H GLY A 21 4.833 -4.223 4.948 1.00 1.41 H new ATOM 0 HA2 GLY A 21 4.176 -6.434 6.069 1.00 1.50 H new ATOM 0 HA3 GLY A 21 2.538 -6.078 5.556 1.00 1.50 H new ATOM 369 N VAL A 22 5.123 -6.422 3.487 1.00 1.18 N ATOM 370 CA VAL A 22 5.506 -6.986 2.149 1.00 1.08 C ATOM 371 C VAL A 22 6.176 -8.349 2.393 1.00 1.11 C ATOM 372 O VAL A 22 7.299 -8.429 2.847 1.00 1.19 O ATOM 373 CB VAL A 22 6.472 -6.005 1.403 1.00 0.93 C ATOM 374 CG1 VAL A 22 5.922 -5.654 0.012 1.00 0.96 C ATOM 375 CG2 VAL A 22 6.644 -4.711 2.213 1.00 0.94 C ATOM 0 H VAL A 22 5.886 -5.979 3.999 1.00 1.18 H new ATOM 0 HA VAL A 22 4.627 -7.114 1.517 1.00 1.08 H new ATOM 0 HB VAL A 22 7.436 -6.501 1.293 1.00 0.93 H new ATOM 0 HG11 VAL A 22 6.608 -4.971 -0.489 1.00 0.96 H new ATOM 0 HG12 VAL A 22 5.819 -6.564 -0.579 1.00 0.96 H new ATOM 0 HG13 VAL A 22 4.947 -5.177 0.116 1.00 0.96 H new ATOM 0 HG21 VAL A 22 7.318 -4.037 1.684 1.00 0.94 H new ATOM 0 HG22 VAL A 22 5.674 -4.229 2.339 1.00 0.94 H new ATOM 0 HG23 VAL A 22 7.062 -4.947 3.192 1.00 0.94 H new ATOM 385 N ASN A 23 5.473 -9.417 2.125 1.00 1.30 N ATOM 386 CA ASN A 23 6.036 -10.779 2.372 1.00 1.35 C ATOM 387 C ASN A 23 7.224 -11.068 1.444 1.00 1.29 C ATOM 388 O ASN A 23 7.374 -12.168 0.954 1.00 1.26 O ATOM 389 CB ASN A 23 4.937 -11.823 2.146 1.00 1.49 C ATOM 390 CG ASN A 23 4.143 -11.464 0.890 1.00 1.73 C ATOM 391 OD1 ASN A 23 4.593 -11.694 -0.213 1.00 2.34 O ATOM 392 ND2 ASN A 23 2.970 -10.906 1.012 1.00 2.26 N ATOM 0 H ASN A 23 4.527 -9.406 1.743 1.00 1.30 H new ATOM 0 HA ASN A 23 6.395 -10.826 3.400 1.00 1.35 H new ATOM 0 HB2 ASN A 23 5.378 -12.814 2.039 1.00 1.49 H new ATOM 0 HB3 ASN A 23 4.274 -11.861 3.010 1.00 1.49 H new ATOM 0 HD21 ASN A 23 2.432 -10.663 0.180 1.00 2.26 H new ATOM 0 HD22 ASN A 23 2.591 -10.712 1.939 1.00 2.26 H new ATOM 399 N GLU A 24 8.075 -10.103 1.219 1.00 1.33 N ATOM 400 CA GLU A 24 9.269 -10.331 0.344 1.00 1.30 C ATOM 401 C GLU A 24 8.837 -10.640 -1.096 1.00 1.30 C ATOM 402 O GLU A 24 9.215 -9.953 -2.024 1.00 1.37 O ATOM 403 CB GLU A 24 10.094 -11.505 0.895 1.00 1.39 C ATOM 404 CG GLU A 24 11.526 -11.430 0.355 1.00 1.51 C ATOM 405 CD GLU A 24 12.277 -10.296 1.054 1.00 1.57 C ATOM 406 OE1 GLU A 24 12.824 -10.541 2.117 1.00 2.15 O ATOM 407 OE2 GLU A 24 12.294 -9.202 0.515 1.00 1.69 O ATOM 0 H GLU A 24 7.997 -9.162 1.604 1.00 1.33 H new ATOM 0 HA GLU A 24 9.874 -9.424 0.339 1.00 1.30 H new ATOM 0 HB2 GLU A 24 10.104 -11.475 1.985 1.00 1.39 H new ATOM 0 HB3 GLU A 24 9.636 -12.451 0.607 1.00 1.39 H new ATOM 0 HG2 GLU A 24 12.039 -12.377 0.522 1.00 1.51 H new ATOM 0 HG3 GLU A 24 11.511 -11.261 -0.722 1.00 1.51 H new ATOM 414 N ARG A 25 8.065 -11.676 -1.291 1.00 1.26 N ATOM 415 CA ARG A 25 7.626 -12.040 -2.672 1.00 1.27 C ATOM 416 C ARG A 25 7.174 -10.790 -3.428 1.00 1.11 C ATOM 417 O ARG A 25 7.425 -10.643 -4.608 1.00 1.14 O ATOM 418 CB ARG A 25 6.465 -13.032 -2.592 1.00 1.39 C ATOM 419 CG ARG A 25 6.100 -13.507 -4.002 1.00 1.55 C ATOM 420 CD ARG A 25 5.240 -14.766 -3.908 1.00 1.73 C ATOM 421 NE ARG A 25 3.957 -14.442 -3.223 1.00 2.26 N ATOM 422 CZ ARG A 25 2.951 -15.270 -3.296 1.00 2.83 C ATOM 423 NH1 ARG A 25 3.065 -16.379 -3.974 1.00 3.11 N ATOM 424 NH2 ARG A 25 1.829 -14.987 -2.691 1.00 3.67 N ATOM 0 H ARG A 25 7.718 -12.288 -0.552 1.00 1.26 H new ATOM 0 HA ARG A 25 8.463 -12.494 -3.203 1.00 1.27 H new ATOM 0 HB2 ARG A 25 6.742 -13.883 -1.971 1.00 1.39 H new ATOM 0 HB3 ARG A 25 5.602 -12.561 -2.121 1.00 1.39 H new ATOM 0 HG2 ARG A 25 5.560 -12.723 -4.533 1.00 1.55 H new ATOM 0 HG3 ARG A 25 7.005 -13.714 -4.573 1.00 1.55 H new ATOM 0 HD2 ARG A 25 5.043 -15.160 -4.905 1.00 1.73 H new ATOM 0 HD3 ARG A 25 5.772 -15.542 -3.358 1.00 1.73 H new ATOM 0 HE ARG A 25 3.865 -13.573 -2.697 1.00 2.26 H new ATOM 0 HH11 ARG A 25 3.941 -16.599 -4.448 1.00 3.11 H new ATOM 0 HH12 ARG A 25 2.278 -17.025 -4.030 1.00 3.11 H new ATOM 0 HH21 ARG A 25 1.740 -14.119 -2.162 1.00 3.67 H new ATOM 0 HH22 ARG A 25 1.042 -15.633 -2.747 1.00 3.67 H new ATOM 438 N GLN A 26 6.509 -9.885 -2.761 1.00 1.01 N ATOM 439 CA GLN A 26 6.039 -8.638 -3.447 1.00 0.88 C ATOM 440 C GLN A 26 7.124 -7.557 -3.326 1.00 0.79 C ATOM 441 O GLN A 26 7.010 -6.493 -3.891 1.00 0.74 O ATOM 442 CB GLN A 26 4.707 -8.146 -2.815 1.00 0.92 C ATOM 443 CG GLN A 26 4.422 -8.900 -1.511 1.00 1.58 C ATOM 444 CD GLN A 26 3.211 -8.274 -0.815 1.00 2.06 C ATOM 445 OE1 GLN A 26 3.266 -7.145 -0.372 1.00 2.40 O ATOM 446 NE2 GLN A 26 2.110 -8.965 -0.701 1.00 2.90 N ATOM 0 H GLN A 26 6.269 -9.952 -1.772 1.00 1.01 H new ATOM 0 HA GLN A 26 5.857 -8.848 -4.501 1.00 0.88 H new ATOM 0 HB2 GLN A 26 4.764 -7.075 -2.618 1.00 0.92 H new ATOM 0 HB3 GLN A 26 3.887 -8.298 -3.517 1.00 0.92 H new ATOM 0 HG2 GLN A 26 4.231 -9.952 -1.721 1.00 1.58 H new ATOM 0 HG3 GLN A 26 5.293 -8.859 -0.857 1.00 1.58 H new ATOM 0 HE21 GLN A 26 2.062 -9.914 -1.073 1.00 2.90 H new ATOM 0 HE22 GLN A 26 1.297 -8.556 -0.240 1.00 2.90 H new ATOM 455 N PHE A 27 8.175 -7.825 -2.602 1.00 0.82 N ATOM 456 CA PHE A 27 9.264 -6.812 -2.456 1.00 0.74 C ATOM 457 C PHE A 27 10.199 -6.904 -3.664 1.00 0.75 C ATOM 458 O PHE A 27 10.270 -6.003 -4.477 1.00 0.74 O ATOM 459 CB PHE A 27 10.044 -7.104 -1.171 1.00 0.78 C ATOM 460 CG PHE A 27 10.902 -5.914 -0.802 1.00 0.75 C ATOM 461 CD1 PHE A 27 12.069 -5.638 -1.525 1.00 1.44 C ATOM 462 CD2 PHE A 27 10.532 -5.090 0.270 1.00 1.15 C ATOM 463 CE1 PHE A 27 12.864 -4.538 -1.179 1.00 1.44 C ATOM 464 CE2 PHE A 27 11.327 -3.991 0.615 1.00 1.15 C ATOM 465 CZ PHE A 27 12.493 -3.715 -0.109 1.00 0.74 C ATOM 0 H PHE A 27 8.329 -8.702 -2.104 1.00 0.82 H new ATOM 0 HA PHE A 27 8.841 -5.809 -2.404 1.00 0.74 H new ATOM 0 HB2 PHE A 27 9.352 -7.329 -0.359 1.00 0.78 H new ATOM 0 HB3 PHE A 27 10.671 -7.985 -1.309 1.00 0.78 H new ATOM 0 HD1 PHE A 27 12.356 -6.274 -2.350 1.00 1.44 H new ATOM 0 HD2 PHE A 27 9.633 -5.303 0.830 1.00 1.15 H new ATOM 0 HE1 PHE A 27 13.763 -4.325 -1.738 1.00 1.44 H new ATOM 0 HE2 PHE A 27 11.041 -3.356 1.440 1.00 1.15 H new ATOM 0 HZ PHE A 27 13.106 -2.867 0.158 1.00 0.74 H new ATOM 475 N ARG A 28 10.915 -7.988 -3.792 1.00 0.84 N ATOM 476 CA ARG A 28 11.842 -8.138 -4.950 1.00 0.90 C ATOM 477 C ARG A 28 11.053 -8.008 -6.255 1.00 0.89 C ATOM 478 O ARG A 28 11.503 -7.402 -7.208 1.00 0.89 O ATOM 479 CB ARG A 28 12.509 -9.513 -4.892 1.00 1.04 C ATOM 480 CG ARG A 28 13.550 -9.623 -6.007 1.00 1.73 C ATOM 481 CD ARG A 28 14.455 -10.825 -5.739 1.00 1.87 C ATOM 482 NE ARG A 28 15.291 -11.096 -6.942 1.00 2.53 N ATOM 483 CZ ARG A 28 16.332 -11.877 -6.851 1.00 3.19 C ATOM 484 NH1 ARG A 28 16.638 -12.425 -5.707 1.00 3.45 N ATOM 485 NH2 ARG A 28 17.067 -12.111 -7.903 1.00 4.07 N ATOM 0 H ARG A 28 10.898 -8.776 -3.145 1.00 0.84 H new ATOM 0 HA ARG A 28 12.605 -7.361 -4.909 1.00 0.90 H new ATOM 0 HB2 ARG A 28 12.984 -9.658 -3.921 1.00 1.04 H new ATOM 0 HB3 ARG A 28 11.760 -10.297 -5.001 1.00 1.04 H new ATOM 0 HG2 ARG A 28 13.055 -9.734 -6.972 1.00 1.73 H new ATOM 0 HG3 ARG A 28 14.144 -8.710 -6.057 1.00 1.73 H new ATOM 0 HD2 ARG A 28 15.092 -10.629 -4.877 1.00 1.87 H new ATOM 0 HD3 ARG A 28 13.852 -11.701 -5.497 1.00 1.87 H new ATOM 0 HE ARG A 28 15.049 -10.671 -7.837 1.00 2.53 H new ATOM 0 HH11 ARG A 28 16.063 -12.243 -4.884 1.00 3.45 H new ATOM 0 HH12 ARG A 28 17.452 -13.036 -5.636 1.00 3.45 H new ATOM 0 HH21 ARG A 28 16.828 -11.683 -8.798 1.00 4.07 H new ATOM 0 HH22 ARG A 28 17.881 -12.722 -7.831 1.00 4.07 H new ATOM 499 N LYS A 29 9.877 -8.572 -6.305 1.00 0.91 N ATOM 500 CA LYS A 29 9.059 -8.481 -7.546 1.00 0.93 C ATOM 501 C LYS A 29 8.683 -7.018 -7.798 1.00 0.80 C ATOM 502 O LYS A 29 9.018 -6.448 -8.817 1.00 0.85 O ATOM 503 CB LYS A 29 7.783 -9.323 -7.381 1.00 1.00 C ATOM 504 CG LYS A 29 7.133 -9.610 -8.764 1.00 1.05 C ATOM 505 CD LYS A 29 7.397 -11.061 -9.206 1.00 1.22 C ATOM 506 CE LYS A 29 8.883 -11.257 -9.523 1.00 1.62 C ATOM 507 NZ LYS A 29 9.651 -11.404 -8.254 1.00 2.20 N ATOM 0 H LYS A 29 9.448 -9.092 -5.539 1.00 0.91 H new ATOM 0 HA LYS A 29 9.633 -8.859 -8.392 1.00 0.93 H new ATOM 0 HB2 LYS A 29 8.023 -10.263 -6.884 1.00 1.00 H new ATOM 0 HB3 LYS A 29 7.074 -8.797 -6.742 1.00 1.00 H new ATOM 0 HG2 LYS A 29 6.059 -9.432 -8.709 1.00 1.05 H new ATOM 0 HG3 LYS A 29 7.533 -8.921 -9.508 1.00 1.05 H new ATOM 0 HD2 LYS A 29 7.092 -11.750 -8.418 1.00 1.22 H new ATOM 0 HD3 LYS A 29 6.796 -11.296 -10.085 1.00 1.22 H new ATOM 0 HE2 LYS A 29 9.019 -12.141 -10.146 1.00 1.62 H new ATOM 0 HE3 LYS A 29 9.259 -10.406 -10.091 1.00 1.62 H new ATOM 0 HZ1 LYS A 29 10.148 -10.515 -8.044 1.00 2.20 H new ATOM 0 HZ2 LYS A 29 8.997 -11.628 -7.477 1.00 2.20 H new ATOM 0 HZ3 LYS A 29 10.345 -12.172 -8.355 1.00 2.20 H new ATOM 521 N THR A 30 7.992 -6.407 -6.875 1.00 0.70 N ATOM 522 CA THR A 30 7.598 -4.983 -7.059 1.00 0.61 C ATOM 523 C THR A 30 8.848 -4.145 -7.362 1.00 0.61 C ATOM 524 O THR A 30 8.758 -3.020 -7.812 1.00 0.63 O ATOM 525 CB THR A 30 6.935 -4.472 -5.777 1.00 0.58 C ATOM 526 OG1 THR A 30 5.797 -5.271 -5.487 1.00 0.74 O ATOM 527 CG2 THR A 30 6.501 -3.020 -5.960 1.00 0.63 C ATOM 0 H THR A 30 7.683 -6.833 -6.001 1.00 0.70 H new ATOM 0 HA THR A 30 6.896 -4.900 -7.889 1.00 0.61 H new ATOM 0 HB THR A 30 7.648 -4.532 -4.954 1.00 0.58 H new ATOM 0 HG1 THR A 30 6.079 -6.083 -5.015 1.00 0.74 H new ATOM 0 HG21 THR A 30 6.030 -2.663 -5.044 1.00 0.63 H new ATOM 0 HG22 THR A 30 7.373 -2.405 -6.183 1.00 0.63 H new ATOM 0 HG23 THR A 30 5.790 -2.954 -6.783 1.00 0.63 H new ATOM 535 N PHE A 31 10.015 -4.685 -7.115 1.00 0.68 N ATOM 536 CA PHE A 31 11.270 -3.918 -7.383 1.00 0.77 C ATOM 537 C PHE A 31 11.605 -3.974 -8.877 1.00 0.90 C ATOM 538 O PHE A 31 11.389 -3.024 -9.603 1.00 0.92 O ATOM 539 CB PHE A 31 12.425 -4.522 -6.573 1.00 0.87 C ATOM 540 CG PHE A 31 13.569 -3.536 -6.500 1.00 0.81 C ATOM 541 CD1 PHE A 31 13.569 -2.533 -5.523 1.00 1.21 C ATOM 542 CD2 PHE A 31 14.632 -3.627 -7.408 1.00 1.66 C ATOM 543 CE1 PHE A 31 14.629 -1.621 -5.454 1.00 1.25 C ATOM 544 CE2 PHE A 31 15.692 -2.715 -7.339 1.00 1.69 C ATOM 545 CZ PHE A 31 15.690 -1.712 -6.362 1.00 0.92 C ATOM 0 H PHE A 31 10.153 -5.623 -6.740 1.00 0.68 H new ATOM 0 HA PHE A 31 11.125 -2.879 -7.088 1.00 0.77 H new ATOM 0 HB2 PHE A 31 12.085 -4.773 -5.568 1.00 0.87 H new ATOM 0 HB3 PHE A 31 12.761 -5.449 -7.037 1.00 0.87 H new ATOM 0 HD1 PHE A 31 12.750 -2.463 -4.822 1.00 1.21 H new ATOM 0 HD2 PHE A 31 14.634 -4.401 -8.161 1.00 1.66 H new ATOM 0 HE1 PHE A 31 14.628 -0.847 -4.700 1.00 1.25 H new ATOM 0 HE2 PHE A 31 16.511 -2.785 -8.039 1.00 1.69 H new ATOM 0 HZ PHE A 31 16.508 -1.008 -6.309 1.00 0.92 H new ATOM 555 N GLU A 32 12.128 -5.075 -9.345 1.00 1.04 N ATOM 556 CA GLU A 32 12.470 -5.175 -10.795 1.00 1.22 C ATOM 557 C GLU A 32 11.250 -4.774 -11.627 1.00 1.22 C ATOM 558 O GLU A 32 11.330 -4.587 -12.824 1.00 1.40 O ATOM 559 CB GLU A 32 12.865 -6.615 -11.129 1.00 1.30 C ATOM 560 CG GLU A 32 14.199 -6.948 -10.459 1.00 1.43 C ATOM 561 CD GLU A 32 14.616 -8.372 -10.830 1.00 1.98 C ATOM 562 OE1 GLU A 32 14.696 -8.655 -12.014 1.00 2.70 O ATOM 563 OE2 GLU A 32 14.847 -9.155 -9.924 1.00 2.24 O ATOM 0 H GLU A 32 12.333 -5.906 -8.790 1.00 1.04 H new ATOM 0 HA GLU A 32 13.304 -4.511 -11.022 1.00 1.22 H new ATOM 0 HB2 GLU A 32 12.092 -7.304 -10.787 1.00 1.30 H new ATOM 0 HB3 GLU A 32 12.947 -6.739 -12.209 1.00 1.30 H new ATOM 0 HG2 GLU A 32 14.964 -6.240 -10.776 1.00 1.43 H new ATOM 0 HG3 GLU A 32 14.108 -6.855 -9.377 1.00 1.43 H new ATOM 570 N GLU A 33 10.122 -4.644 -10.989 1.00 1.08 N ATOM 571 CA GLU A 33 8.879 -4.259 -11.709 1.00 1.14 C ATOM 572 C GLU A 33 8.824 -2.736 -11.854 1.00 1.18 C ATOM 573 O GLU A 33 8.501 -2.212 -12.899 1.00 1.53 O ATOM 574 CB GLU A 33 7.686 -4.732 -10.874 1.00 1.08 C ATOM 575 CG GLU A 33 7.440 -6.224 -11.116 1.00 1.16 C ATOM 576 CD GLU A 33 6.810 -6.420 -12.496 1.00 1.63 C ATOM 577 OE1 GLU A 33 6.660 -5.437 -13.202 1.00 2.26 O ATOM 578 OE2 GLU A 33 6.488 -7.551 -12.823 1.00 2.19 O ATOM 0 H GLU A 33 10.008 -4.790 -9.986 1.00 1.08 H new ATOM 0 HA GLU A 33 8.857 -4.712 -12.700 1.00 1.14 H new ATOM 0 HB2 GLU A 33 7.878 -4.553 -9.816 1.00 1.08 H new ATOM 0 HB3 GLU A 33 6.796 -4.160 -11.138 1.00 1.08 H new ATOM 0 HG2 GLU A 33 8.379 -6.773 -11.052 1.00 1.16 H new ATOM 0 HG3 GLU A 33 6.783 -6.625 -10.344 1.00 1.16 H new ATOM 585 N ALA A 34 9.123 -2.025 -10.804 1.00 0.91 N ATOM 586 CA ALA A 34 9.074 -0.539 -10.867 1.00 0.95 C ATOM 587 C ALA A 34 10.012 -0.026 -11.968 1.00 1.55 C ATOM 588 O ALA A 34 10.025 1.148 -12.283 1.00 1.70 O ATOM 589 CB ALA A 34 9.486 0.033 -9.498 1.00 0.83 C ATOM 0 H ALA A 34 9.400 -2.411 -9.901 1.00 0.91 H new ATOM 0 HA ALA A 34 8.061 -0.214 -11.105 1.00 0.95 H new ATOM 0 HB1 ALA A 34 9.453 1.122 -9.534 1.00 0.83 H new ATOM 0 HB2 ALA A 34 8.798 -0.326 -8.732 1.00 0.83 H new ATOM 0 HB3 ALA A 34 10.498 -0.292 -9.258 1.00 0.83 H new ATOM 595 N GLY A 35 10.796 -0.888 -12.554 1.00 2.02 N ATOM 596 CA GLY A 35 11.726 -0.434 -13.628 1.00 2.71 C ATOM 597 C GLY A 35 10.928 0.183 -14.779 1.00 1.89 C ATOM 598 O GLY A 35 11.487 0.711 -15.719 1.00 2.20 O ATOM 0 H GLY A 35 10.834 -1.884 -12.337 1.00 2.02 H new ATOM 0 HA2 GLY A 35 12.429 0.297 -13.228 1.00 2.71 H new ATOM 0 HA3 GLY A 35 12.315 -1.276 -13.992 1.00 2.71 H new ATOM 602 N LYS A 36 9.626 0.122 -14.715 1.00 1.22 N ATOM 603 CA LYS A 36 8.799 0.707 -15.810 1.00 1.47 C ATOM 604 C LYS A 36 8.918 2.232 -15.778 1.00 1.60 C ATOM 605 O LYS A 36 9.290 2.855 -16.752 1.00 2.06 O ATOM 606 CB LYS A 36 7.331 0.304 -15.618 1.00 1.84 C ATOM 607 CG LYS A 36 7.197 -1.231 -15.594 1.00 1.78 C ATOM 608 CD LYS A 36 7.055 -1.778 -17.020 1.00 1.27 C ATOM 609 CE LYS A 36 7.268 -3.293 -17.006 1.00 1.57 C ATOM 610 NZ LYS A 36 6.917 -3.857 -18.340 1.00 2.06 N ATOM 0 H LYS A 36 9.099 -0.307 -13.954 1.00 1.22 H new ATOM 0 HA LYS A 36 9.153 0.334 -16.771 1.00 1.47 H new ATOM 0 HB2 LYS A 36 6.950 0.724 -14.687 1.00 1.84 H new ATOM 0 HB3 LYS A 36 6.725 0.716 -16.425 1.00 1.84 H new ATOM 0 HG2 LYS A 36 8.071 -1.671 -15.114 1.00 1.78 H new ATOM 0 HG3 LYS A 36 6.329 -1.517 -15.000 1.00 1.78 H new ATOM 0 HD2 LYS A 36 6.067 -1.542 -17.415 1.00 1.27 H new ATOM 0 HD3 LYS A 36 7.783 -1.303 -17.678 1.00 1.27 H new ATOM 0 HE2 LYS A 36 8.306 -3.523 -16.764 1.00 1.57 H new ATOM 0 HE3 LYS A 36 6.651 -3.750 -16.232 1.00 1.57 H new ATOM 0 HZ1 LYS A 36 7.062 -4.887 -18.331 1.00 2.06 H new ATOM 0 HZ2 LYS A 36 5.921 -3.649 -18.553 1.00 2.06 H new ATOM 0 HZ3 LYS A 36 7.523 -3.429 -19.068 1.00 2.06 H new ATOM 624 N MET A 37 8.607 2.840 -14.664 1.00 1.32 N ATOM 625 CA MET A 37 8.705 4.326 -14.571 1.00 1.49 C ATOM 626 C MET A 37 10.086 4.762 -15.093 1.00 1.68 C ATOM 627 O MET A 37 10.945 3.934 -15.322 1.00 1.71 O ATOM 628 CB MET A 37 8.517 4.746 -13.092 1.00 1.44 C ATOM 629 CG MET A 37 7.085 5.247 -12.850 1.00 1.33 C ATOM 630 SD MET A 37 6.961 5.931 -11.177 1.00 1.63 S ATOM 631 CE MET A 37 6.351 4.439 -10.355 1.00 0.92 C ATOM 0 H MET A 37 8.290 2.372 -13.815 1.00 1.32 H new ATOM 0 HA MET A 37 7.933 4.806 -15.173 1.00 1.49 H new ATOM 0 HB2 MET A 37 8.727 3.899 -12.438 1.00 1.44 H new ATOM 0 HB3 MET A 37 9.230 5.530 -12.837 1.00 1.44 H new ATOM 0 HG2 MET A 37 6.825 6.008 -13.586 1.00 1.33 H new ATOM 0 HG3 MET A 37 6.376 4.428 -12.974 1.00 1.33 H new ATOM 0 HE1 MET A 37 6.388 4.578 -9.275 1.00 0.92 H new ATOM 0 HE2 MET A 37 5.322 4.250 -10.661 1.00 0.92 H new ATOM 0 HE3 MET A 37 6.975 3.589 -10.633 1.00 0.92 H new ATOM 641 N PRO A 38 10.303 6.045 -15.294 1.00 1.87 N ATOM 642 CA PRO A 38 11.612 6.562 -15.808 1.00 2.08 C ATOM 643 C PRO A 38 12.774 6.257 -14.853 1.00 2.51 C ATOM 644 O PRO A 38 13.627 7.088 -14.612 1.00 2.87 O ATOM 645 CB PRO A 38 11.383 8.082 -15.941 1.00 2.28 C ATOM 646 CG PRO A 38 9.898 8.244 -15.968 1.00 2.22 C ATOM 647 CD PRO A 38 9.354 7.152 -15.064 1.00 1.95 C ATOM 0 HA PRO A 38 11.895 6.090 -16.749 1.00 2.08 H new ATOM 0 HB2 PRO A 38 11.825 8.623 -15.104 1.00 2.28 H new ATOM 0 HB3 PRO A 38 11.840 8.473 -16.850 1.00 2.28 H new ATOM 0 HG2 PRO A 38 9.604 9.231 -15.611 1.00 2.22 H new ATOM 0 HG3 PRO A 38 9.511 8.143 -16.982 1.00 2.22 H new ATOM 0 HD2 PRO A 38 9.337 7.461 -14.019 1.00 1.95 H new ATOM 0 HD3 PRO A 38 8.334 6.875 -15.331 1.00 1.95 H new ATOM 655 N GLY A 39 12.812 5.070 -14.309 1.00 2.81 N ATOM 656 CA GLY A 39 13.914 4.703 -13.370 1.00 3.32 C ATOM 657 C GLY A 39 13.482 5.001 -11.933 1.00 2.44 C ATOM 658 O GLY A 39 12.674 4.293 -11.368 1.00 2.35 O ATOM 0 H GLY A 39 12.125 4.335 -14.475 1.00 2.81 H new ATOM 0 HA2 GLY A 39 14.159 3.646 -13.475 1.00 3.32 H new ATOM 0 HA3 GLY A 39 14.816 5.265 -13.614 1.00 3.32 H new ATOM 662 N LYS A 40 14.010 6.059 -11.357 1.00 2.19 N ATOM 663 CA LYS A 40 13.653 6.459 -9.953 1.00 1.55 C ATOM 664 C LYS A 40 13.263 5.242 -9.105 1.00 1.28 C ATOM 665 O LYS A 40 12.291 5.271 -8.376 1.00 1.10 O ATOM 666 CB LYS A 40 12.486 7.446 -9.993 1.00 1.83 C ATOM 667 CG LYS A 40 13.001 8.817 -10.442 1.00 2.02 C ATOM 668 CD LYS A 40 11.831 9.678 -10.898 1.00 2.49 C ATOM 669 CE LYS A 40 10.898 9.947 -9.716 1.00 3.04 C ATOM 670 NZ LYS A 40 9.967 11.058 -10.061 1.00 3.55 N ATOM 0 H LYS A 40 14.686 6.674 -11.810 1.00 2.19 H new ATOM 0 HA LYS A 40 14.527 6.923 -9.496 1.00 1.55 H new ATOM 0 HB2 LYS A 40 11.717 7.091 -10.679 1.00 1.83 H new ATOM 0 HB3 LYS A 40 12.025 7.522 -9.008 1.00 1.83 H new ATOM 0 HG2 LYS A 40 13.527 9.305 -9.622 1.00 2.02 H new ATOM 0 HG3 LYS A 40 13.717 8.699 -11.255 1.00 2.02 H new ATOM 0 HD2 LYS A 40 12.197 10.620 -11.306 1.00 2.49 H new ATOM 0 HD3 LYS A 40 11.286 9.175 -11.697 1.00 2.49 H new ATOM 0 HE2 LYS A 40 10.333 9.047 -9.473 1.00 3.04 H new ATOM 0 HE3 LYS A 40 11.480 10.207 -8.832 1.00 3.04 H new ATOM 0 HZ1 LYS A 40 9.332 11.241 -9.258 1.00 3.55 H new ATOM 0 HZ2 LYS A 40 10.514 11.917 -10.273 1.00 3.55 H new ATOM 0 HZ3 LYS A 40 9.403 10.793 -10.894 1.00 3.55 H new ATOM 684 N HIS A 41 14.007 4.173 -9.197 1.00 1.36 N ATOM 685 CA HIS A 41 13.672 2.957 -8.398 1.00 1.22 C ATOM 686 C HIS A 41 13.364 3.359 -6.954 1.00 0.94 C ATOM 687 O HIS A 41 12.370 2.955 -6.384 1.00 0.92 O ATOM 688 CB HIS A 41 14.859 1.992 -8.416 1.00 1.34 C ATOM 689 CG HIS A 41 15.094 1.511 -9.821 1.00 1.20 C ATOM 690 ND1 HIS A 41 16.359 1.486 -10.393 1.00 1.57 N ATOM 691 CD2 HIS A 41 14.238 1.032 -10.782 1.00 1.61 C ATOM 692 CE1 HIS A 41 16.229 1.007 -11.644 1.00 2.39 C ATOM 693 NE2 HIS A 41 14.958 0.717 -11.929 1.00 2.46 N ATOM 0 H HIS A 41 14.832 4.088 -9.790 1.00 1.36 H new ATOM 0 HA HIS A 41 12.799 2.469 -8.832 1.00 1.22 H new ATOM 0 HB2 HIS A 41 15.752 2.490 -8.037 1.00 1.34 H new ATOM 0 HB3 HIS A 41 14.663 1.145 -7.759 1.00 1.34 H new ATOM 0 HD2 HIS A 41 13.170 0.918 -10.665 1.00 1.61 H new ATOM 0 HE1 HIS A 41 17.051 0.874 -12.332 1.00 2.39 H new ATOM 0 HE2 HIS A 41 14.592 0.343 -12.804 1.00 2.46 H new ATOM 702 N GLY A 42 14.213 4.149 -6.358 1.00 0.85 N ATOM 703 CA GLY A 42 13.977 4.577 -4.951 1.00 0.78 C ATOM 704 C GLY A 42 12.546 5.098 -4.791 1.00 0.77 C ATOM 705 O GLY A 42 11.709 4.458 -4.187 1.00 0.75 O ATOM 0 H GLY A 42 15.062 4.518 -6.786 1.00 0.85 H new ATOM 0 HA2 GLY A 42 14.144 3.739 -4.275 1.00 0.78 H new ATOM 0 HA3 GLY A 42 14.688 5.356 -4.676 1.00 0.78 H new ATOM 709 N GLU A 43 12.258 6.257 -5.319 1.00 0.89 N ATOM 710 CA GLU A 43 10.882 6.817 -5.181 1.00 0.93 C ATOM 711 C GLU A 43 9.855 5.811 -5.703 1.00 0.85 C ATOM 712 O GLU A 43 8.936 5.428 -5.006 1.00 0.82 O ATOM 713 CB GLU A 43 10.774 8.116 -5.983 1.00 1.08 C ATOM 714 CG GLU A 43 11.906 9.064 -5.581 1.00 1.36 C ATOM 715 CD GLU A 43 11.734 9.473 -4.117 1.00 1.59 C ATOM 716 OE1 GLU A 43 10.600 9.637 -3.698 1.00 2.17 O ATOM 717 OE2 GLU A 43 12.739 9.615 -3.440 1.00 1.81 O ATOM 0 H GLU A 43 12.914 6.840 -5.839 1.00 0.89 H new ATOM 0 HA GLU A 43 10.684 7.020 -4.128 1.00 0.93 H new ATOM 0 HB2 GLU A 43 10.828 7.902 -7.050 1.00 1.08 H new ATOM 0 HB3 GLU A 43 9.809 8.588 -5.801 1.00 1.08 H new ATOM 0 HG2 GLU A 43 12.870 8.576 -5.722 1.00 1.36 H new ATOM 0 HG3 GLU A 43 11.899 9.947 -6.220 1.00 1.36 H new ATOM 724 N ASN A 44 9.998 5.386 -6.927 1.00 0.84 N ATOM 725 CA ASN A 44 9.026 4.411 -7.500 1.00 0.79 C ATOM 726 C ASN A 44 8.783 3.268 -6.506 1.00 0.64 C ATOM 727 O ASN A 44 7.680 3.058 -6.048 1.00 0.65 O ATOM 728 CB ASN A 44 9.589 3.845 -8.804 1.00 0.83 C ATOM 729 CG ASN A 44 9.981 4.997 -9.732 1.00 1.13 C ATOM 730 OD1 ASN A 44 10.418 4.775 -10.844 1.00 1.81 O ATOM 731 ND2 ASN A 44 9.839 6.227 -9.322 1.00 1.62 N ATOM 0 H ASN A 44 10.747 5.672 -7.557 1.00 0.84 H new ATOM 0 HA ASN A 44 8.081 4.917 -7.697 1.00 0.79 H new ATOM 0 HB2 ASN A 44 10.457 3.219 -8.597 1.00 0.83 H new ATOM 0 HB3 ASN A 44 8.847 3.210 -9.288 1.00 0.83 H new ATOM 0 HD21 ASN A 44 10.095 7.001 -9.935 1.00 1.62 H new ATOM 0 HD22 ASN A 44 9.472 6.414 -8.389 1.00 1.62 H new ATOM 738 N PHE A 45 9.796 2.522 -6.167 1.00 0.60 N ATOM 739 CA PHE A 45 9.594 1.396 -5.208 1.00 0.52 C ATOM 740 C PHE A 45 8.799 1.883 -3.992 1.00 0.51 C ATOM 741 O PHE A 45 7.871 1.237 -3.548 1.00 0.51 O ATOM 742 CB PHE A 45 10.950 0.862 -4.748 1.00 0.65 C ATOM 743 CG PHE A 45 10.744 -0.398 -3.935 1.00 0.39 C ATOM 744 CD1 PHE A 45 10.237 -1.550 -4.549 1.00 1.33 C ATOM 745 CD2 PHE A 45 11.064 -0.418 -2.572 1.00 1.25 C ATOM 746 CE1 PHE A 45 10.051 -2.717 -3.801 1.00 1.58 C ATOM 747 CE2 PHE A 45 10.876 -1.585 -1.826 1.00 1.49 C ATOM 748 CZ PHE A 45 10.370 -2.734 -2.440 1.00 1.23 C ATOM 0 H PHE A 45 10.750 2.640 -6.508 1.00 0.60 H new ATOM 0 HA PHE A 45 9.039 0.600 -5.706 1.00 0.52 H new ATOM 0 HB2 PHE A 45 11.582 0.652 -5.611 1.00 0.65 H new ATOM 0 HB3 PHE A 45 11.466 1.614 -4.150 1.00 0.65 H new ATOM 0 HD1 PHE A 45 9.990 -1.537 -5.600 1.00 1.33 H new ATOM 0 HD2 PHE A 45 11.456 0.469 -2.097 1.00 1.25 H new ATOM 0 HE1 PHE A 45 9.661 -3.605 -4.275 1.00 1.58 H new ATOM 0 HE2 PHE A 45 11.122 -1.599 -0.774 1.00 1.49 H new ATOM 0 HZ PHE A 45 10.225 -3.635 -1.863 1.00 1.23 H new ATOM 758 N MET A 46 9.153 3.015 -3.449 1.00 0.59 N ATOM 759 CA MET A 46 8.414 3.536 -2.262 1.00 0.67 C ATOM 760 C MET A 46 7.002 3.956 -2.680 1.00 0.72 C ATOM 761 O MET A 46 6.137 4.165 -1.853 1.00 0.89 O ATOM 762 CB MET A 46 9.159 4.748 -1.686 1.00 0.83 C ATOM 763 CG MET A 46 10.538 4.322 -1.133 1.00 0.98 C ATOM 764 SD MET A 46 10.932 5.299 0.343 1.00 1.57 S ATOM 765 CE MET A 46 9.636 4.641 1.426 1.00 0.82 C ATOM 0 H MET A 46 9.921 3.602 -3.775 1.00 0.59 H new ATOM 0 HA MET A 46 8.350 2.755 -1.504 1.00 0.67 H new ATOM 0 HB2 MET A 46 9.289 5.504 -2.460 1.00 0.83 H new ATOM 0 HB3 MET A 46 8.567 5.203 -0.892 1.00 0.83 H new ATOM 0 HG2 MET A 46 10.530 3.260 -0.887 1.00 0.98 H new ATOM 0 HG3 MET A 46 11.306 4.467 -1.893 1.00 0.98 H new ATOM 0 HE1 MET A 46 9.991 4.635 2.456 1.00 0.82 H new ATOM 0 HE2 MET A 46 8.747 5.268 1.352 1.00 0.82 H new ATOM 0 HE3 MET A 46 9.389 3.624 1.121 1.00 0.82 H new ATOM 775 N ILE A 47 6.760 4.082 -3.959 1.00 0.70 N ATOM 776 CA ILE A 47 5.403 4.490 -4.437 1.00 0.81 C ATOM 777 C ILE A 47 4.558 3.234 -4.698 1.00 0.73 C ATOM 778 O ILE A 47 3.345 3.266 -4.618 1.00 0.86 O ATOM 779 CB ILE A 47 5.554 5.309 -5.729 1.00 0.87 C ATOM 780 CG1 ILE A 47 6.081 6.706 -5.387 1.00 1.07 C ATOM 781 CG2 ILE A 47 4.213 5.438 -6.449 1.00 0.95 C ATOM 782 CD1 ILE A 47 6.536 7.415 -6.668 1.00 1.11 C ATOM 0 H ILE A 47 7.446 3.920 -4.696 1.00 0.70 H new ATOM 0 HA ILE A 47 4.905 5.099 -3.682 1.00 0.81 H new ATOM 0 HB ILE A 47 6.255 4.795 -6.386 1.00 0.87 H new ATOM 0 HG12 ILE A 47 5.302 7.288 -4.895 1.00 1.07 H new ATOM 0 HG13 ILE A 47 6.913 6.630 -4.687 1.00 1.07 H new ATOM 0 HG21 ILE A 47 4.344 6.021 -7.360 1.00 0.95 H new ATOM 0 HG22 ILE A 47 3.840 4.446 -6.704 1.00 0.95 H new ATOM 0 HG23 ILE A 47 3.497 5.939 -5.797 1.00 0.95 H new ATOM 0 HD11 ILE A 47 6.910 8.408 -6.421 1.00 1.11 H new ATOM 0 HD12 ILE A 47 7.329 6.836 -7.142 1.00 1.11 H new ATOM 0 HD13 ILE A 47 5.693 7.505 -7.353 1.00 1.11 H new ATOM 794 N LEU A 48 5.184 2.129 -5.010 1.00 0.61 N ATOM 795 CA LEU A 48 4.404 0.883 -5.274 1.00 0.65 C ATOM 796 C LEU A 48 3.993 0.239 -3.944 1.00 0.73 C ATOM 797 O LEU A 48 2.857 -0.156 -3.768 1.00 0.99 O ATOM 798 CB LEU A 48 5.255 -0.111 -6.078 1.00 0.59 C ATOM 799 CG LEU A 48 5.849 0.557 -7.330 1.00 0.56 C ATOM 800 CD1 LEU A 48 6.396 -0.524 -8.267 1.00 0.75 C ATOM 801 CD2 LEU A 48 4.776 1.364 -8.071 1.00 0.68 C ATOM 0 H LEU A 48 6.196 2.035 -5.093 1.00 0.61 H new ATOM 0 HA LEU A 48 3.513 1.140 -5.847 1.00 0.65 H new ATOM 0 HB2 LEU A 48 6.059 -0.497 -5.451 1.00 0.59 H new ATOM 0 HB3 LEU A 48 4.643 -0.964 -6.372 1.00 0.59 H new ATOM 0 HG LEU A 48 6.649 1.231 -7.022 1.00 0.56 H new ATOM 0 HD11 LEU A 48 6.818 -0.055 -9.156 1.00 0.75 H new ATOM 0 HD12 LEU A 48 7.172 -1.092 -7.753 1.00 0.75 H new ATOM 0 HD13 LEU A 48 5.588 -1.195 -8.559 1.00 0.75 H new ATOM 0 HD21 LEU A 48 5.215 1.829 -8.954 1.00 0.68 H new ATOM 0 HD22 LEU A 48 3.967 0.700 -8.375 1.00 0.68 H new ATOM 0 HD23 LEU A 48 4.382 2.137 -7.411 1.00 0.68 H new ATOM 813 N LEU A 49 4.898 0.126 -3.005 1.00 0.60 N ATOM 814 CA LEU A 49 4.534 -0.496 -1.695 1.00 0.72 C ATOM 815 C LEU A 49 3.228 0.125 -1.186 1.00 0.87 C ATOM 816 O LEU A 49 2.442 -0.517 -0.519 1.00 1.08 O ATOM 817 CB LEU A 49 5.644 -0.241 -0.666 1.00 0.73 C ATOM 818 CG LEU A 49 6.860 -1.144 -0.948 1.00 0.62 C ATOM 819 CD1 LEU A 49 8.096 -0.558 -0.251 1.00 0.65 C ATOM 820 CD2 LEU A 49 6.615 -2.575 -0.423 1.00 0.69 C ATOM 0 H LEU A 49 5.867 0.435 -3.087 1.00 0.60 H new ATOM 0 HA LEU A 49 4.409 -1.570 -1.832 1.00 0.72 H new ATOM 0 HB2 LEU A 49 5.946 0.806 -0.700 1.00 0.73 H new ATOM 0 HB3 LEU A 49 5.267 -0.432 0.339 1.00 0.73 H new ATOM 0 HG LEU A 49 7.018 -1.189 -2.026 1.00 0.62 H new ATOM 0 HD11 LEU A 49 8.960 -1.193 -0.447 1.00 0.65 H new ATOM 0 HD12 LEU A 49 8.288 0.444 -0.633 1.00 0.65 H new ATOM 0 HD13 LEU A 49 7.919 -0.509 0.823 1.00 0.65 H new ATOM 0 HD21 LEU A 49 7.487 -3.194 -0.634 1.00 0.69 H new ATOM 0 HD22 LEU A 49 6.444 -2.543 0.653 1.00 0.69 H new ATOM 0 HD23 LEU A 49 5.741 -2.999 -0.917 1.00 0.69 H new ATOM 832 N GLU A 50 2.994 1.372 -1.493 1.00 0.88 N ATOM 833 CA GLU A 50 1.743 2.034 -1.025 1.00 1.04 C ATOM 834 C GLU A 50 0.588 1.666 -1.959 1.00 1.01 C ATOM 835 O GLU A 50 -0.484 1.300 -1.521 1.00 1.10 O ATOM 836 CB GLU A 50 1.937 3.552 -1.029 1.00 1.11 C ATOM 837 CG GLU A 50 0.666 4.230 -0.514 1.00 1.59 C ATOM 838 CD GLU A 50 0.956 5.702 -0.217 1.00 1.70 C ATOM 839 OE1 GLU A 50 1.535 5.974 0.821 1.00 2.27 O ATOM 840 OE2 GLU A 50 0.594 6.533 -1.034 1.00 1.97 O ATOM 0 H GLU A 50 3.615 1.961 -2.048 1.00 0.88 H new ATOM 0 HA GLU A 50 1.513 1.699 -0.014 1.00 1.04 H new ATOM 0 HB2 GLU A 50 2.786 3.822 -0.401 1.00 1.11 H new ATOM 0 HB3 GLU A 50 2.163 3.898 -2.038 1.00 1.11 H new ATOM 0 HG2 GLU A 50 -0.129 4.148 -1.256 1.00 1.59 H new ATOM 0 HG3 GLU A 50 0.314 3.729 0.388 1.00 1.59 H new ATOM 847 N SER A 51 0.798 1.761 -3.244 1.00 0.98 N ATOM 848 CA SER A 51 -0.290 1.417 -4.205 1.00 0.99 C ATOM 849 C SER A 51 -0.906 0.070 -3.821 1.00 0.99 C ATOM 850 O SER A 51 -1.985 -0.276 -4.261 1.00 1.08 O ATOM 851 CB SER A 51 0.289 1.329 -5.618 1.00 1.10 C ATOM 852 OG SER A 51 0.761 2.611 -6.012 1.00 1.82 O ATOM 0 H SER A 51 1.675 2.062 -3.670 1.00 0.98 H new ATOM 0 HA SER A 51 -1.059 2.189 -4.174 1.00 0.99 H new ATOM 0 HB2 SER A 51 1.103 0.605 -5.646 1.00 1.10 H new ATOM 0 HB3 SER A 51 -0.473 0.979 -6.315 1.00 1.10 H new ATOM 0 HG SER A 51 1.609 2.801 -5.559 1.00 1.82 H new ATOM 858 N ARG A 52 -0.222 -0.696 -3.011 1.00 1.00 N ATOM 859 CA ARG A 52 -0.753 -2.030 -2.596 1.00 1.02 C ATOM 860 C ARG A 52 -2.246 -1.932 -2.271 1.00 0.88 C ATOM 861 O ARG A 52 -2.653 -1.215 -1.378 1.00 0.82 O ATOM 862 CB ARG A 52 0.002 -2.511 -1.355 1.00 1.09 C ATOM 863 CG ARG A 52 1.402 -2.980 -1.754 1.00 1.25 C ATOM 864 CD ARG A 52 2.117 -3.536 -0.522 1.00 1.73 C ATOM 865 NE ARG A 52 1.291 -4.622 0.076 1.00 2.33 N ATOM 866 CZ ARG A 52 1.811 -5.418 0.968 1.00 2.94 C ATOM 867 NH1 ARG A 52 3.047 -5.248 1.346 1.00 3.14 N ATOM 868 NH2 ARG A 52 1.095 -6.378 1.484 1.00 3.81 N ATOM 0 H ARG A 52 0.687 -0.454 -2.617 1.00 1.00 H new ATOM 0 HA ARG A 52 -0.614 -2.736 -3.415 1.00 1.02 H new ATOM 0 HB2 ARG A 52 0.072 -1.705 -0.625 1.00 1.09 H new ATOM 0 HB3 ARG A 52 -0.543 -3.326 -0.879 1.00 1.09 H new ATOM 0 HG2 ARG A 52 1.335 -3.746 -2.527 1.00 1.25 H new ATOM 0 HG3 ARG A 52 1.970 -2.151 -2.175 1.00 1.25 H new ATOM 0 HD2 ARG A 52 3.099 -3.920 -0.799 1.00 1.73 H new ATOM 0 HD3 ARG A 52 2.280 -2.743 0.208 1.00 1.73 H new ATOM 0 HE ARG A 52 0.320 -4.743 -0.212 1.00 2.33 H new ATOM 0 HH11 ARG A 52 3.604 -4.494 0.944 1.00 3.14 H new ATOM 0 HH12 ARG A 52 3.457 -5.869 2.044 1.00 3.14 H new ATOM 0 HH21 ARG A 52 0.127 -6.507 1.190 1.00 3.81 H new ATOM 0 HH22 ARG A 52 1.503 -7.000 2.182 1.00 3.81 H new ATOM 882 N LEU A 53 -3.061 -2.648 -2.999 1.00 0.89 N ATOM 883 CA LEU A 53 -4.535 -2.610 -2.754 1.00 0.78 C ATOM 884 C LEU A 53 -4.814 -2.665 -1.247 1.00 0.73 C ATOM 885 O LEU A 53 -5.584 -1.889 -0.724 1.00 0.66 O ATOM 886 CB LEU A 53 -5.204 -3.818 -3.432 1.00 0.84 C ATOM 887 CG LEU A 53 -5.361 -3.586 -4.945 1.00 0.83 C ATOM 888 CD1 LEU A 53 -6.338 -2.427 -5.224 1.00 0.81 C ATOM 889 CD2 LEU A 53 -3.994 -3.280 -5.564 1.00 0.90 C ATOM 0 H LEU A 53 -2.768 -3.262 -3.759 1.00 0.89 H new ATOM 0 HA LEU A 53 -4.938 -1.685 -3.167 1.00 0.78 H new ATOM 0 HB2 LEU A 53 -4.607 -4.713 -3.258 1.00 0.84 H new ATOM 0 HB3 LEU A 53 -6.182 -3.995 -2.984 1.00 0.84 H new ATOM 0 HG LEU A 53 -5.769 -4.491 -5.395 1.00 0.83 H new ATOM 0 HD11 LEU A 53 -6.433 -2.282 -6.300 1.00 0.81 H new ATOM 0 HD12 LEU A 53 -7.315 -2.665 -4.803 1.00 0.81 H new ATOM 0 HD13 LEU A 53 -5.959 -1.513 -4.767 1.00 0.81 H new ATOM 0 HD21 LEU A 53 -4.108 -3.116 -6.636 1.00 0.90 H new ATOM 0 HD22 LEU A 53 -3.578 -2.385 -5.102 1.00 0.90 H new ATOM 0 HD23 LEU A 53 -3.322 -4.121 -5.395 1.00 0.90 H new ATOM 901 N ASP A 54 -4.196 -3.574 -0.545 1.00 0.81 N ATOM 902 CA ASP A 54 -4.441 -3.668 0.923 1.00 0.81 C ATOM 903 C ASP A 54 -4.103 -2.332 1.587 1.00 0.76 C ATOM 904 O ASP A 54 -4.928 -1.735 2.250 1.00 0.76 O ATOM 905 CB ASP A 54 -3.564 -4.772 1.519 1.00 0.96 C ATOM 906 CG ASP A 54 -3.728 -4.790 3.039 1.00 1.54 C ATOM 907 OD1 ASP A 54 -3.113 -3.962 3.691 1.00 2.40 O ATOM 908 OD2 ASP A 54 -4.465 -5.631 3.527 1.00 1.90 O ATOM 0 H ASP A 54 -3.535 -4.253 -0.921 1.00 0.81 H new ATOM 0 HA ASP A 54 -5.491 -3.904 1.099 1.00 0.81 H new ATOM 0 HB2 ASP A 54 -3.844 -5.739 1.101 1.00 0.96 H new ATOM 0 HB3 ASP A 54 -2.520 -4.602 1.257 1.00 0.96 H new ATOM 913 N ASN A 55 -2.897 -1.857 1.415 1.00 0.77 N ATOM 914 CA ASN A 55 -2.508 -0.555 2.036 1.00 0.73 C ATOM 915 C ASN A 55 -3.615 0.473 1.787 1.00 0.61 C ATOM 916 O ASN A 55 -4.210 0.997 2.707 1.00 0.59 O ATOM 917 CB ASN A 55 -1.202 -0.061 1.410 1.00 0.78 C ATOM 918 CG ASN A 55 -0.836 1.302 1.999 1.00 0.88 C ATOM 919 OD1 ASN A 55 0.138 1.427 2.715 1.00 1.56 O ATOM 920 ND2 ASN A 55 -1.582 2.338 1.727 1.00 1.10 N ATOM 0 H ASN A 55 -2.165 -2.314 0.872 1.00 0.77 H new ATOM 0 HA ASN A 55 -2.367 -0.688 3.109 1.00 0.73 H new ATOM 0 HB2 ASN A 55 -0.402 -0.777 1.599 1.00 0.78 H new ATOM 0 HB3 ASN A 55 -1.311 0.016 0.328 1.00 0.78 H new ATOM 0 HD21 ASN A 55 -1.347 3.252 2.115 1.00 1.10 H new ATOM 0 HD22 ASN A 55 -2.400 2.234 1.126 1.00 1.10 H new ATOM 927 N LEU A 56 -3.897 0.755 0.545 1.00 0.59 N ATOM 928 CA LEU A 56 -4.966 1.734 0.210 1.00 0.50 C ATOM 929 C LEU A 56 -6.207 1.456 1.073 1.00 0.45 C ATOM 930 O LEU A 56 -6.714 2.333 1.744 1.00 0.43 O ATOM 931 CB LEU A 56 -5.299 1.581 -1.298 1.00 0.50 C ATOM 932 CG LEU A 56 -5.209 2.932 -2.034 1.00 0.51 C ATOM 933 CD1 LEU A 56 -5.037 2.683 -3.538 1.00 0.59 C ATOM 934 CD2 LEU A 56 -6.496 3.727 -1.795 1.00 0.46 C ATOM 0 H LEU A 56 -3.426 0.343 -0.261 1.00 0.59 H new ATOM 0 HA LEU A 56 -4.636 2.753 0.411 1.00 0.50 H new ATOM 0 HB2 LEU A 56 -4.610 0.870 -1.754 1.00 0.50 H new ATOM 0 HB3 LEU A 56 -6.302 1.170 -1.411 1.00 0.50 H new ATOM 0 HG LEU A 56 -4.356 3.496 -1.658 1.00 0.51 H new ATOM 0 HD11 LEU A 56 -4.973 3.638 -4.060 1.00 0.59 H new ATOM 0 HD12 LEU A 56 -4.124 2.113 -3.710 1.00 0.59 H new ATOM 0 HD13 LEU A 56 -5.892 2.121 -3.914 1.00 0.59 H new ATOM 0 HD21 LEU A 56 -6.435 4.683 -2.315 1.00 0.46 H new ATOM 0 HD22 LEU A 56 -7.348 3.162 -2.173 1.00 0.46 H new ATOM 0 HD23 LEU A 56 -6.622 3.902 -0.727 1.00 0.46 H new ATOM 946 N VAL A 57 -6.698 0.246 1.065 1.00 0.47 N ATOM 947 CA VAL A 57 -7.898 -0.080 1.886 1.00 0.45 C ATOM 948 C VAL A 57 -7.608 0.255 3.353 1.00 0.50 C ATOM 949 O VAL A 57 -8.240 1.109 3.943 1.00 0.56 O ATOM 950 CB VAL A 57 -8.201 -1.581 1.739 1.00 0.50 C ATOM 951 CG1 VAL A 57 -9.442 -1.960 2.555 1.00 0.50 C ATOM 952 CG2 VAL A 57 -8.447 -1.921 0.259 1.00 0.50 C ATOM 0 H VAL A 57 -6.319 -0.531 0.524 1.00 0.47 H new ATOM 0 HA VAL A 57 -8.758 0.500 1.551 1.00 0.45 H new ATOM 0 HB VAL A 57 -7.344 -2.144 2.110 1.00 0.50 H new ATOM 0 HG11 VAL A 57 -9.642 -3.025 2.440 1.00 0.50 H new ATOM 0 HG12 VAL A 57 -9.268 -1.735 3.607 1.00 0.50 H new ATOM 0 HG13 VAL A 57 -10.300 -1.389 2.199 1.00 0.50 H new ATOM 0 HG21 VAL A 57 -8.661 -2.985 0.161 1.00 0.50 H new ATOM 0 HG22 VAL A 57 -9.295 -1.345 -0.111 1.00 0.50 H new ATOM 0 HG23 VAL A 57 -7.559 -1.674 -0.323 1.00 0.50 H new ATOM 962 N TYR A 58 -6.657 -0.415 3.943 1.00 0.57 N ATOM 963 CA TYR A 58 -6.319 -0.146 5.370 1.00 0.65 C ATOM 964 C TYR A 58 -6.009 1.347 5.549 1.00 0.64 C ATOM 965 O TYR A 58 -5.995 1.859 6.650 1.00 0.68 O ATOM 966 CB TYR A 58 -5.097 -1.003 5.756 1.00 0.78 C ATOM 967 CG TYR A 58 -4.409 -0.455 6.994 1.00 0.87 C ATOM 968 CD1 TYR A 58 -5.159 -0.117 8.127 1.00 1.48 C ATOM 969 CD2 TYR A 58 -3.017 -0.287 7.005 1.00 1.45 C ATOM 970 CE1 TYR A 58 -4.521 0.388 9.266 1.00 1.54 C ATOM 971 CE2 TYR A 58 -2.380 0.217 8.144 1.00 1.53 C ATOM 972 CZ TYR A 58 -3.132 0.555 9.274 1.00 1.08 C ATOM 973 OH TYR A 58 -2.504 1.053 10.398 1.00 1.20 O ATOM 0 H TYR A 58 -6.097 -1.141 3.496 1.00 0.57 H new ATOM 0 HA TYR A 58 -7.159 -0.404 6.015 1.00 0.65 H new ATOM 0 HB2 TYR A 58 -5.413 -2.030 5.937 1.00 0.78 H new ATOM 0 HB3 TYR A 58 -4.391 -1.029 4.926 1.00 0.78 H new ATOM 0 HD1 TYR A 58 -6.231 -0.246 8.122 1.00 1.48 H new ATOM 0 HD2 TYR A 58 -2.436 -0.547 6.133 1.00 1.45 H new ATOM 0 HE1 TYR A 58 -5.101 0.649 10.139 1.00 1.54 H new ATOM 0 HE2 TYR A 58 -1.308 0.345 8.151 1.00 1.53 H new ATOM 0 HH TYR A 58 -1.539 1.105 10.237 1.00 1.20 H new ATOM 983 N ARG A 59 -5.754 2.049 4.478 1.00 0.66 N ATOM 984 CA ARG A 59 -5.435 3.504 4.598 1.00 0.69 C ATOM 985 C ARG A 59 -6.723 4.334 4.566 1.00 0.62 C ATOM 986 O ARG A 59 -6.913 5.226 5.369 1.00 0.72 O ATOM 987 CB ARG A 59 -4.526 3.918 3.434 1.00 0.75 C ATOM 988 CG ARG A 59 -3.987 5.360 3.647 1.00 0.74 C ATOM 989 CD ARG A 59 -2.493 5.424 3.301 1.00 1.15 C ATOM 990 NE ARG A 59 -1.753 4.422 4.119 1.00 1.12 N ATOM 991 CZ ARG A 59 -0.533 4.088 3.796 1.00 1.63 C ATOM 992 NH1 ARG A 59 0.040 4.633 2.758 1.00 2.19 N ATOM 993 NH2 ARG A 59 0.113 3.209 4.512 1.00 2.38 N ATOM 0 H ARG A 59 -5.752 1.681 3.527 1.00 0.66 H new ATOM 0 HA ARG A 59 -4.927 3.683 5.546 1.00 0.69 H new ATOM 0 HB2 ARG A 59 -3.692 3.221 3.351 1.00 0.75 H new ATOM 0 HB3 ARG A 59 -5.080 3.866 2.497 1.00 0.75 H new ATOM 0 HG2 ARG A 59 -4.543 6.060 3.023 1.00 0.74 H new ATOM 0 HG3 ARG A 59 -4.141 5.665 4.682 1.00 0.74 H new ATOM 0 HD2 ARG A 59 -2.345 5.224 2.240 1.00 1.15 H new ATOM 0 HD3 ARG A 59 -2.106 6.425 3.494 1.00 1.15 H new ATOM 0 HE ARG A 59 -2.200 3.997 4.931 1.00 1.12 H new ATOM 0 HH11 ARG A 59 -0.465 5.320 2.199 1.00 2.19 H new ATOM 0 HH12 ARG A 59 0.993 4.372 2.506 1.00 2.19 H new ATOM 0 HH21 ARG A 59 -0.335 2.783 5.323 1.00 2.38 H new ATOM 0 HH22 ARG A 59 1.066 2.947 4.260 1.00 2.38 H new ATOM 1007 N LEU A 60 -7.607 4.059 3.645 1.00 0.52 N ATOM 1008 CA LEU A 60 -8.871 4.849 3.572 1.00 0.54 C ATOM 1009 C LEU A 60 -9.671 4.667 4.867 1.00 0.63 C ATOM 1010 O LEU A 60 -10.612 5.389 5.130 1.00 0.81 O ATOM 1011 CB LEU A 60 -9.710 4.374 2.381 1.00 0.52 C ATOM 1012 CG LEU A 60 -8.922 4.564 1.070 1.00 0.42 C ATOM 1013 CD1 LEU A 60 -9.496 3.643 -0.009 1.00 0.39 C ATOM 1014 CD2 LEU A 60 -9.024 6.022 0.592 1.00 0.74 C ATOM 0 H LEU A 60 -7.510 3.325 2.943 1.00 0.52 H new ATOM 0 HA LEU A 60 -8.626 5.903 3.444 1.00 0.54 H new ATOM 0 HB2 LEU A 60 -9.973 3.324 2.507 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -10.644 4.934 2.338 1.00 0.52 H new ATOM 0 HG LEU A 60 -7.876 4.319 1.252 1.00 0.42 H new ATOM 0 HD11 LEU A 60 -8.939 3.777 -0.936 1.00 0.39 H new ATOM 0 HD12 LEU A 60 -9.414 2.606 0.317 1.00 0.39 H new ATOM 0 HD13 LEU A 60 -10.545 3.889 -0.177 1.00 0.39 H new ATOM 0 HD21 LEU A 60 -8.463 6.141 -0.335 1.00 0.74 H new ATOM 0 HD22 LEU A 60 -10.070 6.276 0.418 1.00 0.74 H new ATOM 0 HD23 LEU A 60 -8.612 6.684 1.353 1.00 0.74 H new ATOM 1026 N GLY A 61 -9.294 3.721 5.688 1.00 0.61 N ATOM 1027 CA GLY A 61 -10.022 3.508 6.978 1.00 0.74 C ATOM 1028 C GLY A 61 -11.149 2.482 6.805 1.00 0.72 C ATOM 1029 O GLY A 61 -12.134 2.516 7.512 1.00 0.82 O ATOM 0 H GLY A 61 -8.513 3.086 5.522 1.00 0.61 H new ATOM 0 HA2 GLY A 61 -9.325 3.163 7.742 1.00 0.74 H new ATOM 0 HA3 GLY A 61 -10.436 4.454 7.328 1.00 0.74 H new ATOM 1033 N LEU A 62 -11.010 1.567 5.883 1.00 0.62 N ATOM 1034 CA LEU A 62 -12.069 0.528 5.679 1.00 0.63 C ATOM 1035 C LEU A 62 -11.728 -0.701 6.532 1.00 0.72 C ATOM 1036 O LEU A 62 -12.493 -1.635 6.639 1.00 0.80 O ATOM 1037 CB LEU A 62 -12.120 0.138 4.201 1.00 0.50 C ATOM 1038 CG LEU A 62 -12.435 1.373 3.344 1.00 0.44 C ATOM 1039 CD1 LEU A 62 -12.090 1.079 1.882 1.00 0.34 C ATOM 1040 CD2 LEU A 62 -13.926 1.733 3.445 1.00 0.53 C ATOM 0 H LEU A 62 -10.207 1.492 5.259 1.00 0.62 H new ATOM 0 HA LEU A 62 -13.041 0.921 5.977 1.00 0.63 H new ATOM 0 HB2 LEU A 62 -11.166 -0.293 3.897 1.00 0.50 H new ATOM 0 HB3 LEU A 62 -12.880 -0.628 4.044 1.00 0.50 H new ATOM 0 HG LEU A 62 -11.841 2.211 3.709 1.00 0.44 H new ATOM 0 HD11 LEU A 62 -12.313 1.955 1.272 1.00 0.34 H new ATOM 0 HD12 LEU A 62 -11.030 0.840 1.799 1.00 0.34 H new ATOM 0 HD13 LEU A 62 -12.681 0.233 1.532 1.00 0.34 H new ATOM 0 HD21 LEU A 62 -14.131 2.610 2.831 1.00 0.53 H new ATOM 0 HD22 LEU A 62 -14.527 0.895 3.092 1.00 0.53 H new ATOM 0 HD23 LEU A 62 -14.179 1.949 4.483 1.00 0.53 H new ATOM 1052 N ALA A 63 -10.580 -0.690 7.144 1.00 0.75 N ATOM 1053 CA ALA A 63 -10.156 -1.828 8.010 1.00 0.86 C ATOM 1054 C ALA A 63 -9.204 -1.253 9.063 1.00 0.99 C ATOM 1055 O ALA A 63 -8.471 -0.326 8.788 1.00 1.02 O ATOM 1056 CB ALA A 63 -9.456 -2.895 7.154 1.00 0.82 C ATOM 0 H ALA A 63 -9.904 0.071 7.081 1.00 0.75 H new ATOM 0 HA ALA A 63 -11.008 -2.305 8.494 1.00 0.86 H new ATOM 0 HB1 ALA A 63 -9.147 -3.726 7.789 1.00 0.82 H new ATOM 0 HB2 ALA A 63 -10.144 -3.258 6.391 1.00 0.82 H new ATOM 0 HB3 ALA A 63 -8.579 -2.459 6.674 1.00 0.82 H new ATOM 1062 N ARG A 64 -9.218 -1.751 10.271 1.00 1.14 N ATOM 1063 CA ARG A 64 -8.313 -1.158 11.301 1.00 1.28 C ATOM 1064 C ARG A 64 -6.880 -1.627 11.090 1.00 1.28 C ATOM 1065 O ARG A 64 -5.948 -1.003 11.556 1.00 1.37 O ATOM 1066 CB ARG A 64 -8.723 -1.566 12.722 1.00 1.47 C ATOM 1067 CG ARG A 64 -10.165 -1.121 13.017 1.00 1.43 C ATOM 1068 CD ARG A 64 -11.171 -2.201 12.586 1.00 1.55 C ATOM 1069 NE ARG A 64 -11.727 -2.858 13.803 1.00 1.79 N ATOM 1070 CZ ARG A 64 -12.812 -3.578 13.721 1.00 2.25 C ATOM 1071 NH1 ARG A 64 -13.417 -3.720 12.575 1.00 2.85 N ATOM 1072 NH2 ARG A 64 -13.294 -4.154 14.788 1.00 2.50 N ATOM 0 H ARG A 64 -9.803 -2.525 10.586 1.00 1.14 H new ATOM 0 HA ARG A 64 -8.389 -0.076 11.192 1.00 1.28 H new ATOM 0 HB2 ARG A 64 -8.640 -2.647 12.834 1.00 1.47 H new ATOM 0 HB3 ARG A 64 -8.043 -1.117 13.446 1.00 1.47 H new ATOM 0 HG2 ARG A 64 -10.277 -0.918 14.082 1.00 1.43 H new ATOM 0 HG3 ARG A 64 -10.377 -0.190 12.492 1.00 1.43 H new ATOM 0 HD2 ARG A 64 -11.974 -1.755 11.999 1.00 1.55 H new ATOM 0 HD3 ARG A 64 -10.682 -2.939 11.950 1.00 1.55 H new ATOM 0 HE ARG A 64 -11.258 -2.744 14.702 1.00 1.79 H new ATOM 0 HH11 ARG A 64 -13.042 -3.268 11.741 1.00 2.85 H new ATOM 0 HH12 ARG A 64 -14.265 -4.283 12.512 1.00 2.85 H new ATOM 0 HH21 ARG A 64 -12.823 -4.041 15.685 1.00 2.50 H new ATOM 0 HH22 ARG A 64 -14.142 -4.717 14.725 1.00 2.50 H new ATOM 1086 N THR A 65 -6.686 -2.752 10.450 1.00 1.23 N ATOM 1087 CA THR A 65 -5.299 -3.288 10.278 1.00 1.28 C ATOM 1088 C THR A 65 -5.128 -3.853 8.866 1.00 1.20 C ATOM 1089 O THR A 65 -6.020 -3.789 8.044 1.00 1.10 O ATOM 1090 CB THR A 65 -5.076 -4.415 11.313 1.00 1.43 C ATOM 1091 OG1 THR A 65 -5.240 -5.681 10.684 1.00 1.41 O ATOM 1092 CG2 THR A 65 -6.095 -4.288 12.459 1.00 1.51 C ATOM 0 H THR A 65 -7.425 -3.322 10.039 1.00 1.23 H new ATOM 0 HA THR A 65 -4.574 -2.488 10.428 1.00 1.28 H new ATOM 0 HB THR A 65 -4.066 -4.329 11.715 1.00 1.43 H new ATOM 0 HG1 THR A 65 -6.133 -6.032 10.883 1.00 1.41 H new ATOM 0 HG21 THR A 65 -5.930 -5.086 13.183 1.00 1.51 H new ATOM 0 HG22 THR A 65 -5.973 -3.322 12.949 1.00 1.51 H new ATOM 0 HG23 THR A 65 -7.105 -4.366 12.058 1.00 1.51 H new ATOM 1100 N ARG A 66 -3.982 -4.415 8.586 1.00 1.26 N ATOM 1101 CA ARG A 66 -3.743 -4.997 7.237 1.00 1.22 C ATOM 1102 C ARG A 66 -4.481 -6.332 7.132 1.00 1.18 C ATOM 1103 O ARG A 66 -4.928 -6.724 6.073 1.00 1.13 O ATOM 1104 CB ARG A 66 -2.242 -5.224 7.036 1.00 1.35 C ATOM 1105 CG ARG A 66 -1.691 -6.069 8.187 1.00 1.94 C ATOM 1106 CD ARG A 66 -0.197 -6.318 7.971 1.00 2.15 C ATOM 1107 NE ARG A 66 0.267 -7.384 8.903 1.00 2.90 N ATOM 1108 CZ ARG A 66 1.416 -7.971 8.705 1.00 3.42 C ATOM 1109 NH1 ARG A 66 2.158 -7.626 7.688 1.00 3.55 N ATOM 1110 NH2 ARG A 66 1.822 -8.903 9.523 1.00 4.25 N ATOM 0 H ARG A 66 -3.200 -4.495 9.236 1.00 1.26 H new ATOM 0 HA ARG A 66 -4.109 -4.313 6.471 1.00 1.22 H new ATOM 0 HB2 ARG A 66 -2.064 -5.727 6.085 1.00 1.35 H new ATOM 0 HB3 ARG A 66 -1.722 -4.267 6.993 1.00 1.35 H new ATOM 0 HG2 ARG A 66 -1.851 -5.558 9.136 1.00 1.94 H new ATOM 0 HG3 ARG A 66 -2.224 -7.018 8.242 1.00 1.94 H new ATOM 0 HD2 ARG A 66 -0.012 -6.616 6.939 1.00 2.15 H new ATOM 0 HD3 ARG A 66 0.365 -5.400 8.143 1.00 2.15 H new ATOM 0 HE ARG A 66 -0.314 -7.655 9.696 1.00 2.90 H new ATOM 0 HH11 ARG A 66 1.840 -6.898 7.048 1.00 3.55 H new ATOM 0 HH12 ARG A 66 3.056 -8.084 7.533 1.00 3.55 H new ATOM 0 HH21 ARG A 66 1.242 -9.173 10.317 1.00 4.25 H new ATOM 0 HH22 ARG A 66 2.720 -9.362 9.368 1.00 4.25 H new ATOM 1124 N ARG A 67 -4.618 -7.030 8.227 1.00 1.25 N ATOM 1125 CA ARG A 67 -5.334 -8.336 8.192 1.00 1.24 C ATOM 1126 C ARG A 67 -6.787 -8.089 7.790 1.00 1.15 C ATOM 1127 O ARG A 67 -7.359 -8.812 6.999 1.00 1.16 O ATOM 1128 CB ARG A 67 -5.293 -8.985 9.578 1.00 1.31 C ATOM 1129 CG ARG A 67 -3.845 -9.021 10.093 1.00 1.66 C ATOM 1130 CD ARG A 67 -2.975 -9.943 9.207 1.00 1.60 C ATOM 1131 NE ARG A 67 -2.103 -10.803 10.071 1.00 2.18 N ATOM 1132 CZ ARG A 67 -1.418 -10.297 11.064 1.00 2.73 C ATOM 1133 NH1 ARG A 67 -1.382 -9.007 11.253 1.00 2.99 N ATOM 1134 NH2 ARG A 67 -0.738 -11.085 11.851 1.00 3.46 N ATOM 0 H ARG A 67 -4.265 -6.752 9.143 1.00 1.25 H new ATOM 0 HA ARG A 67 -4.855 -9.000 7.473 1.00 1.24 H new ATOM 0 HB2 ARG A 67 -5.921 -8.425 10.271 1.00 1.31 H new ATOM 0 HB3 ARG A 67 -5.696 -9.996 9.528 1.00 1.31 H new ATOM 0 HG2 ARG A 67 -3.429 -8.013 10.097 1.00 1.66 H new ATOM 0 HG3 ARG A 67 -3.828 -9.376 11.123 1.00 1.66 H new ATOM 0 HD2 ARG A 67 -3.612 -10.568 8.581 1.00 1.60 H new ATOM 0 HD3 ARG A 67 -2.360 -9.343 8.536 1.00 1.60 H new ATOM 0 HE ARG A 67 -2.042 -11.803 9.881 1.00 2.18 H new ATOM 0 HH11 ARG A 67 -1.890 -8.385 10.624 1.00 2.99 H new ATOM 0 HH12 ARG A 67 -0.846 -8.620 12.030 1.00 2.99 H new ATOM 0 HH21 ARG A 67 -0.742 -12.092 11.691 1.00 3.46 H new ATOM 0 HH22 ARG A 67 -0.203 -10.694 12.626 1.00 3.46 H new ATOM 1148 N GLN A 68 -7.384 -7.063 8.329 1.00 1.08 N ATOM 1149 CA GLN A 68 -8.796 -6.750 7.984 1.00 1.00 C ATOM 1150 C GLN A 68 -8.862 -6.260 6.532 1.00 0.90 C ATOM 1151 O GLN A 68 -9.755 -6.618 5.790 1.00 0.84 O ATOM 1152 CB GLN A 68 -9.322 -5.685 8.963 1.00 1.00 C ATOM 1153 CG GLN A 68 -9.905 -6.353 10.210 1.00 1.35 C ATOM 1154 CD GLN A 68 -8.889 -7.337 10.793 1.00 1.61 C ATOM 1155 OE1 GLN A 68 -7.766 -6.972 11.077 1.00 2.28 O ATOM 1156 NE2 GLN A 68 -9.239 -8.579 10.986 1.00 2.12 N ATOM 0 H GLN A 68 -6.951 -6.425 8.997 1.00 1.08 H new ATOM 0 HA GLN A 68 -9.422 -7.638 8.071 1.00 1.00 H new ATOM 0 HB2 GLN A 68 -8.514 -5.011 9.247 1.00 1.00 H new ATOM 0 HB3 GLN A 68 -10.086 -5.079 8.476 1.00 1.00 H new ATOM 0 HG2 GLN A 68 -10.161 -5.597 10.953 1.00 1.35 H new ATOM 0 HG3 GLN A 68 -10.827 -6.876 9.956 1.00 1.35 H new ATOM 0 HE21 GLN A 68 -10.182 -8.886 10.748 1.00 2.12 H new ATOM 0 HE22 GLN A 68 -8.570 -9.243 11.375 1.00 2.12 H new ATOM 1165 N ALA A 69 -7.923 -5.460 6.113 1.00 0.89 N ATOM 1166 CA ALA A 69 -7.944 -4.970 4.705 1.00 0.80 C ATOM 1167 C ALA A 69 -7.674 -6.134 3.741 1.00 0.84 C ATOM 1168 O ALA A 69 -8.382 -6.325 2.772 1.00 0.82 O ATOM 1169 CB ALA A 69 -6.874 -3.887 4.527 1.00 0.81 C ATOM 0 H ALA A 69 -7.145 -5.125 6.680 1.00 0.89 H new ATOM 0 HA ALA A 69 -8.925 -4.550 4.484 1.00 0.80 H new ATOM 0 HB1 ALA A 69 -6.888 -3.528 3.498 1.00 0.81 H new ATOM 0 HB2 ALA A 69 -7.080 -3.058 5.204 1.00 0.81 H new ATOM 0 HB3 ALA A 69 -5.893 -4.305 4.752 1.00 0.81 H new ATOM 1175 N ARG A 70 -6.651 -6.903 3.988 1.00 0.97 N ATOM 1176 CA ARG A 70 -6.335 -8.040 3.075 1.00 1.05 C ATOM 1177 C ARG A 70 -7.604 -8.847 2.779 1.00 1.03 C ATOM 1178 O ARG A 70 -7.964 -9.060 1.637 1.00 1.06 O ATOM 1179 CB ARG A 70 -5.299 -8.953 3.743 1.00 1.22 C ATOM 1180 CG ARG A 70 -4.752 -9.973 2.724 1.00 1.67 C ATOM 1181 CD ARG A 70 -3.559 -9.378 1.965 1.00 1.84 C ATOM 1182 NE ARG A 70 -2.458 -9.089 2.926 1.00 1.97 N ATOM 1183 CZ ARG A 70 -1.251 -8.861 2.485 1.00 2.40 C ATOM 1184 NH1 ARG A 70 -1.009 -8.883 1.203 1.00 2.74 N ATOM 1185 NH2 ARG A 70 -0.285 -8.610 3.327 1.00 3.09 N ATOM 0 H ARG A 70 -6.019 -6.795 4.782 1.00 0.97 H new ATOM 0 HA ARG A 70 -5.936 -7.646 2.140 1.00 1.05 H new ATOM 0 HB2 ARG A 70 -4.481 -8.355 4.144 1.00 1.22 H new ATOM 0 HB3 ARG A 70 -5.753 -9.476 4.584 1.00 1.22 H new ATOM 0 HG2 ARG A 70 -4.447 -10.884 3.239 1.00 1.67 H new ATOM 0 HG3 ARG A 70 -5.537 -10.252 2.021 1.00 1.67 H new ATOM 0 HD2 ARG A 70 -3.216 -10.075 1.200 1.00 1.84 H new ATOM 0 HD3 ARG A 70 -3.859 -8.464 1.452 1.00 1.84 H new ATOM 0 HE ARG A 70 -2.647 -9.069 3.928 1.00 1.97 H new ATOM 0 HH11 ARG A 70 -1.763 -9.078 0.545 1.00 2.74 H new ATOM 0 HH12 ARG A 70 -0.065 -8.705 0.859 1.00 2.74 H new ATOM 0 HH21 ARG A 70 -0.474 -8.592 4.329 1.00 3.09 H new ATOM 0 HH22 ARG A 70 0.658 -8.432 2.982 1.00 3.09 H new ATOM 1199 N GLN A 71 -8.273 -9.312 3.797 1.00 1.02 N ATOM 1200 CA GLN A 71 -9.506 -10.123 3.579 1.00 1.04 C ATOM 1201 C GLN A 71 -10.538 -9.320 2.776 1.00 0.92 C ATOM 1202 O GLN A 71 -11.245 -9.865 1.951 1.00 0.96 O ATOM 1203 CB GLN A 71 -10.100 -10.516 4.940 1.00 1.10 C ATOM 1204 CG GLN A 71 -9.327 -11.705 5.524 1.00 1.17 C ATOM 1205 CD GLN A 71 -7.825 -11.410 5.502 1.00 1.48 C ATOM 1206 OE1 GLN A 71 -7.234 -11.128 6.525 1.00 2.27 O ATOM 1207 NE2 GLN A 71 -7.178 -11.467 4.370 1.00 1.72 N ATOM 0 H GLN A 71 -8.019 -9.165 4.774 1.00 1.02 H new ATOM 0 HA GLN A 71 -9.249 -11.020 3.016 1.00 1.04 H new ATOM 0 HB2 GLN A 71 -10.054 -9.669 5.625 1.00 1.10 H new ATOM 0 HB3 GLN A 71 -11.152 -10.776 4.826 1.00 1.10 H new ATOM 0 HG2 GLN A 71 -9.654 -11.896 6.546 1.00 1.17 H new ATOM 0 HG3 GLN A 71 -9.538 -12.606 4.948 1.00 1.17 H new ATOM 0 HE21 GLN A 71 -7.674 -11.704 3.511 1.00 1.72 H new ATOM 0 HE22 GLN A 71 -6.177 -11.275 4.345 1.00 1.72 H new ATOM 1216 N LEU A 72 -10.640 -8.038 3.002 1.00 0.80 N ATOM 1217 CA LEU A 72 -11.641 -7.241 2.234 1.00 0.69 C ATOM 1218 C LEU A 72 -11.337 -7.344 0.738 1.00 0.67 C ATOM 1219 O LEU A 72 -12.226 -7.310 -0.088 1.00 0.72 O ATOM 1220 CB LEU A 72 -11.593 -5.774 2.666 1.00 0.60 C ATOM 1221 CG LEU A 72 -12.269 -5.603 4.037 1.00 0.67 C ATOM 1222 CD1 LEU A 72 -12.078 -4.159 4.516 1.00 0.63 C ATOM 1223 CD2 LEU A 72 -13.781 -5.923 3.943 1.00 0.73 C ATOM 0 H LEU A 72 -10.082 -7.513 3.676 1.00 0.80 H new ATOM 0 HA LEU A 72 -12.637 -7.636 2.434 1.00 0.69 H new ATOM 0 HB2 LEU A 72 -10.558 -5.436 2.718 1.00 0.60 H new ATOM 0 HB3 LEU A 72 -12.095 -5.152 1.925 1.00 0.60 H new ATOM 0 HG LEU A 72 -11.812 -6.294 4.745 1.00 0.67 H new ATOM 0 HD11 LEU A 72 -12.555 -4.032 5.488 1.00 0.63 H new ATOM 0 HD12 LEU A 72 -11.013 -3.943 4.604 1.00 0.63 H new ATOM 0 HD13 LEU A 72 -12.529 -3.475 3.798 1.00 0.63 H new ATOM 0 HD21 LEU A 72 -14.241 -5.796 4.923 1.00 0.73 H new ATOM 0 HD22 LEU A 72 -14.252 -5.246 3.230 1.00 0.73 H new ATOM 0 HD23 LEU A 72 -13.915 -6.952 3.610 1.00 0.73 H new ATOM 1235 N VAL A 73 -10.090 -7.470 0.382 1.00 0.68 N ATOM 1236 CA VAL A 73 -9.737 -7.577 -1.061 1.00 0.68 C ATOM 1237 C VAL A 73 -10.104 -8.972 -1.575 1.00 0.76 C ATOM 1238 O VAL A 73 -10.968 -9.131 -2.414 1.00 0.76 O ATOM 1239 CB VAL A 73 -8.230 -7.346 -1.233 1.00 0.74 C ATOM 1240 CG1 VAL A 73 -7.812 -7.696 -2.663 1.00 0.81 C ATOM 1241 CG2 VAL A 73 -7.904 -5.876 -0.961 1.00 0.65 C ATOM 0 H VAL A 73 -9.300 -7.504 1.027 1.00 0.68 H new ATOM 0 HA VAL A 73 -10.288 -6.827 -1.629 1.00 0.68 H new ATOM 0 HB VAL A 73 -7.689 -7.980 -0.530 1.00 0.74 H new ATOM 0 HG11 VAL A 73 -6.741 -7.530 -2.780 1.00 0.81 H new ATOM 0 HG12 VAL A 73 -8.041 -8.743 -2.863 1.00 0.81 H new ATOM 0 HG13 VAL A 73 -8.356 -7.065 -3.366 1.00 0.81 H new ATOM 0 HG21 VAL A 73 -6.833 -5.712 -1.083 1.00 0.65 H new ATOM 0 HG22 VAL A 73 -8.450 -5.246 -1.663 1.00 0.65 H new ATOM 0 HG23 VAL A 73 -8.196 -5.621 0.058 1.00 0.65 H new ATOM 1251 N THR A 74 -9.438 -9.976 -1.082 1.00 0.87 N ATOM 1252 CA THR A 74 -9.706 -11.369 -1.530 1.00 0.96 C ATOM 1253 C THR A 74 -11.210 -11.626 -1.681 1.00 0.92 C ATOM 1254 O THR A 74 -11.640 -12.295 -2.599 1.00 0.99 O ATOM 1255 CB THR A 74 -9.129 -12.326 -0.491 1.00 1.06 C ATOM 1256 OG1 THR A 74 -9.547 -11.923 0.805 1.00 1.06 O ATOM 1257 CG2 THR A 74 -7.601 -12.301 -0.569 1.00 1.15 C ATOM 0 H THR A 74 -8.707 -9.889 -0.376 1.00 0.87 H new ATOM 0 HA THR A 74 -9.241 -11.525 -2.503 1.00 0.96 H new ATOM 0 HB THR A 74 -9.485 -13.337 -0.688 1.00 1.06 H new ATOM 0 HG1 THR A 74 -9.178 -12.538 1.473 1.00 1.06 H new ATOM 0 HG21 THR A 74 -7.188 -12.984 0.173 1.00 1.15 H new ATOM 0 HG22 THR A 74 -7.282 -12.610 -1.565 1.00 1.15 H new ATOM 0 HG23 THR A 74 -7.243 -11.291 -0.371 1.00 1.15 H new ATOM 1265 N HIS A 75 -12.014 -11.119 -0.787 1.00 0.86 N ATOM 1266 CA HIS A 75 -13.488 -11.360 -0.883 1.00 0.85 C ATOM 1267 C HIS A 75 -14.151 -10.301 -1.772 1.00 0.78 C ATOM 1268 O HIS A 75 -15.234 -9.832 -1.482 1.00 0.83 O ATOM 1269 CB HIS A 75 -14.101 -11.297 0.517 1.00 0.84 C ATOM 1270 CG HIS A 75 -13.683 -12.508 1.304 1.00 0.95 C ATOM 1271 ND1 HIS A 75 -14.523 -13.119 2.225 1.00 1.18 N ATOM 1272 CD2 HIS A 75 -12.519 -13.236 1.318 1.00 1.03 C ATOM 1273 CE1 HIS A 75 -13.857 -14.164 2.751 1.00 1.31 C ATOM 1274 NE2 HIS A 75 -12.634 -14.277 2.231 1.00 1.20 N ATOM 0 H HIS A 75 -11.718 -10.549 0.005 1.00 0.86 H new ATOM 0 HA HIS A 75 -13.655 -12.343 -1.323 1.00 0.85 H new ATOM 0 HB2 HIS A 75 -13.777 -10.390 1.027 1.00 0.84 H new ATOM 0 HB3 HIS A 75 -15.188 -11.253 0.448 1.00 0.84 H new ATOM 0 HD2 HIS A 75 -11.648 -13.031 0.713 1.00 1.03 H new ATOM 0 HE1 HIS A 75 -14.262 -14.828 3.500 1.00 1.31 H new ATOM 0 HE2 HIS A 75 -11.930 -14.980 2.456 1.00 1.20 H new ATOM 1283 N GLY A 76 -13.520 -9.915 -2.848 1.00 0.77 N ATOM 1284 CA GLY A 76 -14.135 -8.884 -3.737 1.00 0.74 C ATOM 1285 C GLY A 76 -14.314 -7.588 -2.946 1.00 0.67 C ATOM 1286 O GLY A 76 -13.353 -7.000 -2.494 1.00 0.75 O ATOM 0 H GLY A 76 -12.611 -10.266 -3.150 1.00 0.77 H new ATOM 0 HA2 GLY A 76 -13.501 -8.710 -4.606 1.00 0.74 H new ATOM 0 HA3 GLY A 76 -15.098 -9.234 -4.109 1.00 0.74 H new ATOM 1290 N HIS A 77 -15.533 -7.138 -2.774 1.00 0.60 N ATOM 1291 CA HIS A 77 -15.790 -5.886 -2.006 1.00 0.58 C ATOM 1292 C HIS A 77 -15.068 -4.695 -2.644 1.00 0.50 C ATOM 1293 O HIS A 77 -15.680 -3.842 -3.255 1.00 0.51 O ATOM 1294 CB HIS A 77 -15.330 -6.065 -0.559 1.00 0.62 C ATOM 1295 CG HIS A 77 -16.037 -7.248 0.043 1.00 0.65 C ATOM 1296 ND1 HIS A 77 -17.335 -7.591 -0.310 1.00 0.69 N ATOM 1297 CD2 HIS A 77 -15.642 -8.181 0.971 1.00 0.73 C ATOM 1298 CE1 HIS A 77 -17.671 -8.687 0.396 1.00 0.76 C ATOM 1299 NE2 HIS A 77 -16.675 -9.084 1.189 1.00 0.77 N ATOM 0 H HIS A 77 -16.370 -7.593 -3.139 1.00 0.60 H new ATOM 0 HA HIS A 77 -16.861 -5.683 -2.023 1.00 0.58 H new ATOM 0 HB2 HIS A 77 -14.251 -6.215 -0.524 1.00 0.62 H new ATOM 0 HB3 HIS A 77 -15.546 -5.165 0.018 1.00 0.62 H new ATOM 0 HD2 HIS A 77 -14.677 -8.208 1.456 1.00 0.73 H new ATOM 0 HE1 HIS A 77 -18.628 -9.183 0.329 1.00 0.76 H new ATOM 0 HE2 HIS A 77 -16.672 -9.883 1.823 1.00 0.77 H new ATOM 1308 N ILE A 78 -13.781 -4.620 -2.490 1.00 0.49 N ATOM 1309 CA ILE A 78 -13.019 -3.475 -3.064 1.00 0.45 C ATOM 1310 C ILE A 78 -13.263 -3.360 -4.577 1.00 0.51 C ATOM 1311 O ILE A 78 -12.751 -4.137 -5.361 1.00 0.57 O ATOM 1312 CB ILE A 78 -11.526 -3.697 -2.794 1.00 0.45 C ATOM 1313 CG1 ILE A 78 -11.325 -4.085 -1.319 1.00 0.91 C ATOM 1314 CG2 ILE A 78 -10.735 -2.420 -3.105 1.00 0.60 C ATOM 1315 CD1 ILE A 78 -12.033 -3.076 -0.404 1.00 0.37 C ATOM 0 H ILE A 78 -13.217 -5.306 -1.988 1.00 0.49 H new ATOM 0 HA ILE A 78 -13.354 -2.549 -2.597 1.00 0.45 H new ATOM 0 HB ILE A 78 -11.164 -4.500 -3.436 1.00 0.45 H new ATOM 0 HG12 ILE A 78 -11.718 -5.086 -1.142 1.00 0.91 H new ATOM 0 HG13 ILE A 78 -10.261 -4.115 -1.085 1.00 0.91 H new ATOM 0 HG21 ILE A 78 -9.676 -2.591 -2.909 1.00 0.60 H new ATOM 0 HG22 ILE A 78 -10.872 -2.153 -4.153 1.00 0.60 H new ATOM 0 HG23 ILE A 78 -11.094 -1.607 -2.474 1.00 0.60 H new ATOM 0 HD11 ILE A 78 -11.883 -3.362 0.637 1.00 0.37 H new ATOM 0 HD12 ILE A 78 -11.619 -2.081 -0.570 1.00 0.37 H new ATOM 0 HD13 ILE A 78 -13.100 -3.068 -0.628 1.00 0.37 H new ATOM 1327 N LEU A 79 -14.025 -2.372 -4.994 1.00 0.52 N ATOM 1328 CA LEU A 79 -14.286 -2.173 -6.457 1.00 0.61 C ATOM 1329 C LEU A 79 -13.333 -1.102 -6.988 1.00 0.63 C ATOM 1330 O LEU A 79 -13.430 0.052 -6.620 1.00 0.69 O ATOM 1331 CB LEU A 79 -15.710 -1.655 -6.703 1.00 0.68 C ATOM 1332 CG LEU A 79 -16.773 -2.638 -6.203 1.00 0.68 C ATOM 1333 CD1 LEU A 79 -18.157 -2.029 -6.467 1.00 0.76 C ATOM 1334 CD2 LEU A 79 -16.643 -3.975 -6.951 1.00 0.76 C ATOM 0 H LEU A 79 -14.478 -1.694 -4.381 1.00 0.52 H new ATOM 0 HA LEU A 79 -14.148 -3.133 -6.954 1.00 0.61 H new ATOM 0 HB2 LEU A 79 -15.839 -0.696 -6.201 1.00 0.68 H new ATOM 0 HB3 LEU A 79 -15.852 -1.479 -7.769 1.00 0.68 H new ATOM 0 HG LEU A 79 -16.640 -2.821 -5.137 1.00 0.68 H new ATOM 0 HD11 LEU A 79 -18.929 -2.715 -6.118 1.00 0.76 H new ATOM 0 HD12 LEU A 79 -18.245 -1.082 -5.935 1.00 0.76 H new ATOM 0 HD13 LEU A 79 -18.281 -1.857 -7.536 1.00 0.76 H new ATOM 0 HD21 LEU A 79 -17.402 -4.669 -6.590 1.00 0.76 H new ATOM 0 HD22 LEU A 79 -16.781 -3.809 -8.019 1.00 0.76 H new ATOM 0 HD23 LEU A 79 -15.653 -4.396 -6.774 1.00 0.76 H new ATOM 1346 N VAL A 80 -12.431 -1.451 -7.863 1.00 0.64 N ATOM 1347 CA VAL A 80 -11.505 -0.420 -8.421 1.00 0.69 C ATOM 1348 C VAL A 80 -12.129 0.146 -9.700 1.00 0.82 C ATOM 1349 O VAL A 80 -12.636 -0.586 -10.526 1.00 0.92 O ATOM 1350 CB VAL A 80 -10.149 -1.058 -8.723 1.00 0.76 C ATOM 1351 CG1 VAL A 80 -9.299 -0.110 -9.576 1.00 0.91 C ATOM 1352 CG2 VAL A 80 -9.430 -1.328 -7.401 1.00 0.70 C ATOM 0 H VAL A 80 -12.294 -2.398 -8.215 1.00 0.64 H new ATOM 0 HA VAL A 80 -11.352 0.385 -7.702 1.00 0.69 H new ATOM 0 HB VAL A 80 -10.298 -1.989 -9.271 1.00 0.76 H new ATOM 0 HG11 VAL A 80 -8.335 -0.574 -9.785 1.00 0.91 H new ATOM 0 HG12 VAL A 80 -9.814 0.096 -10.514 1.00 0.91 H new ATOM 0 HG13 VAL A 80 -9.142 0.824 -9.036 1.00 0.91 H new ATOM 0 HG21 VAL A 80 -8.460 -1.784 -7.601 1.00 0.70 H new ATOM 0 HG22 VAL A 80 -9.287 -0.389 -6.866 1.00 0.70 H new ATOM 0 HG23 VAL A 80 -10.030 -2.004 -6.792 1.00 0.70 H new ATOM 1362 N ASP A 81 -12.106 1.443 -9.863 1.00 0.85 N ATOM 1363 CA ASP A 81 -12.712 2.056 -11.084 1.00 1.00 C ATOM 1364 C ASP A 81 -14.085 1.426 -11.336 1.00 1.01 C ATOM 1365 O ASP A 81 -14.627 1.502 -12.421 1.00 1.14 O ATOM 1366 CB ASP A 81 -11.814 1.793 -12.296 1.00 1.10 C ATOM 1367 CG ASP A 81 -12.250 2.688 -13.457 1.00 1.43 C ATOM 1368 OD1 ASP A 81 -12.527 3.851 -13.211 1.00 1.82 O ATOM 1369 OD2 ASP A 81 -12.298 2.197 -14.572 1.00 1.98 O ATOM 0 H ASP A 81 -11.694 2.104 -9.205 1.00 0.85 H new ATOM 0 HA ASP A 81 -12.815 3.131 -10.933 1.00 1.00 H new ATOM 0 HB2 ASP A 81 -10.773 1.992 -12.041 1.00 1.10 H new ATOM 0 HB3 ASP A 81 -11.876 0.745 -12.588 1.00 1.10 H new ATOM 1374 N GLY A 82 -14.639 0.783 -10.342 1.00 0.95 N ATOM 1375 CA GLY A 82 -15.964 0.120 -10.516 1.00 0.98 C ATOM 1376 C GLY A 82 -15.732 -1.327 -10.954 1.00 0.96 C ATOM 1377 O GLY A 82 -16.456 -1.865 -11.768 1.00 1.03 O ATOM 0 H GLY A 82 -14.228 0.688 -9.413 1.00 0.95 H new ATOM 0 HA2 GLY A 82 -16.526 0.147 -9.582 1.00 0.98 H new ATOM 0 HA3 GLY A 82 -16.557 0.650 -11.261 1.00 0.98 H new ATOM 1381 N SER A 83 -14.716 -1.958 -10.422 1.00 0.90 N ATOM 1382 CA SER A 83 -14.415 -3.372 -10.804 1.00 0.91 C ATOM 1383 C SER A 83 -13.849 -4.120 -9.597 1.00 0.82 C ATOM 1384 O SER A 83 -12.939 -3.657 -8.939 1.00 0.74 O ATOM 1385 CB SER A 83 -13.376 -3.382 -11.930 1.00 0.98 C ATOM 1386 OG SER A 83 -14.009 -3.043 -13.157 1.00 1.10 O ATOM 0 H SER A 83 -14.079 -1.553 -9.736 1.00 0.90 H new ATOM 0 HA SER A 83 -15.331 -3.858 -11.139 1.00 0.91 H new ATOM 0 HB2 SER A 83 -12.579 -2.672 -11.711 1.00 0.98 H new ATOM 0 HB3 SER A 83 -12.914 -4.367 -12.006 1.00 0.98 H new ATOM 0 HG SER A 83 -14.929 -2.756 -12.982 1.00 1.10 H new ATOM 1392 N ARG A 84 -14.372 -5.279 -9.309 1.00 0.84 N ATOM 1393 CA ARG A 84 -13.851 -6.057 -8.154 1.00 0.78 C ATOM 1394 C ARG A 84 -12.413 -6.480 -8.445 1.00 0.79 C ATOM 1395 O ARG A 84 -12.114 -7.017 -9.493 1.00 0.89 O ATOM 1396 CB ARG A 84 -14.719 -7.299 -7.933 1.00 0.85 C ATOM 1397 CG ARG A 84 -14.736 -8.148 -9.206 1.00 1.27 C ATOM 1398 CD ARG A 84 -15.867 -9.175 -9.120 1.00 1.34 C ATOM 1399 NE ARG A 84 -15.678 -10.214 -10.171 1.00 1.97 N ATOM 1400 CZ ARG A 84 -16.337 -11.338 -10.103 1.00 2.29 C ATOM 1401 NH1 ARG A 84 -17.161 -11.552 -9.113 1.00 2.36 N ATOM 1402 NH2 ARG A 84 -16.172 -12.248 -11.023 1.00 3.07 N ATOM 0 H ARG A 84 -15.136 -5.719 -9.823 1.00 0.84 H new ATOM 0 HA ARG A 84 -13.878 -5.440 -7.256 1.00 0.78 H new ATOM 0 HB2 ARG A 84 -14.329 -7.883 -7.099 1.00 0.85 H new ATOM 0 HB3 ARG A 84 -15.734 -7.003 -7.668 1.00 0.85 H new ATOM 0 HG2 ARG A 84 -14.875 -7.510 -10.079 1.00 1.27 H new ATOM 0 HG3 ARG A 84 -13.779 -8.655 -9.331 1.00 1.27 H new ATOM 0 HD2 ARG A 84 -15.877 -9.638 -8.134 1.00 1.34 H new ATOM 0 HD3 ARG A 84 -16.830 -8.682 -9.250 1.00 1.34 H new ATOM 0 HE ARG A 84 -15.033 -10.047 -10.944 1.00 1.97 H new ATOM 0 HH11 ARG A 84 -17.289 -10.841 -8.393 1.00 2.36 H new ATOM 0 HH12 ARG A 84 -17.676 -12.431 -9.059 1.00 2.36 H new ATOM 0 HH21 ARG A 84 -15.528 -12.081 -11.796 1.00 3.07 H new ATOM 0 HH22 ARG A 84 -16.687 -13.127 -10.970 1.00 3.07 H new ATOM 1416 N VAL A 85 -11.521 -6.237 -7.519 1.00 0.72 N ATOM 1417 CA VAL A 85 -10.085 -6.614 -7.711 1.00 0.78 C ATOM 1418 C VAL A 85 -9.658 -7.503 -6.544 1.00 0.79 C ATOM 1419 O VAL A 85 -8.982 -7.077 -5.634 1.00 0.79 O ATOM 1420 CB VAL A 85 -9.238 -5.329 -7.761 1.00 0.72 C ATOM 1421 CG1 VAL A 85 -7.733 -5.647 -7.597 1.00 0.85 C ATOM 1422 CG2 VAL A 85 -9.484 -4.639 -9.112 1.00 0.77 C ATOM 0 H VAL A 85 -11.728 -5.788 -6.627 1.00 0.72 H new ATOM 0 HA VAL A 85 -9.944 -7.161 -8.643 1.00 0.78 H new ATOM 0 HB VAL A 85 -9.529 -4.674 -6.940 1.00 0.72 H new ATOM 0 HG11 VAL A 85 -7.159 -4.721 -7.636 1.00 0.85 H new ATOM 0 HG12 VAL A 85 -7.567 -6.136 -6.637 1.00 0.85 H new ATOM 0 HG13 VAL A 85 -7.411 -6.308 -8.402 1.00 0.85 H new ATOM 0 HG21 VAL A 85 -8.892 -3.725 -9.167 1.00 0.77 H new ATOM 0 HG22 VAL A 85 -9.193 -5.309 -9.921 1.00 0.77 H new ATOM 0 HG23 VAL A 85 -10.541 -4.393 -9.207 1.00 0.77 H new ATOM 1432 N ASN A 86 -10.065 -8.745 -6.565 1.00 0.83 N ATOM 1433 CA ASN A 86 -9.698 -9.673 -5.460 1.00 0.87 C ATOM 1434 C ASN A 86 -8.200 -9.963 -5.516 1.00 0.99 C ATOM 1435 O ASN A 86 -7.697 -10.822 -4.821 1.00 1.33 O ATOM 1436 CB ASN A 86 -10.479 -10.980 -5.610 1.00 0.94 C ATOM 1437 CG ASN A 86 -11.957 -10.669 -5.852 1.00 1.45 C ATOM 1438 OD1 ASN A 86 -12.789 -10.920 -5.003 1.00 1.99 O ATOM 1439 ND2 ASN A 86 -12.321 -10.129 -6.983 1.00 2.18 N ATOM 0 H ASN A 86 -10.637 -9.156 -7.303 1.00 0.83 H new ATOM 0 HA ASN A 86 -9.943 -9.213 -4.502 1.00 0.87 H new ATOM 0 HB2 ASN A 86 -10.079 -11.562 -6.440 1.00 0.94 H new ATOM 0 HB3 ASN A 86 -10.367 -11.588 -4.712 1.00 0.94 H new ATOM 0 HD21 ASN A 86 -13.304 -9.918 -7.154 1.00 2.18 H new ATOM 0 HD22 ASN A 86 -11.622 -9.918 -7.696 1.00 2.18 H new ATOM 1446 N ILE A 87 -7.480 -9.246 -6.337 1.00 0.92 N ATOM 1447 CA ILE A 87 -6.009 -9.466 -6.442 1.00 1.02 C ATOM 1448 C ILE A 87 -5.295 -8.429 -5.552 1.00 1.02 C ATOM 1449 O ILE A 87 -5.361 -7.247 -5.826 1.00 1.03 O ATOM 1450 CB ILE A 87 -5.580 -9.264 -7.899 1.00 1.09 C ATOM 1451 CG1 ILE A 87 -6.250 -10.321 -8.792 1.00 1.12 C ATOM 1452 CG2 ILE A 87 -4.064 -9.409 -8.007 1.00 1.22 C ATOM 1453 CD1 ILE A 87 -7.770 -10.096 -8.858 1.00 1.08 C ATOM 0 H ILE A 87 -7.850 -8.513 -6.943 1.00 0.92 H new ATOM 0 HA ILE A 87 -5.751 -10.475 -6.121 1.00 1.02 H new ATOM 0 HB ILE A 87 -5.882 -8.269 -8.225 1.00 1.09 H new ATOM 0 HG12 ILE A 87 -5.827 -10.276 -9.796 1.00 1.12 H new ATOM 0 HG13 ILE A 87 -6.042 -11.318 -8.402 1.00 1.12 H new ATOM 0 HG21 ILE A 87 -3.758 -9.266 -9.043 1.00 1.22 H new ATOM 0 HG22 ILE A 87 -3.581 -8.660 -7.379 1.00 1.22 H new ATOM 0 HG23 ILE A 87 -3.769 -10.405 -7.676 1.00 1.22 H new ATOM 0 HD11 ILE A 87 -8.223 -10.855 -9.495 1.00 1.08 H new ATOM 0 HD12 ILE A 87 -8.192 -10.165 -7.855 1.00 1.08 H new ATOM 0 HD13 ILE A 87 -7.974 -9.108 -9.270 1.00 1.08 H new ATOM 1465 N PRO A 88 -4.630 -8.838 -4.488 1.00 1.07 N ATOM 1466 CA PRO A 88 -3.935 -7.880 -3.580 1.00 1.11 C ATOM 1467 C PRO A 88 -2.594 -7.401 -4.154 1.00 1.24 C ATOM 1468 O PRO A 88 -2.115 -6.334 -3.825 1.00 1.34 O ATOM 1469 CB PRO A 88 -3.732 -8.693 -2.295 1.00 1.16 C ATOM 1470 CG PRO A 88 -3.612 -10.113 -2.753 1.00 1.27 C ATOM 1471 CD PRO A 88 -4.459 -10.234 -4.030 1.00 1.14 C ATOM 0 HA PRO A 88 -4.509 -6.966 -3.426 1.00 1.11 H new ATOM 0 HB2 PRO A 88 -2.837 -8.373 -1.762 1.00 1.16 H new ATOM 0 HB3 PRO A 88 -4.572 -8.568 -1.611 1.00 1.16 H new ATOM 0 HG2 PRO A 88 -2.572 -10.370 -2.952 1.00 1.27 H new ATOM 0 HG3 PRO A 88 -3.968 -10.800 -1.985 1.00 1.27 H new ATOM 0 HD2 PRO A 88 -3.958 -10.841 -4.784 1.00 1.14 H new ATOM 0 HD3 PRO A 88 -5.420 -10.707 -3.827 1.00 1.14 H new ATOM 1479 N SER A 89 -1.986 -8.180 -5.007 1.00 1.34 N ATOM 1480 CA SER A 89 -0.680 -7.764 -5.596 1.00 1.50 C ATOM 1481 C SER A 89 -0.923 -6.774 -6.738 1.00 1.40 C ATOM 1482 O SER A 89 -0.010 -6.135 -7.223 1.00 1.48 O ATOM 1483 CB SER A 89 0.050 -8.994 -6.136 1.00 1.71 C ATOM 1484 OG SER A 89 1.363 -8.624 -6.534 1.00 1.84 O ATOM 0 H SER A 89 -2.336 -9.085 -5.321 1.00 1.34 H new ATOM 0 HA SER A 89 -0.072 -7.287 -4.827 1.00 1.50 H new ATOM 0 HB2 SER A 89 0.094 -9.770 -5.371 1.00 1.71 H new ATOM 0 HB3 SER A 89 -0.495 -9.412 -6.983 1.00 1.71 H new ATOM 0 HG SER A 89 1.368 -7.684 -6.810 1.00 1.84 H new ATOM 1490 N TYR A 90 -2.146 -6.641 -7.172 1.00 1.28 N ATOM 1491 CA TYR A 90 -2.443 -5.692 -8.283 1.00 1.23 C ATOM 1492 C TYR A 90 -1.973 -4.294 -7.879 1.00 1.25 C ATOM 1493 O TYR A 90 -1.506 -4.085 -6.777 1.00 1.65 O ATOM 1494 CB TYR A 90 -3.951 -5.681 -8.564 1.00 1.12 C ATOM 1495 CG TYR A 90 -4.255 -4.728 -9.701 1.00 1.12 C ATOM 1496 CD1 TYR A 90 -3.749 -4.986 -10.982 1.00 1.67 C ATOM 1497 CD2 TYR A 90 -5.043 -3.588 -9.480 1.00 1.46 C ATOM 1498 CE1 TYR A 90 -4.030 -4.108 -12.036 1.00 1.75 C ATOM 1499 CE2 TYR A 90 -5.322 -2.712 -10.534 1.00 1.44 C ATOM 1500 CZ TYR A 90 -4.816 -2.971 -11.812 1.00 1.22 C ATOM 1501 OH TYR A 90 -5.092 -2.107 -12.852 1.00 1.31 O ATOM 0 H TYR A 90 -2.952 -7.148 -6.806 1.00 1.28 H new ATOM 0 HA TYR A 90 -1.921 -6.004 -9.188 1.00 1.23 H new ATOM 0 HB2 TYR A 90 -4.290 -6.685 -8.819 1.00 1.12 H new ATOM 0 HB3 TYR A 90 -4.495 -5.379 -7.669 1.00 1.12 H new ATOM 0 HD1 TYR A 90 -3.142 -5.862 -11.156 1.00 1.67 H new ATOM 0 HD2 TYR A 90 -5.435 -3.387 -8.494 1.00 1.46 H new ATOM 0 HE1 TYR A 90 -3.640 -4.308 -13.023 1.00 1.75 H new ATOM 0 HE2 TYR A 90 -5.928 -1.835 -10.361 1.00 1.44 H new ATOM 0 HH TYR A 90 -5.651 -1.371 -12.526 1.00 1.31 H new ATOM 1511 N ARG A 91 -2.082 -3.333 -8.760 1.00 1.24 N ATOM 1512 CA ARG A 91 -1.630 -1.948 -8.422 1.00 1.22 C ATOM 1513 C ARG A 91 -2.572 -0.928 -9.060 1.00 1.16 C ATOM 1514 O ARG A 91 -2.992 -1.074 -10.191 1.00 1.28 O ATOM 1515 CB ARG A 91 -0.211 -1.736 -8.950 1.00 1.33 C ATOM 1516 CG ARG A 91 0.755 -2.657 -8.192 1.00 1.41 C ATOM 1517 CD ARG A 91 2.219 -2.347 -8.584 1.00 1.57 C ATOM 1518 NE ARG A 91 2.962 -3.622 -8.850 1.00 1.61 N ATOM 1519 CZ ARG A 91 2.883 -4.640 -8.032 1.00 2.20 C ATOM 1520 NH1 ARG A 91 2.231 -4.536 -6.907 1.00 2.99 N ATOM 1521 NH2 ARG A 91 3.487 -5.758 -8.329 1.00 2.49 N ATOM 0 H ARG A 91 -2.464 -3.446 -9.699 1.00 1.24 H new ATOM 0 HA ARG A 91 -1.640 -1.817 -7.340 1.00 1.22 H new ATOM 0 HB2 ARG A 91 -0.172 -1.949 -10.018 1.00 1.33 H new ATOM 0 HB3 ARG A 91 0.085 -0.695 -8.822 1.00 1.33 H new ATOM 0 HG2 ARG A 91 0.624 -2.526 -7.118 1.00 1.41 H new ATOM 0 HG3 ARG A 91 0.525 -3.699 -8.416 1.00 1.41 H new ATOM 0 HD2 ARG A 91 2.240 -1.713 -9.470 1.00 1.57 H new ATOM 0 HD3 ARG A 91 2.708 -1.792 -7.784 1.00 1.57 H new ATOM 0 HE ARG A 91 3.541 -3.697 -9.686 1.00 1.61 H new ATOM 0 HH11 ARG A 91 1.778 -3.656 -6.660 1.00 2.99 H new ATOM 0 HH12 ARG A 91 2.174 -5.334 -6.275 1.00 2.99 H new ATOM 0 HH21 ARG A 91 4.018 -5.836 -9.196 1.00 2.49 H new ATOM 0 HH22 ARG A 91 3.428 -6.554 -7.694 1.00 2.49 H new ATOM 1535 N VAL A 92 -2.911 0.102 -8.333 1.00 1.01 N ATOM 1536 CA VAL A 92 -3.835 1.144 -8.874 1.00 0.98 C ATOM 1537 C VAL A 92 -3.025 2.301 -9.467 1.00 1.05 C ATOM 1538 O VAL A 92 -1.963 2.639 -8.983 1.00 1.10 O ATOM 1539 CB VAL A 92 -4.713 1.661 -7.732 1.00 0.88 C ATOM 1540 CG1 VAL A 92 -5.922 2.404 -8.302 1.00 0.87 C ATOM 1541 CG2 VAL A 92 -5.190 0.473 -6.893 1.00 0.84 C ATOM 0 H VAL A 92 -2.586 0.269 -7.381 1.00 1.01 H new ATOM 0 HA VAL A 92 -4.458 0.714 -9.658 1.00 0.98 H new ATOM 0 HB VAL A 92 -4.137 2.346 -7.110 1.00 0.88 H new ATOM 0 HG11 VAL A 92 -6.543 2.770 -7.484 1.00 0.87 H new ATOM 0 HG12 VAL A 92 -5.581 3.247 -8.903 1.00 0.87 H new ATOM 0 HG13 VAL A 92 -6.505 1.726 -8.925 1.00 0.87 H new ATOM 0 HG21 VAL A 92 -5.817 0.832 -6.077 1.00 0.84 H new ATOM 0 HG22 VAL A 92 -5.766 -0.207 -7.520 1.00 0.84 H new ATOM 0 HG23 VAL A 92 -4.328 -0.053 -6.484 1.00 0.84 H new ATOM 1551 N LYS A 93 -3.526 2.909 -10.514 1.00 1.10 N ATOM 1552 CA LYS A 93 -2.806 4.053 -11.162 1.00 1.17 C ATOM 1553 C LYS A 93 -3.556 5.357 -10.845 1.00 1.13 C ATOM 1554 O LYS A 93 -4.747 5.341 -10.605 1.00 1.09 O ATOM 1555 CB LYS A 93 -2.787 3.824 -12.682 1.00 1.29 C ATOM 1556 CG LYS A 93 -1.654 2.859 -13.046 1.00 1.55 C ATOM 1557 CD LYS A 93 -1.689 2.573 -14.548 1.00 1.88 C ATOM 1558 CE LYS A 93 -0.373 1.920 -14.975 1.00 2.06 C ATOM 1559 NZ LYS A 93 -0.036 0.818 -14.029 1.00 3.01 N ATOM 0 H LYS A 93 -4.412 2.660 -10.953 1.00 1.10 H new ATOM 0 HA LYS A 93 -1.785 4.121 -10.788 1.00 1.17 H new ATOM 0 HB2 LYS A 93 -3.743 3.417 -13.010 1.00 1.29 H new ATOM 0 HB3 LYS A 93 -2.650 4.773 -13.201 1.00 1.29 H new ATOM 0 HG2 LYS A 93 -0.692 3.290 -12.770 1.00 1.55 H new ATOM 0 HG3 LYS A 93 -1.759 1.930 -12.486 1.00 1.55 H new ATOM 0 HD2 LYS A 93 -2.526 1.916 -14.784 1.00 1.88 H new ATOM 0 HD3 LYS A 93 -1.844 3.499 -15.102 1.00 1.88 H new ATOM 0 HE2 LYS A 93 -0.460 1.529 -15.989 1.00 2.06 H new ATOM 0 HE3 LYS A 93 0.426 2.661 -14.987 1.00 2.06 H new ATOM 0 HZ1 LYS A 93 0.613 0.150 -14.491 1.00 3.01 H new ATOM 0 HZ2 LYS A 93 0.420 1.214 -13.183 1.00 3.01 H new ATOM 0 HZ3 LYS A 93 -0.906 0.320 -13.752 1.00 3.01 H new ATOM 1573 N PRO A 94 -2.875 6.481 -10.845 1.00 1.16 N ATOM 1574 CA PRO A 94 -3.514 7.800 -10.552 1.00 1.14 C ATOM 1575 C PRO A 94 -4.606 8.145 -11.575 1.00 1.16 C ATOM 1576 O PRO A 94 -4.328 8.500 -12.703 1.00 1.28 O ATOM 1577 CB PRO A 94 -2.346 8.807 -10.617 1.00 1.23 C ATOM 1578 CG PRO A 94 -1.282 8.118 -11.412 1.00 1.27 C ATOM 1579 CD PRO A 94 -1.435 6.627 -11.119 1.00 1.25 C ATOM 0 HA PRO A 94 -4.019 7.806 -9.586 1.00 1.14 H new ATOM 0 HB2 PRO A 94 -2.654 9.738 -11.093 1.00 1.23 H new ATOM 0 HB3 PRO A 94 -1.990 9.062 -9.619 1.00 1.23 H new ATOM 0 HG2 PRO A 94 -1.398 8.320 -12.477 1.00 1.27 H new ATOM 0 HG3 PRO A 94 -0.291 8.472 -11.127 1.00 1.27 H new ATOM 0 HD2 PRO A 94 -1.123 6.017 -11.966 1.00 1.25 H new ATOM 0 HD3 PRO A 94 -0.830 6.321 -10.266 1.00 1.25 H new ATOM 1587 N GLY A 95 -5.847 8.035 -11.181 1.00 1.09 N ATOM 1588 CA GLY A 95 -6.972 8.346 -12.114 1.00 1.13 C ATOM 1589 C GLY A 95 -8.150 7.427 -11.790 1.00 1.07 C ATOM 1590 O GLY A 95 -9.284 7.706 -12.127 1.00 1.20 O ATOM 0 H GLY A 95 -6.132 7.741 -10.247 1.00 1.09 H new ATOM 0 HA2 GLY A 95 -7.269 9.390 -12.012 1.00 1.13 H new ATOM 0 HA3 GLY A 95 -6.656 8.204 -13.147 1.00 1.13 H new ATOM 1594 N GLN A 96 -7.883 6.330 -11.132 1.00 1.00 N ATOM 1595 CA GLN A 96 -8.968 5.370 -10.767 1.00 0.94 C ATOM 1596 C GLN A 96 -9.319 5.550 -9.290 1.00 0.82 C ATOM 1597 O GLN A 96 -8.671 6.295 -8.582 1.00 0.78 O ATOM 1598 CB GLN A 96 -8.463 3.943 -10.989 1.00 0.96 C ATOM 1599 CG GLN A 96 -7.949 3.797 -12.423 1.00 1.26 C ATOM 1600 CD GLN A 96 -9.082 4.085 -13.409 1.00 1.42 C ATOM 1601 OE1 GLN A 96 -9.716 3.176 -13.905 1.00 2.05 O ATOM 1602 NE2 GLN A 96 -9.364 5.322 -13.720 1.00 2.03 N ATOM 0 H GLN A 96 -6.949 6.055 -10.828 1.00 1.00 H new ATOM 0 HA GLN A 96 -9.849 5.554 -11.382 1.00 0.94 H new ATOM 0 HB2 GLN A 96 -7.666 3.714 -10.281 1.00 0.96 H new ATOM 0 HB3 GLN A 96 -9.266 3.230 -10.806 1.00 0.96 H new ATOM 0 HG2 GLN A 96 -7.121 4.485 -12.595 1.00 1.26 H new ATOM 0 HG3 GLN A 96 -7.564 2.789 -12.581 1.00 1.26 H new ATOM 0 HE21 GLN A 96 -8.832 6.086 -13.304 1.00 2.03 H new ATOM 0 HE22 GLN A 96 -10.116 5.523 -14.379 1.00 2.03 H new ATOM 1611 N THR A 97 -10.335 4.868 -8.814 1.00 0.77 N ATOM 1612 CA THR A 97 -10.720 4.995 -7.372 1.00 0.66 C ATOM 1613 C THR A 97 -11.037 3.621 -6.796 1.00 0.57 C ATOM 1614 O THR A 97 -11.239 2.664 -7.510 1.00 0.61 O ATOM 1615 CB THR A 97 -11.955 5.893 -7.224 1.00 0.70 C ATOM 1616 OG1 THR A 97 -12.227 6.096 -5.844 1.00 0.63 O ATOM 1617 CG2 THR A 97 -13.165 5.233 -7.863 1.00 0.74 C ATOM 0 H THR A 97 -10.913 4.230 -9.361 1.00 0.77 H new ATOM 0 HA THR A 97 -9.884 5.439 -6.832 1.00 0.66 H new ATOM 0 HB THR A 97 -11.757 6.845 -7.717 1.00 0.70 H new ATOM 0 HG1 THR A 97 -12.370 7.051 -5.676 1.00 0.63 H new ATOM 0 HG21 THR A 97 -14.034 5.881 -7.751 1.00 0.74 H new ATOM 0 HG22 THR A 97 -12.971 5.066 -8.923 1.00 0.74 H new ATOM 0 HG23 THR A 97 -13.359 4.278 -7.375 1.00 0.74 H new ATOM 1625 N ILE A 98 -11.107 3.540 -5.495 1.00 0.47 N ATOM 1626 CA ILE A 98 -11.439 2.256 -4.809 1.00 0.39 C ATOM 1627 C ILE A 98 -12.834 2.432 -4.202 1.00 0.36 C ATOM 1628 O ILE A 98 -13.078 3.384 -3.491 1.00 0.42 O ATOM 1629 CB ILE A 98 -10.409 1.995 -3.694 1.00 0.33 C ATOM 1630 CG1 ILE A 98 -9.119 1.431 -4.310 1.00 0.41 C ATOM 1631 CG2 ILE A 98 -10.971 0.989 -2.676 1.00 0.35 C ATOM 1632 CD1 ILE A 98 -8.523 2.429 -5.313 1.00 0.56 C ATOM 0 H ILE A 98 -10.945 4.326 -4.865 1.00 0.47 H new ATOM 0 HA ILE A 98 -11.418 1.414 -5.500 1.00 0.39 H new ATOM 0 HB ILE A 98 -10.194 2.934 -3.184 1.00 0.33 H new ATOM 0 HG12 ILE A 98 -8.395 1.220 -3.523 1.00 0.41 H new ATOM 0 HG13 ILE A 98 -9.330 0.486 -4.810 1.00 0.41 H new ATOM 0 HG21 ILE A 98 -10.233 0.813 -1.893 1.00 0.35 H new ATOM 0 HG22 ILE A 98 -11.882 1.391 -2.233 1.00 0.35 H new ATOM 0 HG23 ILE A 98 -11.197 0.049 -3.180 1.00 0.35 H new ATOM 0 HD11 ILE A 98 -7.610 2.014 -5.740 1.00 0.56 H new ATOM 0 HD12 ILE A 98 -9.243 2.618 -6.109 1.00 0.56 H new ATOM 0 HD13 ILE A 98 -8.293 3.364 -4.803 1.00 0.56 H new ATOM 1644 N ALA A 99 -13.756 1.547 -4.488 1.00 0.41 N ATOM 1645 CA ALA A 99 -15.144 1.695 -3.937 1.00 0.45 C ATOM 1646 C ALA A 99 -15.616 0.372 -3.331 1.00 0.42 C ATOM 1647 O ALA A 99 -15.479 -0.678 -3.918 1.00 0.48 O ATOM 1648 CB ALA A 99 -16.079 2.118 -5.078 1.00 0.58 C ATOM 0 H ALA A 99 -13.611 0.728 -5.078 1.00 0.41 H new ATOM 0 HA ALA A 99 -15.152 2.451 -3.152 1.00 0.45 H new ATOM 0 HB1 ALA A 99 -17.093 2.230 -4.695 1.00 0.58 H new ATOM 0 HB2 ALA A 99 -15.741 3.068 -5.493 1.00 0.58 H new ATOM 0 HB3 ALA A 99 -16.068 1.357 -5.858 1.00 0.58 H new ATOM 1654 N VAL A 100 -16.173 0.416 -2.150 1.00 0.40 N ATOM 1655 CA VAL A 100 -16.653 -0.843 -1.514 1.00 0.41 C ATOM 1656 C VAL A 100 -17.875 -1.356 -2.281 1.00 0.49 C ATOM 1657 O VAL A 100 -18.685 -0.590 -2.763 1.00 0.54 O ATOM 1658 CB VAL A 100 -17.029 -0.575 -0.056 1.00 0.46 C ATOM 1659 CG1 VAL A 100 -17.325 -1.901 0.645 1.00 0.55 C ATOM 1660 CG2 VAL A 100 -15.863 0.121 0.653 1.00 0.43 C ATOM 0 H VAL A 100 -16.315 1.264 -1.602 1.00 0.40 H new ATOM 0 HA VAL A 100 -15.863 -1.593 -1.542 1.00 0.41 H new ATOM 0 HB VAL A 100 -17.912 0.063 -0.021 1.00 0.46 H new ATOM 0 HG11 VAL A 100 -17.593 -1.711 1.684 1.00 0.55 H new ATOM 0 HG12 VAL A 100 -18.153 -2.401 0.142 1.00 0.55 H new ATOM 0 HG13 VAL A 100 -16.441 -2.537 0.609 1.00 0.55 H new ATOM 0 HG21 VAL A 100 -16.131 0.312 1.692 1.00 0.43 H new ATOM 0 HG22 VAL A 100 -14.981 -0.519 0.617 1.00 0.43 H new ATOM 0 HG23 VAL A 100 -15.646 1.066 0.155 1.00 0.43 H new ATOM 1670 N ARG A 101 -18.004 -2.648 -2.412 1.00 0.55 N ATOM 1671 CA ARG A 101 -19.162 -3.212 -3.164 1.00 0.64 C ATOM 1672 C ARG A 101 -20.459 -3.008 -2.379 1.00 0.75 C ATOM 1673 O ARG A 101 -20.469 -3.015 -1.165 1.00 0.96 O ATOM 1674 CB ARG A 101 -18.941 -4.709 -3.377 1.00 0.66 C ATOM 1675 CG ARG A 101 -20.020 -5.270 -4.298 1.00 0.76 C ATOM 1676 CD ARG A 101 -19.595 -6.652 -4.802 1.00 1.10 C ATOM 1677 NE ARG A 101 -20.756 -7.326 -5.447 1.00 1.67 N ATOM 1678 CZ ARG A 101 -20.564 -8.372 -6.204 1.00 1.98 C ATOM 1679 NH1 ARG A 101 -19.355 -8.824 -6.396 1.00 2.25 N ATOM 1680 NH2 ARG A 101 -21.581 -8.964 -6.769 1.00 2.74 N ATOM 0 H ARG A 101 -17.357 -3.338 -2.031 1.00 0.55 H new ATOM 0 HA ARG A 101 -19.242 -2.701 -4.123 1.00 0.64 H new ATOM 0 HB2 ARG A 101 -17.956 -4.881 -3.810 1.00 0.66 H new ATOM 0 HB3 ARG A 101 -18.963 -5.228 -2.419 1.00 0.66 H new ATOM 0 HG2 ARG A 101 -20.967 -5.342 -3.764 1.00 0.76 H new ATOM 0 HG3 ARG A 101 -20.179 -4.597 -5.141 1.00 0.76 H new ATOM 0 HD2 ARG A 101 -18.776 -6.555 -5.515 1.00 1.10 H new ATOM 0 HD3 ARG A 101 -19.226 -7.255 -3.973 1.00 1.10 H new ATOM 0 HE ARG A 101 -21.700 -6.971 -5.297 1.00 1.67 H new ATOM 0 HH11 ARG A 101 -18.561 -8.360 -5.955 1.00 2.25 H new ATOM 0 HH12 ARG A 101 -19.204 -9.641 -6.987 1.00 2.25 H new ATOM 0 HH21 ARG A 101 -22.525 -8.609 -6.619 1.00 2.74 H new ATOM 0 HH22 ARG A 101 -21.431 -9.781 -7.361 1.00 2.74 H new ATOM 1694 N GLU A 102 -21.559 -2.847 -3.068 1.00 0.90 N ATOM 1695 CA GLU A 102 -22.860 -2.664 -2.365 1.00 1.00 C ATOM 1696 C GLU A 102 -23.152 -3.921 -1.543 1.00 1.03 C ATOM 1697 O GLU A 102 -22.501 -4.934 -1.703 1.00 1.09 O ATOM 1698 CB GLU A 102 -23.973 -2.453 -3.394 1.00 1.13 C ATOM 1699 CG GLU A 102 -23.656 -1.221 -4.243 1.00 1.39 C ATOM 1700 CD GLU A 102 -24.756 -1.022 -5.287 1.00 1.83 C ATOM 1701 OE1 GLU A 102 -25.553 -1.930 -5.460 1.00 2.46 O ATOM 1702 OE2 GLU A 102 -24.783 0.035 -5.896 1.00 2.21 O ATOM 0 H GLU A 102 -21.611 -2.835 -4.087 1.00 0.90 H new ATOM 0 HA GLU A 102 -22.811 -1.794 -1.710 1.00 1.00 H new ATOM 0 HB2 GLU A 102 -24.065 -3.333 -4.031 1.00 1.13 H new ATOM 0 HB3 GLU A 102 -24.930 -2.323 -2.889 1.00 1.13 H new ATOM 0 HG2 GLU A 102 -23.579 -0.339 -3.608 1.00 1.39 H new ATOM 0 HG3 GLU A 102 -22.691 -1.344 -4.735 1.00 1.39 H new ATOM 1709 N LYS A 103 -24.110 -3.867 -0.658 1.00 1.07 N ATOM 1710 CA LYS A 103 -24.427 -5.065 0.179 1.00 1.13 C ATOM 1711 C LYS A 103 -23.268 -5.319 1.155 1.00 1.00 C ATOM 1712 O LYS A 103 -23.467 -5.756 2.271 1.00 1.14 O ATOM 1713 CB LYS A 103 -24.638 -6.294 -0.731 1.00 1.22 C ATOM 1714 CG LYS A 103 -25.595 -7.302 -0.061 1.00 1.79 C ATOM 1715 CD LYS A 103 -27.061 -6.936 -0.364 1.00 1.93 C ATOM 1716 CE LYS A 103 -27.381 -7.137 -1.859 1.00 2.07 C ATOM 1717 NZ LYS A 103 -28.796 -7.581 -2.001 1.00 2.77 N ATOM 0 H LYS A 103 -24.688 -3.046 -0.477 1.00 1.07 H new ATOM 0 HA LYS A 103 -25.341 -4.888 0.745 1.00 1.13 H new ATOM 0 HB2 LYS A 103 -25.047 -5.978 -1.691 1.00 1.22 H new ATOM 0 HB3 LYS A 103 -23.680 -6.772 -0.934 1.00 1.22 H new ATOM 0 HG2 LYS A 103 -25.383 -8.309 -0.421 1.00 1.79 H new ATOM 0 HG3 LYS A 103 -25.431 -7.308 1.016 1.00 1.79 H new ATOM 0 HD2 LYS A 103 -27.726 -7.553 0.240 1.00 1.93 H new ATOM 0 HD3 LYS A 103 -27.246 -5.899 -0.085 1.00 1.93 H new ATOM 0 HE2 LYS A 103 -27.222 -6.207 -2.405 1.00 2.07 H new ATOM 0 HE3 LYS A 103 -26.709 -7.879 -2.291 1.00 2.07 H new ATOM 0 HZ1 LYS A 103 -29.017 -7.718 -3.008 1.00 2.77 H new ATOM 0 HZ2 LYS A 103 -28.931 -8.477 -1.491 1.00 2.77 H new ATOM 0 HZ3 LYS A 103 -29.428 -6.858 -1.603 1.00 2.77 H new ATOM 1731 N SER A 104 -22.060 -5.028 0.745 1.00 0.88 N ATOM 1732 CA SER A 104 -20.882 -5.223 1.638 1.00 0.79 C ATOM 1733 C SER A 104 -20.589 -3.890 2.334 1.00 0.76 C ATOM 1734 O SER A 104 -19.586 -3.723 2.999 1.00 0.67 O ATOM 1735 CB SER A 104 -19.678 -5.648 0.789 1.00 0.70 C ATOM 1736 OG SER A 104 -19.718 -7.056 0.596 1.00 0.77 O ATOM 0 H SER A 104 -21.839 -4.660 -0.180 1.00 0.88 H new ATOM 0 HA SER A 104 -21.081 -5.994 2.382 1.00 0.79 H new ATOM 0 HB2 SER A 104 -19.697 -5.136 -0.173 1.00 0.70 H new ATOM 0 HB3 SER A 104 -18.750 -5.363 1.284 1.00 0.70 H new ATOM 0 HG SER A 104 -19.238 -7.287 -0.227 1.00 0.77 H new ATOM 1742 N ARG A 105 -21.464 -2.938 2.160 1.00 0.93 N ATOM 1743 CA ARG A 105 -21.267 -1.596 2.776 1.00 0.97 C ATOM 1744 C ARG A 105 -21.592 -1.648 4.272 1.00 1.06 C ATOM 1745 O ARG A 105 -21.136 -0.825 5.041 1.00 1.20 O ATOM 1746 CB ARG A 105 -22.211 -0.595 2.094 1.00 1.15 C ATOM 1747 CG ARG A 105 -21.949 -0.560 0.575 1.00 1.08 C ATOM 1748 CD ARG A 105 -20.860 0.465 0.249 1.00 1.12 C ATOM 1749 NE ARG A 105 -21.378 1.857 0.482 1.00 1.66 N ATOM 1750 CZ ARG A 105 -22.410 2.330 -0.167 1.00 2.23 C ATOM 1751 NH1 ARG A 105 -22.933 1.663 -1.159 1.00 2.36 N ATOM 1752 NH2 ARG A 105 -22.892 3.500 0.150 1.00 2.99 N ATOM 0 H ARG A 105 -22.318 -3.035 1.610 1.00 0.93 H new ATOM 0 HA ARG A 105 -20.229 -1.290 2.647 1.00 0.97 H new ATOM 0 HB2 ARG A 105 -23.247 -0.874 2.285 1.00 1.15 H new ATOM 0 HB3 ARG A 105 -22.066 0.399 2.518 1.00 1.15 H new ATOM 0 HG2 ARG A 105 -21.644 -1.548 0.228 1.00 1.08 H new ATOM 0 HG3 ARG A 105 -22.868 -0.306 0.046 1.00 1.08 H new ATOM 0 HD2 ARG A 105 -19.983 0.286 0.870 1.00 1.12 H new ATOM 0 HD3 ARG A 105 -20.544 0.355 -0.788 1.00 1.12 H new ATOM 0 HE ARG A 105 -20.910 2.450 1.167 1.00 1.66 H new ATOM 0 HH11 ARG A 105 -22.537 0.764 -1.434 1.00 2.36 H new ATOM 0 HH12 ARG A 105 -23.738 2.040 -1.659 1.00 2.36 H new ATOM 0 HH21 ARG A 105 -22.464 4.041 0.901 1.00 2.99 H new ATOM 0 HH22 ARG A 105 -23.697 3.873 -0.353 1.00 2.99 H new ATOM 1766 N ASN A 106 -22.391 -2.594 4.692 1.00 1.07 N ATOM 1767 CA ASN A 106 -22.758 -2.679 6.133 1.00 1.19 C ATOM 1768 C ASN A 106 -21.761 -3.572 6.867 1.00 1.15 C ATOM 1769 O ASN A 106 -21.893 -3.830 8.047 1.00 1.23 O ATOM 1770 CB ASN A 106 -24.160 -3.277 6.251 1.00 1.31 C ATOM 1771 CG ASN A 106 -25.202 -2.230 5.853 1.00 1.59 C ATOM 1772 OD1 ASN A 106 -25.148 -1.102 6.301 1.00 2.04 O ATOM 1773 ND2 ASN A 106 -26.154 -2.558 5.024 1.00 2.09 N ATOM 0 H ASN A 106 -22.805 -3.312 4.097 1.00 1.07 H new ATOM 0 HA ASN A 106 -22.739 -1.683 6.577 1.00 1.19 H new ATOM 0 HB2 ASN A 106 -24.247 -4.153 5.609 1.00 1.31 H new ATOM 0 HB3 ASN A 106 -24.338 -3.612 7.273 1.00 1.31 H new ATOM 0 HD21 ASN A 106 -26.853 -1.867 4.752 1.00 2.09 H new ATOM 0 HD22 ASN A 106 -26.199 -3.505 4.648 1.00 2.09 H new ATOM 1780 N LEU A 107 -20.764 -4.047 6.179 1.00 1.04 N ATOM 1781 CA LEU A 107 -19.760 -4.926 6.835 1.00 1.03 C ATOM 1782 C LEU A 107 -19.292 -4.290 8.144 1.00 1.13 C ATOM 1783 O LEU A 107 -18.770 -3.193 8.163 1.00 1.17 O ATOM 1784 CB LEU A 107 -18.568 -5.107 5.901 1.00 0.90 C ATOM 1785 CG LEU A 107 -18.910 -6.126 4.812 1.00 0.87 C ATOM 1786 CD1 LEU A 107 -17.803 -6.108 3.768 1.00 0.79 C ATOM 1787 CD2 LEU A 107 -19.039 -7.541 5.413 1.00 0.94 C ATOM 0 H LEU A 107 -20.600 -3.864 5.189 1.00 1.04 H new ATOM 0 HA LEU A 107 -20.210 -5.895 7.050 1.00 1.03 H new ATOM 0 HB2 LEU A 107 -18.302 -4.152 5.447 1.00 0.90 H new ATOM 0 HB3 LEU A 107 -17.699 -5.444 6.467 1.00 0.90 H new ATOM 0 HG LEU A 107 -19.864 -5.863 4.355 1.00 0.87 H new ATOM 0 HD11 LEU A 107 -18.031 -6.829 2.983 1.00 0.79 H new ATOM 0 HD12 LEU A 107 -17.729 -5.111 3.334 1.00 0.79 H new ATOM 0 HD13 LEU A 107 -16.855 -6.371 4.238 1.00 0.79 H new ATOM 0 HD21 LEU A 107 -19.282 -8.251 4.623 1.00 0.94 H new ATOM 0 HD22 LEU A 107 -18.096 -7.826 5.879 1.00 0.94 H new ATOM 0 HD23 LEU A 107 -19.830 -7.547 6.163 1.00 0.94 H new ATOM 1799 N GLN A 108 -19.466 -4.976 9.240 1.00 1.21 N ATOM 1800 CA GLN A 108 -19.021 -4.412 10.542 1.00 1.32 C ATOM 1801 C GLN A 108 -17.537 -4.061 10.449 1.00 1.25 C ATOM 1802 O GLN A 108 -17.126 -2.964 10.772 1.00 1.28 O ATOM 1803 CB GLN A 108 -19.248 -5.441 11.658 1.00 1.46 C ATOM 1804 CG GLN A 108 -18.533 -6.757 11.319 1.00 1.56 C ATOM 1805 CD GLN A 108 -19.137 -7.899 12.142 1.00 1.88 C ATOM 1806 OE1 GLN A 108 -19.856 -8.726 11.619 1.00 2.20 O ATOM 1807 NE2 GLN A 108 -18.872 -7.979 13.418 1.00 2.48 N ATOM 0 H GLN A 108 -19.896 -5.900 9.289 1.00 1.21 H new ATOM 0 HA GLN A 108 -19.595 -3.514 10.771 1.00 1.32 H new ATOM 0 HB2 GLN A 108 -18.876 -5.050 12.605 1.00 1.46 H new ATOM 0 HB3 GLN A 108 -20.315 -5.621 11.785 1.00 1.46 H new ATOM 0 HG2 GLN A 108 -18.631 -6.972 10.255 1.00 1.56 H new ATOM 0 HG3 GLN A 108 -17.467 -6.668 11.530 1.00 1.56 H new ATOM 0 HE21 GLN A 108 -18.268 -7.285 13.858 1.00 2.48 H new ATOM 0 HE22 GLN A 108 -19.269 -8.736 13.975 1.00 2.48 H new ATOM 1816 N VAL A 109 -16.730 -4.986 10.013 1.00 1.19 N ATOM 1817 CA VAL A 109 -15.268 -4.722 9.899 1.00 1.15 C ATOM 1818 C VAL A 109 -15.030 -3.361 9.226 1.00 1.05 C ATOM 1819 O VAL A 109 -14.105 -2.650 9.568 1.00 1.07 O ATOM 1820 CB VAL A 109 -14.618 -5.850 9.081 1.00 1.11 C ATOM 1821 CG1 VAL A 109 -15.463 -6.144 7.842 1.00 1.01 C ATOM 1822 CG2 VAL A 109 -13.206 -5.443 8.644 1.00 1.04 C ATOM 0 H VAL A 109 -17.022 -5.921 9.728 1.00 1.19 H new ATOM 0 HA VAL A 109 -14.819 -4.694 10.892 1.00 1.15 H new ATOM 0 HB VAL A 109 -14.558 -6.742 9.704 1.00 1.11 H new ATOM 0 HG11 VAL A 109 -14.998 -6.944 7.266 1.00 1.01 H new ATOM 0 HG12 VAL A 109 -16.463 -6.451 8.148 1.00 1.01 H new ATOM 0 HG13 VAL A 109 -15.532 -5.247 7.227 1.00 1.01 H new ATOM 0 HG21 VAL A 109 -12.757 -6.251 8.066 1.00 1.04 H new ATOM 0 HG22 VAL A 109 -13.260 -4.544 8.030 1.00 1.04 H new ATOM 0 HG23 VAL A 109 -12.595 -5.245 9.525 1.00 1.04 H new ATOM 1832 N ILE A 110 -15.857 -2.975 8.288 1.00 0.96 N ATOM 1833 CA ILE A 110 -15.659 -1.650 7.626 1.00 0.87 C ATOM 1834 C ILE A 110 -16.384 -0.577 8.437 1.00 0.96 C ATOM 1835 O ILE A 110 -15.786 0.373 8.896 1.00 0.99 O ATOM 1836 CB ILE A 110 -16.211 -1.695 6.196 1.00 0.79 C ATOM 1837 CG1 ILE A 110 -15.266 -2.537 5.336 1.00 0.70 C ATOM 1838 CG2 ILE A 110 -16.290 -0.274 5.624 1.00 0.77 C ATOM 1839 CD1 ILE A 110 -15.865 -2.758 3.949 1.00 0.64 C ATOM 0 H ILE A 110 -16.655 -3.515 7.954 1.00 0.96 H new ATOM 0 HA ILE A 110 -14.596 -1.415 7.581 1.00 0.87 H new ATOM 0 HB ILE A 110 -17.209 -2.132 6.199 1.00 0.79 H new ATOM 0 HG12 ILE A 110 -14.302 -2.037 5.247 1.00 0.70 H new ATOM 0 HG13 ILE A 110 -15.084 -3.498 5.818 1.00 0.70 H new ATOM 0 HG21 ILE A 110 -16.683 -0.312 4.608 1.00 0.77 H new ATOM 0 HG22 ILE A 110 -16.949 0.332 6.245 1.00 0.77 H new ATOM 0 HG23 ILE A 110 -15.294 0.169 5.612 1.00 0.77 H new ATOM 0 HD11 ILE A 110 -15.181 -3.358 3.349 1.00 0.64 H new ATOM 0 HD12 ILE A 110 -16.818 -3.278 4.043 1.00 0.64 H new ATOM 0 HD13 ILE A 110 -16.024 -1.795 3.464 1.00 0.64 H new ATOM 1851 N LYS A 111 -17.663 -0.738 8.637 1.00 1.02 N ATOM 1852 CA LYS A 111 -18.423 0.264 9.438 1.00 1.13 C ATOM 1853 C LYS A 111 -17.671 0.519 10.743 1.00 1.19 C ATOM 1854 O LYS A 111 -17.744 1.585 11.321 1.00 1.26 O ATOM 1855 CB LYS A 111 -19.817 -0.286 9.752 1.00 1.23 C ATOM 1856 CG LYS A 111 -20.623 -0.500 8.443 1.00 1.17 C ATOM 1857 CD LYS A 111 -21.591 0.676 8.188 1.00 1.35 C ATOM 1858 CE LYS A 111 -20.830 1.926 7.728 1.00 1.23 C ATOM 1859 NZ LYS A 111 -20.371 2.694 8.920 1.00 1.58 N ATOM 0 H LYS A 111 -18.215 -1.519 8.281 1.00 1.02 H new ATOM 0 HA LYS A 111 -18.521 1.193 8.877 1.00 1.13 H new ATOM 0 HB2 LYS A 111 -19.730 -1.229 10.291 1.00 1.23 H new ATOM 0 HB3 LYS A 111 -20.349 0.406 10.405 1.00 1.23 H new ATOM 0 HG2 LYS A 111 -19.937 -0.599 7.602 1.00 1.17 H new ATOM 0 HG3 LYS A 111 -21.186 -1.431 8.507 1.00 1.17 H new ATOM 0 HD2 LYS A 111 -22.322 0.392 7.431 1.00 1.35 H new ATOM 0 HD3 LYS A 111 -22.146 0.899 9.099 1.00 1.35 H new ATOM 0 HE2 LYS A 111 -19.975 1.640 7.115 1.00 1.23 H new ATOM 0 HE3 LYS A 111 -21.474 2.549 7.106 1.00 1.23 H new ATOM 0 HZ1 LYS A 111 -20.583 3.703 8.785 1.00 1.58 H new ATOM 0 HZ2 LYS A 111 -20.864 2.347 9.767 1.00 1.58 H new ATOM 0 HZ3 LYS A 111 -19.346 2.569 9.040 1.00 1.58 H new ATOM 1873 N GLU A 112 -16.941 -0.460 11.203 1.00 1.18 N ATOM 1874 CA GLU A 112 -16.169 -0.292 12.465 1.00 1.26 C ATOM 1875 C GLU A 112 -14.849 0.420 12.160 1.00 1.19 C ATOM 1876 O GLU A 112 -14.375 1.224 12.938 1.00 1.28 O ATOM 1877 CB GLU A 112 -15.878 -1.665 13.073 1.00 1.29 C ATOM 1878 CG GLU A 112 -17.176 -2.269 13.613 1.00 1.47 C ATOM 1879 CD GLU A 112 -17.583 -1.541 14.896 1.00 1.84 C ATOM 1880 OE1 GLU A 112 -16.864 -1.661 15.874 1.00 2.56 O ATOM 1881 OE2 GLU A 112 -18.605 -0.876 14.877 1.00 1.95 O ATOM 0 H GLU A 112 -16.846 -1.372 10.757 1.00 1.18 H new ATOM 0 HA GLU A 112 -16.750 0.301 13.171 1.00 1.26 H new ATOM 0 HB2 GLU A 112 -15.444 -2.323 12.321 1.00 1.29 H new ATOM 0 HB3 GLU A 112 -15.146 -1.572 13.876 1.00 1.29 H new ATOM 0 HG2 GLU A 112 -17.967 -2.184 12.868 1.00 1.47 H new ATOM 0 HG3 GLU A 112 -17.039 -3.332 13.813 1.00 1.47 H new ATOM 1888 N ALA A 113 -14.249 0.135 11.033 1.00 1.06 N ATOM 1889 CA ALA A 113 -12.962 0.808 10.695 1.00 1.01 C ATOM 1890 C ALA A 113 -13.220 2.292 10.427 1.00 0.97 C ATOM 1891 O ALA A 113 -12.396 3.133 10.726 1.00 0.96 O ATOM 1892 CB ALA A 113 -12.332 0.143 9.466 1.00 0.93 C ATOM 0 H ALA A 113 -14.592 -0.529 10.338 1.00 1.06 H new ATOM 0 HA ALA A 113 -12.270 0.713 11.532 1.00 1.01 H new ATOM 0 HB1 ALA A 113 -11.392 0.640 9.225 1.00 0.93 H new ATOM 0 HB2 ALA A 113 -12.142 -0.909 9.679 1.00 0.93 H new ATOM 0 HB3 ALA A 113 -13.013 0.225 8.619 1.00 0.93 H new ATOM 1898 N LEU A 114 -14.362 2.631 9.887 1.00 0.98 N ATOM 1899 CA LEU A 114 -14.654 4.065 9.637 1.00 0.97 C ATOM 1900 C LEU A 114 -14.473 4.823 10.952 1.00 1.06 C ATOM 1901 O LEU A 114 -14.173 6.000 10.971 1.00 1.09 O ATOM 1902 CB LEU A 114 -16.100 4.239 9.161 1.00 1.02 C ATOM 1903 CG LEU A 114 -16.377 3.463 7.861 1.00 0.93 C ATOM 1904 CD1 LEU A 114 -17.678 3.983 7.248 1.00 1.02 C ATOM 1905 CD2 LEU A 114 -15.243 3.647 6.842 1.00 0.89 C ATOM 0 H LEU A 114 -15.097 1.979 9.612 1.00 0.98 H new ATOM 0 HA LEU A 114 -13.981 4.446 8.869 1.00 0.97 H new ATOM 0 HB2 LEU A 114 -16.782 3.897 9.940 1.00 1.02 H new ATOM 0 HB3 LEU A 114 -16.304 5.298 9.002 1.00 1.02 H new ATOM 0 HG LEU A 114 -16.451 2.403 8.103 1.00 0.93 H new ATOM 0 HD11 LEU A 114 -17.887 3.442 6.325 1.00 1.02 H new ATOM 0 HD12 LEU A 114 -18.497 3.832 7.951 1.00 1.02 H new ATOM 0 HD13 LEU A 114 -17.578 5.046 7.030 1.00 1.02 H new ATOM 0 HD21 LEU A 114 -15.473 3.085 5.937 1.00 0.89 H new ATOM 0 HD22 LEU A 114 -15.142 4.704 6.597 1.00 0.89 H new ATOM 0 HD23 LEU A 114 -14.308 3.282 7.268 1.00 0.89 H new ATOM 1917 N GLU A 115 -14.660 4.148 12.055 1.00 1.19 N ATOM 1918 CA GLU A 115 -14.507 4.812 13.380 1.00 1.30 C ATOM 1919 C GLU A 115 -13.032 4.846 13.775 1.00 1.29 C ATOM 1920 O GLU A 115 -12.471 5.894 14.026 1.00 1.36 O ATOM 1921 CB GLU A 115 -15.298 4.033 14.433 1.00 1.42 C ATOM 1922 CG GLU A 115 -16.776 3.999 14.040 1.00 1.48 C ATOM 1923 CD GLU A 115 -17.364 5.407 14.144 1.00 2.00 C ATOM 1924 OE1 GLU A 115 -17.365 5.948 15.238 1.00 2.73 O ATOM 1925 OE2 GLU A 115 -17.803 5.921 13.128 1.00 2.38 O ATOM 0 H GLU A 115 -14.913 3.161 12.094 1.00 1.19 H new ATOM 0 HA GLU A 115 -14.886 5.832 13.317 1.00 1.30 H new ATOM 0 HB2 GLU A 115 -14.910 3.018 14.517 1.00 1.42 H new ATOM 0 HB3 GLU A 115 -15.181 4.501 15.410 1.00 1.42 H new ATOM 0 HG2 GLU A 115 -16.884 3.622 13.023 1.00 1.48 H new ATOM 0 HG3 GLU A 115 -17.321 3.317 14.692 1.00 1.48 H new ATOM 1932 N ALA A 116 -12.399 3.709 13.840 1.00 1.25 N ATOM 1933 CA ALA A 116 -10.960 3.668 14.227 1.00 1.27 C ATOM 1934 C ALA A 116 -10.155 4.644 13.366 1.00 1.22 C ATOM 1935 O ALA A 116 -9.200 5.244 13.819 1.00 1.45 O ATOM 1936 CB ALA A 116 -10.429 2.245 14.018 1.00 1.25 C ATOM 0 H ALA A 116 -12.818 2.801 13.641 1.00 1.25 H new ATOM 0 HA ALA A 116 -10.859 3.955 15.274 1.00 1.27 H new ATOM 0 HB1 ALA A 116 -9.376 2.205 14.298 1.00 1.25 H new ATOM 0 HB2 ALA A 116 -10.996 1.550 14.637 1.00 1.25 H new ATOM 0 HB3 ALA A 116 -10.536 1.967 12.969 1.00 1.25 H new ATOM 1942 N ASN A 117 -10.524 4.799 12.127 1.00 1.16 N ATOM 1943 CA ASN A 117 -9.772 5.725 11.235 1.00 1.10 C ATOM 1944 C ASN A 117 -10.142 7.175 11.555 1.00 1.52 C ATOM 1945 O ASN A 117 -11.269 7.479 11.893 1.00 2.05 O ATOM 1946 CB ASN A 117 -10.122 5.419 9.779 1.00 1.42 C ATOM 1947 CG ASN A 117 -9.173 6.182 8.853 1.00 1.19 C ATOM 1948 OD1 ASN A 117 -8.251 5.611 8.305 1.00 1.49 O ATOM 1949 ND2 ASN A 117 -9.361 7.458 8.654 1.00 1.68 N ATOM 0 H ASN A 117 -11.315 4.324 11.692 1.00 1.16 H new ATOM 0 HA ASN A 117 -8.702 5.587 11.394 1.00 1.10 H new ATOM 0 HB2 ASN A 117 -10.045 4.348 9.593 1.00 1.42 H new ATOM 0 HB3 ASN A 117 -11.154 5.705 9.575 1.00 1.42 H new ATOM 0 HD21 ASN A 117 -8.734 7.976 8.038 1.00 1.68 H new ATOM 0 HD22 ASN A 117 -10.135 7.937 9.114 1.00 1.68 H new ATOM 1956 N ASN A 118 -9.198 8.072 11.448 1.00 1.67 N ATOM 1957 CA ASN A 118 -9.489 9.505 11.741 1.00 2.33 C ATOM 1958 C ASN A 118 -8.449 10.386 11.046 1.00 1.95 C ATOM 1959 O ASN A 118 -8.089 11.440 11.532 1.00 2.55 O ATOM 1960 CB ASN A 118 -9.430 9.740 13.252 1.00 3.26 C ATOM 1961 CG ASN A 118 -10.552 8.957 13.937 1.00 4.00 C ATOM 1962 OD1 ASN A 118 -11.710 9.121 13.609 1.00 4.45 O ATOM 1963 ND2 ASN A 118 -10.255 8.106 14.881 1.00 4.51 N ATOM 0 H ASN A 118 -8.237 7.873 11.170 1.00 1.67 H new ATOM 0 HA ASN A 118 -10.484 9.757 11.374 1.00 2.33 H new ATOM 0 HB2 ASN A 118 -8.462 9.425 13.642 1.00 3.26 H new ATOM 0 HB3 ASN A 118 -9.530 10.803 13.469 1.00 3.26 H new ATOM 0 HD21 ASN A 118 -10.995 7.578 15.343 1.00 4.51 H new ATOM 0 HD22 ASN A 118 -9.282 7.968 15.156 1.00 4.51 H new ATOM 1970 N TYR A 119 -7.968 9.961 9.910 1.00 1.33 N ATOM 1971 CA TYR A 119 -6.953 10.771 9.176 1.00 1.26 C ATOM 1972 C TYR A 119 -6.668 10.118 7.820 1.00 1.10 C ATOM 1973 O TYR A 119 -6.093 9.050 7.746 1.00 1.08 O ATOM 1974 CB TYR A 119 -5.657 10.839 9.995 1.00 1.57 C ATOM 1975 CG TYR A 119 -4.565 11.480 9.168 1.00 1.68 C ATOM 1976 CD1 TYR A 119 -4.424 12.873 9.151 1.00 2.46 C ATOM 1977 CD2 TYR A 119 -3.697 10.679 8.416 1.00 1.82 C ATOM 1978 CE1 TYR A 119 -3.416 13.465 8.380 1.00 2.65 C ATOM 1979 CE2 TYR A 119 -2.688 11.271 7.647 1.00 2.23 C ATOM 1980 CZ TYR A 119 -2.547 12.664 7.629 1.00 2.33 C ATOM 1981 OH TYR A 119 -1.553 13.248 6.870 1.00 2.77 O ATOM 0 H TYR A 119 -8.234 9.087 9.457 1.00 1.33 H new ATOM 0 HA TYR A 119 -7.335 11.780 9.023 1.00 1.26 H new ATOM 0 HB2 TYR A 119 -5.821 11.414 10.907 1.00 1.57 H new ATOM 0 HB3 TYR A 119 -5.355 9.837 10.300 1.00 1.57 H new ATOM 0 HD1 TYR A 119 -5.092 13.491 9.732 1.00 2.46 H new ATOM 0 HD2 TYR A 119 -3.806 9.605 8.429 1.00 1.82 H new ATOM 0 HE1 TYR A 119 -3.309 14.540 8.365 1.00 2.65 H new ATOM 0 HE2 TYR A 119 -2.018 10.653 7.067 1.00 2.23 H new ATOM 0 HH TYR A 119 -1.039 12.551 6.412 1.00 2.77 H new ATOM 1991 N ILE A 120 -7.064 10.759 6.747 1.00 1.11 N ATOM 1992 CA ILE A 120 -6.821 10.195 5.381 1.00 0.98 C ATOM 1993 C ILE A 120 -5.763 11.053 4.664 1.00 1.00 C ATOM 1994 O ILE A 120 -5.860 12.264 4.671 1.00 1.09 O ATOM 1995 CB ILE A 120 -8.125 10.245 4.590 1.00 0.93 C ATOM 1996 CG1 ILE A 120 -9.216 9.559 5.412 1.00 0.94 C ATOM 1997 CG2 ILE A 120 -7.944 9.518 3.250 1.00 0.96 C ATOM 1998 CD1 ILE A 120 -10.481 9.426 4.578 1.00 0.89 C ATOM 0 H ILE A 120 -7.549 11.656 6.759 1.00 1.11 H new ATOM 0 HA ILE A 120 -6.470 9.166 5.458 1.00 0.98 H new ATOM 0 HB ILE A 120 -8.405 11.279 4.391 1.00 0.93 H new ATOM 0 HG12 ILE A 120 -8.877 8.575 5.735 1.00 0.94 H new ATOM 0 HG13 ILE A 120 -9.422 10.136 6.313 1.00 0.94 H new ATOM 0 HG21 ILE A 120 -8.877 9.555 2.687 1.00 0.96 H new ATOM 0 HG22 ILE A 120 -7.154 10.003 2.676 1.00 0.96 H new ATOM 0 HG23 ILE A 120 -7.672 8.479 3.434 1.00 0.96 H new ATOM 0 HD11 ILE A 120 -11.256 8.936 5.168 1.00 0.89 H new ATOM 0 HD12 ILE A 120 -10.825 10.416 4.278 1.00 0.89 H new ATOM 0 HD13 ILE A 120 -10.270 8.830 3.690 1.00 0.89 H new ATOM 2010 N PRO A 121 -4.764 10.457 4.040 1.00 0.98 N ATOM 2011 CA PRO A 121 -3.716 11.232 3.315 1.00 1.05 C ATOM 2012 C PRO A 121 -4.305 12.401 2.513 1.00 1.02 C ATOM 2013 O PRO A 121 -5.505 12.528 2.371 1.00 0.97 O ATOM 2014 CB PRO A 121 -3.087 10.194 2.384 1.00 1.09 C ATOM 2015 CG PRO A 121 -3.231 8.892 3.107 1.00 1.01 C ATOM 2016 CD PRO A 121 -4.508 9.002 3.956 1.00 0.94 C ATOM 0 HA PRO A 121 -3.002 11.694 3.997 1.00 1.05 H new ATOM 0 HB2 PRO A 121 -3.595 10.169 1.420 1.00 1.09 H new ATOM 0 HB3 PRO A 121 -2.040 10.423 2.187 1.00 1.09 H new ATOM 0 HG2 PRO A 121 -3.304 8.063 2.403 1.00 1.01 H new ATOM 0 HG3 PRO A 121 -2.362 8.700 3.737 1.00 1.01 H new ATOM 0 HD2 PRO A 121 -5.342 8.477 3.490 1.00 0.94 H new ATOM 0 HD3 PRO A 121 -4.368 8.565 4.944 1.00 0.94 H new ATOM 2024 N ASP A 122 -3.469 13.259 1.993 1.00 1.10 N ATOM 2025 CA ASP A 122 -3.979 14.425 1.213 1.00 1.13 C ATOM 2026 C ASP A 122 -4.187 14.041 -0.256 1.00 1.08 C ATOM 2027 O ASP A 122 -4.971 14.653 -0.954 1.00 1.24 O ATOM 2028 CB ASP A 122 -2.965 15.568 1.296 1.00 1.28 C ATOM 2029 CG ASP A 122 -2.603 15.824 2.760 1.00 1.31 C ATOM 2030 OD1 ASP A 122 -3.512 15.908 3.569 1.00 1.75 O ATOM 2031 OD2 ASP A 122 -1.422 15.932 3.047 1.00 1.68 O ATOM 0 H ASP A 122 -2.454 13.203 2.074 1.00 1.10 H new ATOM 0 HA ASP A 122 -4.935 14.738 1.633 1.00 1.13 H new ATOM 0 HB2 ASP A 122 -2.070 15.316 0.728 1.00 1.28 H new ATOM 0 HB3 ASP A 122 -3.382 16.471 0.850 1.00 1.28 H new ATOM 2036 N TYR A 123 -3.487 13.049 -0.746 1.00 0.92 N ATOM 2037 CA TYR A 123 -3.656 12.664 -2.182 1.00 0.88 C ATOM 2038 C TYR A 123 -4.836 11.692 -2.342 1.00 0.80 C ATOM 2039 O TYR A 123 -5.279 11.425 -3.445 1.00 0.84 O ATOM 2040 CB TYR A 123 -2.365 12.022 -2.707 1.00 0.90 C ATOM 2041 CG TYR A 123 -1.772 11.096 -1.674 1.00 1.00 C ATOM 2042 CD1 TYR A 123 -0.931 11.605 -0.678 1.00 1.72 C ATOM 2043 CD2 TYR A 123 -2.050 9.726 -1.722 1.00 1.45 C ATOM 2044 CE1 TYR A 123 -0.370 10.743 0.272 1.00 1.77 C ATOM 2045 CE2 TYR A 123 -1.488 8.864 -0.774 1.00 1.56 C ATOM 2046 CZ TYR A 123 -0.649 9.372 0.224 1.00 1.21 C ATOM 2047 OH TYR A 123 -0.095 8.523 1.159 1.00 1.33 O ATOM 0 H TYR A 123 -2.812 12.493 -0.221 1.00 0.92 H new ATOM 0 HA TYR A 123 -3.867 13.562 -2.763 1.00 0.88 H new ATOM 0 HB2 TYR A 123 -2.574 11.468 -3.622 1.00 0.90 H new ATOM 0 HB3 TYR A 123 -1.644 12.799 -2.963 1.00 0.90 H new ATOM 0 HD1 TYR A 123 -0.715 12.663 -0.642 1.00 1.72 H new ATOM 0 HD2 TYR A 123 -2.699 9.333 -2.491 1.00 1.45 H new ATOM 0 HE1 TYR A 123 0.278 11.136 1.042 1.00 1.77 H new ATOM 0 HE2 TYR A 123 -1.702 7.806 -0.813 1.00 1.56 H new ATOM 0 HH TYR A 123 -0.564 7.663 1.138 1.00 1.33 H new ATOM 2057 N LEU A 124 -5.356 11.168 -1.257 1.00 0.73 N ATOM 2058 CA LEU A 124 -6.518 10.225 -1.351 1.00 0.66 C ATOM 2059 C LEU A 124 -7.804 10.954 -0.967 1.00 0.68 C ATOM 2060 O LEU A 124 -7.906 11.542 0.092 1.00 0.77 O ATOM 2061 CB LEU A 124 -6.322 9.043 -0.386 1.00 0.61 C ATOM 2062 CG LEU A 124 -5.192 8.118 -0.866 1.00 0.62 C ATOM 2063 CD1 LEU A 124 -5.060 6.935 0.105 1.00 0.58 C ATOM 2064 CD2 LEU A 124 -5.495 7.585 -2.279 1.00 0.67 C ATOM 0 H LEU A 124 -5.026 11.352 -0.310 1.00 0.73 H new ATOM 0 HA LEU A 124 -6.584 9.857 -2.375 1.00 0.66 H new ATOM 0 HB2 LEU A 124 -6.090 9.418 0.611 1.00 0.61 H new ATOM 0 HB3 LEU A 124 -7.250 8.477 -0.306 1.00 0.61 H new ATOM 0 HG LEU A 124 -4.261 8.684 -0.896 1.00 0.62 H new ATOM 0 HD11 LEU A 124 -4.260 6.276 -0.231 1.00 0.58 H new ATOM 0 HD12 LEU A 124 -4.828 7.307 1.103 1.00 0.58 H new ATOM 0 HD13 LEU A 124 -5.998 6.381 0.133 1.00 0.58 H new ATOM 0 HD21 LEU A 124 -4.685 6.932 -2.603 1.00 0.67 H new ATOM 0 HD22 LEU A 124 -6.429 7.024 -2.264 1.00 0.67 H new ATOM 0 HD23 LEU A 124 -5.586 8.422 -2.972 1.00 0.67 H new ATOM 2076 N SER A 125 -8.799 10.891 -1.815 1.00 0.67 N ATOM 2077 CA SER A 125 -10.109 11.545 -1.512 1.00 0.73 C ATOM 2078 C SER A 125 -11.108 10.445 -1.151 1.00 0.68 C ATOM 2079 O SER A 125 -11.379 9.568 -1.949 1.00 0.71 O ATOM 2080 CB SER A 125 -10.608 12.302 -2.744 1.00 0.81 C ATOM 2081 OG SER A 125 -12.027 12.371 -2.708 1.00 1.35 O ATOM 0 H SER A 125 -8.760 10.410 -2.713 1.00 0.67 H new ATOM 0 HA SER A 125 -9.999 12.251 -0.689 1.00 0.73 H new ATOM 0 HB2 SER A 125 -10.184 13.306 -2.765 1.00 0.81 H new ATOM 0 HB3 SER A 125 -10.280 11.798 -3.653 1.00 0.81 H new ATOM 0 HG SER A 125 -12.351 12.857 -3.495 1.00 1.35 H new ATOM 2087 N PHE A 126 -11.654 10.472 0.042 1.00 0.64 N ATOM 2088 CA PHE A 126 -12.631 9.413 0.456 1.00 0.62 C ATOM 2089 C PHE A 126 -14.024 10.016 0.617 1.00 0.74 C ATOM 2090 O PHE A 126 -14.203 11.029 1.263 1.00 0.87 O ATOM 2091 CB PHE A 126 -12.191 8.815 1.789 1.00 0.63 C ATOM 2092 CG PHE A 126 -13.131 7.695 2.177 1.00 0.69 C ATOM 2093 CD1 PHE A 126 -13.166 6.520 1.418 1.00 1.42 C ATOM 2094 CD2 PHE A 126 -13.966 7.830 3.296 1.00 1.36 C ATOM 2095 CE1 PHE A 126 -14.032 5.480 1.776 1.00 1.49 C ATOM 2096 CE2 PHE A 126 -14.832 6.790 3.653 1.00 1.39 C ATOM 2097 CZ PHE A 126 -14.865 5.615 2.893 1.00 0.87 C ATOM 0 H PHE A 126 -11.465 11.183 0.748 1.00 0.64 H new ATOM 0 HA PHE A 126 -12.661 8.639 -0.311 1.00 0.62 H new ATOM 0 HB2 PHE A 126 -11.172 8.437 1.711 1.00 0.63 H new ATOM 0 HB3 PHE A 126 -12.188 9.584 2.561 1.00 0.63 H new ATOM 0 HD1 PHE A 126 -12.525 6.415 0.555 1.00 1.42 H new ATOM 0 HD2 PHE A 126 -13.941 8.737 3.882 1.00 1.36 H new ATOM 0 HE1 PHE A 126 -14.057 4.573 1.190 1.00 1.49 H new ATOM 0 HE2 PHE A 126 -15.475 6.894 4.515 1.00 1.39 H new ATOM 0 HZ PHE A 126 -15.533 4.812 3.168 1.00 0.87 H new ATOM 2107 N ASP A 127 -15.010 9.385 0.033 1.00 0.80 N ATOM 2108 CA ASP A 127 -16.417 9.880 0.137 1.00 0.94 C ATOM 2109 C ASP A 127 -17.243 8.841 0.908 1.00 0.96 C ATOM 2110 O ASP A 127 -17.741 7.896 0.328 1.00 0.93 O ATOM 2111 CB ASP A 127 -16.998 10.038 -1.271 1.00 1.00 C ATOM 2112 CG ASP A 127 -18.340 10.767 -1.191 1.00 1.49 C ATOM 2113 OD1 ASP A 127 -18.383 11.824 -0.583 1.00 1.92 O ATOM 2114 OD2 ASP A 127 -19.303 10.256 -1.739 1.00 2.18 O ATOM 0 H ASP A 127 -14.899 8.535 -0.520 1.00 0.80 H new ATOM 0 HA ASP A 127 -16.442 10.840 0.653 1.00 0.94 H new ATOM 0 HB2 ASP A 127 -16.306 10.597 -1.901 1.00 1.00 H new ATOM 0 HB3 ASP A 127 -17.131 9.060 -1.733 1.00 1.00 H new ATOM 2119 N PRO A 128 -17.375 9.000 2.206 1.00 1.05 N ATOM 2120 CA PRO A 128 -18.146 8.046 3.060 1.00 1.10 C ATOM 2121 C PRO A 128 -19.550 7.768 2.508 1.00 1.19 C ATOM 2122 O PRO A 128 -20.055 6.667 2.603 1.00 1.23 O ATOM 2123 CB PRO A 128 -18.220 8.755 4.421 1.00 1.23 C ATOM 2124 CG PRO A 128 -17.029 9.656 4.447 1.00 1.40 C ATOM 2125 CD PRO A 128 -16.806 10.100 3.005 1.00 1.18 C ATOM 0 HA PRO A 128 -17.669 7.067 3.108 1.00 1.10 H new ATOM 0 HB2 PRO A 128 -19.146 9.321 4.523 1.00 1.23 H new ATOM 0 HB3 PRO A 128 -18.192 8.039 5.242 1.00 1.23 H new ATOM 0 HG2 PRO A 128 -17.203 10.514 5.097 1.00 1.40 H new ATOM 0 HG3 PRO A 128 -16.154 9.135 4.834 1.00 1.40 H new ATOM 0 HD2 PRO A 128 -17.305 11.046 2.796 1.00 1.18 H new ATOM 0 HD3 PRO A 128 -15.747 10.244 2.790 1.00 1.18 H new ATOM 2133 N GLU A 129 -20.184 8.752 1.935 1.00 1.25 N ATOM 2134 CA GLU A 129 -21.549 8.528 1.384 1.00 1.36 C ATOM 2135 C GLU A 129 -21.515 7.323 0.445 1.00 1.21 C ATOM 2136 O GLU A 129 -22.281 6.390 0.587 1.00 1.26 O ATOM 2137 CB GLU A 129 -22.000 9.769 0.610 1.00 1.48 C ATOM 2138 CG GLU A 129 -23.504 9.685 0.344 1.00 1.70 C ATOM 2139 CD GLU A 129 -23.956 10.922 -0.435 1.00 2.08 C ATOM 2140 OE1 GLU A 129 -23.154 11.448 -1.189 1.00 2.70 O ATOM 2141 OE2 GLU A 129 -25.095 11.322 -0.264 1.00 2.49 O ATOM 0 H GLU A 129 -19.818 9.698 1.825 1.00 1.25 H new ATOM 0 HA GLU A 129 -22.249 8.341 2.199 1.00 1.36 H new ATOM 0 HB2 GLU A 129 -21.770 10.669 1.180 1.00 1.48 H new ATOM 0 HB3 GLU A 129 -21.457 9.841 -0.332 1.00 1.48 H new ATOM 0 HG2 GLU A 129 -23.734 8.782 -0.222 1.00 1.70 H new ATOM 0 HG3 GLU A 129 -24.047 9.617 1.287 1.00 1.70 H new ATOM 2148 N LYS A 130 -20.626 7.337 -0.515 1.00 1.07 N ATOM 2149 CA LYS A 130 -20.518 6.202 -1.477 1.00 0.96 C ATOM 2150 C LYS A 130 -19.295 5.351 -1.115 1.00 0.80 C ATOM 2151 O LYS A 130 -18.958 4.409 -1.803 1.00 0.73 O ATOM 2152 CB LYS A 130 -20.348 6.773 -2.892 1.00 1.01 C ATOM 2153 CG LYS A 130 -21.713 7.201 -3.462 1.00 1.15 C ATOM 2154 CD LYS A 130 -22.415 5.999 -4.121 1.00 1.29 C ATOM 2155 CE LYS A 130 -21.972 5.862 -5.583 1.00 1.69 C ATOM 2156 NZ LYS A 130 -22.603 4.652 -6.181 1.00 1.92 N ATOM 0 H LYS A 130 -19.963 8.096 -0.674 1.00 1.07 H new ATOM 0 HA LYS A 130 -21.414 5.583 -1.433 1.00 0.96 H new ATOM 0 HB2 LYS A 130 -19.672 7.628 -2.868 1.00 1.01 H new ATOM 0 HB3 LYS A 130 -19.893 6.025 -3.541 1.00 1.01 H new ATOM 0 HG2 LYS A 130 -22.338 7.604 -2.665 1.00 1.15 H new ATOM 0 HG3 LYS A 130 -21.576 7.997 -4.194 1.00 1.15 H new ATOM 0 HD2 LYS A 130 -22.178 5.086 -3.575 1.00 1.29 H new ATOM 0 HD3 LYS A 130 -23.496 6.128 -4.072 1.00 1.29 H new ATOM 0 HE2 LYS A 130 -22.258 6.750 -6.146 1.00 1.69 H new ATOM 0 HE3 LYS A 130 -20.886 5.785 -5.640 1.00 1.69 H new ATOM 0 HZ1 LYS A 130 -22.303 4.558 -7.172 1.00 1.92 H new ATOM 0 HZ2 LYS A 130 -22.309 3.808 -5.649 1.00 1.92 H new ATOM 0 HZ3 LYS A 130 -23.638 4.744 -6.140 1.00 1.92 H new ATOM 2170 N MET A 131 -18.625 5.681 -0.042 1.00 0.78 N ATOM 2171 CA MET A 131 -17.421 4.897 0.358 1.00 0.65 C ATOM 2172 C MET A 131 -16.513 4.710 -0.860 1.00 0.57 C ATOM 2173 O MET A 131 -16.299 3.602 -1.319 1.00 0.50 O ATOM 2174 CB MET A 131 -17.857 3.526 0.892 1.00 0.62 C ATOM 2175 CG MET A 131 -18.422 3.677 2.310 1.00 0.77 C ATOM 2176 SD MET A 131 -19.461 2.242 2.702 1.00 1.58 S ATOM 2177 CE MET A 131 -18.295 1.365 3.775 1.00 0.86 C ATOM 0 H MET A 131 -18.860 6.459 0.574 1.00 0.78 H new ATOM 0 HA MET A 131 -16.878 5.431 1.138 1.00 0.65 H new ATOM 0 HB2 MET A 131 -18.611 3.092 0.235 1.00 0.62 H new ATOM 0 HB3 MET A 131 -17.009 2.842 0.900 1.00 0.62 H new ATOM 0 HG2 MET A 131 -17.608 3.758 3.031 1.00 0.77 H new ATOM 0 HG3 MET A 131 -19.006 4.594 2.385 1.00 0.77 H new ATOM 0 HE1 MET A 131 -18.558 0.308 3.811 1.00 0.86 H new ATOM 0 HE2 MET A 131 -17.285 1.474 3.380 1.00 0.86 H new ATOM 0 HE3 MET A 131 -18.339 1.785 4.780 1.00 0.86 H new ATOM 2187 N GLU A 132 -15.987 5.792 -1.393 1.00 0.62 N ATOM 2188 CA GLU A 132 -15.095 5.699 -2.598 1.00 0.59 C ATOM 2189 C GLU A 132 -13.751 6.383 -2.324 1.00 0.57 C ATOM 2190 O GLU A 132 -13.676 7.582 -2.144 1.00 0.69 O ATOM 2191 CB GLU A 132 -15.781 6.379 -3.788 1.00 0.74 C ATOM 2192 CG GLU A 132 -14.825 6.431 -4.981 1.00 0.84 C ATOM 2193 CD GLU A 132 -15.604 6.830 -6.236 1.00 1.28 C ATOM 2194 OE1 GLU A 132 -16.603 6.189 -6.518 1.00 1.94 O ATOM 2195 OE2 GLU A 132 -15.187 7.769 -6.894 1.00 1.79 O ATOM 0 H GLU A 132 -16.138 6.738 -1.044 1.00 0.62 H new ATOM 0 HA GLU A 132 -14.913 4.648 -2.824 1.00 0.59 H new ATOM 0 HB2 GLU A 132 -16.685 5.833 -4.059 1.00 0.74 H new ATOM 0 HB3 GLU A 132 -16.089 7.388 -3.513 1.00 0.74 H new ATOM 0 HG2 GLU A 132 -14.027 7.148 -4.791 1.00 0.84 H new ATOM 0 HG3 GLU A 132 -14.353 5.459 -5.126 1.00 0.84 H new ATOM 2202 N GLY A 133 -12.684 5.623 -2.317 1.00 0.47 N ATOM 2203 CA GLY A 133 -11.329 6.212 -2.086 1.00 0.51 C ATOM 2204 C GLY A 133 -10.711 6.541 -3.445 1.00 0.54 C ATOM 2205 O GLY A 133 -10.212 5.675 -4.135 1.00 0.55 O ATOM 0 H GLY A 133 -12.694 4.613 -2.462 1.00 0.47 H new ATOM 0 HA2 GLY A 133 -11.405 7.112 -1.476 1.00 0.51 H new ATOM 0 HA3 GLY A 133 -10.697 5.510 -1.542 1.00 0.51 H new ATOM 2209 N THR A 134 -10.775 7.781 -3.855 1.00 0.60 N ATOM 2210 CA THR A 134 -10.228 8.154 -5.194 1.00 0.67 C ATOM 2211 C THR A 134 -8.763 8.579 -5.116 1.00 0.67 C ATOM 2212 O THR A 134 -8.359 9.343 -4.262 1.00 0.68 O ATOM 2213 CB THR A 134 -11.054 9.299 -5.776 1.00 0.76 C ATOM 2214 OG1 THR A 134 -12.427 8.932 -5.788 1.00 0.78 O ATOM 2215 CG2 THR A 134 -10.592 9.602 -7.206 1.00 0.84 C ATOM 0 H THR A 134 -11.181 8.550 -3.322 1.00 0.60 H new ATOM 0 HA THR A 134 -10.287 7.274 -5.834 1.00 0.67 H new ATOM 0 HB THR A 134 -10.918 10.189 -5.161 1.00 0.76 H new ATOM 0 HG1 THR A 134 -12.959 9.666 -6.160 1.00 0.78 H new ATOM 0 HG21 THR A 134 -11.186 10.420 -7.615 1.00 0.84 H new ATOM 0 HG22 THR A 134 -9.540 9.887 -7.196 1.00 0.84 H new ATOM 0 HG23 THR A 134 -10.721 8.715 -7.826 1.00 0.84 H new ATOM 2223 N TYR A 135 -7.979 8.111 -6.053 1.00 0.70 N ATOM 2224 CA TYR A 135 -6.542 8.498 -6.114 1.00 0.75 C ATOM 2225 C TYR A 135 -6.490 9.790 -6.935 1.00 0.83 C ATOM 2226 O TYR A 135 -6.408 9.764 -8.148 1.00 0.94 O ATOM 2227 CB TYR A 135 -5.744 7.364 -6.809 1.00 0.81 C ATOM 2228 CG TYR A 135 -4.460 7.070 -6.061 1.00 0.81 C ATOM 2229 CD1 TYR A 135 -4.488 6.251 -4.929 1.00 1.40 C ATOM 2230 CD2 TYR A 135 -3.246 7.604 -6.509 1.00 1.37 C ATOM 2231 CE1 TYR A 135 -3.303 5.965 -4.241 1.00 1.44 C ATOM 2232 CE2 TYR A 135 -2.061 7.319 -5.820 1.00 1.38 C ATOM 2233 CZ TYR A 135 -2.089 6.498 -4.687 1.00 0.88 C ATOM 2234 OH TYR A 135 -0.920 6.217 -4.009 1.00 0.95 O ATOM 0 H TYR A 135 -8.280 7.469 -6.787 1.00 0.70 H new ATOM 0 HA TYR A 135 -6.106 8.652 -5.127 1.00 0.75 H new ATOM 0 HB2 TYR A 135 -6.355 6.463 -6.860 1.00 0.81 H new ATOM 0 HB3 TYR A 135 -5.514 7.652 -7.835 1.00 0.81 H new ATOM 0 HD1 TYR A 135 -5.425 5.838 -4.585 1.00 1.40 H new ATOM 0 HD2 TYR A 135 -3.224 8.235 -7.385 1.00 1.37 H new ATOM 0 HE1 TYR A 135 -3.326 5.333 -3.366 1.00 1.44 H new ATOM 0 HE2 TYR A 135 -1.124 7.733 -6.163 1.00 1.38 H new ATOM 0 HH TYR A 135 -0.167 6.227 -4.637 1.00 0.95 H new ATOM 2244 N THR A 136 -6.597 10.921 -6.293 1.00 0.82 N ATOM 2245 CA THR A 136 -6.617 12.208 -7.055 1.00 0.91 C ATOM 2246 C THR A 136 -5.192 12.739 -7.252 1.00 0.96 C ATOM 2247 O THR A 136 -4.975 13.685 -7.983 1.00 1.03 O ATOM 2248 CB THR A 136 -7.496 13.249 -6.310 1.00 0.90 C ATOM 2249 OG1 THR A 136 -6.745 14.432 -6.071 1.00 0.96 O ATOM 2250 CG2 THR A 136 -7.991 12.685 -4.969 1.00 0.82 C ATOM 0 H THR A 136 -6.671 11.013 -5.280 1.00 0.82 H new ATOM 0 HA THR A 136 -7.048 12.029 -8.040 1.00 0.91 H new ATOM 0 HB THR A 136 -8.358 13.478 -6.936 1.00 0.90 H new ATOM 0 HG1 THR A 136 -7.305 15.086 -5.602 1.00 0.96 H new ATOM 0 HG21 THR A 136 -8.605 13.431 -4.465 1.00 0.82 H new ATOM 0 HG22 THR A 136 -8.584 11.788 -5.148 1.00 0.82 H new ATOM 0 HG23 THR A 136 -7.136 12.435 -4.342 1.00 0.82 H new ATOM 2258 N ARG A 137 -4.217 12.147 -6.618 1.00 0.96 N ATOM 2259 CA ARG A 137 -2.820 12.641 -6.799 1.00 1.04 C ATOM 2260 C ARG A 137 -1.821 11.568 -6.354 1.00 1.01 C ATOM 2261 O ARG A 137 -2.178 10.595 -5.722 1.00 1.00 O ATOM 2262 CB ARG A 137 -2.624 13.912 -5.965 1.00 1.06 C ATOM 2263 CG ARG A 137 -1.368 14.656 -6.430 1.00 1.38 C ATOM 2264 CD ARG A 137 -1.307 16.023 -5.746 1.00 1.68 C ATOM 2265 NE ARG A 137 -2.343 16.919 -6.331 1.00 2.38 N ATOM 2266 CZ ARG A 137 -2.681 18.017 -5.713 1.00 2.78 C ATOM 2267 NH1 ARG A 137 -2.113 18.330 -4.580 1.00 2.77 N ATOM 2268 NH2 ARG A 137 -3.588 18.803 -6.226 1.00 3.73 N ATOM 0 H ARG A 137 -4.323 11.351 -5.989 1.00 0.96 H new ATOM 0 HA ARG A 137 -2.648 12.864 -7.852 1.00 1.04 H new ATOM 0 HB2 ARG A 137 -3.496 14.558 -6.062 1.00 1.06 H new ATOM 0 HB3 ARG A 137 -2.534 13.654 -4.910 1.00 1.06 H new ATOM 0 HG2 ARG A 137 -0.477 14.076 -6.188 1.00 1.38 H new ATOM 0 HG3 ARG A 137 -1.384 14.779 -7.513 1.00 1.38 H new ATOM 0 HD2 ARG A 137 -1.470 15.912 -4.674 1.00 1.68 H new ATOM 0 HD3 ARG A 137 -0.317 16.462 -5.874 1.00 1.68 H new ATOM 0 HE ARG A 137 -2.788 16.674 -7.215 1.00 2.38 H new ATOM 0 HH11 ARG A 137 -1.405 17.716 -4.178 1.00 2.77 H new ATOM 0 HH12 ARG A 137 -2.377 19.189 -4.097 1.00 2.77 H new ATOM 0 HH21 ARG A 137 -4.033 18.559 -7.111 1.00 3.73 H new ATOM 0 HH22 ARG A 137 -3.852 19.661 -5.742 1.00 3.73 H new ATOM 2282 N LEU A 138 -0.567 11.738 -6.690 1.00 1.04 N ATOM 2283 CA LEU A 138 0.467 10.734 -6.294 1.00 1.06 C ATOM 2284 C LEU A 138 1.062 11.133 -4.933 1.00 1.13 C ATOM 2285 O LEU A 138 1.031 12.288 -4.559 1.00 1.18 O ATOM 2286 CB LEU A 138 1.574 10.706 -7.364 1.00 1.11 C ATOM 2287 CG LEU A 138 1.203 9.713 -8.486 1.00 1.10 C ATOM 2288 CD1 LEU A 138 1.955 10.081 -9.760 1.00 1.08 C ATOM 2289 CD2 LEU A 138 1.584 8.281 -8.083 1.00 1.17 C ATOM 0 H LEU A 138 -0.214 12.532 -7.224 1.00 1.04 H new ATOM 0 HA LEU A 138 0.018 9.744 -6.213 1.00 1.06 H new ATOM 0 HB2 LEU A 138 1.712 11.703 -7.782 1.00 1.11 H new ATOM 0 HB3 LEU A 138 2.522 10.416 -6.910 1.00 1.11 H new ATOM 0 HG LEU A 138 0.127 9.765 -8.654 1.00 1.10 H new ATOM 0 HD11 LEU A 138 1.693 9.380 -10.552 1.00 1.08 H new ATOM 0 HD12 LEU A 138 1.682 11.091 -10.065 1.00 1.08 H new ATOM 0 HD13 LEU A 138 3.028 10.035 -9.575 1.00 1.08 H new ATOM 0 HD21 LEU A 138 1.316 7.594 -8.885 1.00 1.17 H new ATOM 0 HD22 LEU A 138 2.658 8.227 -7.903 1.00 1.17 H new ATOM 0 HD23 LEU A 138 1.050 8.004 -7.174 1.00 1.17 H new ATOM 2301 N PRO A 139 1.608 10.190 -4.196 1.00 1.18 N ATOM 2302 CA PRO A 139 2.221 10.471 -2.864 1.00 1.30 C ATOM 2303 C PRO A 139 3.633 11.061 -2.988 1.00 1.23 C ATOM 2304 O PRO A 139 4.281 10.929 -4.008 1.00 1.30 O ATOM 2305 CB PRO A 139 2.273 9.087 -2.212 1.00 1.39 C ATOM 2306 CG PRO A 139 2.474 8.149 -3.357 1.00 1.25 C ATOM 2307 CD PRO A 139 1.703 8.754 -4.539 1.00 1.16 C ATOM 0 HA PRO A 139 1.655 11.208 -2.294 1.00 1.30 H new ATOM 0 HB2 PRO A 139 3.088 9.017 -1.492 1.00 1.39 H new ATOM 0 HB3 PRO A 139 1.352 8.866 -1.673 1.00 1.39 H new ATOM 0 HG2 PRO A 139 3.533 8.044 -3.594 1.00 1.25 H new ATOM 0 HG3 PRO A 139 2.101 7.154 -3.116 1.00 1.25 H new ATOM 0 HD2 PRO A 139 2.229 8.601 -5.481 1.00 1.16 H new ATOM 0 HD3 PRO A 139 0.717 8.302 -4.648 1.00 1.16 H new ATOM 2315 N GLU A 140 4.111 11.704 -1.950 1.00 1.23 N ATOM 2316 CA GLU A 140 5.484 12.306 -1.983 1.00 1.28 C ATOM 2317 C GLU A 140 6.254 11.871 -0.732 1.00 1.27 C ATOM 2318 O GLU A 140 5.727 11.202 0.134 1.00 1.14 O ATOM 2319 CB GLU A 140 5.378 13.841 -2.023 1.00 1.44 C ATOM 2320 CG GLU A 140 4.102 14.246 -2.764 1.00 1.52 C ATOM 2321 CD GLU A 140 4.086 15.763 -2.961 1.00 2.22 C ATOM 2322 OE1 GLU A 140 4.476 16.464 -2.042 1.00 2.75 O ATOM 2323 OE2 GLU A 140 3.685 16.198 -4.029 1.00 2.80 O ATOM 0 H GLU A 140 3.606 11.839 -1.074 1.00 1.23 H new ATOM 0 HA GLU A 140 6.012 11.964 -2.873 1.00 1.28 H new ATOM 0 HB2 GLU A 140 5.365 14.242 -1.009 1.00 1.44 H new ATOM 0 HB3 GLU A 140 6.250 14.263 -2.522 1.00 1.44 H new ATOM 0 HG2 GLU A 140 4.054 13.743 -3.730 1.00 1.52 H new ATOM 0 HG3 GLU A 140 3.225 13.933 -2.198 1.00 1.52 H new ATOM 2330 N ARG A 141 7.501 12.240 -0.638 1.00 1.50 N ATOM 2331 CA ARG A 141 8.311 11.843 0.549 1.00 1.62 C ATOM 2332 C ARG A 141 7.736 12.490 1.810 1.00 1.82 C ATOM 2333 O ARG A 141 7.789 11.927 2.885 1.00 1.88 O ATOM 2334 CB ARG A 141 9.758 12.304 0.354 1.00 1.91 C ATOM 2335 CG ARG A 141 10.215 11.968 -1.067 1.00 2.24 C ATOM 2336 CD ARG A 141 11.736 12.106 -1.160 1.00 2.57 C ATOM 2337 NE ARG A 141 12.160 11.982 -2.583 1.00 3.39 N ATOM 2338 CZ ARG A 141 13.357 12.358 -2.943 1.00 4.11 C ATOM 2339 NH1 ARG A 141 14.183 12.842 -2.056 1.00 4.27 N ATOM 2340 NH2 ARG A 141 13.728 12.250 -4.190 1.00 5.03 N ATOM 0 H ARG A 141 7.995 12.800 -1.332 1.00 1.50 H new ATOM 0 HA ARG A 141 8.283 10.759 0.657 1.00 1.62 H new ATOM 0 HB2 ARG A 141 9.835 13.377 0.528 1.00 1.91 H new ATOM 0 HB3 ARG A 141 10.407 11.816 1.081 1.00 1.91 H new ATOM 0 HG2 ARG A 141 9.915 10.953 -1.326 1.00 2.24 H new ATOM 0 HG3 ARG A 141 9.734 12.635 -1.782 1.00 2.24 H new ATOM 0 HD2 ARG A 141 12.050 13.070 -0.759 1.00 2.57 H new ATOM 0 HD3 ARG A 141 12.219 11.337 -0.557 1.00 2.57 H new ATOM 0 HE ARG A 141 11.515 11.603 -3.276 1.00 3.39 H new ATOM 0 HH11 ARG A 141 13.893 12.926 -1.082 1.00 4.27 H new ATOM 0 HH12 ARG A 141 15.118 13.136 -2.337 1.00 4.27 H new ATOM 0 HH21 ARG A 141 13.082 11.872 -4.883 1.00 5.03 H new ATOM 0 HH22 ARG A 141 14.663 12.544 -4.471 1.00 5.03 H new ATOM 2354 N SER A 142 7.193 13.670 1.691 1.00 2.02 N ATOM 2355 CA SER A 142 6.622 14.352 2.888 1.00 2.34 C ATOM 2356 C SER A 142 5.491 13.507 3.480 1.00 2.30 C ATOM 2357 O SER A 142 4.853 13.898 4.437 1.00 2.62 O ATOM 2358 CB SER A 142 6.073 15.720 2.480 1.00 2.60 C ATOM 2359 OG SER A 142 5.264 15.574 1.320 1.00 2.51 O ATOM 0 H SER A 142 7.120 14.192 0.818 1.00 2.02 H new ATOM 0 HA SER A 142 7.405 14.478 3.636 1.00 2.34 H new ATOM 0 HB2 SER A 142 5.488 16.147 3.294 1.00 2.60 H new ATOM 0 HB3 SER A 142 6.893 16.409 2.281 1.00 2.60 H new ATOM 0 HG SER A 142 4.909 16.449 1.057 1.00 2.51 H new ATOM 2365 N GLU A 143 5.234 12.351 2.921 1.00 2.07 N ATOM 2366 CA GLU A 143 4.141 11.480 3.452 1.00 2.17 C ATOM 2367 C GLU A 143 4.572 10.013 3.378 1.00 1.96 C ATOM 2368 O GLU A 143 3.762 9.127 3.194 1.00 2.39 O ATOM 2369 CB GLU A 143 2.877 11.685 2.613 1.00 2.18 C ATOM 2370 CG GLU A 143 2.638 13.183 2.408 1.00 2.76 C ATOM 2371 CD GLU A 143 1.213 13.411 1.902 1.00 3.26 C ATOM 2372 OE1 GLU A 143 0.288 13.056 2.615 1.00 3.88 O ATOM 2373 OE2 GLU A 143 1.070 13.938 0.811 1.00 3.48 O ATOM 0 H GLU A 143 5.735 11.972 2.118 1.00 2.07 H new ATOM 0 HA GLU A 143 3.937 11.744 4.490 1.00 2.17 H new ATOM 0 HB2 GLU A 143 2.983 11.187 1.649 1.00 2.18 H new ATOM 0 HB3 GLU A 143 2.019 11.234 3.112 1.00 2.18 H new ATOM 0 HG2 GLU A 143 2.792 13.718 3.345 1.00 2.76 H new ATOM 0 HG3 GLU A 143 3.357 13.582 1.692 1.00 2.76 H new ATOM 2380 N LEU A 144 5.846 9.750 3.529 1.00 1.52 N ATOM 2381 CA LEU A 144 6.346 8.340 3.477 1.00 1.32 C ATOM 2382 C LEU A 144 7.452 8.165 4.528 1.00 1.46 C ATOM 2383 O LEU A 144 8.147 9.107 4.853 1.00 1.70 O ATOM 2384 CB LEU A 144 6.940 8.057 2.091 1.00 1.25 C ATOM 2385 CG LEU A 144 5.839 7.976 1.025 1.00 1.20 C ATOM 2386 CD1 LEU A 144 6.503 7.762 -0.339 1.00 1.27 C ATOM 2387 CD2 LEU A 144 4.880 6.804 1.321 1.00 1.01 C ATOM 0 H LEU A 144 6.566 10.455 3.687 1.00 1.52 H new ATOM 0 HA LEU A 144 5.522 7.654 3.673 1.00 1.32 H new ATOM 0 HB2 LEU A 144 7.648 8.843 1.828 1.00 1.25 H new ATOM 0 HB3 LEU A 144 7.497 7.120 2.115 1.00 1.25 H new ATOM 0 HG LEU A 144 5.261 8.900 1.029 1.00 1.20 H new ATOM 0 HD11 LEU A 144 5.736 7.702 -1.111 1.00 1.27 H new ATOM 0 HD12 LEU A 144 7.170 8.597 -0.554 1.00 1.27 H new ATOM 0 HD13 LEU A 144 7.076 6.835 -0.323 1.00 1.27 H new ATOM 0 HD21 LEU A 144 4.107 6.764 0.554 1.00 1.01 H new ATOM 0 HD22 LEU A 144 5.439 5.868 1.322 1.00 1.01 H new ATOM 0 HD23 LEU A 144 4.416 6.951 2.296 1.00 1.01 H new ATOM 2399 N PRO A 145 7.631 6.971 5.051 1.00 1.41 N ATOM 2400 CA PRO A 145 8.685 6.692 6.064 1.00 1.65 C ATOM 2401 C PRO A 145 9.969 7.492 5.807 1.00 1.82 C ATOM 2402 O PRO A 145 10.691 7.239 4.863 1.00 1.74 O ATOM 2403 CB PRO A 145 8.931 5.194 5.889 1.00 1.57 C ATOM 2404 CG PRO A 145 7.596 4.633 5.502 1.00 1.38 C ATOM 2405 CD PRO A 145 6.853 5.751 4.745 1.00 1.21 C ATOM 0 HA PRO A 145 8.382 6.976 7.072 1.00 1.65 H new ATOM 0 HB2 PRO A 145 9.679 5.003 5.120 1.00 1.57 H new ATOM 0 HB3 PRO A 145 9.298 4.743 6.811 1.00 1.57 H new ATOM 0 HG2 PRO A 145 7.714 3.751 4.873 1.00 1.38 H new ATOM 0 HG3 PRO A 145 7.035 4.323 6.384 1.00 1.38 H new ATOM 0 HD2 PRO A 145 6.823 5.555 3.673 1.00 1.21 H new ATOM 0 HD3 PRO A 145 5.820 5.842 5.081 1.00 1.21 H new ATOM 2413 N ALA A 146 10.256 8.457 6.638 1.00 2.33 N ATOM 2414 CA ALA A 146 11.488 9.272 6.438 1.00 2.58 C ATOM 2415 C ALA A 146 12.704 8.501 6.955 1.00 1.89 C ATOM 2416 O ALA A 146 13.809 8.671 6.477 1.00 2.36 O ATOM 2417 CB ALA A 146 11.358 10.587 7.209 1.00 3.11 C ATOM 0 H ALA A 146 9.691 8.716 7.447 1.00 2.33 H new ATOM 0 HA ALA A 146 11.615 9.480 5.376 1.00 2.58 H new ATOM 0 HB1 ALA A 146 12.258 11.184 7.064 1.00 3.11 H new ATOM 0 HB2 ALA A 146 10.493 11.140 6.843 1.00 3.11 H new ATOM 0 HB3 ALA A 146 11.230 10.375 8.271 1.00 3.11 H new ATOM 2423 N GLU A 147 12.511 7.657 7.930 1.00 1.23 N ATOM 2424 CA GLU A 147 13.655 6.878 8.481 1.00 1.16 C ATOM 2425 C GLU A 147 14.104 5.831 7.455 1.00 1.09 C ATOM 2426 O GLU A 147 14.866 4.937 7.765 1.00 1.83 O ATOM 2427 CB GLU A 147 13.216 6.183 9.776 1.00 1.57 C ATOM 2428 CG GLU A 147 11.770 5.700 9.631 1.00 1.77 C ATOM 2429 CD GLU A 147 11.455 4.685 10.731 1.00 2.24 C ATOM 2430 OE1 GLU A 147 12.091 3.644 10.749 1.00 2.50 O ATOM 2431 OE2 GLU A 147 10.584 4.965 11.538 1.00 2.89 O ATOM 0 H GLU A 147 11.609 7.473 8.370 1.00 1.23 H new ATOM 0 HA GLU A 147 14.488 7.548 8.694 1.00 1.16 H new ATOM 0 HB2 GLU A 147 13.873 5.340 9.989 1.00 1.57 H new ATOM 0 HB3 GLU A 147 13.298 6.872 10.617 1.00 1.57 H new ATOM 0 HG2 GLU A 147 11.085 6.546 9.696 1.00 1.77 H new ATOM 0 HG3 GLU A 147 11.624 5.246 8.651 1.00 1.77 H new ATOM 2438 N ILE A 148 13.639 5.944 6.234 1.00 0.98 N ATOM 2439 CA ILE A 148 14.029 4.967 5.165 1.00 0.80 C ATOM 2440 C ILE A 148 14.786 5.709 4.059 1.00 0.83 C ATOM 2441 O ILE A 148 14.536 6.869 3.797 1.00 1.07 O ATOM 2442 CB ILE A 148 12.764 4.330 4.575 1.00 0.79 C ATOM 2443 CG1 ILE A 148 11.925 3.694 5.697 1.00 0.84 C ATOM 2444 CG2 ILE A 148 13.154 3.260 3.552 1.00 0.79 C ATOM 2445 CD1 ILE A 148 12.768 2.708 6.520 1.00 0.83 C ATOM 0 H ILE A 148 13.000 6.678 5.928 1.00 0.98 H new ATOM 0 HA ILE A 148 14.665 4.190 5.589 1.00 0.80 H new ATOM 0 HB ILE A 148 12.173 5.102 4.082 1.00 0.79 H new ATOM 0 HG12 ILE A 148 11.531 4.474 6.349 1.00 0.84 H new ATOM 0 HG13 ILE A 148 11.068 3.175 5.267 1.00 0.84 H new ATOM 0 HG21 ILE A 148 12.253 2.810 3.135 1.00 0.79 H new ATOM 0 HG22 ILE A 148 13.735 3.717 2.751 1.00 0.79 H new ATOM 0 HG23 ILE A 148 13.752 2.490 4.040 1.00 0.79 H new ATOM 0 HD11 ILE A 148 12.153 2.272 7.307 1.00 0.83 H new ATOM 0 HD12 ILE A 148 13.140 1.917 5.870 1.00 0.83 H new ATOM 0 HD13 ILE A 148 13.610 3.235 6.968 1.00 0.83 H new ATOM 2457 N ASN A 149 15.706 5.040 3.404 1.00 0.79 N ATOM 2458 CA ASN A 149 16.490 5.685 2.298 1.00 0.92 C ATOM 2459 C ASN A 149 16.378 4.807 1.049 1.00 1.09 C ATOM 2460 O ASN A 149 16.455 5.281 -0.066 1.00 2.09 O ATOM 2461 CB ASN A 149 17.968 5.817 2.722 1.00 0.94 C ATOM 2462 CG ASN A 149 18.623 6.987 1.979 1.00 1.09 C ATOM 2463 OD1 ASN A 149 18.024 8.032 1.820 1.00 1.70 O ATOM 2464 ND2 ASN A 149 19.835 6.853 1.514 1.00 1.26 N ATOM 0 H ASN A 149 15.950 4.067 3.589 1.00 0.79 H new ATOM 0 HA ASN A 149 16.097 6.679 2.086 1.00 0.92 H new ATOM 0 HB2 ASN A 149 18.033 5.976 3.798 1.00 0.94 H new ATOM 0 HB3 ASN A 149 18.502 4.892 2.504 1.00 0.94 H new ATOM 0 HD21 ASN A 149 20.279 7.625 1.017 1.00 1.26 H new ATOM 0 HD22 ASN A 149 20.338 5.976 1.647 1.00 1.26 H new ATOM 2471 N GLU A 150 16.188 3.528 1.240 1.00 0.74 N ATOM 2472 CA GLU A 150 16.055 2.590 0.085 1.00 0.77 C ATOM 2473 C GLU A 150 17.366 2.516 -0.705 1.00 0.80 C ATOM 2474 O GLU A 150 17.593 1.584 -1.446 1.00 0.83 O ATOM 2475 CB GLU A 150 14.921 3.062 -0.837 1.00 1.05 C ATOM 2476 CG GLU A 150 14.439 1.894 -1.703 1.00 1.14 C ATOM 2477 CD GLU A 150 13.682 0.890 -0.832 1.00 1.90 C ATOM 2478 OE1 GLU A 150 13.235 1.281 0.234 1.00 2.37 O ATOM 2479 OE2 GLU A 150 13.562 -0.251 -1.244 1.00 2.60 O ATOM 0 H GLU A 150 16.118 3.088 2.158 1.00 0.74 H new ATOM 0 HA GLU A 150 15.824 1.596 0.469 1.00 0.77 H new ATOM 0 HB2 GLU A 150 14.095 3.452 -0.243 1.00 1.05 H new ATOM 0 HB3 GLU A 150 15.270 3.877 -1.471 1.00 1.05 H new ATOM 0 HG2 GLU A 150 13.792 2.261 -2.499 1.00 1.14 H new ATOM 0 HG3 GLU A 150 15.289 1.408 -2.182 1.00 1.14 H new ATOM 2486 N ALA A 151 18.233 3.477 -0.550 1.00 0.86 N ATOM 2487 CA ALA A 151 19.519 3.437 -1.294 1.00 0.96 C ATOM 2488 C ALA A 151 20.359 2.268 -0.786 1.00 0.97 C ATOM 2489 O ALA A 151 20.842 1.457 -1.548 1.00 1.09 O ATOM 2490 CB ALA A 151 20.280 4.740 -1.068 1.00 1.03 C ATOM 0 H ALA A 151 18.106 4.286 0.058 1.00 0.86 H new ATOM 0 HA ALA A 151 19.320 3.312 -2.358 1.00 0.96 H new ATOM 0 HB1 ALA A 151 21.223 4.710 -1.614 1.00 1.03 H new ATOM 0 HB2 ALA A 151 19.681 5.578 -1.425 1.00 1.03 H new ATOM 0 HB3 ALA A 151 20.481 4.864 -0.004 1.00 1.03 H new ATOM 2496 N LEU A 152 20.537 2.172 0.502 1.00 0.91 N ATOM 2497 CA LEU A 152 21.345 1.051 1.055 1.00 0.96 C ATOM 2498 C LEU A 152 20.796 -0.260 0.470 1.00 1.00 C ATOM 2499 O LEU A 152 21.481 -1.260 0.395 1.00 1.27 O ATOM 2500 CB LEU A 152 21.257 1.026 2.601 1.00 0.93 C ATOM 2501 CG LEU A 152 20.758 2.383 3.161 1.00 1.02 C ATOM 2502 CD1 LEU A 152 19.223 2.402 3.231 1.00 1.03 C ATOM 2503 CD2 LEU A 152 21.312 2.597 4.574 1.00 1.05 C ATOM 0 H LEU A 152 20.159 2.820 1.194 1.00 0.91 H new ATOM 0 HA LEU A 152 22.393 1.178 0.785 1.00 0.96 H new ATOM 0 HB2 LEU A 152 20.582 0.230 2.916 1.00 0.93 H new ATOM 0 HB3 LEU A 152 22.237 0.796 3.019 1.00 0.93 H new ATOM 0 HG LEU A 152 21.104 3.175 2.497 1.00 1.02 H new ATOM 0 HD11 LEU A 152 18.889 3.361 3.626 1.00 1.03 H new ATOM 0 HD12 LEU A 152 18.811 2.258 2.232 1.00 1.03 H new ATOM 0 HD13 LEU A 152 18.879 1.601 3.885 1.00 1.03 H new ATOM 0 HD21 LEU A 152 20.958 3.552 4.963 1.00 1.05 H new ATOM 0 HD22 LEU A 152 20.971 1.792 5.224 1.00 1.05 H new ATOM 0 HD23 LEU A 152 22.401 2.600 4.541 1.00 1.05 H new ATOM 2515 N ILE A 153 19.557 -0.240 0.046 1.00 0.81 N ATOM 2516 CA ILE A 153 18.937 -1.460 -0.552 1.00 0.85 C ATOM 2517 C ILE A 153 19.163 -1.448 -2.067 1.00 0.89 C ATOM 2518 O ILE A 153 19.083 -2.464 -2.725 1.00 1.04 O ATOM 2519 CB ILE A 153 17.432 -1.473 -0.259 1.00 0.78 C ATOM 2520 CG1 ILE A 153 17.189 -1.066 1.195 1.00 0.77 C ATOM 2521 CG2 ILE A 153 16.878 -2.882 -0.483 1.00 0.87 C ATOM 2522 CD1 ILE A 153 15.691 -1.128 1.495 1.00 0.72 C ATOM 0 H ILE A 153 18.945 0.575 0.089 1.00 0.81 H new ATOM 0 HA ILE A 153 19.394 -2.350 -0.119 1.00 0.85 H new ATOM 0 HB ILE A 153 16.931 -0.771 -0.926 1.00 0.78 H new ATOM 0 HG12 ILE A 153 17.733 -1.730 1.866 1.00 0.77 H new ATOM 0 HG13 ILE A 153 17.565 -0.058 1.370 1.00 0.77 H new ATOM 0 HG21 ILE A 153 15.808 -2.890 -0.274 1.00 0.87 H new ATOM 0 HG22 ILE A 153 17.048 -3.180 -1.518 1.00 0.87 H new ATOM 0 HG23 ILE A 153 17.383 -3.582 0.183 1.00 0.87 H new ATOM 0 HD11 ILE A 153 15.515 -0.838 2.531 1.00 0.72 H new ATOM 0 HD12 ILE A 153 15.159 -0.446 0.832 1.00 0.72 H new ATOM 0 HD13 ILE A 153 15.330 -2.144 1.336 1.00 0.72 H new ATOM 2534 N VAL A 154 19.442 -0.301 -2.625 1.00 0.84 N ATOM 2535 CA VAL A 154 19.674 -0.224 -4.096 1.00 0.92 C ATOM 2536 C VAL A 154 20.984 -0.945 -4.430 1.00 1.06 C ATOM 2537 O VAL A 154 21.002 -1.922 -5.153 1.00 1.12 O ATOM 2538 CB VAL A 154 19.753 1.257 -4.523 1.00 0.91 C ATOM 2539 CG1 VAL A 154 20.419 1.382 -5.901 1.00 1.03 C ATOM 2540 CG2 VAL A 154 18.338 1.845 -4.596 1.00 0.80 C ATOM 0 H VAL A 154 19.519 0.585 -2.126 1.00 0.84 H new ATOM 0 HA VAL A 154 18.854 -0.702 -4.633 1.00 0.92 H new ATOM 0 HB VAL A 154 20.347 1.801 -3.788 1.00 0.91 H new ATOM 0 HG11 VAL A 154 20.467 2.432 -6.188 1.00 1.03 H new ATOM 0 HG12 VAL A 154 21.428 0.971 -5.856 1.00 1.03 H new ATOM 0 HG13 VAL A 154 19.835 0.831 -6.638 1.00 1.03 H new ATOM 0 HG21 VAL A 154 18.394 2.891 -4.898 1.00 0.80 H new ATOM 0 HG22 VAL A 154 17.750 1.288 -5.325 1.00 0.80 H new ATOM 0 HG23 VAL A 154 17.864 1.774 -3.617 1.00 0.80 H new ATOM 2550 N GLU A 155 22.080 -0.464 -3.915 1.00 1.14 N ATOM 2551 CA GLU A 155 23.391 -1.111 -4.204 1.00 1.29 C ATOM 2552 C GLU A 155 23.374 -2.569 -3.733 1.00 1.34 C ATOM 2553 O GLU A 155 24.231 -3.353 -4.088 1.00 1.55 O ATOM 2554 CB GLU A 155 24.503 -0.354 -3.475 1.00 1.36 C ATOM 2555 CG GLU A 155 24.187 -0.297 -1.979 1.00 1.32 C ATOM 2556 CD GLU A 155 25.238 0.556 -1.268 1.00 1.64 C ATOM 2557 OE1 GLU A 155 25.316 1.737 -1.567 1.00 2.26 O ATOM 2558 OE2 GLU A 155 25.948 0.015 -0.436 1.00 1.90 O ATOM 0 H GLU A 155 22.125 0.352 -3.304 1.00 1.14 H new ATOM 0 HA GLU A 155 23.571 -1.086 -5.279 1.00 1.29 H new ATOM 0 HB2 GLU A 155 25.461 -0.849 -3.636 1.00 1.36 H new ATOM 0 HB3 GLU A 155 24.594 0.655 -3.877 1.00 1.36 H new ATOM 0 HG2 GLU A 155 23.194 0.125 -1.822 1.00 1.32 H new ATOM 0 HG3 GLU A 155 24.176 -1.303 -1.560 1.00 1.32 H new ATOM 2565 N PHE A 156 22.411 -2.942 -2.933 1.00 1.24 N ATOM 2566 CA PHE A 156 22.357 -4.351 -2.446 1.00 1.32 C ATOM 2567 C PHE A 156 22.366 -5.310 -3.637 1.00 1.47 C ATOM 2568 O PHE A 156 22.950 -6.375 -3.584 1.00 1.55 O ATOM 2569 CB PHE A 156 21.077 -4.574 -1.638 1.00 1.25 C ATOM 2570 CG PHE A 156 21.084 -5.975 -1.074 1.00 1.36 C ATOM 2571 CD1 PHE A 156 21.789 -6.252 0.103 1.00 1.94 C ATOM 2572 CD2 PHE A 156 20.389 -6.997 -1.731 1.00 1.80 C ATOM 2573 CE1 PHE A 156 21.799 -7.551 0.623 1.00 2.06 C ATOM 2574 CE2 PHE A 156 20.398 -8.296 -1.210 1.00 1.90 C ATOM 2575 CZ PHE A 156 21.103 -8.574 -0.033 1.00 1.65 C ATOM 0 H PHE A 156 21.663 -2.335 -2.597 1.00 1.24 H new ATOM 0 HA PHE A 156 23.226 -4.539 -1.815 1.00 1.32 H new ATOM 0 HB2 PHE A 156 21.010 -3.844 -0.831 1.00 1.25 H new ATOM 0 HB3 PHE A 156 20.202 -4.429 -2.272 1.00 1.25 H new ATOM 0 HD1 PHE A 156 22.325 -5.463 0.610 1.00 1.94 H new ATOM 0 HD2 PHE A 156 19.846 -6.783 -2.640 1.00 1.80 H new ATOM 0 HE1 PHE A 156 22.344 -7.765 1.531 1.00 2.06 H new ATOM 0 HE2 PHE A 156 19.861 -9.084 -1.716 1.00 1.90 H new ATOM 0 HZ PHE A 156 21.110 -9.576 0.369 1.00 1.65 H new ATOM 2585 N TYR A 157 21.720 -4.946 -4.709 1.00 1.56 N ATOM 2586 CA TYR A 157 21.686 -5.838 -5.897 1.00 1.74 C ATOM 2587 C TYR A 157 23.001 -5.713 -6.669 1.00 1.83 C ATOM 2588 O TYR A 157 23.432 -6.636 -7.332 1.00 2.02 O ATOM 2589 CB TYR A 157 20.522 -5.423 -6.797 1.00 1.77 C ATOM 2590 CG TYR A 157 19.218 -5.846 -6.163 1.00 1.65 C ATOM 2591 CD1 TYR A 157 18.695 -7.119 -6.418 1.00 2.02 C ATOM 2592 CD2 TYR A 157 18.532 -4.963 -5.321 1.00 2.08 C ATOM 2593 CE1 TYR A 157 17.486 -7.510 -5.830 1.00 2.08 C ATOM 2594 CE2 TYR A 157 17.323 -5.354 -4.733 1.00 2.23 C ATOM 2595 CZ TYR A 157 16.800 -6.627 -4.988 1.00 1.92 C ATOM 2596 OH TYR A 157 15.608 -7.012 -4.408 1.00 2.22 O ATOM 0 H TYR A 157 21.213 -4.067 -4.812 1.00 1.56 H new ATOM 0 HA TYR A 157 21.555 -6.872 -5.578 1.00 1.74 H new ATOM 0 HB2 TYR A 157 20.532 -4.343 -6.947 1.00 1.77 H new ATOM 0 HB3 TYR A 157 20.627 -5.883 -7.780 1.00 1.77 H new ATOM 0 HD1 TYR A 157 19.224 -7.800 -7.068 1.00 2.02 H new ATOM 0 HD2 TYR A 157 18.935 -3.980 -5.125 1.00 2.08 H new ATOM 0 HE1 TYR A 157 17.083 -8.493 -6.026 1.00 2.08 H new ATOM 0 HE2 TYR A 157 16.794 -4.673 -4.083 1.00 2.23 H new ATOM 0 HH TYR A 157 15.264 -6.282 -3.852 1.00 2.22 H new ATOM 2606 N SER A 158 23.642 -4.580 -6.590 1.00 1.75 N ATOM 2607 CA SER A 158 24.928 -4.399 -7.320 1.00 1.87 C ATOM 2608 C SER A 158 25.955 -5.408 -6.803 1.00 2.00 C ATOM 2609 O SER A 158 26.919 -5.726 -7.472 1.00 2.12 O ATOM 2610 CB SER A 158 25.449 -2.980 -7.092 1.00 1.89 C ATOM 2611 OG SER A 158 26.543 -2.735 -7.966 1.00 2.42 O ATOM 0 H SER A 158 23.331 -3.772 -6.051 1.00 1.75 H new ATOM 0 HA SER A 158 24.766 -4.559 -8.386 1.00 1.87 H new ATOM 0 HB2 SER A 158 24.655 -2.255 -7.273 1.00 1.89 H new ATOM 0 HB3 SER A 158 25.762 -2.858 -6.055 1.00 1.89 H new ATOM 0 HG SER A 158 26.878 -1.825 -7.823 1.00 2.42 H new ATOM 2617 N ARG A 159 25.758 -5.915 -5.617 1.00 2.16 N ATOM 2618 CA ARG A 159 26.723 -6.904 -5.059 1.00 2.40 C ATOM 2619 C ARG A 159 26.591 -8.228 -5.814 1.00 3.28 C ATOM 2620 O ARG A 159 26.497 -9.253 -5.160 1.00 4.21 O ATOM 2621 CB ARG A 159 26.422 -7.130 -3.576 1.00 2.32 C ATOM 2622 CG ARG A 159 26.842 -5.890 -2.773 1.00 2.10 C ATOM 2623 CD ARG A 159 26.672 -6.146 -1.258 1.00 2.05 C ATOM 2624 NE ARG A 159 26.021 -4.963 -0.608 1.00 2.89 N ATOM 2625 CZ ARG A 159 26.428 -3.743 -0.851 1.00 3.39 C ATOM 2626 NH1 ARG A 159 27.486 -3.532 -1.585 1.00 3.38 N ATOM 2627 NH2 ARG A 159 25.789 -2.731 -0.330 1.00 4.37 N ATOM 2628 OXT ARG A 159 26.588 -8.194 -7.034 1.00 3.31 O ATOM 0 H ARG A 159 24.970 -5.687 -5.010 1.00 2.16 H new ATOM 0 HA ARG A 159 27.738 -6.523 -5.170 1.00 2.40 H new ATOM 0 HB2 ARG A 159 25.359 -7.324 -3.435 1.00 2.32 H new ATOM 0 HB3 ARG A 159 26.957 -8.008 -3.215 1.00 2.32 H new ATOM 0 HG2 ARG A 159 27.880 -5.642 -2.992 1.00 2.10 H new ATOM 0 HG3 ARG A 159 26.239 -5.033 -3.073 1.00 2.10 H new ATOM 0 HD2 ARG A 159 26.067 -7.038 -1.097 1.00 2.05 H new ATOM 0 HD3 ARG A 159 27.644 -6.333 -0.801 1.00 2.05 H new ATOM 0 HE ARG A 159 25.245 -5.112 0.037 1.00 2.89 H new ATOM 0 HH11 ARG A 159 28.002 -4.321 -1.974 1.00 3.38 H new ATOM 0 HH12 ARG A 159 27.797 -2.578 -1.770 1.00 3.38 H new ATOM 0 HH21 ARG A 159 24.976 -2.893 0.264 1.00 4.37 H new ATOM 0 HH22 ARG A 159 26.103 -1.779 -0.517 1.00 4.37 H new TER 2642 ARG A 159