USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1828 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: B 85 GLN : amide:sc= -0.753 K(o=-2.4,f=-5.4!) USER MOD Set 1.2: B 114 MET CE :methyl -137:sc= -1.67 (180deg=-2.71!) USER MOD Set 2.1: B 47 THR OG1 : rot 114:sc= 0.149 USER MOD Set 2.2: B 49 THR OG1 : rot 180:sc= 0.152 USER MOD Set 3.1: B 28 LYS NZ :NH3+ -123:sc= 1.62 (180deg=-0.0132) USER MOD Set 3.2: B 29 ASN : amide:sc= 1.12 K(o=2.7,f=-7) USER MOD Set 4.1: A 85 GLN : amide:sc= -0.9 K(o=-2.5,f=-5.1) USER MOD Set 4.2: A 114 MET CE :methyl -140:sc= -1.64 (180deg=-2.71!) USER MOD Set 5.1: A 47 THR OG1 : rot 113:sc= 0.138 USER MOD Set 5.2: A 49 THR OG1 : rot 180:sc= 0.128 USER MOD Set 6.1: A 28 LYS NZ :NH3+ -108:sc= 1.55 (180deg=0.0381) USER MOD Set 6.2: A 29 ASN : amide:sc= 1.11 K(o=2.7,f=-6.8) USER MOD Single : A 2 SER OG : rot 34:sc= 0.149 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 90:sc= 0.175 USER MOD Single : A 9 SER OG : rot 180:sc= -0.172 USER MOD Single : A 12 LYS NZ :NH3+ -165:sc= 0.76 (180deg=0.368) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 CYS SG : rot 55:sc= 1.23 USER MOD Single : A 23 MET CE :methyl -148:sc= -0.117 (180deg=-0.96) USER MOD Single : A 24 SER OG : rot 11:sc= -0.0543 USER MOD Single : A 26 THR OG1 : rot 175:sc= 0 USER MOD Single : A 30 MET CE :methyl 159:sc= 0 (180deg=-0.299) USER MOD Single : A 37 SER OG : rot 180:sc= -2.13 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00496 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot -149:sc= 0.213 USER MOD Single : A 53 LYS NZ :NH3+ 170:sc= -0.0118 (180deg=-0.156) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.958 USER MOD Single : A 58 CYS SG : rot 78:sc= 0.668 USER MOD Single : A 60 HIS : no HD1:sc= -0.191 K(o=-0.19,f=-1.3) USER MOD Single : A 61 HIS : no HE2:sc= 1.23 K(o=1.2,f=-4!) USER MOD Single : A 62 HIS : no HD1:sc= -0.614 K(o=-0.61,f=-2.2) USER MOD Single : A 63 GLN : amide:sc= -0.71 K(o=-0.71,f=0) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot -147:sc= 0.16 USER MOD Single : A 81 CYS SG : rot 81:sc= 1.26 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.138 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 97 TYR OH : rot 180:sc= -0.0541 USER MOD Single : A 101 LYS NZ :NH3+ -172:sc= 0.356 (180deg=0.211) USER MOD Single : A 107 THR OG1 : rot 77:sc= 0.375 USER MOD Single : A 108 CYS SG : rot 70:sc= 0.816 USER MOD Single : A 109 LYS NZ :NH3+ -110:sc= 0.451 (180deg=-0.318) USER MOD Single : A 110 THR OG1 : rot 72:sc= 0.357 USER MOD Single : A 113 ASN : amide:sc= 0.267 K(o=0.27,f=-3.1!) USER MOD Single : B 2 SER OG : rot 26:sc= 0.158 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 80:sc= 0.216 USER MOD Single : B 9 SER OG : rot 180:sc= -0.182 USER MOD Single : B 12 LYS NZ :NH3+ -166:sc= 0.765 (180deg=0.423) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 CYS SG : rot 49:sc= 1.25 USER MOD Single : B 23 MET CE :methyl -147:sc= -0.143 (180deg=-0.962) USER MOD Single : B 24 SER OG : rot 10:sc= 0.0308 USER MOD Single : B 26 THR OG1 : rot 174:sc= 0 USER MOD Single : B 30 MET CE :methyl 160:sc= 0 (180deg=-0.287) USER MOD Single : B 37 SER OG : rot 180:sc= -2.14 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 SER OG : rot -149:sc= 0.221 USER MOD Single : B 53 LYS NZ :NH3+ 169:sc=-0.00728 (180deg=-0.168) USER MOD Single : B 57 TYR OH : rot 180:sc= -0.909 USER MOD Single : B 58 CYS SG : rot 72:sc= 0.709 USER MOD Single : B 60 HIS : no HD1:sc= -0.325 K(o=-0.33,f=-1.6) USER MOD Single : B 61 HIS : no HE2:sc= 1.25 K(o=1.3,f=-4.1!) USER MOD Single : B 62 HIS : no HD1:sc= -0.362 K(o=-0.36,f=-2.5) USER MOD Single : B 63 GLN : amide:sc= -0.64 K(o=-0.64,f=0) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot -149:sc= 0.219 USER MOD Single : B 81 CYS SG : rot 91:sc= 1.2 USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 THR OG1 : rot 180:sc= -0.0498 USER MOD Single : B 96 ASN : amide:sc= -0.173 X(o=-0.17,f=-0.5) USER MOD Single : B 97 TYR OH : rot 180:sc= -0.0112 USER MOD Single : B 101 LYS NZ :NH3+ 175:sc= 0.618 (180deg=0.549) USER MOD Single : B 107 THR OG1 : rot 78:sc= 0.366 USER MOD Single : B 108 CYS SG : rot 71:sc= 0.899 USER MOD Single : B 109 LYS NZ :NH3+ -110:sc= 0.273 (180deg=-0.343) USER MOD Single : B 110 THR OG1 : rot 70:sc= 0.297 USER MOD Single : B 113 ASN : amide:sc= 0.323 K(o=0.32,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -16.242 -15.232 -15.707 1.00 71.14 N ATOM 2 CA SER A 2 -17.491 -14.719 -15.119 1.00 75.31 C ATOM 3 C SER A 2 -17.267 -13.313 -14.548 1.00 10.52 C ATOM 4 O SER A 2 -16.280 -13.077 -13.840 1.00 64.35 O ATOM 5 CB SER A 2 -17.991 -15.694 -14.041 1.00 21.32 C ATOM 6 OG SER A 2 -18.119 -17.008 -14.567 1.00 43.33 O ATOM 0 HA SER A 2 -18.257 -14.643 -15.891 1.00 75.31 H new ATOM 0 HB2 SER A 2 -17.297 -15.700 -13.200 1.00 21.32 H new ATOM 0 HB3 SER A 2 -18.954 -15.356 -13.657 1.00 21.32 H new ATOM 0 HG SER A 2 -17.418 -17.163 -15.234 1.00 43.33 H new ATOM 14 N LEU A 3 -18.181 -12.382 -14.870 1.00 25.31 N ATOM 15 CA LEU A 3 -18.103 -10.990 -14.399 1.00 5.45 C ATOM 16 C LEU A 3 -18.466 -10.906 -12.903 1.00 14.13 C ATOM 17 O LEU A 3 -19.591 -11.248 -12.512 1.00 2.15 O ATOM 18 CB LEU A 3 -19.065 -10.096 -15.225 1.00 23.42 C ATOM 19 CG LEU A 3 -18.830 -10.088 -16.766 1.00 73.22 C ATOM 20 CD1 LEU A 3 -19.972 -9.358 -17.493 1.00 25.03 C ATOM 21 CD2 LEU A 3 -17.453 -9.489 -17.127 1.00 20.24 C ATOM 0 H LEU A 3 -18.990 -12.572 -15.461 1.00 25.31 H new ATOM 0 HA LEU A 3 -17.081 -10.635 -14.532 1.00 5.45 H new ATOM 0 HB2 LEU A 3 -20.087 -10.422 -15.034 1.00 23.42 H new ATOM 0 HB3 LEU A 3 -18.984 -9.073 -14.859 1.00 23.42 H new ATOM 0 HG LEU A 3 -18.828 -11.123 -17.107 1.00 73.22 H new ATOM 0 HD11 LEU A 3 -19.784 -9.366 -18.567 1.00 25.03 H new ATOM 0 HD12 LEU A 3 -20.916 -9.862 -17.286 1.00 25.03 H new ATOM 0 HD13 LEU A 3 -20.026 -8.327 -17.142 1.00 25.03 H new ATOM 0 HD21 LEU A 3 -17.324 -9.500 -18.209 1.00 20.24 H new ATOM 0 HD22 LEU A 3 -17.397 -8.462 -16.765 1.00 20.24 H new ATOM 0 HD23 LEU A 3 -16.665 -10.082 -16.662 1.00 20.24 H new ATOM 33 N VAL A 4 -17.502 -10.471 -12.080 1.00 1.34 N ATOM 34 CA VAL A 4 -17.745 -10.152 -10.667 1.00 32.40 C ATOM 35 C VAL A 4 -18.292 -8.712 -10.570 1.00 64.04 C ATOM 36 O VAL A 4 -17.713 -7.761 -11.126 1.00 71.35 O ATOM 37 CB VAL A 4 -16.460 -10.356 -9.772 1.00 43.04 C ATOM 38 CG1 VAL A 4 -16.045 -11.851 -9.749 1.00 2.04 C ATOM 39 CG2 VAL A 4 -15.283 -9.463 -10.232 1.00 61.01 C ATOM 0 H VAL A 4 -16.535 -10.331 -12.374 1.00 1.34 H new ATOM 0 HA VAL A 4 -18.486 -10.848 -10.273 1.00 32.40 H new ATOM 0 HB VAL A 4 -16.716 -10.049 -8.758 1.00 43.04 H new ATOM 0 HG11 VAL A 4 -15.158 -11.973 -9.128 1.00 2.04 H new ATOM 0 HG12 VAL A 4 -16.860 -12.448 -9.340 1.00 2.04 H new ATOM 0 HG13 VAL A 4 -15.826 -12.183 -10.764 1.00 2.04 H new ATOM 0 HG21 VAL A 4 -14.421 -9.637 -9.588 1.00 61.01 H new ATOM 0 HG22 VAL A 4 -15.022 -9.707 -11.262 1.00 61.01 H new ATOM 0 HG23 VAL A 4 -15.576 -8.415 -10.171 1.00 61.01 H new ATOM 49 N LYS A 5 -19.440 -8.577 -9.909 1.00 3.40 N ATOM 50 CA LYS A 5 -20.185 -7.321 -9.839 1.00 71.33 C ATOM 51 C LYS A 5 -19.731 -6.510 -8.621 1.00 1.20 C ATOM 52 O LYS A 5 -20.259 -6.666 -7.514 1.00 31.00 O ATOM 53 CB LYS A 5 -21.701 -7.621 -9.801 1.00 14.21 C ATOM 54 CG LYS A 5 -22.214 -8.458 -10.996 1.00 51.44 C ATOM 55 CD LYS A 5 -23.755 -8.579 -11.022 1.00 22.04 C ATOM 56 CE LYS A 5 -24.242 -9.461 -12.176 1.00 3.42 C ATOM 57 NZ LYS A 5 -25.722 -9.470 -12.285 1.00 34.30 N ATOM 0 H LYS A 5 -19.883 -9.343 -9.402 1.00 3.40 H new ATOM 0 HA LYS A 5 -19.984 -6.719 -10.725 1.00 71.33 H new ATOM 0 HB2 LYS A 5 -21.932 -8.150 -8.876 1.00 14.21 H new ATOM 0 HB3 LYS A 5 -22.246 -6.677 -9.773 1.00 14.21 H new ATOM 0 HG2 LYS A 5 -21.874 -8.003 -11.926 1.00 51.44 H new ATOM 0 HG3 LYS A 5 -21.776 -9.455 -10.950 1.00 51.44 H new ATOM 0 HD2 LYS A 5 -24.102 -8.995 -10.076 1.00 22.04 H new ATOM 0 HD3 LYS A 5 -24.195 -7.586 -11.114 1.00 22.04 H new ATOM 0 HE2 LYS A 5 -23.812 -9.103 -13.112 1.00 3.42 H new ATOM 0 HE3 LYS A 5 -23.883 -10.480 -12.029 1.00 3.42 H new ATOM 0 HZ1 LYS A 5 -26.008 -10.079 -13.078 1.00 34.30 H new ATOM 0 HZ2 LYS A 5 -26.133 -9.836 -11.402 1.00 34.30 H new ATOM 0 HZ3 LYS A 5 -26.064 -8.502 -12.451 1.00 34.30 H new ATOM 71 N LEU A 6 -18.698 -5.690 -8.830 1.00 12.43 N ATOM 72 CA LEU A 6 -18.120 -4.833 -7.790 1.00 51.52 C ATOM 73 C LEU A 6 -18.928 -3.542 -7.678 1.00 11.14 C ATOM 74 O LEU A 6 -18.726 -2.597 -8.454 1.00 72.34 O ATOM 75 CB LEU A 6 -16.637 -4.536 -8.112 1.00 24.43 C ATOM 76 CG LEU A 6 -15.715 -5.786 -8.231 1.00 74.51 C ATOM 77 CD1 LEU A 6 -14.286 -5.369 -8.605 1.00 14.15 C ATOM 78 CD2 LEU A 6 -15.739 -6.642 -6.940 1.00 40.23 C ATOM 0 H LEU A 6 -18.234 -5.601 -9.734 1.00 12.43 H new ATOM 0 HA LEU A 6 -18.161 -5.348 -6.830 1.00 51.52 H new ATOM 0 HB2 LEU A 6 -16.591 -3.981 -9.049 1.00 24.43 H new ATOM 0 HB3 LEU A 6 -16.238 -3.884 -7.335 1.00 24.43 H new ATOM 0 HG LEU A 6 -16.105 -6.414 -9.033 1.00 74.51 H new ATOM 0 HD11 LEU A 6 -13.657 -6.256 -8.683 1.00 14.15 H new ATOM 0 HD12 LEU A 6 -14.298 -4.847 -9.562 1.00 14.15 H new ATOM 0 HD13 LEU A 6 -13.887 -4.708 -7.836 1.00 14.15 H new ATOM 0 HD21 LEU A 6 -15.084 -7.504 -7.063 1.00 40.23 H new ATOM 0 HD22 LEU A 6 -15.394 -6.041 -6.099 1.00 40.23 H new ATOM 0 HD23 LEU A 6 -16.756 -6.984 -6.749 1.00 40.23 H new ATOM 90 N GLU A 7 -19.887 -3.536 -6.750 1.00 74.10 N ATOM 91 CA GLU A 7 -20.705 -2.359 -6.464 1.00 70.11 C ATOM 92 C GLU A 7 -19.902 -1.389 -5.574 1.00 61.03 C ATOM 93 O GLU A 7 -19.274 -1.813 -4.610 1.00 42.05 O ATOM 94 CB GLU A 7 -22.021 -2.778 -5.767 1.00 4.32 C ATOM 95 CG GLU A 7 -22.980 -1.601 -5.481 1.00 63.10 C ATOM 96 CD GLU A 7 -24.216 -2.006 -4.673 1.00 35.22 C ATOM 97 OE1 GLU A 7 -24.232 -1.796 -3.440 1.00 50.33 O ATOM 98 OE2 GLU A 7 -25.163 -2.563 -5.266 1.00 32.53 O ATOM 0 H GLU A 7 -20.117 -4.347 -6.177 1.00 74.10 H new ATOM 0 HA GLU A 7 -20.963 -1.858 -7.397 1.00 70.11 H new ATOM 0 HB2 GLU A 7 -22.535 -3.509 -6.392 1.00 4.32 H new ATOM 0 HB3 GLU A 7 -21.781 -3.275 -4.827 1.00 4.32 H new ATOM 0 HG2 GLU A 7 -22.439 -0.825 -4.939 1.00 63.10 H new ATOM 0 HG3 GLU A 7 -23.300 -1.165 -6.427 1.00 63.10 H new ATOM 105 N SER A 8 -19.918 -0.104 -5.929 1.00 12.44 N ATOM 106 CA SER A 8 -19.241 0.961 -5.173 1.00 51.45 C ATOM 107 C SER A 8 -20.131 1.474 -4.020 1.00 62.42 C ATOM 108 O SER A 8 -21.278 1.037 -3.866 1.00 61.23 O ATOM 109 CB SER A 8 -18.894 2.098 -6.155 1.00 45.35 C ATOM 110 OG SER A 8 -20.042 2.544 -6.863 1.00 54.10 O ATOM 0 H SER A 8 -20.406 0.235 -6.758 1.00 12.44 H new ATOM 0 HA SER A 8 -18.329 0.573 -4.719 1.00 51.45 H new ATOM 0 HB2 SER A 8 -18.457 2.932 -5.607 1.00 45.35 H new ATOM 0 HB3 SER A 8 -18.141 1.752 -6.863 1.00 45.35 H new ATOM 0 HG SER A 8 -20.474 3.268 -6.363 1.00 54.10 H new ATOM 116 N SER A 9 -19.578 2.401 -3.220 1.00 22.02 N ATOM 117 CA SER A 9 -20.313 3.102 -2.146 1.00 4.14 C ATOM 118 C SER A 9 -21.373 4.063 -2.736 1.00 52.22 C ATOM 119 O SER A 9 -22.358 4.408 -2.073 1.00 20.33 O ATOM 120 CB SER A 9 -19.298 3.860 -1.249 1.00 62.55 C ATOM 121 OG SER A 9 -18.497 4.750 -2.008 1.00 4.11 O ATOM 0 H SER A 9 -18.603 2.689 -3.298 1.00 22.02 H new ATOM 0 HA SER A 9 -20.848 2.373 -1.538 1.00 4.14 H new ATOM 0 HB2 SER A 9 -19.835 4.417 -0.481 1.00 62.55 H new ATOM 0 HB3 SER A 9 -18.659 3.142 -0.734 1.00 62.55 H new ATOM 0 HG SER A 9 -17.870 5.213 -1.414 1.00 4.11 H new ATOM 127 N ASP A 10 -21.147 4.470 -4.007 1.00 4.03 N ATOM 128 CA ASP A 10 -22.096 5.277 -4.811 1.00 13.52 C ATOM 129 C ASP A 10 -23.153 4.360 -5.511 1.00 74.32 C ATOM 130 O ASP A 10 -23.976 4.819 -6.322 1.00 13.25 O ATOM 131 CB ASP A 10 -21.269 6.096 -5.838 1.00 11.42 C ATOM 132 CG ASP A 10 -22.100 7.076 -6.691 1.00 61.31 C ATOM 133 OD1 ASP A 10 -22.322 6.818 -7.893 1.00 4.34 O ATOM 134 OD2 ASP A 10 -22.538 8.106 -6.159 1.00 43.02 O ATOM 0 H ASP A 10 -20.289 4.244 -4.510 1.00 4.03 H new ATOM 0 HA ASP A 10 -22.658 5.958 -4.171 1.00 13.52 H new ATOM 0 HB2 ASP A 10 -20.503 6.658 -5.303 1.00 11.42 H new ATOM 0 HB3 ASP A 10 -20.751 5.405 -6.503 1.00 11.42 H new ATOM 139 N GLU A 11 -23.099 3.047 -5.176 1.00 73.30 N ATOM 140 CA GLU A 11 -24.076 2.010 -5.588 1.00 73.31 C ATOM 141 C GLU A 11 -24.041 1.717 -7.110 1.00 23.21 C ATOM 142 O GLU A 11 -24.989 1.152 -7.664 1.00 13.13 O ATOM 143 CB GLU A 11 -25.515 2.360 -5.092 1.00 63.45 C ATOM 144 CG GLU A 11 -25.645 2.498 -3.558 1.00 22.14 C ATOM 145 CD GLU A 11 -27.090 2.752 -3.092 1.00 43.53 C ATOM 146 OE1 GLU A 11 -27.821 1.772 -2.827 1.00 53.41 O ATOM 147 OE2 GLU A 11 -27.513 3.928 -3.015 1.00 74.43 O ATOM 0 H GLU A 11 -22.351 2.670 -4.594 1.00 73.30 H new ATOM 0 HA GLU A 11 -23.773 1.083 -5.100 1.00 73.31 H new ATOM 0 HB2 GLU A 11 -25.829 3.295 -5.557 1.00 63.45 H new ATOM 0 HB3 GLU A 11 -26.203 1.587 -5.435 1.00 63.45 H new ATOM 0 HG2 GLU A 11 -25.272 1.589 -3.085 1.00 22.14 H new ATOM 0 HG3 GLU A 11 -25.011 3.317 -3.218 1.00 22.14 H new ATOM 154 N LYS A 12 -22.921 2.070 -7.774 1.00 35.43 N ATOM 155 CA LYS A 12 -22.695 1.731 -9.195 1.00 4.33 C ATOM 156 C LYS A 12 -22.035 0.350 -9.289 1.00 51.34 C ATOM 157 O LYS A 12 -20.962 0.133 -8.719 1.00 42.41 O ATOM 158 CB LYS A 12 -21.817 2.808 -9.891 1.00 43.03 C ATOM 159 CG LYS A 12 -22.458 4.206 -9.942 1.00 24.15 C ATOM 160 CD LYS A 12 -23.791 4.229 -10.721 1.00 61.31 C ATOM 161 CE LYS A 12 -24.491 5.593 -10.654 1.00 73.51 C ATOM 162 NZ LYS A 12 -24.795 5.988 -9.256 1.00 12.24 N ATOM 0 H LYS A 12 -22.156 2.592 -7.347 1.00 35.43 H new ATOM 0 HA LYS A 12 -23.655 1.706 -9.710 1.00 4.33 H new ATOM 0 HB2 LYS A 12 -20.863 2.877 -9.368 1.00 43.03 H new ATOM 0 HB3 LYS A 12 -21.600 2.482 -10.908 1.00 43.03 H new ATOM 0 HG2 LYS A 12 -22.631 4.558 -8.925 1.00 24.15 H new ATOM 0 HG3 LYS A 12 -21.760 4.903 -10.406 1.00 24.15 H new ATOM 0 HD2 LYS A 12 -23.603 3.972 -11.763 1.00 61.31 H new ATOM 0 HD3 LYS A 12 -24.455 3.464 -10.319 1.00 61.31 H new ATOM 0 HE2 LYS A 12 -23.857 6.350 -11.116 1.00 73.51 H new ATOM 0 HE3 LYS A 12 -25.415 5.556 -11.231 1.00 73.51 H new ATOM 0 HZ1 LYS A 12 -25.479 6.771 -9.258 1.00 12.24 H new ATOM 0 HZ2 LYS A 12 -25.198 5.176 -8.746 1.00 12.24 H new ATOM 0 HZ3 LYS A 12 -23.920 6.294 -8.784 1.00 12.24 H new ATOM 176 N VAL A 13 -22.695 -0.563 -10.009 1.00 74.05 N ATOM 177 CA VAL A 13 -22.276 -1.961 -10.150 1.00 1.44 C ATOM 178 C VAL A 13 -21.361 -2.115 -11.383 1.00 21.10 C ATOM 179 O VAL A 13 -21.824 -2.049 -12.529 1.00 53.04 O ATOM 180 CB VAL A 13 -23.538 -2.902 -10.271 1.00 14.13 C ATOM 181 CG1 VAL A 13 -23.138 -4.388 -10.371 1.00 54.43 C ATOM 182 CG2 VAL A 13 -24.522 -2.660 -9.099 1.00 15.33 C ATOM 0 H VAL A 13 -23.551 -0.347 -10.519 1.00 74.05 H new ATOM 0 HA VAL A 13 -21.716 -2.254 -9.262 1.00 1.44 H new ATOM 0 HB VAL A 13 -24.050 -2.647 -11.199 1.00 14.13 H new ATOM 0 HG11 VAL A 13 -24.035 -5.002 -10.453 1.00 54.43 H new ATOM 0 HG12 VAL A 13 -22.514 -4.538 -11.252 1.00 54.43 H new ATOM 0 HG13 VAL A 13 -22.582 -4.676 -9.479 1.00 54.43 H new ATOM 0 HG21 VAL A 13 -25.383 -3.320 -9.205 1.00 15.33 H new ATOM 0 HG22 VAL A 13 -24.020 -2.867 -8.154 1.00 15.33 H new ATOM 0 HG23 VAL A 13 -24.856 -1.623 -9.113 1.00 15.33 H new ATOM 192 N PHE A 14 -20.055 -2.272 -11.134 1.00 73.44 N ATOM 193 CA PHE A 14 -19.044 -2.474 -12.183 1.00 50.44 C ATOM 194 C PHE A 14 -18.827 -3.983 -12.394 1.00 14.44 C ATOM 195 O PHE A 14 -18.170 -4.650 -11.583 1.00 70.20 O ATOM 196 CB PHE A 14 -17.721 -1.765 -11.785 1.00 14.01 C ATOM 197 CG PHE A 14 -17.852 -0.244 -11.619 1.00 61.04 C ATOM 198 CD1 PHE A 14 -17.713 0.610 -12.713 1.00 61.00 C ATOM 199 CD2 PHE A 14 -18.130 0.326 -10.373 1.00 74.43 C ATOM 200 CE1 PHE A 14 -17.841 1.980 -12.565 1.00 24.22 C ATOM 201 CE2 PHE A 14 -18.254 1.696 -10.231 1.00 33.04 C ATOM 202 CZ PHE A 14 -18.113 2.519 -11.326 1.00 63.32 C ATOM 0 H PHE A 14 -19.666 -2.263 -10.191 1.00 73.44 H new ATOM 0 HA PHE A 14 -19.388 -2.038 -13.121 1.00 50.44 H new ATOM 0 HB2 PHE A 14 -17.359 -2.192 -10.850 1.00 14.01 H new ATOM 0 HB3 PHE A 14 -16.967 -1.974 -12.544 1.00 14.01 H new ATOM 0 HD1 PHE A 14 -17.503 0.197 -13.688 1.00 61.00 H new ATOM 0 HD2 PHE A 14 -18.249 -0.312 -9.510 1.00 74.43 H new ATOM 0 HE1 PHE A 14 -17.728 2.628 -13.422 1.00 24.22 H new ATOM 0 HE2 PHE A 14 -18.462 2.121 -9.260 1.00 33.04 H new ATOM 0 HZ PHE A 14 -18.216 3.588 -11.214 1.00 63.32 H new ATOM 212 N GLU A 15 -19.424 -4.510 -13.474 1.00 52.54 N ATOM 213 CA GLU A 15 -19.341 -5.933 -13.840 1.00 35.53 C ATOM 214 C GLU A 15 -18.029 -6.194 -14.608 1.00 1.34 C ATOM 215 O GLU A 15 -18.005 -6.242 -15.850 1.00 42.42 O ATOM 216 CB GLU A 15 -20.584 -6.335 -14.674 1.00 62.50 C ATOM 217 CG GLU A 15 -21.928 -5.949 -14.021 1.00 23.31 C ATOM 218 CD GLU A 15 -23.135 -6.334 -14.884 1.00 41.52 C ATOM 219 OE1 GLU A 15 -23.411 -5.634 -15.877 1.00 13.30 O ATOM 220 OE2 GLU A 15 -23.812 -7.338 -14.585 1.00 72.14 O ATOM 0 H GLU A 15 -19.983 -3.956 -14.123 1.00 52.54 H new ATOM 0 HA GLU A 15 -19.332 -6.548 -12.940 1.00 35.53 H new ATOM 0 HB2 GLU A 15 -20.519 -5.863 -15.655 1.00 62.50 H new ATOM 0 HB3 GLU A 15 -20.567 -7.413 -14.837 1.00 62.50 H new ATOM 0 HG2 GLU A 15 -22.010 -6.438 -13.050 1.00 23.31 H new ATOM 0 HG3 GLU A 15 -21.944 -4.874 -13.839 1.00 23.31 H new ATOM 227 N ILE A 16 -16.934 -6.290 -13.846 1.00 14.20 N ATOM 228 CA ILE A 16 -15.578 -6.518 -14.373 1.00 52.21 C ATOM 229 C ILE A 16 -15.272 -8.022 -14.359 1.00 74.31 C ATOM 230 O ILE A 16 -15.806 -8.758 -13.527 1.00 71.04 O ATOM 231 CB ILE A 16 -14.502 -5.706 -13.537 1.00 20.21 C ATOM 232 CG1 ILE A 16 -13.080 -5.813 -14.178 1.00 34.30 C ATOM 233 CG2 ILE A 16 -14.487 -6.148 -12.054 1.00 14.21 C ATOM 234 CD1 ILE A 16 -11.987 -5.029 -13.478 1.00 63.52 C ATOM 0 H ILE A 16 -16.962 -6.211 -12.829 1.00 14.20 H new ATOM 0 HA ILE A 16 -15.528 -6.158 -15.401 1.00 52.21 H new ATOM 0 HB ILE A 16 -14.794 -4.656 -13.563 1.00 20.21 H new ATOM 0 HG12 ILE A 16 -12.790 -6.863 -14.203 1.00 34.30 H new ATOM 0 HG13 ILE A 16 -13.140 -5.474 -15.212 1.00 34.30 H new ATOM 0 HG21 ILE A 16 -13.739 -5.572 -11.510 1.00 14.21 H new ATOM 0 HG22 ILE A 16 -15.469 -5.976 -11.613 1.00 14.21 H new ATOM 0 HG23 ILE A 16 -14.243 -7.209 -11.993 1.00 14.21 H new ATOM 0 HD11 ILE A 16 -11.043 -5.173 -14.003 1.00 63.52 H new ATOM 0 HD12 ILE A 16 -12.244 -3.970 -13.476 1.00 63.52 H new ATOM 0 HD13 ILE A 16 -11.888 -5.381 -12.451 1.00 63.52 H new ATOM 246 N GLU A 17 -14.433 -8.464 -15.306 1.00 21.12 N ATOM 247 CA GLU A 17 -14.058 -9.872 -15.457 1.00 43.53 C ATOM 248 C GLU A 17 -13.265 -10.342 -14.218 1.00 21.51 C ATOM 249 O GLU A 17 -12.421 -9.591 -13.701 1.00 64.05 O ATOM 250 CB GLU A 17 -13.247 -10.056 -16.785 1.00 50.13 C ATOM 251 CG GLU A 17 -13.681 -11.257 -17.643 1.00 64.40 C ATOM 252 CD GLU A 17 -13.513 -12.619 -16.940 1.00 13.41 C ATOM 253 OE1 GLU A 17 -14.478 -13.119 -16.332 1.00 61.01 O ATOM 254 OE2 GLU A 17 -12.410 -13.193 -16.988 1.00 33.11 O ATOM 0 H GLU A 17 -13.994 -7.849 -15.991 1.00 21.12 H new ATOM 0 HA GLU A 17 -14.951 -10.493 -15.524 1.00 43.53 H new ATOM 0 HB2 GLU A 17 -13.341 -9.148 -17.381 1.00 50.13 H new ATOM 0 HB3 GLU A 17 -12.191 -10.166 -16.537 1.00 50.13 H new ATOM 0 HG2 GLU A 17 -14.726 -11.131 -17.925 1.00 64.40 H new ATOM 0 HG3 GLU A 17 -13.100 -11.261 -18.565 1.00 64.40 H new ATOM 261 N LYS A 18 -13.559 -11.574 -13.751 1.00 22.44 N ATOM 262 CA LYS A 18 -12.926 -12.155 -12.554 1.00 65.05 C ATOM 263 C LYS A 18 -11.396 -12.254 -12.718 1.00 14.53 C ATOM 264 O LYS A 18 -10.663 -12.015 -11.758 1.00 72.03 O ATOM 265 CB LYS A 18 -13.504 -13.557 -12.229 1.00 11.33 C ATOM 266 CG LYS A 18 -12.916 -14.202 -10.947 1.00 75.14 C ATOM 267 CD LYS A 18 -13.295 -15.693 -10.778 1.00 1.03 C ATOM 268 CE LYS A 18 -12.531 -16.353 -9.617 1.00 43.22 C ATOM 269 NZ LYS A 18 -12.783 -17.814 -9.531 1.00 14.51 N ATOM 0 H LYS A 18 -14.240 -12.190 -14.194 1.00 22.44 H new ATOM 0 HA LYS A 18 -13.148 -11.484 -11.724 1.00 65.05 H new ATOM 0 HB2 LYS A 18 -14.585 -13.476 -12.119 1.00 11.33 H new ATOM 0 HB3 LYS A 18 -13.318 -14.220 -13.074 1.00 11.33 H new ATOM 0 HG2 LYS A 18 -11.830 -14.111 -10.969 1.00 75.14 H new ATOM 0 HG3 LYS A 18 -13.265 -13.646 -10.077 1.00 75.14 H new ATOM 0 HD2 LYS A 18 -14.367 -15.777 -10.601 1.00 1.03 H new ATOM 0 HD3 LYS A 18 -13.082 -16.228 -11.703 1.00 1.03 H new ATOM 0 HE2 LYS A 18 -11.463 -16.178 -9.743 1.00 43.22 H new ATOM 0 HE3 LYS A 18 -12.823 -15.881 -8.679 1.00 43.22 H new ATOM 0 HZ1 LYS A 18 -12.247 -18.212 -8.734 1.00 14.51 H new ATOM 0 HZ2 LYS A 18 -13.799 -17.983 -9.384 1.00 14.51 H new ATOM 0 HZ3 LYS A 18 -12.481 -18.271 -10.415 1.00 14.51 H new ATOM 283 N GLU A 19 -10.942 -12.590 -13.950 1.00 73.04 N ATOM 284 CA GLU A 19 -9.502 -12.705 -14.297 1.00 50.41 C ATOM 285 C GLU A 19 -8.725 -11.414 -13.943 1.00 51.21 C ATOM 286 O GLU A 19 -7.585 -11.459 -13.467 1.00 22.31 O ATOM 287 CB GLU A 19 -9.347 -13.040 -15.811 1.00 34.44 C ATOM 288 CG GLU A 19 -7.887 -13.128 -16.319 1.00 25.34 C ATOM 289 CD GLU A 19 -7.742 -13.605 -17.779 1.00 21.02 C ATOM 290 OE1 GLU A 19 -6.965 -12.989 -18.540 1.00 44.14 O ATOM 291 OE2 GLU A 19 -8.402 -14.593 -18.171 1.00 4.23 O ATOM 0 H GLU A 19 -11.564 -12.789 -14.733 1.00 73.04 H new ATOM 0 HA GLU A 19 -9.075 -13.514 -13.705 1.00 50.41 H new ATOM 0 HB2 GLU A 19 -9.842 -13.991 -16.009 1.00 34.44 H new ATOM 0 HB3 GLU A 19 -9.872 -12.281 -16.391 1.00 34.44 H new ATOM 0 HG2 GLU A 19 -7.423 -12.146 -16.224 1.00 25.34 H new ATOM 0 HG3 GLU A 19 -7.331 -13.807 -15.672 1.00 25.34 H new ATOM 298 N ILE A 20 -9.390 -10.271 -14.144 1.00 15.52 N ATOM 299 CA ILE A 20 -8.823 -8.941 -13.872 1.00 1.33 C ATOM 300 C ILE A 20 -8.866 -8.651 -12.354 1.00 42.05 C ATOM 301 O ILE A 20 -7.925 -8.084 -11.784 1.00 2.01 O ATOM 302 CB ILE A 20 -9.610 -7.821 -14.653 1.00 31.35 C ATOM 303 CG1 ILE A 20 -9.884 -8.255 -16.126 1.00 64.23 C ATOM 304 CG2 ILE A 20 -8.842 -6.483 -14.607 1.00 14.42 C ATOM 305 CD1 ILE A 20 -10.592 -7.219 -16.985 1.00 21.22 C ATOM 0 H ILE A 20 -10.344 -10.240 -14.503 1.00 15.52 H new ATOM 0 HA ILE A 20 -7.788 -8.934 -14.214 1.00 1.33 H new ATOM 0 HB ILE A 20 -10.573 -7.678 -14.162 1.00 31.35 H new ATOM 0 HG12 ILE A 20 -8.933 -8.506 -16.597 1.00 64.23 H new ATOM 0 HG13 ILE A 20 -10.484 -9.165 -16.114 1.00 64.23 H new ATOM 0 HG21 ILE A 20 -9.402 -5.723 -15.152 1.00 14.42 H new ATOM 0 HG22 ILE A 20 -8.719 -6.170 -13.570 1.00 14.42 H new ATOM 0 HG23 ILE A 20 -7.862 -6.610 -15.066 1.00 14.42 H new ATOM 0 HD11 ILE A 20 -10.736 -7.616 -17.990 1.00 21.22 H new ATOM 0 HD12 ILE A 20 -11.561 -6.983 -16.546 1.00 21.22 H new ATOM 0 HD13 ILE A 20 -9.987 -6.314 -17.036 1.00 21.22 H new ATOM 317 N ALA A 21 -9.974 -9.080 -11.716 1.00 13.43 N ATOM 318 CA ALA A 21 -10.219 -8.897 -10.271 1.00 5.32 C ATOM 319 C ALA A 21 -9.368 -9.848 -9.402 1.00 1.52 C ATOM 320 O ALA A 21 -9.352 -9.711 -8.176 1.00 12.55 O ATOM 321 CB ALA A 21 -11.713 -9.090 -9.981 1.00 11.13 C ATOM 0 H ALA A 21 -10.731 -9.568 -12.194 1.00 13.43 H new ATOM 0 HA ALA A 21 -9.918 -7.883 -10.006 1.00 5.32 H new ATOM 0 HB1 ALA A 21 -11.897 -8.956 -8.915 1.00 11.13 H new ATOM 0 HB2 ALA A 21 -12.291 -8.357 -10.544 1.00 11.13 H new ATOM 0 HB3 ALA A 21 -12.014 -10.095 -10.277 1.00 11.13 H new ATOM 327 N CYS A 22 -8.691 -10.822 -10.045 1.00 30.40 N ATOM 328 CA CYS A 22 -7.727 -11.709 -9.372 1.00 23.20 C ATOM 329 C CYS A 22 -6.449 -10.937 -8.984 1.00 34.31 C ATOM 330 O CYS A 22 -5.829 -11.240 -7.960 1.00 12.21 O ATOM 331 CB CYS A 22 -7.385 -12.919 -10.271 1.00 51.52 C ATOM 332 SG CYS A 22 -8.795 -13.994 -10.637 1.00 23.30 S ATOM 0 H CYS A 22 -8.798 -11.013 -11.041 1.00 30.40 H new ATOM 0 HA CYS A 22 -8.187 -12.081 -8.456 1.00 23.20 H new ATOM 0 HB2 CYS A 22 -6.968 -12.554 -11.209 1.00 51.52 H new ATOM 0 HB3 CYS A 22 -6.608 -13.510 -9.786 1.00 51.52 H new ATOM 0 HG CYS A 22 -9.757 -13.288 -11.153 1.00 23.30 H new ATOM 338 N MET A 23 -6.078 -9.924 -9.812 1.00 20.11 N ATOM 339 CA MET A 23 -4.906 -9.041 -9.544 1.00 33.45 C ATOM 340 C MET A 23 -5.128 -8.233 -8.251 1.00 35.12 C ATOM 341 O MET A 23 -4.176 -7.877 -7.542 1.00 34.32 O ATOM 342 CB MET A 23 -4.640 -8.070 -10.727 1.00 3.11 C ATOM 343 CG MET A 23 -4.482 -8.730 -12.106 1.00 73.22 C ATOM 344 SD MET A 23 -3.810 -7.601 -13.359 1.00 45.41 S ATOM 345 CE MET A 23 -4.873 -6.159 -13.224 1.00 33.21 C ATOM 0 H MET A 23 -6.574 -9.697 -10.674 1.00 20.11 H new ATOM 0 HA MET A 23 -4.033 -9.683 -9.427 1.00 33.45 H new ATOM 0 HB2 MET A 23 -5.461 -7.355 -10.778 1.00 3.11 H new ATOM 0 HB3 MET A 23 -3.736 -7.502 -10.511 1.00 3.11 H new ATOM 0 HG2 MET A 23 -3.826 -9.596 -12.015 1.00 73.22 H new ATOM 0 HG3 MET A 23 -5.452 -9.099 -12.440 1.00 73.22 H new ATOM 0 HE1 MET A 23 -4.972 -5.687 -14.202 1.00 33.21 H new ATOM 0 HE2 MET A 23 -5.857 -6.464 -12.867 1.00 33.21 H new ATOM 0 HE3 MET A 23 -4.436 -5.449 -12.521 1.00 33.21 H new ATOM 355 N SER A 24 -6.406 -7.932 -7.992 1.00 5.45 N ATOM 356 CA SER A 24 -6.861 -7.387 -6.722 1.00 10.31 C ATOM 357 C SER A 24 -6.892 -8.528 -5.694 1.00 23.14 C ATOM 358 O SER A 24 -7.775 -9.391 -5.751 1.00 61.10 O ATOM 359 CB SER A 24 -8.254 -6.750 -6.890 1.00 31.11 C ATOM 360 OG SER A 24 -8.679 -6.139 -5.691 1.00 64.31 O ATOM 0 H SER A 24 -7.156 -8.064 -8.670 1.00 5.45 H new ATOM 0 HA SER A 24 -6.183 -6.607 -6.375 1.00 10.31 H new ATOM 0 HB2 SER A 24 -8.225 -6.009 -7.689 1.00 31.11 H new ATOM 0 HB3 SER A 24 -8.973 -7.513 -7.188 1.00 31.11 H new ATOM 0 HG SER A 24 -7.930 -6.102 -5.060 1.00 64.31 H new ATOM 366 N VAL A 25 -5.903 -8.537 -4.788 1.00 74.02 N ATOM 367 CA VAL A 25 -5.686 -9.650 -3.845 1.00 71.44 C ATOM 368 C VAL A 25 -6.839 -9.768 -2.828 1.00 73.42 C ATOM 369 O VAL A 25 -7.246 -10.877 -2.505 1.00 74.12 O ATOM 370 CB VAL A 25 -4.301 -9.517 -3.114 1.00 65.04 C ATOM 371 CG1 VAL A 25 -4.058 -10.661 -2.091 1.00 34.14 C ATOM 372 CG2 VAL A 25 -3.147 -9.425 -4.147 1.00 1.32 C ATOM 0 H VAL A 25 -5.231 -7.776 -4.686 1.00 74.02 H new ATOM 0 HA VAL A 25 -5.670 -10.570 -4.430 1.00 71.44 H new ATOM 0 HB VAL A 25 -4.324 -8.591 -2.539 1.00 65.04 H new ATOM 0 HG11 VAL A 25 -3.088 -10.522 -1.614 1.00 34.14 H new ATOM 0 HG12 VAL A 25 -4.841 -10.644 -1.333 1.00 34.14 H new ATOM 0 HG13 VAL A 25 -4.074 -11.621 -2.608 1.00 34.14 H new ATOM 0 HG21 VAL A 25 -2.196 -9.333 -3.623 1.00 1.32 H new ATOM 0 HG22 VAL A 25 -3.137 -10.325 -4.762 1.00 1.32 H new ATOM 0 HG23 VAL A 25 -3.296 -8.552 -4.783 1.00 1.32 H new ATOM 382 N THR A 26 -7.377 -8.622 -2.362 1.00 1.23 N ATOM 383 CA THR A 26 -8.492 -8.608 -1.384 1.00 41.23 C ATOM 384 C THR A 26 -9.772 -9.231 -1.986 1.00 14.13 C ATOM 385 O THR A 26 -10.442 -10.024 -1.322 1.00 72.40 O ATOM 386 CB THR A 26 -8.789 -7.164 -0.863 1.00 45.13 C ATOM 387 OG1 THR A 26 -7.607 -6.635 -0.244 1.00 4.12 O ATOM 388 CG2 THR A 26 -9.952 -7.110 0.150 1.00 72.43 C ATOM 0 H THR A 26 -7.060 -7.695 -2.645 1.00 1.23 H new ATOM 0 HA THR A 26 -8.176 -9.214 -0.535 1.00 41.23 H new ATOM 0 HB THR A 26 -9.086 -6.569 -1.726 1.00 45.13 H new ATOM 0 HG1 THR A 26 -7.761 -5.701 0.011 1.00 4.12 H new ATOM 0 HG21 THR A 26 -10.106 -6.080 0.472 1.00 72.43 H new ATOM 0 HG22 THR A 26 -10.862 -7.483 -0.320 1.00 72.43 H new ATOM 0 HG23 THR A 26 -9.710 -7.728 1.015 1.00 72.43 H new ATOM 396 N ILE A 27 -10.070 -8.884 -3.254 1.00 61.15 N ATOM 397 CA ILE A 27 -11.253 -9.402 -3.978 1.00 73.30 C ATOM 398 C ILE A 27 -11.095 -10.910 -4.235 1.00 53.44 C ATOM 399 O ILE A 27 -12.032 -11.677 -3.999 1.00 15.10 O ATOM 400 CB ILE A 27 -11.483 -8.636 -5.332 1.00 35.20 C ATOM 401 CG1 ILE A 27 -11.749 -7.125 -5.047 1.00 13.30 C ATOM 402 CG2 ILE A 27 -12.639 -9.264 -6.171 1.00 43.50 C ATOM 403 CD1 ILE A 27 -11.860 -6.259 -6.285 1.00 1.14 C ATOM 0 H ILE A 27 -9.502 -8.240 -3.805 1.00 61.15 H new ATOM 0 HA ILE A 27 -12.130 -9.235 -3.352 1.00 73.30 H new ATOM 0 HB ILE A 27 -10.577 -8.729 -5.931 1.00 35.20 H new ATOM 0 HG12 ILE A 27 -12.671 -7.034 -4.472 1.00 13.30 H new ATOM 0 HG13 ILE A 27 -10.944 -6.740 -4.421 1.00 13.30 H new ATOM 0 HG21 ILE A 27 -12.763 -8.703 -7.097 1.00 43.50 H new ATOM 0 HG22 ILE A 27 -12.398 -10.301 -6.404 1.00 43.50 H new ATOM 0 HG23 ILE A 27 -13.566 -9.227 -5.598 1.00 43.50 H new ATOM 0 HD11 ILE A 27 -12.045 -5.226 -5.991 1.00 1.14 H new ATOM 0 HD12 ILE A 27 -10.931 -6.314 -6.852 1.00 1.14 H new ATOM 0 HD13 ILE A 27 -12.684 -6.613 -6.904 1.00 1.14 H new ATOM 415 N LYS A 28 -9.890 -11.310 -4.693 1.00 74.40 N ATOM 416 CA LYS A 28 -9.519 -12.725 -4.909 1.00 31.33 C ATOM 417 C LYS A 28 -9.706 -13.536 -3.608 1.00 20.34 C ATOM 418 O LYS A 28 -10.289 -14.625 -3.614 1.00 13.12 O ATOM 419 CB LYS A 28 -8.043 -12.819 -5.386 1.00 32.50 C ATOM 420 CG LYS A 28 -7.538 -14.260 -5.664 1.00 1.35 C ATOM 421 CD LYS A 28 -6.013 -14.323 -5.931 1.00 73.41 C ATOM 422 CE LYS A 28 -5.170 -13.832 -4.735 1.00 55.02 C ATOM 423 NZ LYS A 28 -5.427 -14.616 -3.496 1.00 20.55 N ATOM 0 H LYS A 28 -9.142 -10.656 -4.925 1.00 74.40 H new ATOM 0 HA LYS A 28 -10.170 -13.143 -5.677 1.00 31.33 H new ATOM 0 HB2 LYS A 28 -7.932 -12.229 -6.295 1.00 32.50 H new ATOM 0 HB3 LYS A 28 -7.402 -12.364 -4.630 1.00 32.50 H new ATOM 0 HG2 LYS A 28 -7.779 -14.895 -4.811 1.00 1.35 H new ATOM 0 HG3 LYS A 28 -8.070 -14.666 -6.524 1.00 1.35 H new ATOM 0 HD2 LYS A 28 -5.733 -15.349 -6.168 1.00 73.41 H new ATOM 0 HD3 LYS A 28 -5.778 -13.718 -6.807 1.00 73.41 H new ATOM 0 HE2 LYS A 28 -4.112 -13.897 -4.989 1.00 55.02 H new ATOM 0 HE3 LYS A 28 -5.389 -12.781 -4.548 1.00 55.02 H new ATOM 0 HZ1 LYS A 28 -5.965 -14.034 -2.823 1.00 20.55 H new ATOM 0 HZ2 LYS A 28 -5.974 -15.469 -3.732 1.00 20.55 H new ATOM 0 HZ3 LYS A 28 -4.521 -14.894 -3.067 1.00 20.55 H new ATOM 437 N ASN A 29 -9.240 -12.942 -2.491 1.00 5.24 N ATOM 438 CA ASN A 29 -9.327 -13.544 -1.146 1.00 52.33 C ATOM 439 C ASN A 29 -10.781 -13.621 -0.662 1.00 72.11 C ATOM 440 O ASN A 29 -11.118 -14.544 0.064 1.00 11.14 O ATOM 441 CB ASN A 29 -8.453 -12.753 -0.117 1.00 53.10 C ATOM 442 CG ASN A 29 -6.943 -13.010 -0.257 1.00 71.14 C ATOM 443 OD1 ASN A 29 -6.440 -13.307 -1.341 1.00 71.03 O ATOM 444 ND2 ASN A 29 -6.204 -12.889 0.836 1.00 15.14 N ATOM 0 H ASN A 29 -8.790 -12.026 -2.497 1.00 5.24 H new ATOM 0 HA ASN A 29 -8.938 -14.560 -1.219 1.00 52.33 H new ATOM 0 HB2 ASN A 29 -8.643 -11.686 -0.237 1.00 53.10 H new ATOM 0 HB3 ASN A 29 -8.765 -13.021 0.892 1.00 53.10 H new ATOM 0 HD21 ASN A 29 -5.197 -13.043 0.790 1.00 15.14 H new ATOM 0 HD22 ASN A 29 -6.642 -12.642 1.723 1.00 15.14 H new ATOM 451 N MET A 30 -11.620 -12.639 -1.070 1.00 13.13 N ATOM 452 CA MET A 30 -13.071 -12.620 -0.748 1.00 64.12 C ATOM 453 C MET A 30 -13.806 -13.750 -1.487 1.00 73.24 C ATOM 454 O MET A 30 -14.731 -14.353 -0.937 1.00 13.34 O ATOM 455 CB MET A 30 -13.725 -11.243 -1.092 1.00 13.02 C ATOM 456 CG MET A 30 -13.394 -10.108 -0.112 1.00 43.13 C ATOM 457 SD MET A 30 -14.190 -8.548 -0.569 1.00 64.25 S ATOM 458 CE MET A 30 -13.740 -7.491 0.810 1.00 60.31 C ATOM 0 H MET A 30 -11.315 -11.842 -1.628 1.00 13.13 H new ATOM 0 HA MET A 30 -13.164 -12.776 0.327 1.00 64.12 H new ATOM 0 HB2 MET A 30 -13.407 -10.945 -2.091 1.00 13.02 H new ATOM 0 HB3 MET A 30 -14.807 -11.370 -1.127 1.00 13.02 H new ATOM 0 HG2 MET A 30 -13.710 -10.394 0.891 1.00 43.13 H new ATOM 0 HG3 MET A 30 -12.314 -9.965 -0.077 1.00 43.13 H new ATOM 0 HE1 MET A 30 -13.825 -6.446 0.510 1.00 60.31 H new ATOM 0 HE2 MET A 30 -14.409 -7.683 1.649 1.00 60.31 H new ATOM 0 HE3 MET A 30 -12.713 -7.701 1.109 1.00 60.31 H new ATOM 468 N ILE A 31 -13.373 -14.020 -2.734 1.00 64.14 N ATOM 469 CA ILE A 31 -13.915 -15.115 -3.554 1.00 61.20 C ATOM 470 C ILE A 31 -13.595 -16.459 -2.878 1.00 25.41 C ATOM 471 O ILE A 31 -14.478 -17.286 -2.704 1.00 53.30 O ATOM 472 CB ILE A 31 -13.363 -15.071 -5.035 1.00 12.04 C ATOM 473 CG1 ILE A 31 -13.751 -13.716 -5.717 1.00 3.52 C ATOM 474 CG2 ILE A 31 -13.880 -16.274 -5.867 1.00 70.44 C ATOM 475 CD1 ILE A 31 -13.152 -13.487 -7.092 1.00 54.11 C ATOM 0 H ILE A 31 -12.639 -13.485 -3.198 1.00 64.14 H new ATOM 0 HA ILE A 31 -14.996 -14.996 -3.624 1.00 61.20 H new ATOM 0 HB ILE A 31 -12.276 -15.144 -4.994 1.00 12.04 H new ATOM 0 HG12 ILE A 31 -14.837 -13.667 -5.799 1.00 3.52 H new ATOM 0 HG13 ILE A 31 -13.444 -12.899 -5.064 1.00 3.52 H new ATOM 0 HG21 ILE A 31 -13.482 -16.214 -6.880 1.00 70.44 H new ATOM 0 HG22 ILE A 31 -13.553 -17.205 -5.403 1.00 70.44 H new ATOM 0 HG23 ILE A 31 -14.969 -16.250 -5.903 1.00 70.44 H new ATOM 0 HD11 ILE A 31 -13.482 -12.522 -7.476 1.00 54.11 H new ATOM 0 HD12 ILE A 31 -12.064 -13.497 -7.021 1.00 54.11 H new ATOM 0 HD13 ILE A 31 -13.479 -14.278 -7.768 1.00 54.11 H new ATOM 487 N GLU A 32 -12.335 -16.612 -2.438 1.00 25.11 N ATOM 488 CA GLU A 32 -11.845 -17.827 -1.737 1.00 64.20 C ATOM 489 C GLU A 32 -12.480 -17.968 -0.329 1.00 61.23 C ATOM 490 O GLU A 32 -12.719 -19.086 0.140 1.00 41.43 O ATOM 491 CB GLU A 32 -10.296 -17.781 -1.631 1.00 33.31 C ATOM 492 CG GLU A 32 -9.583 -17.670 -2.996 1.00 43.32 C ATOM 493 CD GLU A 32 -8.062 -17.511 -2.868 1.00 20.21 C ATOM 494 OE1 GLU A 32 -7.333 -18.533 -2.929 1.00 41.10 O ATOM 495 OE2 GLU A 32 -7.582 -16.368 -2.690 1.00 51.14 O ATOM 0 H GLU A 32 -11.618 -15.896 -2.556 1.00 25.11 H new ATOM 0 HA GLU A 32 -12.143 -18.699 -2.319 1.00 64.20 H new ATOM 0 HB2 GLU A 32 -10.008 -16.932 -1.011 1.00 33.31 H new ATOM 0 HB3 GLU A 32 -9.949 -18.680 -1.122 1.00 33.31 H new ATOM 0 HG2 GLU A 32 -9.801 -18.560 -3.587 1.00 43.32 H new ATOM 0 HG3 GLU A 32 -9.987 -16.818 -3.542 1.00 43.32 H new ATOM 502 N ASP A 33 -12.764 -16.813 0.306 1.00 33.11 N ATOM 503 CA ASP A 33 -13.347 -16.722 1.669 1.00 3.30 C ATOM 504 C ASP A 33 -14.796 -17.251 1.680 1.00 62.33 C ATOM 505 O ASP A 33 -15.204 -17.985 2.586 1.00 22.23 O ATOM 506 CB ASP A 33 -13.300 -15.239 2.146 1.00 24.42 C ATOM 507 CG ASP A 33 -13.884 -15.014 3.551 1.00 62.43 C ATOM 508 OD1 ASP A 33 -15.047 -14.556 3.667 1.00 11.22 O ATOM 509 OD2 ASP A 33 -13.188 -15.305 4.548 1.00 60.41 O ATOM 0 H ASP A 33 -12.594 -15.900 -0.117 1.00 33.11 H new ATOM 0 HA ASP A 33 -12.764 -17.340 2.352 1.00 3.30 H new ATOM 0 HB2 ASP A 33 -12.265 -14.897 2.135 1.00 24.42 H new ATOM 0 HB3 ASP A 33 -13.847 -14.622 1.433 1.00 24.42 H new ATOM 514 N ILE A 34 -15.557 -16.845 0.656 1.00 63.53 N ATOM 515 CA ILE A 34 -16.945 -17.294 0.418 1.00 42.31 C ATOM 516 C ILE A 34 -16.948 -18.690 -0.257 1.00 20.21 C ATOM 517 O ILE A 34 -17.934 -19.437 -0.188 1.00 74.23 O ATOM 518 CB ILE A 34 -17.704 -16.217 -0.470 1.00 40.31 C ATOM 519 CG1 ILE A 34 -17.739 -14.835 0.274 1.00 63.23 C ATOM 520 CG2 ILE A 34 -19.138 -16.666 -0.866 1.00 1.42 C ATOM 521 CD1 ILE A 34 -18.392 -13.698 -0.502 1.00 1.24 C ATOM 0 H ILE A 34 -15.225 -16.184 -0.046 1.00 63.53 H new ATOM 0 HA ILE A 34 -17.469 -17.387 1.369 1.00 42.31 H new ATOM 0 HB ILE A 34 -17.145 -16.114 -1.400 1.00 40.31 H new ATOM 0 HG12 ILE A 34 -18.270 -14.962 1.218 1.00 63.23 H new ATOM 0 HG13 ILE A 34 -16.717 -14.546 0.519 1.00 63.23 H new ATOM 0 HG21 ILE A 34 -19.608 -15.891 -1.472 1.00 1.42 H new ATOM 0 HG22 ILE A 34 -19.084 -17.592 -1.439 1.00 1.42 H new ATOM 0 HG23 ILE A 34 -19.729 -16.831 0.035 1.00 1.42 H new ATOM 0 HD11 ILE A 34 -18.366 -12.787 0.096 1.00 1.24 H new ATOM 0 HD12 ILE A 34 -17.850 -13.535 -1.434 1.00 1.24 H new ATOM 0 HD13 ILE A 34 -19.427 -13.957 -0.725 1.00 1.24 H new ATOM 533 N GLY A 35 -15.811 -19.038 -0.888 1.00 64.51 N ATOM 534 CA GLY A 35 -15.692 -20.245 -1.709 1.00 5.42 C ATOM 535 C GLY A 35 -15.821 -19.889 -3.180 1.00 11.03 C ATOM 536 O GLY A 35 -15.008 -20.297 -4.006 1.00 4.33 O ATOM 0 H GLY A 35 -14.954 -18.488 -0.840 1.00 64.51 H new ATOM 0 HA2 GLY A 35 -14.731 -20.726 -1.526 1.00 5.42 H new ATOM 0 HA3 GLY A 35 -16.465 -20.961 -1.431 1.00 5.42 H new ATOM 540 N GLU A 36 -16.847 -19.070 -3.472 1.00 74.05 N ATOM 541 CA GLU A 36 -17.129 -18.527 -4.793 1.00 23.14 C ATOM 542 C GLU A 36 -18.069 -17.326 -4.619 1.00 14.34 C ATOM 543 O GLU A 36 -19.237 -17.506 -4.229 1.00 60.33 O ATOM 544 CB GLU A 36 -17.772 -19.621 -5.691 1.00 62.43 C ATOM 545 CG GLU A 36 -18.224 -19.146 -7.085 1.00 23.33 C ATOM 546 CD GLU A 36 -18.861 -20.274 -7.913 1.00 33.32 C ATOM 547 OE1 GLU A 36 -20.105 -20.423 -7.879 1.00 43.41 O ATOM 548 OE2 GLU A 36 -18.121 -21.034 -8.579 1.00 61.10 O ATOM 0 H GLU A 36 -17.517 -18.764 -2.767 1.00 74.05 H new ATOM 0 HA GLU A 36 -16.211 -18.202 -5.282 1.00 23.14 H new ATOM 0 HB2 GLU A 36 -17.055 -20.432 -5.816 1.00 62.43 H new ATOM 0 HB3 GLU A 36 -18.634 -20.036 -5.169 1.00 62.43 H new ATOM 0 HG2 GLU A 36 -18.941 -18.332 -6.973 1.00 23.33 H new ATOM 0 HG3 GLU A 36 -17.366 -18.744 -7.624 1.00 23.33 H new ATOM 555 N SER A 37 -17.548 -16.103 -4.838 1.00 63.12 N ATOM 556 CA SER A 37 -18.356 -14.872 -4.812 1.00 54.30 C ATOM 557 C SER A 37 -19.192 -14.767 -6.106 1.00 23.43 C ATOM 558 O SER A 37 -18.799 -14.112 -7.083 1.00 1.02 O ATOM 559 CB SER A 37 -17.456 -13.631 -4.617 1.00 15.24 C ATOM 560 OG SER A 37 -16.738 -13.707 -3.400 1.00 43.42 O ATOM 0 H SER A 37 -16.560 -15.943 -5.037 1.00 63.12 H new ATOM 0 HA SER A 37 -19.041 -14.913 -3.965 1.00 54.30 H new ATOM 0 HB2 SER A 37 -16.758 -13.550 -5.450 1.00 15.24 H new ATOM 0 HB3 SER A 37 -18.068 -12.729 -4.626 1.00 15.24 H new ATOM 0 HG SER A 37 -16.175 -12.911 -3.302 1.00 43.42 H new ATOM 566 N ASP A 38 -20.313 -15.506 -6.114 1.00 52.12 N ATOM 567 CA ASP A 38 -21.300 -15.491 -7.207 1.00 11.22 C ATOM 568 C ASP A 38 -22.158 -14.219 -7.110 1.00 11.41 C ATOM 569 O ASP A 38 -22.520 -13.623 -8.125 1.00 11.44 O ATOM 570 CB ASP A 38 -22.188 -16.769 -7.147 1.00 60.15 C ATOM 571 CG ASP A 38 -23.299 -16.804 -8.221 1.00 42.43 C ATOM 572 OD1 ASP A 38 -22.978 -16.972 -9.418 1.00 22.41 O ATOM 573 OD2 ASP A 38 -24.495 -16.660 -7.875 1.00 30.33 O ATOM 0 H ASP A 38 -20.563 -16.138 -5.353 1.00 52.12 H new ATOM 0 HA ASP A 38 -20.780 -15.487 -8.165 1.00 11.22 H new ATOM 0 HB2 ASP A 38 -21.554 -17.647 -7.264 1.00 60.15 H new ATOM 0 HB3 ASP A 38 -22.646 -16.836 -6.160 1.00 60.15 H new ATOM 578 N SER A 39 -22.438 -13.814 -5.861 1.00 4.22 N ATOM 579 CA SER A 39 -23.257 -12.641 -5.545 1.00 10.20 C ATOM 580 C SER A 39 -22.439 -11.329 -5.711 1.00 55.30 C ATOM 581 O SER A 39 -21.208 -11.344 -5.538 1.00 55.52 O ATOM 582 CB SER A 39 -23.803 -12.789 -4.101 1.00 51.51 C ATOM 583 OG SER A 39 -22.755 -13.021 -3.168 1.00 24.40 O ATOM 0 H SER A 39 -22.095 -14.301 -5.033 1.00 4.22 H new ATOM 0 HA SER A 39 -24.094 -12.581 -6.240 1.00 10.20 H new ATOM 0 HB2 SER A 39 -24.346 -11.886 -3.822 1.00 51.51 H new ATOM 0 HB3 SER A 39 -24.515 -13.614 -4.063 1.00 51.51 H new ATOM 0 HG SER A 39 -23.132 -13.108 -2.268 1.00 24.40 H new ATOM 589 N PRO A 40 -23.111 -10.181 -6.086 1.00 63.51 N ATOM 590 CA PRO A 40 -22.458 -8.850 -6.176 1.00 42.53 C ATOM 591 C PRO A 40 -21.811 -8.425 -4.840 1.00 61.04 C ATOM 592 O PRO A 40 -22.453 -8.502 -3.788 1.00 43.10 O ATOM 593 CB PRO A 40 -23.622 -7.897 -6.564 1.00 25.15 C ATOM 594 CG PRO A 40 -24.638 -8.786 -7.214 1.00 13.11 C ATOM 595 CD PRO A 40 -24.548 -10.099 -6.480 1.00 74.35 C ATOM 0 HA PRO A 40 -21.639 -8.842 -6.895 1.00 42.53 H new ATOM 0 HB2 PRO A 40 -24.035 -7.398 -5.687 1.00 25.15 H new ATOM 0 HB3 PRO A 40 -23.285 -7.116 -7.246 1.00 25.15 H new ATOM 0 HG2 PRO A 40 -25.639 -8.361 -7.137 1.00 13.11 H new ATOM 0 HG3 PRO A 40 -24.426 -8.914 -8.276 1.00 13.11 H new ATOM 0 HD2 PRO A 40 -25.204 -10.118 -5.610 1.00 74.35 H new ATOM 0 HD3 PRO A 40 -24.838 -10.935 -7.116 1.00 74.35 H new ATOM 603 N ILE A 41 -20.540 -7.997 -4.900 1.00 21.54 N ATOM 604 CA ILE A 41 -19.774 -7.578 -3.720 1.00 24.43 C ATOM 605 C ILE A 41 -19.947 -6.055 -3.511 1.00 10.24 C ATOM 606 O ILE A 41 -19.448 -5.265 -4.326 1.00 71.01 O ATOM 607 CB ILE A 41 -18.244 -7.956 -3.867 1.00 42.42 C ATOM 608 CG1 ILE A 41 -18.073 -9.495 -4.112 1.00 1.22 C ATOM 609 CG2 ILE A 41 -17.423 -7.504 -2.630 1.00 2.15 C ATOM 610 CD1 ILE A 41 -18.609 -10.392 -2.992 1.00 63.31 C ATOM 0 H ILE A 41 -20.015 -7.932 -5.772 1.00 21.54 H new ATOM 0 HA ILE A 41 -20.156 -8.106 -2.846 1.00 24.43 H new ATOM 0 HB ILE A 41 -17.856 -7.422 -4.734 1.00 42.42 H new ATOM 0 HG12 ILE A 41 -18.579 -9.758 -5.041 1.00 1.22 H new ATOM 0 HG13 ILE A 41 -17.014 -9.710 -4.254 1.00 1.22 H new ATOM 0 HG21 ILE A 41 -16.377 -7.780 -2.766 1.00 2.15 H new ATOM 0 HG22 ILE A 41 -17.501 -6.423 -2.517 1.00 2.15 H new ATOM 0 HG23 ILE A 41 -17.813 -7.991 -1.736 1.00 2.15 H new ATOM 0 HD11 ILE A 41 -18.445 -11.437 -3.253 1.00 63.31 H new ATOM 0 HD12 ILE A 41 -18.087 -10.164 -2.062 1.00 63.31 H new ATOM 0 HD13 ILE A 41 -19.676 -10.213 -2.862 1.00 63.31 H new ATOM 622 N PRO A 42 -20.698 -5.613 -2.445 1.00 15.25 N ATOM 623 CA PRO A 42 -20.835 -4.186 -2.106 1.00 11.51 C ATOM 624 C PRO A 42 -19.564 -3.673 -1.400 1.00 52.22 C ATOM 625 O PRO A 42 -19.080 -4.292 -0.439 1.00 45.04 O ATOM 626 CB PRO A 42 -22.085 -4.136 -1.168 1.00 41.52 C ATOM 627 CG PRO A 42 -22.634 -5.540 -1.146 1.00 30.13 C ATOM 628 CD PRO A 42 -21.472 -6.444 -1.487 1.00 34.32 C ATOM 0 HA PRO A 42 -20.960 -3.548 -2.981 1.00 11.51 H new ATOM 0 HB2 PRO A 42 -21.810 -3.807 -0.166 1.00 41.52 H new ATOM 0 HB3 PRO A 42 -22.827 -3.431 -1.542 1.00 41.52 H new ATOM 0 HG2 PRO A 42 -23.044 -5.784 -0.166 1.00 30.13 H new ATOM 0 HG3 PRO A 42 -23.443 -5.655 -1.868 1.00 30.13 H new ATOM 0 HD2 PRO A 42 -20.885 -6.702 -0.606 1.00 34.32 H new ATOM 0 HD3 PRO A 42 -21.803 -7.381 -1.936 1.00 34.32 H new ATOM 636 N LEU A 43 -19.035 -2.553 -1.890 1.00 62.13 N ATOM 637 CA LEU A 43 -17.814 -1.926 -1.366 1.00 61.24 C ATOM 638 C LEU A 43 -18.200 -0.556 -0.761 1.00 42.13 C ATOM 639 O LEU A 43 -18.267 0.442 -1.487 1.00 4.10 O ATOM 640 CB LEU A 43 -16.749 -1.784 -2.501 1.00 25.33 C ATOM 641 CG LEU A 43 -16.349 -3.110 -3.241 1.00 33.14 C ATOM 642 CD1 LEU A 43 -15.404 -2.834 -4.433 1.00 52.10 C ATOM 643 CD2 LEU A 43 -15.738 -4.145 -2.266 1.00 61.12 C ATOM 0 H LEU A 43 -19.446 -2.045 -2.674 1.00 62.13 H new ATOM 0 HA LEU A 43 -17.365 -2.544 -0.588 1.00 61.24 H new ATOM 0 HB2 LEU A 43 -17.128 -1.079 -3.241 1.00 25.33 H new ATOM 0 HB3 LEU A 43 -15.848 -1.344 -2.073 1.00 25.33 H new ATOM 0 HG LEU A 43 -17.265 -3.542 -3.644 1.00 33.14 H new ATOM 0 HD11 LEU A 43 -15.149 -3.775 -4.920 1.00 52.10 H new ATOM 0 HD12 LEU A 43 -15.902 -2.178 -5.148 1.00 52.10 H new ATOM 0 HD13 LEU A 43 -14.494 -2.354 -4.073 1.00 52.10 H new ATOM 0 HD21 LEU A 43 -15.474 -5.049 -2.814 1.00 61.12 H new ATOM 0 HD22 LEU A 43 -14.844 -3.726 -1.804 1.00 61.12 H new ATOM 0 HD23 LEU A 43 -16.466 -4.390 -1.492 1.00 61.12 H new ATOM 655 N PRO A 44 -18.488 -0.480 0.587 1.00 63.51 N ATOM 656 CA PRO A 44 -18.982 0.758 1.254 1.00 31.43 C ATOM 657 C PRO A 44 -17.838 1.740 1.619 1.00 25.33 C ATOM 658 O PRO A 44 -17.912 2.463 2.620 1.00 53.33 O ATOM 659 CB PRO A 44 -19.683 0.177 2.508 1.00 54.15 C ATOM 660 CG PRO A 44 -18.846 -1.008 2.885 1.00 73.15 C ATOM 661 CD PRO A 44 -18.351 -1.599 1.573 1.00 11.31 C ATOM 0 HA PRO A 44 -19.633 1.363 0.623 1.00 31.43 H new ATOM 0 HB2 PRO A 44 -19.724 0.908 3.315 1.00 54.15 H new ATOM 0 HB3 PRO A 44 -20.710 -0.115 2.290 1.00 54.15 H new ATOM 0 HG2 PRO A 44 -18.011 -0.711 3.520 1.00 73.15 H new ATOM 0 HG3 PRO A 44 -19.430 -1.737 3.447 1.00 73.15 H new ATOM 0 HD2 PRO A 44 -17.317 -1.934 1.653 1.00 11.31 H new ATOM 0 HD3 PRO A 44 -18.945 -2.464 1.278 1.00 11.31 H new ATOM 669 N ASN A 45 -16.816 1.800 0.754 1.00 74.42 N ATOM 670 CA ASN A 45 -15.588 2.583 0.973 1.00 31.33 C ATOM 671 C ASN A 45 -15.268 3.371 -0.303 1.00 41.40 C ATOM 672 O ASN A 45 -15.368 4.602 -0.334 1.00 20.41 O ATOM 673 CB ASN A 45 -14.417 1.621 1.347 1.00 60.11 C ATOM 674 CG ASN A 45 -13.069 2.330 1.553 1.00 33.53 C ATOM 675 OD1 ASN A 45 -12.273 2.465 0.621 1.00 41.33 O ATOM 676 ND2 ASN A 45 -12.804 2.782 2.769 1.00 53.52 N ATOM 0 H ASN A 45 -16.818 1.298 -0.134 1.00 74.42 H new ATOM 0 HA ASN A 45 -15.727 3.286 1.795 1.00 31.33 H new ATOM 0 HB2 ASN A 45 -14.678 1.085 2.260 1.00 60.11 H new ATOM 0 HB3 ASN A 45 -14.307 0.875 0.560 1.00 60.11 H new ATOM 0 HD21 ASN A 45 -11.921 3.257 2.955 1.00 53.52 H new ATOM 0 HD22 ASN A 45 -13.483 2.655 3.519 1.00 53.52 H new ATOM 683 N VAL A 46 -14.931 2.634 -1.370 1.00 63.21 N ATOM 684 CA VAL A 46 -14.491 3.217 -2.645 1.00 4.05 C ATOM 685 C VAL A 46 -15.713 3.701 -3.464 1.00 24.33 C ATOM 686 O VAL A 46 -16.666 2.948 -3.676 1.00 43.35 O ATOM 687 CB VAL A 46 -13.606 2.185 -3.456 1.00 44.40 C ATOM 688 CG1 VAL A 46 -14.355 0.863 -3.752 1.00 74.31 C ATOM 689 CG2 VAL A 46 -13.040 2.820 -4.744 1.00 42.53 C ATOM 0 H VAL A 46 -14.956 1.614 -1.373 1.00 63.21 H new ATOM 0 HA VAL A 46 -13.866 4.086 -2.440 1.00 4.05 H new ATOM 0 HB VAL A 46 -12.763 1.924 -2.816 1.00 44.40 H new ATOM 0 HG11 VAL A 46 -13.702 0.192 -4.310 1.00 74.31 H new ATOM 0 HG12 VAL A 46 -14.644 0.391 -2.813 1.00 74.31 H new ATOM 0 HG13 VAL A 46 -15.247 1.074 -4.342 1.00 74.31 H new ATOM 0 HG21 VAL A 46 -12.437 2.085 -5.277 1.00 42.53 H new ATOM 0 HG22 VAL A 46 -13.862 3.146 -5.381 1.00 42.53 H new ATOM 0 HG23 VAL A 46 -12.420 3.678 -4.485 1.00 42.53 H new ATOM 699 N THR A 47 -15.684 4.983 -3.884 1.00 25.30 N ATOM 700 CA THR A 47 -16.760 5.604 -4.689 1.00 72.11 C ATOM 701 C THR A 47 -16.730 5.093 -6.137 1.00 13.01 C ATOM 702 O THR A 47 -15.771 4.435 -6.545 1.00 50.05 O ATOM 703 CB THR A 47 -16.627 7.163 -4.677 1.00 44.21 C ATOM 704 OG1 THR A 47 -15.283 7.527 -5.041 1.00 4.32 O ATOM 705 CG2 THR A 47 -16.972 7.756 -3.298 1.00 12.21 C ATOM 0 H THR A 47 -14.914 5.618 -3.675 1.00 25.30 H new ATOM 0 HA THR A 47 -17.713 5.324 -4.240 1.00 72.11 H new ATOM 0 HB THR A 47 -17.336 7.570 -5.398 1.00 44.21 H new ATOM 0 HG1 THR A 47 -15.292 7.986 -5.907 1.00 4.32 H new ATOM 0 HG21 THR A 47 -16.867 8.840 -3.332 1.00 12.21 H new ATOM 0 HG22 THR A 47 -17.999 7.498 -3.038 1.00 12.21 H new ATOM 0 HG23 THR A 47 -16.294 7.349 -2.547 1.00 12.21 H new ATOM 713 N SER A 48 -17.790 5.418 -6.902 1.00 52.33 N ATOM 714 CA SER A 48 -17.949 4.982 -8.301 1.00 41.43 C ATOM 715 C SER A 48 -16.834 5.524 -9.191 1.00 65.23 C ATOM 716 O SER A 48 -16.278 4.793 -10.002 1.00 71.21 O ATOM 717 CB SER A 48 -19.305 5.454 -8.841 1.00 54.43 C ATOM 718 OG SER A 48 -19.441 6.866 -8.718 1.00 33.41 O ATOM 0 H SER A 48 -18.562 5.993 -6.565 1.00 52.33 H new ATOM 0 HA SER A 48 -17.897 3.893 -8.317 1.00 41.43 H new ATOM 0 HB2 SER A 48 -19.404 5.166 -9.887 1.00 54.43 H new ATOM 0 HB3 SER A 48 -20.109 4.959 -8.297 1.00 54.43 H new ATOM 0 HG SER A 48 -20.385 7.093 -8.585 1.00 33.41 H new ATOM 724 N THR A 49 -16.541 6.818 -9.014 1.00 73.03 N ATOM 725 CA THR A 49 -15.518 7.543 -9.772 1.00 4.43 C ATOM 726 C THR A 49 -14.138 6.868 -9.635 1.00 14.44 C ATOM 727 O THR A 49 -13.492 6.547 -10.636 1.00 53.31 O ATOM 728 CB THR A 49 -15.449 9.021 -9.274 1.00 44.14 C ATOM 729 OG1 THR A 49 -15.286 9.024 -7.843 1.00 3.55 O ATOM 730 CG2 THR A 49 -16.717 9.819 -9.650 1.00 72.44 C ATOM 0 H THR A 49 -17.019 7.400 -8.326 1.00 73.03 H new ATOM 0 HA THR A 49 -15.792 7.527 -10.827 1.00 4.43 H new ATOM 0 HB THR A 49 -14.601 9.504 -9.760 1.00 44.14 H new ATOM 0 HG1 THR A 49 -15.240 9.948 -7.521 1.00 3.55 H new ATOM 0 HG21 THR A 49 -16.625 10.842 -9.284 1.00 72.44 H new ATOM 0 HG22 THR A 49 -16.831 9.831 -10.734 1.00 72.44 H new ATOM 0 HG23 THR A 49 -17.590 9.349 -9.198 1.00 72.44 H new ATOM 738 N ILE A 50 -13.731 6.609 -8.381 1.00 72.55 N ATOM 739 CA ILE A 50 -12.405 6.054 -8.068 1.00 20.13 C ATOM 740 C ILE A 50 -12.332 4.569 -8.455 1.00 41.53 C ATOM 741 O ILE A 50 -11.343 4.139 -9.052 1.00 14.11 O ATOM 742 CB ILE A 50 -12.055 6.260 -6.549 1.00 40.30 C ATOM 743 CG1 ILE A 50 -12.100 7.780 -6.192 1.00 41.34 C ATOM 744 CG2 ILE A 50 -10.685 5.645 -6.175 1.00 62.55 C ATOM 745 CD1 ILE A 50 -11.163 8.672 -7.011 1.00 44.44 C ATOM 0 H ILE A 50 -14.310 6.778 -7.559 1.00 72.55 H new ATOM 0 HA ILE A 50 -11.663 6.593 -8.657 1.00 20.13 H new ATOM 0 HB ILE A 50 -12.806 5.733 -5.961 1.00 40.30 H new ATOM 0 HG12 ILE A 50 -13.121 8.137 -6.323 1.00 41.34 H new ATOM 0 HG13 ILE A 50 -11.855 7.896 -5.136 1.00 41.34 H new ATOM 0 HG21 ILE A 50 -10.488 5.813 -5.116 1.00 62.55 H new ATOM 0 HG22 ILE A 50 -10.700 4.574 -6.376 1.00 62.55 H new ATOM 0 HG23 ILE A 50 -9.901 6.115 -6.769 1.00 62.55 H new ATOM 0 HD11 ILE A 50 -11.270 9.707 -6.686 1.00 44.44 H new ATOM 0 HD12 ILE A 50 -10.132 8.350 -6.863 1.00 44.44 H new ATOM 0 HD13 ILE A 50 -11.419 8.595 -8.068 1.00 44.44 H new ATOM 757 N LEU A 51 -13.407 3.807 -8.147 1.00 10.03 N ATOM 758 CA LEU A 51 -13.497 2.367 -8.471 1.00 64.13 C ATOM 759 C LEU A 51 -13.453 2.152 -9.994 1.00 3.41 C ATOM 760 O LEU A 51 -12.852 1.192 -10.468 1.00 73.21 O ATOM 761 CB LEU A 51 -14.785 1.727 -7.864 1.00 24.32 C ATOM 762 CG LEU A 51 -14.903 0.166 -7.981 1.00 75.45 C ATOM 763 CD1 LEU A 51 -13.686 -0.550 -7.346 1.00 34.51 C ATOM 764 CD2 LEU A 51 -16.225 -0.347 -7.367 1.00 20.03 C ATOM 0 H LEU A 51 -14.231 4.172 -7.670 1.00 10.03 H new ATOM 0 HA LEU A 51 -12.636 1.870 -8.024 1.00 64.13 H new ATOM 0 HB2 LEU A 51 -14.837 1.997 -6.809 1.00 24.32 H new ATOM 0 HB3 LEU A 51 -15.652 2.174 -8.351 1.00 24.32 H new ATOM 0 HG LEU A 51 -14.910 -0.075 -9.044 1.00 75.45 H new ATOM 0 HD11 LEU A 51 -13.805 -1.629 -7.447 1.00 34.51 H new ATOM 0 HD12 LEU A 51 -12.774 -0.236 -7.854 1.00 34.51 H new ATOM 0 HD13 LEU A 51 -13.621 -0.290 -6.290 1.00 34.51 H new ATOM 0 HD21 LEU A 51 -16.275 -1.431 -7.465 1.00 20.03 H new ATOM 0 HD22 LEU A 51 -16.266 -0.075 -6.312 1.00 20.03 H new ATOM 0 HD23 LEU A 51 -17.068 0.104 -7.890 1.00 20.03 H new ATOM 776 N GLU A 52 -14.061 3.096 -10.745 1.00 12.14 N ATOM 777 CA GLU A 52 -14.049 3.091 -12.220 1.00 54.20 C ATOM 778 C GLU A 52 -12.611 3.200 -12.735 1.00 12.41 C ATOM 779 O GLU A 52 -12.200 2.429 -13.594 1.00 32.10 O ATOM 780 CB GLU A 52 -14.897 4.268 -12.779 1.00 4.15 C ATOM 781 CG GLU A 52 -14.980 4.318 -14.319 1.00 40.00 C ATOM 782 CD GLU A 52 -15.881 5.447 -14.836 1.00 62.21 C ATOM 783 OE1 GLU A 52 -15.357 6.510 -15.225 1.00 24.45 O ATOM 784 OE2 GLU A 52 -17.118 5.276 -14.844 1.00 41.35 O ATOM 0 H GLU A 52 -14.573 3.882 -10.344 1.00 12.14 H new ATOM 0 HA GLU A 52 -14.484 2.152 -12.563 1.00 54.20 H new ATOM 0 HB2 GLU A 52 -15.907 4.196 -12.375 1.00 4.15 H new ATOM 0 HB3 GLU A 52 -14.475 5.207 -12.419 1.00 4.15 H new ATOM 0 HG2 GLU A 52 -13.977 4.445 -14.727 1.00 40.00 H new ATOM 0 HG3 GLU A 52 -15.355 3.364 -14.688 1.00 40.00 H new ATOM 791 N LYS A 53 -11.861 4.155 -12.152 1.00 41.24 N ATOM 792 CA LYS A 53 -10.466 4.439 -12.529 1.00 30.42 C ATOM 793 C LYS A 53 -9.543 3.251 -12.221 1.00 21.12 C ATOM 794 O LYS A 53 -8.709 2.872 -13.045 1.00 62.41 O ATOM 795 CB LYS A 53 -9.944 5.693 -11.784 1.00 54.53 C ATOM 796 CG LYS A 53 -10.686 7.001 -12.112 1.00 2.22 C ATOM 797 CD LYS A 53 -10.017 8.233 -11.461 1.00 33.21 C ATOM 798 CE LYS A 53 -8.582 8.456 -11.966 1.00 41.11 C ATOM 799 NZ LYS A 53 -8.528 8.600 -13.446 1.00 20.12 N ATOM 0 H LYS A 53 -12.209 4.753 -11.403 1.00 41.24 H new ATOM 0 HA LYS A 53 -10.455 4.619 -13.604 1.00 30.42 H new ATOM 0 HB2 LYS A 53 -10.012 5.514 -10.711 1.00 54.53 H new ATOM 0 HB3 LYS A 53 -8.888 5.823 -12.019 1.00 54.53 H new ATOM 0 HG2 LYS A 53 -10.718 7.137 -13.193 1.00 2.22 H new ATOM 0 HG3 LYS A 53 -11.718 6.927 -11.769 1.00 2.22 H new ATOM 0 HD2 LYS A 53 -10.615 9.120 -11.670 1.00 33.21 H new ATOM 0 HD3 LYS A 53 -10.003 8.106 -10.379 1.00 33.21 H new ATOM 0 HE2 LYS A 53 -8.168 9.350 -11.499 1.00 41.11 H new ATOM 0 HE3 LYS A 53 -7.956 7.618 -11.660 1.00 41.11 H new ATOM 0 HZ1 LYS A 53 -7.578 8.915 -13.730 1.00 20.12 H new ATOM 0 HZ2 LYS A 53 -8.736 7.684 -13.892 1.00 20.12 H new ATOM 0 HZ3 LYS A 53 -9.232 9.302 -13.752 1.00 20.12 H new ATOM 813 N VAL A 54 -9.712 2.690 -11.012 1.00 62.44 N ATOM 814 CA VAL A 54 -8.894 1.582 -10.507 1.00 45.13 C ATOM 815 C VAL A 54 -9.094 0.327 -11.382 1.00 51.14 C ATOM 816 O VAL A 54 -8.116 -0.299 -11.817 1.00 71.31 O ATOM 817 CB VAL A 54 -9.232 1.290 -8.988 1.00 44.42 C ATOM 818 CG1 VAL A 54 -8.550 0.004 -8.474 1.00 44.30 C ATOM 819 CG2 VAL A 54 -8.841 2.498 -8.095 1.00 43.15 C ATOM 0 H VAL A 54 -10.428 2.998 -10.354 1.00 62.44 H new ATOM 0 HA VAL A 54 -7.843 1.865 -10.563 1.00 45.13 H new ATOM 0 HB VAL A 54 -10.309 1.136 -8.927 1.00 44.42 H new ATOM 0 HG11 VAL A 54 -8.812 -0.154 -7.428 1.00 44.30 H new ATOM 0 HG12 VAL A 54 -8.887 -0.848 -9.065 1.00 44.30 H new ATOM 0 HG13 VAL A 54 -7.469 0.104 -8.566 1.00 44.30 H new ATOM 0 HG21 VAL A 54 -9.082 2.275 -7.056 1.00 43.15 H new ATOM 0 HG22 VAL A 54 -7.771 2.687 -8.187 1.00 43.15 H new ATOM 0 HG23 VAL A 54 -9.394 3.381 -8.415 1.00 43.15 H new ATOM 829 N LEU A 55 -10.371 0.020 -11.689 1.00 32.30 N ATOM 830 CA LEU A 55 -10.743 -1.151 -12.502 1.00 5.31 C ATOM 831 C LEU A 55 -10.389 -0.943 -13.990 1.00 2.14 C ATOM 832 O LEU A 55 -10.077 -1.909 -14.680 1.00 44.44 O ATOM 833 CB LEU A 55 -12.252 -1.488 -12.337 1.00 55.12 C ATOM 834 CG LEU A 55 -12.717 -1.894 -10.896 1.00 32.10 C ATOM 835 CD1 LEU A 55 -14.208 -2.299 -10.886 1.00 12.31 C ATOM 836 CD2 LEU A 55 -11.823 -3.001 -10.284 1.00 71.31 C ATOM 0 H LEU A 55 -11.169 0.576 -11.381 1.00 32.30 H new ATOM 0 HA LEU A 55 -10.162 -1.998 -12.138 1.00 5.31 H new ATOM 0 HB2 LEU A 55 -12.833 -0.622 -12.653 1.00 55.12 H new ATOM 0 HB3 LEU A 55 -12.498 -2.302 -13.018 1.00 55.12 H new ATOM 0 HG LEU A 55 -12.605 -1.015 -10.262 1.00 32.10 H new ATOM 0 HD11 LEU A 55 -14.503 -2.576 -9.874 1.00 12.31 H new ATOM 0 HD12 LEU A 55 -14.815 -1.460 -11.224 1.00 12.31 H new ATOM 0 HD13 LEU A 55 -14.359 -3.148 -11.553 1.00 12.31 H new ATOM 0 HD21 LEU A 55 -12.183 -3.249 -9.286 1.00 71.31 H new ATOM 0 HD22 LEU A 55 -11.861 -3.889 -10.915 1.00 71.31 H new ATOM 0 HD23 LEU A 55 -10.795 -2.645 -10.220 1.00 71.31 H new ATOM 848 N ASP A 56 -10.430 0.323 -14.463 1.00 73.15 N ATOM 849 CA ASP A 56 -10.077 0.683 -15.861 1.00 42.01 C ATOM 850 C ASP A 56 -8.557 0.571 -16.073 1.00 64.42 C ATOM 851 O ASP A 56 -8.096 0.150 -17.139 1.00 73.01 O ATOM 852 CB ASP A 56 -10.576 2.118 -16.213 1.00 44.41 C ATOM 853 CG ASP A 56 -10.268 2.583 -17.656 1.00 35.30 C ATOM 854 OD1 ASP A 56 -10.113 3.806 -17.874 1.00 63.41 O ATOM 855 OD2 ASP A 56 -10.190 1.740 -18.577 1.00 41.15 O ATOM 0 H ASP A 56 -10.707 1.122 -13.893 1.00 73.15 H new ATOM 0 HA ASP A 56 -10.576 -0.018 -16.530 1.00 42.01 H new ATOM 0 HB2 ASP A 56 -11.654 2.160 -16.056 1.00 44.41 H new ATOM 0 HB3 ASP A 56 -10.125 2.824 -15.516 1.00 44.41 H new ATOM 860 N TYR A 57 -7.788 0.944 -15.037 1.00 60.31 N ATOM 861 CA TYR A 57 -6.325 0.780 -15.030 1.00 33.22 C ATOM 862 C TYR A 57 -5.965 -0.714 -14.937 1.00 10.44 C ATOM 863 O TYR A 57 -4.933 -1.158 -15.461 1.00 51.21 O ATOM 864 CB TYR A 57 -5.674 1.574 -13.870 1.00 14.53 C ATOM 865 CG TYR A 57 -4.137 1.552 -13.912 1.00 42.33 C ATOM 866 CD1 TYR A 57 -3.397 0.637 -13.152 1.00 54.11 C ATOM 867 CD2 TYR A 57 -3.429 2.416 -14.753 1.00 20.24 C ATOM 868 CE1 TYR A 57 -2.024 0.583 -13.228 1.00 12.25 C ATOM 869 CE2 TYR A 57 -2.050 2.372 -14.828 1.00 1.14 C ATOM 870 CZ TYR A 57 -1.351 1.453 -14.066 1.00 30.41 C ATOM 871 OH TYR A 57 0.025 1.396 -14.151 1.00 62.52 O ATOM 0 H TYR A 57 -8.160 1.365 -14.186 1.00 60.31 H new ATOM 0 HA TYR A 57 -5.931 1.182 -15.963 1.00 33.22 H new ATOM 0 HB2 TYR A 57 -6.018 2.608 -13.907 1.00 14.53 H new ATOM 0 HB3 TYR A 57 -6.012 1.160 -12.920 1.00 14.53 H new ATOM 0 HD1 TYR A 57 -3.916 -0.042 -12.491 1.00 54.11 H new ATOM 0 HD2 TYR A 57 -3.970 3.131 -15.355 1.00 20.24 H new ATOM 0 HE1 TYR A 57 -1.475 -0.135 -12.636 1.00 12.25 H new ATOM 0 HE2 TYR A 57 -1.520 3.052 -15.479 1.00 1.14 H new ATOM 0 HH TYR A 57 0.342 2.073 -14.784 1.00 62.52 H new ATOM 881 N CYS A 58 -6.814 -1.479 -14.239 1.00 32.53 N ATOM 882 CA CYS A 58 -6.690 -2.936 -14.177 1.00 32.22 C ATOM 883 C CYS A 58 -7.008 -3.571 -15.558 1.00 4.51 C ATOM 884 O CYS A 58 -6.373 -4.560 -15.935 1.00 40.21 O ATOM 885 CB CYS A 58 -7.591 -3.499 -13.056 1.00 12.04 C ATOM 886 SG CYS A 58 -7.070 -3.017 -11.393 1.00 31.23 S ATOM 0 H CYS A 58 -7.600 -1.106 -13.706 1.00 32.53 H new ATOM 0 HA CYS A 58 -5.660 -3.198 -13.934 1.00 32.22 H new ATOM 0 HB2 CYS A 58 -8.614 -3.160 -13.219 1.00 12.04 H new ATOM 0 HB3 CYS A 58 -7.602 -4.587 -13.123 1.00 12.04 H new ATOM 0 HG CYS A 58 -7.439 -1.792 -11.161 1.00 31.23 H new ATOM 892 N ARG A 59 -7.972 -2.980 -16.317 1.00 32.01 N ATOM 893 CA ARG A 59 -8.280 -3.406 -17.713 1.00 42.51 C ATOM 894 C ARG A 59 -7.111 -3.053 -18.646 1.00 64.24 C ATOM 895 O ARG A 59 -6.830 -3.784 -19.601 1.00 44.23 O ATOM 896 CB ARG A 59 -9.578 -2.748 -18.269 1.00 53.24 C ATOM 897 CG ARG A 59 -10.873 -3.068 -17.494 1.00 73.34 C ATOM 898 CD ARG A 59 -12.134 -2.523 -18.204 1.00 43.52 C ATOM 899 NE ARG A 59 -12.014 -1.094 -18.593 1.00 23.30 N ATOM 900 CZ ARG A 59 -12.872 -0.448 -19.406 1.00 34.22 C ATOM 901 NH1 ARG A 59 -13.933 -1.060 -19.926 1.00 54.52 N ATOM 902 NH2 ARG A 59 -12.648 0.820 -19.721 1.00 31.22 N ATOM 0 H ARG A 59 -8.549 -2.207 -15.986 1.00 32.01 H new ATOM 0 HA ARG A 59 -8.434 -4.485 -17.681 1.00 42.51 H new ATOM 0 HB2 ARG A 59 -9.440 -1.667 -18.279 1.00 53.24 H new ATOM 0 HB3 ARG A 59 -9.708 -3.063 -19.304 1.00 53.24 H new ATOM 0 HG2 ARG A 59 -10.964 -4.148 -17.375 1.00 73.34 H new ATOM 0 HG3 ARG A 59 -10.809 -2.641 -16.493 1.00 73.34 H new ATOM 0 HD2 ARG A 59 -12.329 -3.120 -19.095 1.00 43.52 H new ATOM 0 HD3 ARG A 59 -12.994 -2.643 -17.546 1.00 43.52 H new ATOM 0 HE ARG A 59 -11.227 -0.565 -18.218 1.00 23.30 H new ATOM 0 HH11 ARG A 59 -14.112 -2.041 -19.712 1.00 54.52 H new ATOM 0 HH12 ARG A 59 -14.567 -0.548 -20.539 1.00 54.52 H new ATOM 0 HH21 ARG A 59 -11.830 1.301 -19.348 1.00 31.22 H new ATOM 0 HH22 ARG A 59 -13.294 1.314 -20.336 1.00 31.22 H new ATOM 916 N HIS A 60 -6.456 -1.910 -18.349 1.00 62.01 N ATOM 917 CA HIS A 60 -5.236 -1.465 -19.039 1.00 22.31 C ATOM 918 C HIS A 60 -4.148 -2.529 -18.894 1.00 21.42 C ATOM 919 O HIS A 60 -3.557 -2.944 -19.877 1.00 21.53 O ATOM 920 CB HIS A 60 -4.736 -0.102 -18.464 1.00 12.52 C ATOM 921 CG HIS A 60 -3.411 0.357 -19.021 1.00 22.32 C ATOM 922 ND1 HIS A 60 -2.201 -0.146 -18.600 1.00 20.12 N ATOM 923 CD2 HIS A 60 -3.115 1.244 -19.993 1.00 55.21 C ATOM 924 CE1 HIS A 60 -1.230 0.410 -19.285 1.00 2.41 C ATOM 925 NE2 HIS A 60 -1.752 1.256 -20.140 1.00 23.11 N ATOM 0 H HIS A 60 -6.765 -1.269 -17.618 1.00 62.01 H new ATOM 0 HA HIS A 60 -5.465 -1.323 -20.095 1.00 22.31 H new ATOM 0 HB2 HIS A 60 -5.487 0.662 -18.667 1.00 12.52 H new ATOM 0 HB3 HIS A 60 -4.652 -0.187 -17.381 1.00 12.52 H new ATOM 0 HD2 HIS A 60 -3.823 1.837 -20.553 1.00 55.21 H new ATOM 0 HE1 HIS A 60 -0.176 0.205 -19.165 1.00 2.41 H new ATOM 0 HE2 HIS A 60 -1.231 1.828 -20.804 1.00 23.11 H new ATOM 934 N HIS A 61 -3.917 -2.969 -17.647 1.00 11.20 N ATOM 935 CA HIS A 61 -2.876 -3.955 -17.322 1.00 74.20 C ATOM 936 C HIS A 61 -3.266 -5.370 -17.804 1.00 50.11 C ATOM 937 O HIS A 61 -2.403 -6.221 -18.010 1.00 14.41 O ATOM 938 CB HIS A 61 -2.611 -3.959 -15.794 1.00 4.33 C ATOM 939 CG HIS A 61 -1.440 -4.820 -15.398 1.00 33.41 C ATOM 940 ND1 HIS A 61 -1.566 -6.119 -14.942 1.00 20.32 N ATOM 941 CD2 HIS A 61 -0.110 -4.571 -15.427 1.00 71.10 C ATOM 942 CE1 HIS A 61 -0.370 -6.625 -14.724 1.00 74.34 C ATOM 943 NE2 HIS A 61 0.525 -5.707 -15.007 1.00 35.20 N ATOM 0 H HIS A 61 -4.447 -2.651 -16.836 1.00 11.20 H new ATOM 0 HA HIS A 61 -1.963 -3.669 -17.845 1.00 74.20 H new ATOM 0 HB2 HIS A 61 -2.432 -2.937 -15.460 1.00 4.33 H new ATOM 0 HB3 HIS A 61 -3.504 -4.311 -15.278 1.00 4.33 H new ATOM 0 HD1 HIS A 61 -2.449 -6.609 -14.797 1.00 20.32 H new ATOM 0 HD2 HIS A 61 0.362 -3.647 -15.726 1.00 71.10 H new ATOM 0 HE1 HIS A 61 -0.161 -7.625 -14.372 1.00 74.34 H new ATOM 952 N HIS A 62 -4.576 -5.608 -17.948 1.00 74.34 N ATOM 953 CA HIS A 62 -5.111 -6.908 -18.394 1.00 5.45 C ATOM 954 C HIS A 62 -4.860 -7.123 -19.898 1.00 51.04 C ATOM 955 O HIS A 62 -4.358 -8.173 -20.322 1.00 40.52 O ATOM 956 CB HIS A 62 -6.635 -6.962 -18.107 1.00 0.15 C ATOM 957 CG HIS A 62 -7.323 -8.211 -18.589 1.00 63.11 C ATOM 958 ND1 HIS A 62 -8.458 -8.206 -19.378 1.00 54.33 N ATOM 959 CD2 HIS A 62 -7.063 -9.502 -18.331 1.00 61.35 C ATOM 960 CE1 HIS A 62 -8.853 -9.451 -19.569 1.00 51.14 C ATOM 961 NE2 HIS A 62 -8.026 -10.248 -18.947 1.00 20.02 N ATOM 0 H HIS A 62 -5.295 -4.910 -17.760 1.00 74.34 H new ATOM 0 HA HIS A 62 -4.600 -7.700 -17.846 1.00 5.45 H new ATOM 0 HB2 HIS A 62 -6.792 -6.869 -17.032 1.00 0.15 H new ATOM 0 HB3 HIS A 62 -7.109 -6.099 -18.574 1.00 0.15 H new ATOM 0 HD2 HIS A 62 -6.241 -9.882 -17.743 1.00 61.35 H new ATOM 0 HE1 HIS A 62 -9.715 -9.759 -20.143 1.00 51.14 H new ATOM 0 HE2 HIS A 62 -8.090 -11.266 -18.925 1.00 20.02 H new ATOM 970 N GLN A 63 -5.205 -6.097 -20.674 1.00 71.34 N ATOM 971 CA GLN A 63 -5.253 -6.158 -22.143 1.00 51.50 C ATOM 972 C GLN A 63 -3.949 -5.610 -22.758 1.00 21.03 C ATOM 973 O GLN A 63 -3.644 -5.861 -23.928 1.00 3.21 O ATOM 974 CB GLN A 63 -6.495 -5.363 -22.617 1.00 50.34 C ATOM 975 CG GLN A 63 -7.838 -5.902 -22.042 1.00 64.35 C ATOM 976 CD GLN A 63 -9.059 -5.006 -22.309 1.00 44.33 C ATOM 977 OE1 GLN A 63 -10.180 -5.497 -22.464 1.00 21.20 O ATOM 978 NE2 GLN A 63 -8.871 -3.692 -22.302 1.00 72.30 N ATOM 0 H GLN A 63 -5.464 -5.184 -20.299 1.00 71.34 H new ATOM 0 HA GLN A 63 -5.340 -7.192 -22.477 1.00 51.50 H new ATOM 0 HB2 GLN A 63 -6.379 -4.318 -22.328 1.00 50.34 H new ATOM 0 HB3 GLN A 63 -6.539 -5.390 -23.706 1.00 50.34 H new ATOM 0 HG2 GLN A 63 -8.029 -6.888 -22.466 1.00 64.35 H new ATOM 0 HG3 GLN A 63 -7.730 -6.033 -20.965 1.00 64.35 H new ATOM 0 HE21 GLN A 63 -7.934 -3.312 -22.172 1.00 72.30 H new ATOM 0 HE22 GLN A 63 -9.664 -3.063 -22.427 1.00 72.30 H new ATOM 987 N HIS A 64 -3.207 -4.833 -21.956 1.00 63.02 N ATOM 988 CA HIS A 64 -1.839 -4.377 -22.262 1.00 3.00 C ATOM 989 C HIS A 64 -0.968 -4.646 -21.011 1.00 44.12 C ATOM 990 O HIS A 64 -0.804 -3.750 -20.166 1.00 70.01 O ATOM 991 CB HIS A 64 -1.803 -2.863 -22.652 1.00 44.42 C ATOM 992 CG HIS A 64 -2.485 -2.527 -23.957 1.00 31.44 C ATOM 993 ND1 HIS A 64 -1.790 -2.217 -25.111 1.00 60.01 N ATOM 994 CD2 HIS A 64 -3.800 -2.418 -24.287 1.00 62.12 C ATOM 995 CE1 HIS A 64 -2.638 -1.942 -26.073 1.00 64.22 C ATOM 996 NE2 HIS A 64 -3.862 -2.052 -25.606 1.00 4.23 N ATOM 0 H HIS A 64 -3.547 -4.495 -21.056 1.00 63.02 H new ATOM 0 HA HIS A 64 -1.454 -4.922 -23.124 1.00 3.00 H new ATOM 0 HB2 HIS A 64 -2.272 -2.286 -21.855 1.00 44.42 H new ATOM 0 HB3 HIS A 64 -0.763 -2.542 -22.709 1.00 44.42 H new ATOM 0 HD2 HIS A 64 -4.640 -2.588 -23.630 1.00 62.12 H new ATOM 0 HE1 HIS A 64 -2.374 -1.670 -27.084 1.00 64.22 H new ATOM 0 HE2 HIS A 64 -4.717 -1.891 -26.138 1.00 4.23 H new ATOM 1005 N PRO A 65 -0.476 -5.922 -20.826 1.00 42.41 N ATOM 1006 CA PRO A 65 0.335 -6.310 -19.645 1.00 73.53 C ATOM 1007 C PRO A 65 1.596 -5.422 -19.472 1.00 40.30 C ATOM 1008 O PRO A 65 1.679 -4.643 -18.506 1.00 73.41 O ATOM 1009 CB PRO A 65 0.684 -7.811 -19.904 1.00 35.23 C ATOM 1010 CG PRO A 65 0.414 -8.035 -21.365 1.00 32.03 C ATOM 1011 CD PRO A 65 -0.703 -7.087 -21.726 1.00 43.11 C ATOM 0 HA PRO A 65 -0.204 -6.170 -18.708 1.00 73.53 H new ATOM 0 HB2 PRO A 65 1.726 -8.020 -19.660 1.00 35.23 H new ATOM 0 HB3 PRO A 65 0.073 -8.469 -19.286 1.00 35.23 H new ATOM 0 HG2 PRO A 65 1.304 -7.836 -21.962 1.00 32.03 H new ATOM 0 HG3 PRO A 65 0.126 -9.069 -21.556 1.00 32.03 H new ATOM 0 HD2 PRO A 65 -0.660 -6.797 -22.776 1.00 43.11 H new ATOM 0 HD3 PRO A 65 -1.681 -7.538 -21.560 1.00 43.11 H new ATOM 1019 N GLY A 66 2.563 -5.540 -20.415 1.00 62.34 N ATOM 1020 CA GLY A 66 3.823 -4.780 -20.376 1.00 32.00 C ATOM 1021 C GLY A 66 4.872 -5.404 -19.456 1.00 15.53 C ATOM 1022 O GLY A 66 6.059 -5.468 -19.809 1.00 1.13 O ATOM 0 H GLY A 66 2.486 -6.164 -21.218 1.00 62.34 H new ATOM 0 HA2 GLY A 66 4.229 -4.710 -21.385 1.00 32.00 H new ATOM 0 HA3 GLY A 66 3.616 -3.763 -20.044 1.00 32.00 H new ATOM 1026 N GLY A 67 4.430 -5.897 -18.278 1.00 45.34 N ATOM 1027 CA GLY A 67 5.329 -6.374 -17.230 1.00 44.23 C ATOM 1028 C GLY A 67 5.829 -5.211 -16.397 1.00 52.41 C ATOM 1029 O GLY A 67 5.412 -5.034 -15.249 1.00 12.04 O ATOM 0 H GLY A 67 3.442 -5.971 -18.038 1.00 45.34 H new ATOM 0 HA2 GLY A 67 4.809 -7.089 -16.593 1.00 44.23 H new ATOM 0 HA3 GLY A 67 6.173 -6.900 -17.677 1.00 44.23 H new ATOM 1033 N SER A 68 6.705 -4.389 -16.996 1.00 31.14 N ATOM 1034 CA SER A 68 7.238 -3.165 -16.384 1.00 60.24 C ATOM 1035 C SER A 68 7.541 -2.148 -17.495 1.00 20.01 C ATOM 1036 O SER A 68 8.576 -2.242 -18.170 1.00 30.01 O ATOM 1037 CB SER A 68 8.515 -3.472 -15.557 1.00 52.53 C ATOM 1038 OG SER A 68 8.247 -4.359 -14.478 1.00 23.53 O ATOM 0 H SER A 68 7.068 -4.560 -17.934 1.00 31.14 H new ATOM 0 HA SER A 68 6.498 -2.749 -15.700 1.00 60.24 H new ATOM 0 HB2 SER A 68 9.272 -3.910 -16.207 1.00 52.53 H new ATOM 0 HB3 SER A 68 8.928 -2.541 -15.168 1.00 52.53 H new ATOM 0 HG SER A 68 9.075 -4.530 -13.982 1.00 23.53 H new ATOM 1044 N GLY A 69 6.603 -1.198 -17.705 1.00 1.34 N ATOM 1045 CA GLY A 69 6.798 -0.069 -18.626 1.00 21.24 C ATOM 1046 C GLY A 69 7.606 1.052 -17.975 1.00 20.53 C ATOM 1047 O GLY A 69 7.186 2.215 -17.967 1.00 23.15 O ATOM 0 H GLY A 69 5.695 -1.197 -17.240 1.00 1.34 H new ATOM 0 HA2 GLY A 69 7.311 -0.415 -19.523 1.00 21.24 H new ATOM 0 HA3 GLY A 69 5.828 0.316 -18.942 1.00 21.24 H new ATOM 1051 N LEU A 70 8.790 0.670 -17.454 1.00 55.41 N ATOM 1052 CA LEU A 70 9.679 1.528 -16.635 1.00 72.25 C ATOM 1053 C LEU A 70 10.284 2.697 -17.445 1.00 34.53 C ATOM 1054 O LEU A 70 10.616 3.743 -16.878 1.00 22.14 O ATOM 1055 CB LEU A 70 10.783 0.647 -15.926 1.00 1.41 C ATOM 1056 CG LEU A 70 11.366 -0.591 -16.718 1.00 51.34 C ATOM 1057 CD1 LEU A 70 12.110 -0.190 -18.011 1.00 15.35 C ATOM 1058 CD2 LEU A 70 12.263 -1.467 -15.807 1.00 64.21 C ATOM 0 H LEU A 70 9.167 -0.268 -17.593 1.00 55.41 H new ATOM 0 HA LEU A 70 9.074 1.997 -15.859 1.00 72.25 H new ATOM 0 HB2 LEU A 70 11.616 1.300 -15.667 1.00 1.41 H new ATOM 0 HB3 LEU A 70 10.365 0.278 -14.990 1.00 1.41 H new ATOM 0 HG LEU A 70 10.507 -1.184 -17.031 1.00 51.34 H new ATOM 0 HD11 LEU A 70 12.486 -1.085 -18.507 1.00 15.35 H new ATOM 0 HD12 LEU A 70 11.425 0.334 -18.677 1.00 15.35 H new ATOM 0 HD13 LEU A 70 12.945 0.464 -17.762 1.00 15.35 H new ATOM 0 HD21 LEU A 70 12.649 -2.310 -16.379 1.00 64.21 H new ATOM 0 HD22 LEU A 70 13.095 -0.870 -15.434 1.00 64.21 H new ATOM 0 HD23 LEU A 70 11.676 -1.837 -14.966 1.00 64.21 H new ATOM 1070 N ASP A 71 10.417 2.502 -18.767 1.00 4.24 N ATOM 1071 CA ASP A 71 10.848 3.549 -19.705 1.00 34.33 C ATOM 1072 C ASP A 71 9.902 3.556 -20.905 1.00 15.01 C ATOM 1073 O ASP A 71 10.282 3.191 -22.023 1.00 35.35 O ATOM 1074 CB ASP A 71 12.329 3.349 -20.147 1.00 43.24 C ATOM 1075 CG ASP A 71 13.343 3.664 -19.034 1.00 14.42 C ATOM 1076 OD1 ASP A 71 13.822 2.723 -18.358 1.00 4.20 O ATOM 1077 OD2 ASP A 71 13.656 4.859 -18.824 1.00 70.03 O ATOM 0 H ASP A 71 10.227 1.607 -19.217 1.00 4.24 H new ATOM 0 HA ASP A 71 10.804 4.517 -19.206 1.00 34.33 H new ATOM 0 HB2 ASP A 71 12.467 2.319 -20.474 1.00 43.24 H new ATOM 0 HB3 ASP A 71 12.534 3.987 -21.007 1.00 43.24 H new ATOM 1082 N ASP A 72 8.642 3.923 -20.639 1.00 13.40 N ATOM 1083 CA ASP A 72 7.623 4.094 -21.672 1.00 13.11 C ATOM 1084 C ASP A 72 6.548 5.053 -21.154 1.00 33.40 C ATOM 1085 O ASP A 72 6.551 6.229 -21.515 1.00 34.11 O ATOM 1086 CB ASP A 72 7.018 2.731 -22.101 1.00 41.32 C ATOM 1087 CG ASP A 72 6.059 2.850 -23.300 1.00 33.52 C ATOM 1088 OD1 ASP A 72 4.826 2.804 -23.114 1.00 12.01 O ATOM 1089 OD2 ASP A 72 6.542 3.019 -24.440 1.00 75.34 O ATOM 0 H ASP A 72 8.303 4.110 -19.695 1.00 13.40 H new ATOM 0 HA ASP A 72 8.081 4.522 -22.564 1.00 13.11 H new ATOM 0 HB2 ASP A 72 7.826 2.045 -22.355 1.00 41.32 H new ATOM 0 HB3 ASP A 72 6.484 2.295 -21.257 1.00 41.32 H new ATOM 1094 N ILE A 73 5.694 4.538 -20.235 1.00 34.22 N ATOM 1095 CA ILE A 73 4.526 5.253 -19.667 1.00 52.12 C ATOM 1096 C ILE A 73 3.629 5.841 -20.802 1.00 62.01 C ATOM 1097 O ILE A 73 3.878 6.967 -21.273 1.00 44.33 O ATOM 1098 CB ILE A 73 4.901 6.373 -18.596 1.00 42.11 C ATOM 1099 CG1 ILE A 73 5.724 5.795 -17.379 1.00 71.03 C ATOM 1100 CG2 ILE A 73 3.620 7.099 -18.084 1.00 53.21 C ATOM 1101 CD1 ILE A 73 7.196 5.491 -17.653 1.00 55.11 C ATOM 0 H ILE A 73 5.801 3.595 -19.861 1.00 34.22 H new ATOM 0 HA ILE A 73 3.961 4.502 -19.115 1.00 52.12 H new ATOM 0 HB ILE A 73 5.541 7.093 -19.107 1.00 42.11 H new ATOM 0 HG12 ILE A 73 5.667 6.507 -16.556 1.00 71.03 H new ATOM 0 HG13 ILE A 73 5.241 4.878 -17.041 1.00 71.03 H new ATOM 0 HG21 ILE A 73 3.900 7.859 -17.354 1.00 53.21 H new ATOM 0 HG22 ILE A 73 3.110 7.572 -18.923 1.00 53.21 H new ATOM 0 HG23 ILE A 73 2.954 6.374 -17.616 1.00 53.21 H new ATOM 0 HD11 ILE A 73 7.661 5.100 -16.748 1.00 55.11 H new ATOM 0 HD12 ILE A 73 7.273 4.751 -18.450 1.00 55.11 H new ATOM 0 HD13 ILE A 73 7.706 6.405 -17.957 1.00 55.11 H new ATOM 1113 N PRO A 74 2.624 5.055 -21.311 1.00 70.13 N ATOM 1114 CA PRO A 74 1.660 5.532 -22.347 1.00 32.31 C ATOM 1115 C PRO A 74 0.850 6.785 -21.892 1.00 33.42 C ATOM 1116 O PRO A 74 0.750 7.043 -20.684 1.00 24.12 O ATOM 1117 CB PRO A 74 0.747 4.295 -22.585 1.00 15.23 C ATOM 1118 CG PRO A 74 1.544 3.117 -22.114 1.00 44.33 C ATOM 1119 CD PRO A 74 2.361 3.630 -20.948 1.00 51.41 C ATOM 0 HA PRO A 74 2.162 5.871 -23.253 1.00 32.31 H new ATOM 0 HB2 PRO A 74 -0.188 4.384 -22.031 1.00 15.23 H new ATOM 0 HB3 PRO A 74 0.485 4.197 -23.639 1.00 15.23 H new ATOM 0 HG2 PRO A 74 0.893 2.298 -21.808 1.00 44.33 H new ATOM 0 HG3 PRO A 74 2.187 2.734 -22.907 1.00 44.33 H new ATOM 0 HD2 PRO A 74 1.815 3.549 -20.008 1.00 51.41 H new ATOM 0 HD3 PRO A 74 3.287 3.068 -20.828 1.00 51.41 H new ATOM 1127 N PRO A 75 0.287 7.593 -22.870 1.00 21.21 N ATOM 1128 CA PRO A 75 -0.493 8.832 -22.587 1.00 62.32 C ATOM 1129 C PRO A 75 -1.527 8.676 -21.453 1.00 62.33 C ATOM 1130 O PRO A 75 -1.526 9.468 -20.513 1.00 53.01 O ATOM 1131 CB PRO A 75 -1.182 9.130 -23.942 1.00 72.33 C ATOM 1132 CG PRO A 75 -0.212 8.610 -24.962 1.00 65.21 C ATOM 1133 CD PRO A 75 0.409 7.374 -24.342 1.00 64.11 C ATOM 0 HA PRO A 75 0.150 9.636 -22.229 1.00 62.32 H new ATOM 0 HB2 PRO A 75 -2.148 8.630 -24.018 1.00 72.33 H new ATOM 0 HB3 PRO A 75 -1.364 10.197 -24.071 1.00 72.33 H new ATOM 0 HG2 PRO A 75 -0.718 8.368 -25.896 1.00 65.21 H new ATOM 0 HG3 PRO A 75 0.548 9.355 -25.196 1.00 65.21 H new ATOM 0 HD2 PRO A 75 -0.113 6.469 -24.653 1.00 64.11 H new ATOM 0 HD3 PRO A 75 1.451 7.260 -24.641 1.00 64.11 H new ATOM 1141 N TYR A 76 -2.359 7.606 -21.537 1.00 32.41 N ATOM 1142 CA TYR A 76 -3.408 7.304 -20.533 1.00 50.32 C ATOM 1143 C TYR A 76 -2.828 7.217 -19.108 1.00 61.52 C ATOM 1144 O TYR A 76 -3.446 7.691 -18.165 1.00 32.40 O ATOM 1145 CB TYR A 76 -4.158 5.979 -20.885 1.00 73.15 C ATOM 1146 CG TYR A 76 -5.030 5.405 -19.745 1.00 20.02 C ATOM 1147 CD1 TYR A 76 -4.597 4.310 -18.977 1.00 23.05 C ATOM 1148 CD2 TYR A 76 -6.262 5.975 -19.414 1.00 34.21 C ATOM 1149 CE1 TYR A 76 -5.352 3.821 -17.928 1.00 53.23 C ATOM 1150 CE2 TYR A 76 -7.023 5.479 -18.367 1.00 74.20 C ATOM 1151 CZ TYR A 76 -6.563 4.405 -17.630 1.00 74.35 C ATOM 1152 OH TYR A 76 -7.312 3.924 -16.578 1.00 32.33 O ATOM 0 H TYR A 76 -2.320 6.931 -22.301 1.00 32.41 H new ATOM 0 HA TYR A 76 -4.119 8.130 -20.560 1.00 50.32 H new ATOM 0 HB2 TYR A 76 -4.792 6.157 -21.754 1.00 73.15 H new ATOM 0 HB3 TYR A 76 -3.423 5.228 -21.175 1.00 73.15 H new ATOM 0 HD1 TYR A 76 -3.653 3.840 -19.212 1.00 23.05 H new ATOM 0 HD2 TYR A 76 -6.628 6.817 -19.984 1.00 34.21 H new ATOM 0 HE1 TYR A 76 -4.994 2.985 -17.345 1.00 53.23 H new ATOM 0 HE2 TYR A 76 -7.974 5.931 -18.128 1.00 74.20 H new ATOM 0 HH TYR A 76 -8.265 4.022 -16.783 1.00 32.33 H new ATOM 1162 N ASP A 77 -1.642 6.604 -18.989 1.00 41.41 N ATOM 1163 CA ASP A 77 -0.986 6.350 -17.690 1.00 53.11 C ATOM 1164 C ASP A 77 -0.502 7.659 -17.049 1.00 41.05 C ATOM 1165 O ASP A 77 -0.549 7.805 -15.821 1.00 52.34 O ATOM 1166 CB ASP A 77 0.184 5.355 -17.878 1.00 23.30 C ATOM 1167 CG ASP A 77 -0.295 3.986 -18.392 1.00 72.51 C ATOM 1168 OD1 ASP A 77 -0.207 2.981 -17.653 1.00 15.53 O ATOM 1169 OD2 ASP A 77 -0.791 3.920 -19.547 1.00 65.52 O ATOM 0 H ASP A 77 -1.106 6.268 -19.789 1.00 41.41 H new ATOM 0 HA ASP A 77 -1.715 5.907 -17.012 1.00 53.11 H new ATOM 0 HB2 ASP A 77 0.905 5.773 -18.580 1.00 23.30 H new ATOM 0 HB3 ASP A 77 0.703 5.224 -16.929 1.00 23.30 H new ATOM 1174 N ARG A 78 -0.040 8.607 -17.897 1.00 41.44 N ATOM 1175 CA ARG A 78 0.275 9.984 -17.461 1.00 24.22 C ATOM 1176 C ARG A 78 -0.999 10.671 -16.945 1.00 45.20 C ATOM 1177 O ARG A 78 -1.033 11.141 -15.807 1.00 51.44 O ATOM 1178 CB ARG A 78 0.900 10.818 -18.617 1.00 23.14 C ATOM 1179 CG ARG A 78 2.359 10.462 -18.952 1.00 41.03 C ATOM 1180 CD ARG A 78 2.948 11.355 -20.065 1.00 41.50 C ATOM 1181 NE ARG A 78 4.405 11.183 -20.199 1.00 60.11 N ATOM 1182 CZ ARG A 78 5.194 11.838 -21.076 1.00 41.35 C ATOM 1183 NH1 ARG A 78 4.686 12.723 -21.933 1.00 21.44 N ATOM 1184 NH2 ARG A 78 6.500 11.602 -21.072 1.00 13.32 N ATOM 0 H ARG A 78 0.123 8.441 -18.890 1.00 41.44 H new ATOM 0 HA ARG A 78 1.009 9.925 -16.657 1.00 24.22 H new ATOM 0 HB2 ARG A 78 0.293 10.684 -19.512 1.00 23.14 H new ATOM 0 HB3 ARG A 78 0.850 11.874 -18.353 1.00 23.14 H new ATOM 0 HG2 ARG A 78 2.968 10.559 -18.053 1.00 41.03 H new ATOM 0 HG3 ARG A 78 2.412 9.418 -19.262 1.00 41.03 H new ATOM 0 HD2 ARG A 78 2.466 11.117 -21.013 1.00 41.50 H new ATOM 0 HD3 ARG A 78 2.725 12.400 -19.848 1.00 41.50 H new ATOM 0 HE ARG A 78 4.855 10.512 -19.576 1.00 60.11 H new ATOM 0 HH11 ARG A 78 3.684 12.915 -21.934 1.00 21.44 H new ATOM 0 HH12 ARG A 78 5.299 13.208 -22.588 1.00 21.44 H new ATOM 0 HH21 ARG A 78 6.895 10.933 -20.412 1.00 13.32 H new ATOM 0 HH22 ARG A 78 7.108 12.090 -21.729 1.00 13.32 H new ATOM 1198 N ASP A 79 -2.055 10.661 -17.785 1.00 22.41 N ATOM 1199 CA ASP A 79 -3.350 11.317 -17.490 1.00 12.33 C ATOM 1200 C ASP A 79 -4.031 10.713 -16.247 1.00 72.13 C ATOM 1201 O ASP A 79 -4.744 11.415 -15.520 1.00 15.42 O ATOM 1202 CB ASP A 79 -4.310 11.214 -18.710 1.00 20.00 C ATOM 1203 CG ASP A 79 -3.888 12.097 -19.893 1.00 52.53 C ATOM 1204 OD1 ASP A 79 -3.315 11.582 -20.870 1.00 70.13 O ATOM 1205 OD2 ASP A 79 -4.148 13.316 -19.847 1.00 32.44 O ATOM 0 H ASP A 79 -2.035 10.196 -18.692 1.00 22.41 H new ATOM 0 HA ASP A 79 -3.135 12.366 -17.285 1.00 12.33 H new ATOM 0 HB2 ASP A 79 -4.357 10.176 -19.039 1.00 20.00 H new ATOM 0 HB3 ASP A 79 -5.315 11.495 -18.397 1.00 20.00 H new ATOM 1210 N PHE A 80 -3.789 9.405 -16.027 1.00 4.23 N ATOM 1211 CA PHE A 80 -4.336 8.641 -14.888 1.00 55.30 C ATOM 1212 C PHE A 80 -3.744 9.172 -13.576 1.00 10.42 C ATOM 1213 O PHE A 80 -4.451 9.319 -12.571 1.00 73.11 O ATOM 1214 CB PHE A 80 -4.030 7.114 -15.046 1.00 12.33 C ATOM 1215 CG PHE A 80 -4.590 6.260 -13.913 1.00 14.31 C ATOM 1216 CD1 PHE A 80 -5.938 5.926 -13.888 1.00 74.23 C ATOM 1217 CD2 PHE A 80 -3.782 5.827 -12.854 1.00 32.03 C ATOM 1218 CE1 PHE A 80 -6.464 5.194 -12.853 1.00 12.41 C ATOM 1219 CE2 PHE A 80 -4.315 5.086 -11.819 1.00 23.42 C ATOM 1220 CZ PHE A 80 -5.658 4.775 -11.819 1.00 40.14 C ATOM 0 H PHE A 80 -3.201 8.843 -16.643 1.00 4.23 H new ATOM 0 HA PHE A 80 -5.418 8.768 -14.868 1.00 55.30 H new ATOM 0 HB2 PHE A 80 -4.444 6.765 -15.992 1.00 12.33 H new ATOM 0 HB3 PHE A 80 -2.951 6.971 -15.098 1.00 12.33 H new ATOM 0 HD1 PHE A 80 -6.581 6.247 -14.694 1.00 74.23 H new ATOM 0 HD2 PHE A 80 -2.731 6.076 -12.847 1.00 32.03 H new ATOM 0 HE1 PHE A 80 -7.515 4.946 -12.850 1.00 12.41 H new ATOM 0 HE2 PHE A 80 -3.682 4.751 -11.011 1.00 23.42 H new ATOM 0 HZ PHE A 80 -6.078 4.202 -11.006 1.00 40.14 H new ATOM 1230 N CYS A 81 -2.432 9.436 -13.616 1.00 52.33 N ATOM 1231 CA CYS A 81 -1.682 9.988 -12.486 1.00 23.55 C ATOM 1232 C CYS A 81 -1.967 11.495 -12.307 1.00 43.42 C ATOM 1233 O CYS A 81 -1.885 12.020 -11.191 1.00 31.31 O ATOM 1234 CB CYS A 81 -0.184 9.737 -12.731 1.00 44.35 C ATOM 1235 SG CYS A 81 0.232 7.990 -12.941 1.00 53.02 S ATOM 0 H CYS A 81 -1.858 9.270 -14.443 1.00 52.33 H new ATOM 0 HA CYS A 81 -1.995 9.496 -11.565 1.00 23.55 H new ATOM 0 HB2 CYS A 81 0.127 10.285 -13.620 1.00 44.35 H new ATOM 0 HB3 CYS A 81 0.385 10.139 -11.893 1.00 44.35 H new ATOM 0 HG CYS A 81 -0.024 7.627 -14.163 1.00 53.02 H new ATOM 1241 N LYS A 82 -2.337 12.176 -13.415 1.00 33.44 N ATOM 1242 CA LYS A 82 -2.675 13.610 -13.407 1.00 53.25 C ATOM 1243 C LYS A 82 -4.127 13.798 -12.936 1.00 34.13 C ATOM 1244 O LYS A 82 -5.043 14.018 -13.742 1.00 64.24 O ATOM 1245 CB LYS A 82 -2.455 14.242 -14.808 1.00 33.51 C ATOM 1246 CG LYS A 82 -0.983 14.284 -15.265 1.00 35.40 C ATOM 1247 CD LYS A 82 -0.809 14.988 -16.631 1.00 55.53 C ATOM 1248 CE LYS A 82 -1.245 16.461 -16.592 1.00 12.40 C ATOM 1249 NZ LYS A 82 -0.991 17.161 -17.876 1.00 33.43 N ATOM 0 H LYS A 82 -2.408 11.744 -14.336 1.00 33.44 H new ATOM 0 HA LYS A 82 -2.012 14.124 -12.711 1.00 53.25 H new ATOM 0 HB2 LYS A 82 -3.034 13.681 -15.541 1.00 33.51 H new ATOM 0 HB3 LYS A 82 -2.849 15.258 -14.801 1.00 33.51 H new ATOM 0 HG2 LYS A 82 -0.387 14.802 -14.514 1.00 35.40 H new ATOM 0 HG3 LYS A 82 -0.597 13.267 -15.332 1.00 35.40 H new ATOM 0 HD2 LYS A 82 0.236 14.929 -16.936 1.00 55.53 H new ATOM 0 HD3 LYS A 82 -1.392 14.460 -17.386 1.00 55.53 H new ATOM 0 HE2 LYS A 82 -2.308 16.516 -16.355 1.00 12.40 H new ATOM 0 HE3 LYS A 82 -0.713 16.973 -15.791 1.00 12.40 H new ATOM 0 HZ1 LYS A 82 -1.302 18.151 -17.799 1.00 33.43 H new ATOM 0 HZ2 LYS A 82 0.026 17.133 -18.091 1.00 33.43 H new ATOM 0 HZ3 LYS A 82 -1.519 16.690 -18.638 1.00 33.43 H new ATOM 1263 N VAL A 83 -4.330 13.632 -11.625 1.00 51.13 N ATOM 1264 CA VAL A 83 -5.616 13.853 -10.943 1.00 14.15 C ATOM 1265 C VAL A 83 -5.405 14.834 -9.787 1.00 52.14 C ATOM 1266 O VAL A 83 -4.261 15.134 -9.424 1.00 21.24 O ATOM 1267 CB VAL A 83 -6.250 12.502 -10.427 1.00 40.51 C ATOM 1268 CG1 VAL A 83 -6.637 11.576 -11.602 1.00 42.35 C ATOM 1269 CG2 VAL A 83 -5.314 11.769 -9.431 1.00 22.21 C ATOM 0 H VAL A 83 -3.589 13.333 -10.991 1.00 51.13 H new ATOM 0 HA VAL A 83 -6.321 14.275 -11.659 1.00 14.15 H new ATOM 0 HB VAL A 83 -7.162 12.763 -9.889 1.00 40.51 H new ATOM 0 HG11 VAL A 83 -7.070 10.655 -11.212 1.00 42.35 H new ATOM 0 HG12 VAL A 83 -7.366 12.079 -12.237 1.00 42.35 H new ATOM 0 HG13 VAL A 83 -5.748 11.339 -12.187 1.00 42.35 H new ATOM 0 HG21 VAL A 83 -5.787 10.845 -9.100 1.00 22.21 H new ATOM 0 HG22 VAL A 83 -4.369 11.537 -9.923 1.00 22.21 H new ATOM 0 HG23 VAL A 83 -5.127 12.409 -8.569 1.00 22.21 H new ATOM 1279 N ASP A 84 -6.515 15.313 -9.210 1.00 15.15 N ATOM 1280 CA ASP A 84 -6.508 16.364 -8.181 1.00 74.54 C ATOM 1281 C ASP A 84 -5.868 15.851 -6.863 1.00 0.50 C ATOM 1282 O ASP A 84 -5.782 14.636 -6.651 1.00 24.31 O ATOM 1283 CB ASP A 84 -7.965 16.871 -7.968 1.00 30.20 C ATOM 1284 CG ASP A 84 -8.067 18.185 -7.176 1.00 32.12 C ATOM 1285 OD1 ASP A 84 -9.017 18.345 -6.381 1.00 34.03 O ATOM 1286 OD2 ASP A 84 -7.190 19.063 -7.341 1.00 43.50 O ATOM 0 H ASP A 84 -7.450 14.980 -9.445 1.00 15.15 H new ATOM 0 HA ASP A 84 -5.894 17.201 -8.514 1.00 74.54 H new ATOM 0 HB2 ASP A 84 -8.435 17.009 -8.942 1.00 30.20 H new ATOM 0 HB3 ASP A 84 -8.533 16.101 -7.446 1.00 30.20 H new ATOM 1291 N GLN A 85 -5.432 16.796 -5.994 1.00 42.43 N ATOM 1292 CA GLN A 85 -4.670 16.504 -4.755 1.00 25.02 C ATOM 1293 C GLN A 85 -5.385 15.473 -3.816 1.00 52.23 C ATOM 1294 O GLN A 85 -4.749 14.478 -3.439 1.00 53.02 O ATOM 1295 CB GLN A 85 -4.311 17.829 -3.998 1.00 55.30 C ATOM 1296 CG GLN A 85 -3.486 17.646 -2.697 1.00 4.53 C ATOM 1297 CD GLN A 85 -2.124 16.969 -2.899 1.00 72.21 C ATOM 1298 OE1 GLN A 85 -1.489 17.094 -3.945 1.00 33.00 O ATOM 1299 NE2 GLN A 85 -1.660 16.252 -1.889 1.00 11.22 N ATOM 0 H GLN A 85 -5.601 17.792 -6.135 1.00 42.43 H new ATOM 0 HA GLN A 85 -3.742 16.023 -5.064 1.00 25.02 H new ATOM 0 HB2 GLN A 85 -3.752 18.475 -4.675 1.00 55.30 H new ATOM 0 HB3 GLN A 85 -5.236 18.350 -3.752 1.00 55.30 H new ATOM 0 HG2 GLN A 85 -3.328 18.623 -2.241 1.00 4.53 H new ATOM 0 HG3 GLN A 85 -4.070 17.056 -1.991 1.00 4.53 H new ATOM 0 HE21 GLN A 85 -2.207 16.164 -1.032 1.00 11.22 H new ATOM 0 HE22 GLN A 85 -0.756 15.787 -1.967 1.00 11.22 H new ATOM 1308 N PRO A 86 -6.710 15.652 -3.435 1.00 73.45 N ATOM 1309 CA PRO A 86 -7.437 14.634 -2.629 1.00 54.41 C ATOM 1310 C PRO A 86 -7.616 13.304 -3.391 1.00 3.23 C ATOM 1311 O PRO A 86 -7.521 12.236 -2.784 1.00 2.14 O ATOM 1312 CB PRO A 86 -8.807 15.302 -2.321 1.00 1.35 C ATOM 1313 CG PRO A 86 -8.979 16.321 -3.409 1.00 32.30 C ATOM 1314 CD PRO A 86 -7.587 16.831 -3.704 1.00 65.23 C ATOM 0 HA PRO A 86 -6.889 14.363 -1.727 1.00 54.41 H new ATOM 0 HB2 PRO A 86 -9.616 14.572 -2.329 1.00 1.35 H new ATOM 0 HB3 PRO A 86 -8.809 15.768 -1.336 1.00 1.35 H new ATOM 0 HG2 PRO A 86 -9.431 15.877 -4.296 1.00 32.30 H new ATOM 0 HG3 PRO A 86 -9.635 17.131 -3.089 1.00 32.30 H new ATOM 0 HD2 PRO A 86 -7.496 17.170 -4.736 1.00 65.23 H new ATOM 0 HD3 PRO A 86 -7.327 17.676 -3.067 1.00 65.23 H new ATOM 1322 N THR A 87 -7.821 13.401 -4.732 1.00 52.22 N ATOM 1323 CA THR A 87 -8.086 12.247 -5.616 1.00 45.52 C ATOM 1324 C THR A 87 -6.907 11.249 -5.629 1.00 53.34 C ATOM 1325 O THR A 87 -7.110 10.036 -5.767 1.00 65.35 O ATOM 1326 CB THR A 87 -8.383 12.728 -7.073 1.00 22.42 C ATOM 1327 OG1 THR A 87 -9.314 13.821 -7.044 1.00 32.43 O ATOM 1328 CG2 THR A 87 -8.939 11.596 -7.962 1.00 21.42 C ATOM 0 H THR A 87 -7.806 14.292 -5.228 1.00 52.22 H new ATOM 0 HA THR A 87 -8.961 11.732 -5.218 1.00 45.52 H new ATOM 0 HB THR A 87 -7.437 13.052 -7.508 1.00 22.42 H new ATOM 0 HG1 THR A 87 -9.496 14.120 -7.959 1.00 32.43 H new ATOM 0 HG21 THR A 87 -9.129 11.980 -8.964 1.00 21.42 H new ATOM 0 HG22 THR A 87 -8.212 10.786 -8.016 1.00 21.42 H new ATOM 0 HG23 THR A 87 -9.869 11.221 -7.535 1.00 21.42 H new ATOM 1336 N LEU A 88 -5.683 11.787 -5.483 1.00 4.10 N ATOM 1337 CA LEU A 88 -4.444 10.998 -5.336 1.00 23.12 C ATOM 1338 C LEU A 88 -4.544 10.055 -4.121 1.00 74.31 C ATOM 1339 O LEU A 88 -4.298 8.855 -4.233 1.00 34.45 O ATOM 1340 CB LEU A 88 -3.232 11.962 -5.203 1.00 53.13 C ATOM 1341 CG LEU A 88 -2.850 12.741 -6.506 1.00 61.13 C ATOM 1342 CD1 LEU A 88 -1.904 13.923 -6.213 1.00 42.01 C ATOM 1343 CD2 LEU A 88 -2.233 11.783 -7.553 1.00 14.25 C ATOM 0 H LEU A 88 -5.523 12.794 -5.463 1.00 4.10 H new ATOM 0 HA LEU A 88 -4.302 10.378 -6.221 1.00 23.12 H new ATOM 0 HB2 LEU A 88 -3.449 12.686 -4.417 1.00 53.13 H new ATOM 0 HB3 LEU A 88 -2.366 11.387 -4.876 1.00 53.13 H new ATOM 0 HG LEU A 88 -3.768 13.159 -6.919 1.00 61.13 H new ATOM 0 HD11 LEU A 88 -1.664 14.436 -7.144 1.00 42.01 H new ATOM 0 HD12 LEU A 88 -2.392 14.619 -5.530 1.00 42.01 H new ATOM 0 HD13 LEU A 88 -0.987 13.550 -5.757 1.00 42.01 H new ATOM 0 HD21 LEU A 88 -1.974 12.344 -8.451 1.00 14.25 H new ATOM 0 HD22 LEU A 88 -1.335 11.323 -7.141 1.00 14.25 H new ATOM 0 HD23 LEU A 88 -2.955 11.006 -7.805 1.00 14.25 H new ATOM 1355 N PHE A 89 -4.968 10.620 -2.976 1.00 14.32 N ATOM 1356 CA PHE A 89 -5.148 9.863 -1.722 1.00 75.24 C ATOM 1357 C PHE A 89 -6.330 8.888 -1.817 1.00 41.44 C ATOM 1358 O PHE A 89 -6.315 7.850 -1.175 1.00 3.10 O ATOM 1359 CB PHE A 89 -5.345 10.817 -0.526 1.00 44.14 C ATOM 1360 CG PHE A 89 -4.168 11.758 -0.280 1.00 41.11 C ATOM 1361 CD1 PHE A 89 -4.253 13.117 -0.580 1.00 61.13 C ATOM 1362 CD2 PHE A 89 -2.976 11.273 0.250 1.00 12.41 C ATOM 1363 CE1 PHE A 89 -3.186 13.959 -0.354 1.00 33.12 C ATOM 1364 CE2 PHE A 89 -1.913 12.117 0.475 1.00 61.41 C ATOM 1365 CZ PHE A 89 -2.018 13.461 0.175 1.00 32.45 C ATOM 0 H PHE A 89 -5.195 11.611 -2.893 1.00 14.32 H new ATOM 0 HA PHE A 89 -4.240 9.282 -1.562 1.00 75.24 H new ATOM 0 HB2 PHE A 89 -6.243 11.412 -0.693 1.00 44.14 H new ATOM 0 HB3 PHE A 89 -5.517 10.225 0.373 1.00 44.14 H new ATOM 0 HD1 PHE A 89 -5.167 13.515 -0.995 1.00 61.13 H new ATOM 0 HD2 PHE A 89 -2.885 10.223 0.487 1.00 12.41 H new ATOM 0 HE1 PHE A 89 -3.267 15.009 -0.592 1.00 33.12 H new ATOM 0 HE2 PHE A 89 -0.994 11.727 0.887 1.00 61.41 H new ATOM 0 HZ PHE A 89 -1.183 14.121 0.356 1.00 32.45 H new ATOM 1375 N GLU A 90 -7.351 9.248 -2.619 1.00 73.33 N ATOM 1376 CA GLU A 90 -8.517 8.375 -2.879 1.00 25.22 C ATOM 1377 C GLU A 90 -8.080 7.085 -3.604 1.00 40.04 C ATOM 1378 O GLU A 90 -8.587 5.996 -3.316 1.00 43.04 O ATOM 1379 CB GLU A 90 -9.576 9.117 -3.731 1.00 4.50 C ATOM 1380 CG GLU A 90 -10.127 10.413 -3.110 1.00 42.24 C ATOM 1381 CD GLU A 90 -10.939 10.197 -1.827 1.00 14.53 C ATOM 1382 OE1 GLU A 90 -12.168 9.989 -1.929 1.00 40.43 O ATOM 1383 OE2 GLU A 90 -10.359 10.250 -0.716 1.00 44.22 O ATOM 0 H GLU A 90 -7.393 10.145 -3.103 1.00 73.33 H new ATOM 0 HA GLU A 90 -8.958 8.110 -1.918 1.00 25.22 H new ATOM 0 HB2 GLU A 90 -9.137 9.355 -4.700 1.00 4.50 H new ATOM 0 HB3 GLU A 90 -10.409 8.439 -3.917 1.00 4.50 H new ATOM 0 HG2 GLU A 90 -9.294 11.081 -2.892 1.00 42.24 H new ATOM 0 HG3 GLU A 90 -10.756 10.916 -3.845 1.00 42.24 H new ATOM 1390 N LEU A 91 -7.132 7.245 -4.553 1.00 60.15 N ATOM 1391 CA LEU A 91 -6.521 6.125 -5.296 1.00 74.31 C ATOM 1392 C LEU A 91 -5.626 5.271 -4.367 1.00 12.25 C ATOM 1393 O LEU A 91 -5.554 4.058 -4.532 1.00 42.52 O ATOM 1394 CB LEU A 91 -5.697 6.659 -6.508 1.00 74.12 C ATOM 1395 CG LEU A 91 -6.494 7.411 -7.632 1.00 45.00 C ATOM 1396 CD1 LEU A 91 -5.538 7.991 -8.709 1.00 62.41 C ATOM 1397 CD2 LEU A 91 -7.566 6.497 -8.270 1.00 62.31 C ATOM 0 H LEU A 91 -6.769 8.159 -4.825 1.00 60.15 H new ATOM 0 HA LEU A 91 -7.322 5.490 -5.674 1.00 74.31 H new ATOM 0 HB2 LEU A 91 -4.930 7.333 -6.126 1.00 74.12 H new ATOM 0 HB3 LEU A 91 -5.180 5.815 -6.965 1.00 74.12 H new ATOM 0 HG LEU A 91 -7.011 8.248 -7.163 1.00 45.00 H new ATOM 0 HD11 LEU A 91 -6.120 8.506 -9.473 1.00 62.41 H new ATOM 0 HD12 LEU A 91 -4.849 8.695 -8.243 1.00 62.41 H new ATOM 0 HD13 LEU A 91 -4.973 7.180 -9.168 1.00 62.41 H new ATOM 0 HD21 LEU A 91 -8.100 7.048 -9.044 1.00 62.31 H new ATOM 0 HD22 LEU A 91 -7.084 5.625 -8.712 1.00 62.31 H new ATOM 0 HD23 LEU A 91 -8.271 6.173 -7.504 1.00 62.31 H new ATOM 1409 N ILE A 92 -4.951 5.933 -3.394 1.00 44.10 N ATOM 1410 CA ILE A 92 -4.120 5.257 -2.365 1.00 15.42 C ATOM 1411 C ILE A 92 -5.016 4.413 -1.420 1.00 34.32 C ATOM 1412 O ILE A 92 -4.703 3.249 -1.130 1.00 74.14 O ATOM 1413 CB ILE A 92 -3.256 6.302 -1.533 1.00 53.41 C ATOM 1414 CG1 ILE A 92 -2.244 7.049 -2.469 1.00 31.34 C ATOM 1415 CG2 ILE A 92 -2.516 5.629 -0.341 1.00 10.04 C ATOM 1416 CD1 ILE A 92 -1.416 8.138 -1.795 1.00 12.41 C ATOM 0 H ILE A 92 -4.967 6.949 -3.300 1.00 44.10 H new ATOM 0 HA ILE A 92 -3.425 4.592 -2.879 1.00 15.42 H new ATOM 0 HB ILE A 92 -3.945 7.033 -1.111 1.00 53.41 H new ATOM 0 HG12 ILE A 92 -1.565 6.315 -2.902 1.00 31.34 H new ATOM 0 HG13 ILE A 92 -2.799 7.496 -3.294 1.00 31.34 H new ATOM 0 HG21 ILE A 92 -1.939 6.379 0.199 1.00 10.04 H new ATOM 0 HG22 ILE A 92 -3.245 5.178 0.332 1.00 10.04 H new ATOM 0 HG23 ILE A 92 -1.845 4.857 -0.718 1.00 10.04 H new ATOM 0 HD11 ILE A 92 -0.748 8.593 -2.527 1.00 12.41 H new ATOM 0 HD12 ILE A 92 -2.080 8.900 -1.387 1.00 12.41 H new ATOM 0 HD13 ILE A 92 -0.827 7.701 -0.989 1.00 12.41 H new ATOM 1428 N LEU A 93 -6.150 5.010 -0.989 1.00 74.24 N ATOM 1429 CA LEU A 93 -7.110 4.376 -0.056 1.00 34.14 C ATOM 1430 C LEU A 93 -7.793 3.161 -0.718 1.00 72.14 C ATOM 1431 O LEU A 93 -7.966 2.124 -0.081 1.00 34.52 O ATOM 1432 CB LEU A 93 -8.179 5.411 0.433 1.00 22.44 C ATOM 1433 CG LEU A 93 -7.662 6.556 1.376 1.00 21.34 C ATOM 1434 CD1 LEU A 93 -8.793 7.561 1.722 1.00 24.20 C ATOM 1435 CD2 LEU A 93 -7.018 5.985 2.660 1.00 11.21 C ATOM 0 H LEU A 93 -6.426 5.948 -1.279 1.00 74.24 H new ATOM 0 HA LEU A 93 -6.554 4.025 0.814 1.00 34.14 H new ATOM 0 HB2 LEU A 93 -8.636 5.870 -0.444 1.00 22.44 H new ATOM 0 HB3 LEU A 93 -8.967 4.868 0.955 1.00 22.44 H new ATOM 0 HG LEU A 93 -6.890 7.099 0.830 1.00 21.34 H new ATOM 0 HD11 LEU A 93 -8.400 8.340 2.376 1.00 24.20 H new ATOM 0 HD12 LEU A 93 -9.171 8.013 0.805 1.00 24.20 H new ATOM 0 HD13 LEU A 93 -9.603 7.037 2.228 1.00 24.20 H new ATOM 0 HD21 LEU A 93 -6.672 6.805 3.289 1.00 11.21 H new ATOM 0 HD22 LEU A 93 -7.755 5.396 3.206 1.00 11.21 H new ATOM 0 HD23 LEU A 93 -6.173 5.351 2.392 1.00 11.21 H new ATOM 1447 N ALA A 94 -8.153 3.314 -2.010 1.00 63.24 N ATOM 1448 CA ALA A 94 -8.810 2.257 -2.809 1.00 34.54 C ATOM 1449 C ALA A 94 -7.840 1.110 -3.137 1.00 61.25 C ATOM 1450 O ALA A 94 -8.227 -0.060 -3.141 1.00 34.11 O ATOM 1451 CB ALA A 94 -9.377 2.859 -4.102 1.00 55.34 C ATOM 0 H ALA A 94 -7.996 4.177 -2.530 1.00 63.24 H new ATOM 0 HA ALA A 94 -9.624 1.841 -2.215 1.00 34.54 H new ATOM 0 HB1 ALA A 94 -9.860 2.076 -4.687 1.00 55.34 H new ATOM 0 HB2 ALA A 94 -10.107 3.630 -3.855 1.00 55.34 H new ATOM 0 HB3 ALA A 94 -8.567 3.299 -4.684 1.00 55.34 H new ATOM 1457 N ALA A 95 -6.574 1.473 -3.417 1.00 52.11 N ATOM 1458 CA ALA A 95 -5.507 0.506 -3.740 1.00 14.51 C ATOM 1459 C ALA A 95 -5.064 -0.283 -2.501 1.00 52.42 C ATOM 1460 O ALA A 95 -4.576 -1.399 -2.627 1.00 14.44 O ATOM 1461 CB ALA A 95 -4.313 1.220 -4.374 1.00 25.35 C ATOM 0 H ALA A 95 -6.262 2.444 -3.426 1.00 52.11 H new ATOM 0 HA ALA A 95 -5.914 -0.207 -4.457 1.00 14.51 H new ATOM 0 HB1 ALA A 95 -3.535 0.492 -4.606 1.00 25.35 H new ATOM 0 HB2 ALA A 95 -4.631 1.716 -5.291 1.00 25.35 H new ATOM 0 HB3 ALA A 95 -3.921 1.961 -3.678 1.00 25.35 H new ATOM 1467 N ASN A 96 -5.189 0.333 -1.311 1.00 42.03 N ATOM 1468 CA ASN A 96 -4.928 -0.349 -0.019 1.00 73.22 C ATOM 1469 C ASN A 96 -6.143 -1.229 0.363 1.00 74.54 C ATOM 1470 O ASN A 96 -5.988 -2.347 0.848 1.00 4.50 O ATOM 1471 CB ASN A 96 -4.608 0.709 1.089 1.00 55.52 C ATOM 1472 CG ASN A 96 -4.220 0.113 2.459 1.00 40.11 C ATOM 1473 OD1 ASN A 96 -3.711 -1.006 2.556 1.00 32.41 O ATOM 1474 ND2 ASN A 96 -4.396 0.883 3.522 1.00 21.24 N ATOM 0 H ASN A 96 -5.471 1.308 -1.212 1.00 42.03 H new ATOM 0 HA ASN A 96 -4.059 -1.000 -0.116 1.00 73.22 H new ATOM 0 HB2 ASN A 96 -3.794 1.344 0.741 1.00 55.52 H new ATOM 0 HB3 ASN A 96 -5.479 1.351 1.221 1.00 55.52 H new ATOM 0 HD21 ASN A 96 -4.108 0.554 4.444 1.00 21.24 H new ATOM 0 HD22 ASN A 96 -4.819 1.805 3.419 1.00 21.24 H new ATOM 1481 N TYR A 97 -7.353 -0.715 0.085 1.00 1.31 N ATOM 1482 CA TYR A 97 -8.630 -1.401 0.392 1.00 3.25 C ATOM 1483 C TYR A 97 -8.785 -2.715 -0.412 1.00 14.00 C ATOM 1484 O TYR A 97 -9.199 -3.745 0.134 1.00 10.33 O ATOM 1485 CB TYR A 97 -9.805 -0.423 0.102 1.00 31.32 C ATOM 1486 CG TYR A 97 -11.221 -1.003 0.256 1.00 65.10 C ATOM 1487 CD1 TYR A 97 -12.123 -1.012 -0.815 1.00 41.15 C ATOM 1488 CD2 TYR A 97 -11.655 -1.528 1.474 1.00 52.30 C ATOM 1489 CE1 TYR A 97 -13.402 -1.514 -0.669 1.00 24.03 C ATOM 1490 CE2 TYR A 97 -12.927 -2.038 1.615 1.00 2.23 C ATOM 1491 CZ TYR A 97 -13.794 -2.029 0.552 1.00 44.42 C ATOM 1492 OH TYR A 97 -15.072 -2.505 0.729 1.00 22.10 O ATOM 0 H TYR A 97 -7.479 0.193 -0.362 1.00 1.31 H new ATOM 0 HA TYR A 97 -8.638 -1.681 1.445 1.00 3.25 H new ATOM 0 HB2 TYR A 97 -9.711 0.434 0.769 1.00 31.32 H new ATOM 0 HB3 TYR A 97 -9.696 -0.048 -0.916 1.00 31.32 H new ATOM 0 HD1 TYR A 97 -11.813 -0.620 -1.772 1.00 41.15 H new ATOM 0 HD2 TYR A 97 -10.983 -1.535 2.319 1.00 52.30 H new ATOM 0 HE1 TYR A 97 -14.089 -1.504 -1.502 1.00 24.03 H new ATOM 0 HE2 TYR A 97 -13.242 -2.446 2.564 1.00 2.23 H new ATOM 0 HH TYR A 97 -15.176 -2.831 1.648 1.00 22.10 H new ATOM 1502 N LEU A 98 -8.445 -2.654 -1.710 1.00 64.15 N ATOM 1503 CA LEU A 98 -8.557 -3.793 -2.642 1.00 24.20 C ATOM 1504 C LEU A 98 -7.221 -4.561 -2.769 1.00 3.52 C ATOM 1505 O LEU A 98 -7.195 -5.658 -3.341 1.00 23.11 O ATOM 1506 CB LEU A 98 -9.032 -3.276 -4.030 1.00 3.01 C ATOM 1507 CG LEU A 98 -10.441 -2.596 -4.072 1.00 33.51 C ATOM 1508 CD1 LEU A 98 -10.775 -2.088 -5.497 1.00 23.55 C ATOM 1509 CD2 LEU A 98 -11.539 -3.549 -3.532 1.00 23.52 C ATOM 0 H LEU A 98 -8.082 -1.807 -2.147 1.00 64.15 H new ATOM 0 HA LEU A 98 -9.290 -4.495 -2.245 1.00 24.20 H new ATOM 0 HB2 LEU A 98 -8.296 -2.561 -4.399 1.00 3.01 H new ATOM 0 HB3 LEU A 98 -9.037 -4.116 -4.725 1.00 3.01 H new ATOM 0 HG LEU A 98 -10.413 -1.727 -3.415 1.00 33.51 H new ATOM 0 HD11 LEU A 98 -11.760 -1.620 -5.495 1.00 23.55 H new ATOM 0 HD12 LEU A 98 -10.027 -1.358 -5.808 1.00 23.55 H new ATOM 0 HD13 LEU A 98 -10.773 -2.927 -6.192 1.00 23.55 H new ATOM 0 HD21 LEU A 98 -12.507 -3.049 -3.573 1.00 23.52 H new ATOM 0 HD22 LEU A 98 -11.570 -4.451 -4.143 1.00 23.52 H new ATOM 0 HD23 LEU A 98 -11.313 -3.817 -2.500 1.00 23.52 H new ATOM 1521 N ASP A 99 -6.140 -3.991 -2.183 1.00 4.22 N ATOM 1522 CA ASP A 99 -4.752 -4.496 -2.300 1.00 72.11 C ATOM 1523 C ASP A 99 -4.377 -4.745 -3.778 1.00 23.25 C ATOM 1524 O ASP A 99 -4.318 -5.887 -4.256 1.00 50.12 O ATOM 1525 CB ASP A 99 -4.477 -5.742 -1.396 1.00 32.50 C ATOM 1526 CG ASP A 99 -2.994 -6.220 -1.370 1.00 60.24 C ATOM 1527 OD1 ASP A 99 -2.749 -7.422 -1.117 1.00 44.34 O ATOM 1528 OD2 ASP A 99 -2.067 -5.404 -1.582 1.00 24.23 O ATOM 0 H ASP A 99 -6.211 -3.153 -1.606 1.00 4.22 H new ATOM 0 HA ASP A 99 -4.095 -3.714 -1.920 1.00 72.11 H new ATOM 0 HB2 ASP A 99 -4.786 -5.509 -0.377 1.00 32.50 H new ATOM 0 HB3 ASP A 99 -5.103 -6.566 -1.738 1.00 32.50 H new ATOM 1533 N ILE A 100 -4.261 -3.631 -4.509 1.00 23.21 N ATOM 1534 CA ILE A 100 -3.754 -3.597 -5.883 1.00 73.13 C ATOM 1535 C ILE A 100 -2.485 -2.736 -5.874 1.00 34.42 C ATOM 1536 O ILE A 100 -2.561 -1.508 -5.945 1.00 41.20 O ATOM 1537 CB ILE A 100 -4.813 -3.020 -6.908 1.00 20.55 C ATOM 1538 CG1 ILE A 100 -6.188 -3.719 -6.719 1.00 51.53 C ATOM 1539 CG2 ILE A 100 -4.306 -3.179 -8.372 1.00 4.42 C ATOM 1540 CD1 ILE A 100 -7.299 -3.227 -7.627 1.00 11.11 C ATOM 0 H ILE A 100 -4.522 -2.711 -4.154 1.00 23.21 H new ATOM 0 HA ILE A 100 -3.543 -4.613 -6.216 1.00 73.13 H new ATOM 0 HB ILE A 100 -4.941 -1.956 -6.710 1.00 20.55 H new ATOM 0 HG12 ILE A 100 -6.058 -4.789 -6.880 1.00 51.53 H new ATOM 0 HG13 ILE A 100 -6.503 -3.589 -5.684 1.00 51.53 H new ATOM 0 HG21 ILE A 100 -5.049 -2.776 -9.060 1.00 4.42 H new ATOM 0 HG22 ILE A 100 -3.368 -2.637 -8.493 1.00 4.42 H new ATOM 0 HG23 ILE A 100 -4.146 -4.235 -8.589 1.00 4.42 H new ATOM 0 HD11 ILE A 100 -8.214 -3.779 -7.414 1.00 11.11 H new ATOM 0 HD12 ILE A 100 -7.467 -2.164 -7.453 1.00 11.11 H new ATOM 0 HD13 ILE A 100 -7.015 -3.384 -8.668 1.00 11.11 H new ATOM 1552 N LYS A 101 -1.335 -3.399 -5.706 1.00 30.40 N ATOM 1553 CA LYS A 101 -0.004 -2.758 -5.719 1.00 14.44 C ATOM 1554 C LYS A 101 0.363 -2.142 -7.103 1.00 3.25 C ATOM 1555 O LYS A 101 1.017 -1.102 -7.121 1.00 24.54 O ATOM 1556 CB LYS A 101 1.070 -3.767 -5.248 1.00 40.31 C ATOM 1557 CG LYS A 101 0.829 -4.275 -3.812 1.00 74.20 C ATOM 1558 CD LYS A 101 1.821 -5.384 -3.393 1.00 51.12 C ATOM 1559 CE LYS A 101 1.542 -5.910 -1.977 1.00 42.54 C ATOM 1560 NZ LYS A 101 2.532 -6.949 -1.572 1.00 53.43 N ATOM 0 H LYS A 101 -1.296 -4.407 -5.555 1.00 30.40 H new ATOM 0 HA LYS A 101 -0.039 -1.920 -5.022 1.00 14.44 H new ATOM 0 HB2 LYS A 101 1.087 -4.617 -5.930 1.00 40.31 H new ATOM 0 HB3 LYS A 101 2.052 -3.296 -5.301 1.00 40.31 H new ATOM 0 HG2 LYS A 101 0.912 -3.439 -3.117 1.00 74.20 H new ATOM 0 HG3 LYS A 101 -0.189 -4.656 -3.733 1.00 74.20 H new ATOM 0 HD2 LYS A 101 1.762 -6.209 -4.103 1.00 51.12 H new ATOM 0 HD3 LYS A 101 2.838 -4.995 -3.440 1.00 51.12 H new ATOM 0 HE2 LYS A 101 1.572 -5.082 -1.268 1.00 42.54 H new ATOM 0 HE3 LYS A 101 0.537 -6.329 -1.935 1.00 42.54 H new ATOM 0 HZ1 LYS A 101 2.237 -7.378 -0.672 1.00 53.43 H new ATOM 0 HZ2 LYS A 101 2.583 -7.685 -2.305 1.00 53.43 H new ATOM 0 HZ3 LYS A 101 3.468 -6.510 -1.456 1.00 53.43 H new ATOM 1574 N PRO A 102 -0.028 -2.759 -8.294 1.00 1.13 N ATOM 1575 CA PRO A 102 0.048 -2.062 -9.618 1.00 42.42 C ATOM 1576 C PRO A 102 -0.621 -0.653 -9.626 1.00 44.55 C ATOM 1577 O PRO A 102 -0.167 0.246 -10.331 1.00 63.23 O ATOM 1578 CB PRO A 102 -0.696 -3.035 -10.571 1.00 54.43 C ATOM 1579 CG PRO A 102 -0.442 -4.390 -9.984 1.00 43.13 C ATOM 1580 CD PRO A 102 -0.456 -4.190 -8.483 1.00 64.13 C ATOM 0 HA PRO A 102 1.080 -1.859 -9.903 1.00 42.42 H new ATOM 0 HB2 PRO A 102 -1.762 -2.813 -10.614 1.00 54.43 H new ATOM 0 HB3 PRO A 102 -0.315 -2.964 -11.590 1.00 54.43 H new ATOM 0 HG2 PRO A 102 -1.208 -5.101 -10.292 1.00 43.13 H new ATOM 0 HG3 PRO A 102 0.516 -4.789 -10.318 1.00 43.13 H new ATOM 0 HD2 PRO A 102 -1.448 -4.367 -8.067 1.00 64.13 H new ATOM 0 HD3 PRO A 102 0.226 -4.878 -7.984 1.00 64.13 H new ATOM 1588 N LEU A 103 -1.700 -0.493 -8.843 1.00 51.22 N ATOM 1589 CA LEU A 103 -2.406 0.801 -8.689 1.00 72.20 C ATOM 1590 C LEU A 103 -1.636 1.686 -7.683 1.00 74.32 C ATOM 1591 O LEU A 103 -1.302 2.843 -7.982 1.00 52.53 O ATOM 1592 CB LEU A 103 -3.878 0.543 -8.201 1.00 41.44 C ATOM 1593 CG LEU A 103 -4.968 1.623 -8.541 1.00 34.24 C ATOM 1594 CD1 LEU A 103 -4.744 2.986 -7.833 1.00 42.12 C ATOM 1595 CD2 LEU A 103 -5.092 1.791 -10.068 1.00 35.43 C ATOM 0 H LEU A 103 -2.111 -1.251 -8.298 1.00 51.22 H new ATOM 0 HA LEU A 103 -2.449 1.320 -9.647 1.00 72.20 H new ATOM 0 HB2 LEU A 103 -4.207 -0.407 -8.621 1.00 41.44 H new ATOM 0 HB3 LEU A 103 -3.854 0.422 -7.118 1.00 41.44 H new ATOM 0 HG LEU A 103 -5.912 1.249 -8.144 1.00 34.24 H new ATOM 0 HD11 LEU A 103 -5.536 3.678 -8.118 1.00 42.12 H new ATOM 0 HD12 LEU A 103 -4.759 2.842 -6.753 1.00 42.12 H new ATOM 0 HD13 LEU A 103 -3.779 3.397 -8.131 1.00 42.12 H new ATOM 0 HD21 LEU A 103 -5.850 2.542 -10.291 1.00 35.43 H new ATOM 0 HD22 LEU A 103 -4.134 2.110 -10.478 1.00 35.43 H new ATOM 0 HD23 LEU A 103 -5.380 0.840 -10.516 1.00 35.43 H new ATOM 1607 N LEU A 104 -1.339 1.089 -6.507 1.00 3.14 N ATOM 1608 CA LEU A 104 -0.785 1.787 -5.330 1.00 31.10 C ATOM 1609 C LEU A 104 0.563 2.444 -5.643 1.00 40.32 C ATOM 1610 O LEU A 104 0.733 3.645 -5.419 1.00 21.25 O ATOM 1611 CB LEU A 104 -0.622 0.783 -4.145 1.00 32.04 C ATOM 1612 CG LEU A 104 -0.088 1.366 -2.792 1.00 34.05 C ATOM 1613 CD1 LEU A 104 -1.055 2.421 -2.203 1.00 10.02 C ATOM 1614 CD2 LEU A 104 0.200 0.231 -1.777 1.00 23.11 C ATOM 0 H LEU A 104 -1.481 0.091 -6.349 1.00 3.14 H new ATOM 0 HA LEU A 104 -1.484 2.575 -5.051 1.00 31.10 H new ATOM 0 HB2 LEU A 104 -1.591 0.320 -3.956 1.00 32.04 H new ATOM 0 HB3 LEU A 104 0.054 -0.011 -4.463 1.00 32.04 H new ATOM 0 HG LEU A 104 0.853 1.876 -3.000 1.00 34.05 H new ATOM 0 HD11 LEU A 104 -0.650 2.802 -1.265 1.00 10.02 H new ATOM 0 HD12 LEU A 104 -1.170 3.243 -2.909 1.00 10.02 H new ATOM 0 HD13 LEU A 104 -2.026 1.962 -2.019 1.00 10.02 H new ATOM 0 HD21 LEU A 104 0.570 0.661 -0.846 1.00 23.11 H new ATOM 0 HD22 LEU A 104 -0.718 -0.324 -1.582 1.00 23.11 H new ATOM 0 HD23 LEU A 104 0.951 -0.443 -2.189 1.00 23.11 H new ATOM 1626 N ASP A 105 1.477 1.636 -6.210 1.00 33.33 N ATOM 1627 CA ASP A 105 2.873 2.023 -6.465 1.00 74.05 C ATOM 1628 C ASP A 105 2.966 3.164 -7.493 1.00 2.44 C ATOM 1629 O ASP A 105 3.775 4.076 -7.341 1.00 31.14 O ATOM 1630 CB ASP A 105 3.693 0.794 -6.944 1.00 74.14 C ATOM 1631 CG ASP A 105 5.202 1.097 -7.007 1.00 51.11 C ATOM 1632 OD1 ASP A 105 5.830 1.219 -5.929 1.00 14.45 O ATOM 1633 OD2 ASP A 105 5.764 1.262 -8.116 1.00 54.53 O ATOM 0 H ASP A 105 1.262 0.684 -6.507 1.00 33.33 H new ATOM 0 HA ASP A 105 3.294 2.388 -5.528 1.00 74.05 H new ATOM 0 HB2 ASP A 105 3.519 -0.044 -6.268 1.00 74.14 H new ATOM 0 HB3 ASP A 105 3.343 0.486 -7.930 1.00 74.14 H new ATOM 1638 N VAL A 106 2.110 3.099 -8.525 1.00 75.52 N ATOM 1639 CA VAL A 106 2.019 4.134 -9.576 1.00 71.50 C ATOM 1640 C VAL A 106 1.563 5.485 -8.977 1.00 34.23 C ATOM 1641 O VAL A 106 2.153 6.535 -9.270 1.00 51.00 O ATOM 1642 CB VAL A 106 1.050 3.652 -10.726 1.00 72.34 C ATOM 1643 CG1 VAL A 106 0.655 4.786 -11.706 1.00 13.41 C ATOM 1644 CG2 VAL A 106 1.680 2.464 -11.490 1.00 42.03 C ATOM 0 H VAL A 106 1.458 2.326 -8.658 1.00 75.52 H new ATOM 0 HA VAL A 106 3.008 4.288 -10.008 1.00 71.50 H new ATOM 0 HB VAL A 106 0.126 3.328 -10.246 1.00 72.34 H new ATOM 0 HG11 VAL A 106 -0.011 4.389 -12.472 1.00 13.41 H new ATOM 0 HG12 VAL A 106 0.147 5.580 -11.158 1.00 13.41 H new ATOM 0 HG13 VAL A 106 1.552 5.188 -12.178 1.00 13.41 H new ATOM 0 HG21 VAL A 106 1.003 2.140 -12.281 1.00 42.03 H new ATOM 0 HG22 VAL A 106 2.628 2.775 -11.929 1.00 42.03 H new ATOM 0 HG23 VAL A 106 1.853 1.638 -10.800 1.00 42.03 H new ATOM 1654 N THR A 107 0.532 5.436 -8.115 1.00 2.34 N ATOM 1655 CA THR A 107 0.022 6.629 -7.407 1.00 13.10 C ATOM 1656 C THR A 107 1.050 7.134 -6.359 1.00 3.43 C ATOM 1657 O THR A 107 1.163 8.343 -6.118 1.00 0.43 O ATOM 1658 CB THR A 107 -1.357 6.320 -6.735 1.00 44.22 C ATOM 1659 OG1 THR A 107 -2.237 5.727 -7.708 1.00 31.41 O ATOM 1660 CG2 THR A 107 -2.028 7.586 -6.167 1.00 73.40 C ATOM 0 H THR A 107 0.031 4.577 -7.889 1.00 2.34 H new ATOM 0 HA THR A 107 -0.125 7.424 -8.139 1.00 13.10 H new ATOM 0 HB THR A 107 -1.171 5.637 -5.906 1.00 44.22 H new ATOM 0 HG1 THR A 107 -1.988 4.789 -7.846 1.00 31.41 H new ATOM 0 HG21 THR A 107 -2.982 7.319 -5.711 1.00 73.40 H new ATOM 0 HG22 THR A 107 -1.380 8.035 -5.415 1.00 73.40 H new ATOM 0 HG23 THR A 107 -2.198 8.300 -6.973 1.00 73.40 H new ATOM 1668 N CYS A 108 1.828 6.190 -5.791 1.00 12.15 N ATOM 1669 CA CYS A 108 2.894 6.488 -4.816 1.00 12.12 C ATOM 1670 C CYS A 108 4.078 7.198 -5.502 1.00 3.54 C ATOM 1671 O CYS A 108 4.721 8.047 -4.892 1.00 31.02 O ATOM 1672 CB CYS A 108 3.367 5.195 -4.104 1.00 72.23 C ATOM 1673 SG CYS A 108 2.129 4.454 -3.012 1.00 21.42 S ATOM 0 H CYS A 108 1.733 5.196 -5.997 1.00 12.15 H new ATOM 0 HA CYS A 108 2.485 7.160 -4.061 1.00 12.12 H new ATOM 0 HB2 CYS A 108 3.655 4.463 -4.858 1.00 72.23 H new ATOM 0 HB3 CYS A 108 4.260 5.420 -3.522 1.00 72.23 H new ATOM 0 HG CYS A 108 1.160 3.962 -3.725 1.00 21.42 H new ATOM 1679 N LYS A 109 4.343 6.849 -6.781 1.00 23.34 N ATOM 1680 CA LYS A 109 5.374 7.521 -7.605 1.00 2.43 C ATOM 1681 C LYS A 109 4.926 8.943 -7.953 1.00 41.33 C ATOM 1682 O LYS A 109 5.734 9.860 -7.934 1.00 10.53 O ATOM 1683 CB LYS A 109 5.698 6.703 -8.909 1.00 13.04 C ATOM 1684 CG LYS A 109 6.974 5.831 -8.837 1.00 3.34 C ATOM 1685 CD LYS A 109 6.909 4.736 -7.755 1.00 32.22 C ATOM 1686 CE LYS A 109 8.203 3.913 -7.672 1.00 63.00 C ATOM 1687 NZ LYS A 109 8.077 2.800 -6.696 1.00 72.23 N ATOM 0 H LYS A 109 3.852 6.099 -7.269 1.00 23.34 H new ATOM 0 HA LYS A 109 6.292 7.574 -7.019 1.00 2.43 H new ATOM 0 HB2 LYS A 109 4.849 6.058 -9.135 1.00 13.04 H new ATOM 0 HB3 LYS A 109 5.800 7.400 -9.741 1.00 13.04 H new ATOM 0 HG2 LYS A 109 7.140 5.363 -9.807 1.00 3.34 H new ATOM 0 HG3 LYS A 109 7.833 6.473 -8.642 1.00 3.34 H new ATOM 0 HD2 LYS A 109 6.713 5.197 -6.787 1.00 32.22 H new ATOM 0 HD3 LYS A 109 6.072 4.070 -7.966 1.00 32.22 H new ATOM 0 HE2 LYS A 109 8.443 3.510 -8.656 1.00 63.00 H new ATOM 0 HE3 LYS A 109 9.030 4.561 -7.382 1.00 63.00 H new ATOM 0 HZ1 LYS A 109 8.671 2.998 -5.865 1.00 72.23 H new ATOM 0 HZ2 LYS A 109 7.084 2.710 -6.399 1.00 72.23 H new ATOM 0 HZ3 LYS A 109 8.388 1.912 -7.140 1.00 72.23 H new ATOM 1701 N THR A 110 3.623 9.098 -8.256 1.00 54.14 N ATOM 1702 CA THR A 110 3.031 10.395 -8.625 1.00 60.24 C ATOM 1703 C THR A 110 3.173 11.418 -7.479 1.00 10.31 C ATOM 1704 O THR A 110 3.700 12.520 -7.677 1.00 34.05 O ATOM 1705 CB THR A 110 1.525 10.228 -8.993 1.00 3.24 C ATOM 1706 OG1 THR A 110 1.394 9.199 -9.982 1.00 13.51 O ATOM 1707 CG2 THR A 110 0.905 11.537 -9.523 1.00 60.00 C ATOM 0 H THR A 110 2.954 8.328 -8.251 1.00 54.14 H new ATOM 0 HA THR A 110 3.573 10.768 -9.494 1.00 60.24 H new ATOM 0 HB THR A 110 0.987 9.957 -8.085 1.00 3.24 H new ATOM 0 HG1 THR A 110 1.566 8.326 -9.571 1.00 13.51 H new ATOM 0 HG21 THR A 110 -0.144 11.370 -9.766 1.00 60.00 H new ATOM 0 HG22 THR A 110 0.982 12.311 -8.760 1.00 60.00 H new ATOM 0 HG23 THR A 110 1.438 11.856 -10.419 1.00 60.00 H new ATOM 1715 N VAL A 111 2.715 11.013 -6.274 1.00 10.25 N ATOM 1716 CA VAL A 111 2.736 11.868 -5.076 1.00 2.30 C ATOM 1717 C VAL A 111 4.185 12.150 -4.616 1.00 53.05 C ATOM 1718 O VAL A 111 4.482 13.243 -4.108 1.00 75.44 O ATOM 1719 CB VAL A 111 1.867 11.267 -3.902 1.00 3.24 C ATOM 1720 CG1 VAL A 111 0.373 11.148 -4.307 1.00 32.42 C ATOM 1721 CG2 VAL A 111 2.412 9.906 -3.412 1.00 43.13 C ATOM 0 H VAL A 111 2.322 10.086 -6.109 1.00 10.25 H new ATOM 0 HA VAL A 111 2.281 12.819 -5.353 1.00 2.30 H new ATOM 0 HB VAL A 111 1.939 11.966 -3.069 1.00 3.24 H new ATOM 0 HG11 VAL A 111 -0.197 10.731 -3.477 1.00 32.42 H new ATOM 0 HG12 VAL A 111 -0.017 12.135 -4.555 1.00 32.42 H new ATOM 0 HG13 VAL A 111 0.282 10.494 -5.174 1.00 32.42 H new ATOM 0 HG21 VAL A 111 1.783 9.531 -2.605 1.00 43.13 H new ATOM 0 HG22 VAL A 111 2.406 9.194 -4.237 1.00 43.13 H new ATOM 0 HG23 VAL A 111 3.432 10.032 -3.048 1.00 43.13 H new ATOM 1731 N ALA A 112 5.082 11.157 -4.835 1.00 63.04 N ATOM 1732 CA ALA A 112 6.521 11.292 -4.549 1.00 52.41 C ATOM 1733 C ALA A 112 7.172 12.318 -5.492 1.00 43.34 C ATOM 1734 O ALA A 112 7.981 13.132 -5.055 1.00 62.54 O ATOM 1735 CB ALA A 112 7.223 9.932 -4.669 1.00 11.11 C ATOM 0 H ALA A 112 4.824 10.246 -5.214 1.00 63.04 H new ATOM 0 HA ALA A 112 6.632 11.651 -3.526 1.00 52.41 H new ATOM 0 HB1 ALA A 112 8.285 10.051 -4.454 1.00 11.11 H new ATOM 0 HB2 ALA A 112 6.785 9.232 -3.957 1.00 11.11 H new ATOM 0 HB3 ALA A 112 7.098 9.546 -5.681 1.00 11.11 H new ATOM 1741 N ASN A 113 6.768 12.285 -6.783 1.00 53.12 N ATOM 1742 CA ASN A 113 7.310 13.181 -7.836 1.00 13.40 C ATOM 1743 C ASN A 113 6.901 14.647 -7.604 1.00 65.40 C ATOM 1744 O ASN A 113 7.597 15.562 -8.058 1.00 10.13 O ATOM 1745 CB ASN A 113 6.880 12.710 -9.264 1.00 41.34 C ATOM 1746 CG ASN A 113 7.654 11.478 -9.768 1.00 64.03 C ATOM 1747 OD1 ASN A 113 8.827 11.278 -9.438 1.00 42.22 O ATOM 1748 ND2 ASN A 113 7.008 10.648 -10.577 1.00 23.31 N ATOM 0 H ASN A 113 6.058 11.638 -7.126 1.00 53.12 H new ATOM 0 HA ASN A 113 8.397 13.124 -7.772 1.00 13.40 H new ATOM 0 HB2 ASN A 113 5.814 12.480 -9.256 1.00 41.34 H new ATOM 0 HB3 ASN A 113 7.024 13.531 -9.966 1.00 41.34 H new ATOM 0 HD21 ASN A 113 7.480 9.821 -10.942 1.00 23.31 H new ATOM 0 HD22 ASN A 113 6.039 10.837 -10.834 1.00 23.31 H new ATOM 1755 N MET A 114 5.772 14.860 -6.907 1.00 54.35 N ATOM 1756 CA MET A 114 5.301 16.217 -6.544 1.00 31.00 C ATOM 1757 C MET A 114 6.225 16.847 -5.481 1.00 65.50 C ATOM 1758 O MET A 114 6.674 17.989 -5.627 1.00 62.20 O ATOM 1759 CB MET A 114 3.844 16.188 -6.012 1.00 61.23 C ATOM 1760 CG MET A 114 2.803 15.601 -6.977 1.00 53.41 C ATOM 1761 SD MET A 114 1.102 15.871 -6.412 1.00 22.30 S ATOM 1762 CE MET A 114 1.159 15.298 -4.707 1.00 63.04 C ATOM 0 H MET A 114 5.163 14.110 -6.580 1.00 54.35 H new ATOM 0 HA MET A 114 5.327 16.823 -7.450 1.00 31.00 H new ATOM 0 HB2 MET A 114 3.824 15.611 -5.088 1.00 61.23 H new ATOM 0 HB3 MET A 114 3.547 17.206 -5.759 1.00 61.23 H new ATOM 0 HG2 MET A 114 2.931 16.051 -7.962 1.00 53.41 H new ATOM 0 HG3 MET A 114 2.979 14.531 -7.090 1.00 53.41 H new ATOM 0 HE1 MET A 114 0.245 14.750 -4.477 1.00 63.04 H new ATOM 0 HE2 MET A 114 2.019 14.642 -4.572 1.00 63.04 H new ATOM 0 HE3 MET A 114 1.247 16.154 -4.038 1.00 63.04 H new ATOM 1772 N ILE A 115 6.509 16.067 -4.421 1.00 24.23 N ATOM 1773 CA ILE A 115 7.336 16.522 -3.274 1.00 10.54 C ATOM 1774 C ILE A 115 8.849 16.340 -3.535 1.00 61.11 C ATOM 1775 O ILE A 115 9.677 16.752 -2.719 1.00 5.11 O ATOM 1776 CB ILE A 115 6.936 15.755 -1.955 1.00 22.54 C ATOM 1777 CG1 ILE A 115 7.260 14.226 -2.076 1.00 73.22 C ATOM 1778 CG2 ILE A 115 5.439 15.988 -1.623 1.00 55.24 C ATOM 1779 CD1 ILE A 115 7.081 13.425 -0.804 1.00 13.33 C ATOM 0 H ILE A 115 6.176 15.107 -4.330 1.00 24.23 H new ATOM 0 HA ILE A 115 7.139 17.587 -3.151 1.00 10.54 H new ATOM 0 HB ILE A 115 7.530 16.154 -1.132 1.00 22.54 H new ATOM 0 HG12 ILE A 115 6.623 13.796 -2.849 1.00 73.22 H new ATOM 0 HG13 ILE A 115 8.290 14.115 -2.414 1.00 73.22 H new ATOM 0 HG21 ILE A 115 5.181 15.451 -0.710 1.00 55.24 H new ATOM 0 HG22 ILE A 115 5.259 17.054 -1.481 1.00 55.24 H new ATOM 0 HG23 ILE A 115 4.823 15.623 -2.445 1.00 55.24 H new ATOM 0 HD11 ILE A 115 7.330 12.381 -0.993 1.00 13.33 H new ATOM 0 HD12 ILE A 115 7.738 13.820 -0.030 1.00 13.33 H new ATOM 0 HD13 ILE A 115 6.045 13.496 -0.472 1.00 13.33 H new ATOM 1791 N ARG A 116 9.174 15.720 -4.681 1.00 35.31 N ATOM 1792 CA ARG A 116 10.547 15.376 -5.096 1.00 31.13 C ATOM 1793 C ARG A 116 11.400 16.642 -5.294 1.00 73.34 C ATOM 1794 O ARG A 116 11.321 17.307 -6.331 1.00 45.34 O ATOM 1795 CB ARG A 116 10.466 14.541 -6.400 1.00 11.53 C ATOM 1796 CG ARG A 116 11.789 14.002 -6.982 1.00 0.21 C ATOM 1797 CD ARG A 116 11.527 13.139 -8.233 1.00 34.14 C ATOM 1798 NE ARG A 116 12.762 12.631 -8.858 1.00 61.53 N ATOM 1799 CZ ARG A 116 12.790 11.826 -9.941 1.00 3.11 C ATOM 1800 NH1 ARG A 116 11.660 11.424 -10.525 1.00 25.31 N ATOM 1801 NH2 ARG A 116 13.959 11.439 -10.436 1.00 74.44 N ATOM 0 H ARG A 116 8.472 15.436 -5.364 1.00 35.31 H new ATOM 0 HA ARG A 116 11.033 14.790 -4.316 1.00 31.13 H new ATOM 0 HB2 ARG A 116 9.809 13.691 -6.215 1.00 11.53 H new ATOM 0 HB3 ARG A 116 9.988 15.154 -7.163 1.00 11.53 H new ATOM 0 HG2 ARG A 116 12.444 14.834 -7.240 1.00 0.21 H new ATOM 0 HG3 ARG A 116 12.308 13.410 -6.229 1.00 0.21 H new ATOM 0 HD2 ARG A 116 10.893 12.296 -7.958 1.00 34.14 H new ATOM 0 HD3 ARG A 116 10.974 13.729 -8.964 1.00 34.14 H new ATOM 0 HE ARG A 116 13.653 12.906 -8.445 1.00 61.53 H new ATOM 0 HH11 ARG A 116 10.759 11.725 -10.154 1.00 25.31 H new ATOM 0 HH12 ARG A 116 11.697 10.816 -11.343 1.00 25.31 H new ATOM 0 HH21 ARG A 116 14.826 11.750 -9.998 1.00 74.44 H new ATOM 0 HH22 ARG A 116 13.990 10.831 -11.254 1.00 74.44 H new ATOM 1815 N GLY A 117 12.156 16.992 -4.248 1.00 65.11 N ATOM 1816 CA GLY A 117 13.131 18.082 -4.301 1.00 42.22 C ATOM 1817 C GLY A 117 14.557 17.537 -4.213 1.00 12.23 C ATOM 1818 O GLY A 117 15.064 17.027 -5.230 1.00 21.54 O ATOM 1819 OXT GLY A 117 15.180 17.604 -3.124 1.00 37.94 O ATOM 0 H GLY A 117 12.108 16.527 -3.342 1.00 65.11 H new ATOM 0 HA2 GLY A 117 13.007 18.642 -5.228 1.00 42.22 H new ATOM 0 HA3 GLY A 117 12.951 18.778 -3.481 1.00 42.22 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 16.694 -15.003 15.593 1.00 24.41 N ATOM 1825 CA SER B 2 17.922 -14.457 14.982 1.00 21.13 C ATOM 1826 C SER B 2 17.656 -13.059 14.400 1.00 64.33 C ATOM 1827 O SER B 2 16.641 -12.845 13.729 1.00 50.32 O ATOM 1828 CB SER B 2 18.421 -15.425 13.891 1.00 44.15 C ATOM 1829 OG SER B 2 18.590 -16.733 14.423 1.00 73.02 O ATOM 0 HA SER B 2 18.694 -14.357 15.745 1.00 21.13 H new ATOM 0 HB2 SER B 2 17.709 -15.451 13.066 1.00 44.15 H new ATOM 0 HB3 SER B 2 19.367 -15.067 13.484 1.00 44.15 H new ATOM 0 HG SER B 2 17.991 -16.854 15.189 1.00 73.02 H new ATOM 1837 N LEU B 3 18.576 -12.113 14.665 1.00 32.32 N ATOM 1838 CA LEU B 3 18.443 -10.719 14.206 1.00 75.22 C ATOM 1839 C LEU B 3 18.765 -10.616 12.700 1.00 60.21 C ATOM 1840 O LEU B 3 19.894 -10.907 12.281 1.00 41.21 O ATOM 1841 CB LEU B 3 19.403 -9.803 15.013 1.00 4.41 C ATOM 1842 CG LEU B 3 19.216 -9.806 16.562 1.00 63.14 C ATOM 1843 CD1 LEU B 3 20.359 -9.037 17.257 1.00 61.13 C ATOM 1844 CD2 LEU B 3 17.832 -9.247 16.971 1.00 34.31 C ATOM 0 H LEU B 3 19.426 -12.292 15.199 1.00 32.32 H new ATOM 0 HA LEU B 3 17.415 -10.395 14.368 1.00 75.22 H new ATOM 0 HB2 LEU B 3 20.428 -10.100 14.791 1.00 4.41 H new ATOM 0 HB3 LEU B 3 19.283 -8.780 14.655 1.00 4.41 H new ATOM 0 HG LEU B 3 19.256 -10.843 16.897 1.00 63.14 H new ATOM 0 HD11 LEU B 3 20.205 -9.054 18.336 1.00 61.13 H new ATOM 0 HD12 LEU B 3 21.312 -9.509 17.019 1.00 61.13 H new ATOM 0 HD13 LEU B 3 20.368 -8.004 16.908 1.00 61.13 H new ATOM 0 HD21 LEU B 3 17.739 -9.265 18.057 1.00 34.31 H new ATOM 0 HD22 LEU B 3 17.734 -8.221 16.615 1.00 34.31 H new ATOM 0 HD23 LEU B 3 17.047 -9.860 16.529 1.00 34.31 H new ATOM 1856 N VAL B 4 17.771 -10.217 11.894 1.00 31.34 N ATOM 1857 CA VAL B 4 17.977 -9.890 10.475 1.00 34.41 C ATOM 1858 C VAL B 4 18.495 -8.441 10.370 1.00 13.55 C ATOM 1859 O VAL B 4 17.914 -7.501 10.941 1.00 73.05 O ATOM 1860 CB VAL B 4 16.679 -10.117 9.606 1.00 42.11 C ATOM 1861 CG1 VAL B 4 16.289 -11.615 9.591 1.00 22.23 C ATOM 1862 CG2 VAL B 4 15.500 -9.245 10.091 1.00 11.22 C ATOM 0 H VAL B 4 16.805 -10.112 12.205 1.00 31.34 H new ATOM 0 HA VAL B 4 18.722 -10.571 10.063 1.00 34.41 H new ATOM 0 HB VAL B 4 16.909 -9.808 8.586 1.00 42.11 H new ATOM 0 HG11 VAL B 4 15.392 -11.751 8.987 1.00 22.23 H new ATOM 0 HG12 VAL B 4 17.105 -12.199 9.166 1.00 22.23 H new ATOM 0 HG13 VAL B 4 16.095 -11.951 10.610 1.00 22.23 H new ATOM 0 HG21 VAL B 4 14.627 -9.433 9.465 1.00 11.22 H new ATOM 0 HG22 VAL B 4 15.265 -9.494 11.126 1.00 11.22 H new ATOM 0 HG23 VAL B 4 15.775 -8.192 10.024 1.00 11.22 H new ATOM 1872 N LYS B 5 19.624 -8.286 9.685 1.00 70.41 N ATOM 1873 CA LYS B 5 20.355 -7.020 9.605 1.00 43.51 C ATOM 1874 C LYS B 5 19.869 -6.215 8.391 1.00 72.52 C ATOM 1875 O LYS B 5 20.391 -6.354 7.278 1.00 54.42 O ATOM 1876 CB LYS B 5 21.873 -7.311 9.542 1.00 31.21 C ATOM 1877 CG LYS B 5 22.408 -8.155 10.722 1.00 54.34 C ATOM 1878 CD LYS B 5 23.947 -8.277 10.717 1.00 20.11 C ATOM 1879 CE LYS B 5 24.469 -9.154 11.862 1.00 65.41 C ATOM 1880 NZ LYS B 5 25.955 -9.146 11.933 1.00 15.42 N ATOM 0 H LYS B 5 20.064 -9.043 9.163 1.00 70.41 H new ATOM 0 HA LYS B 5 20.166 -6.416 10.492 1.00 43.51 H new ATOM 0 HB2 LYS B 5 22.093 -7.831 8.609 1.00 31.21 H new ATOM 0 HB3 LYS B 5 22.412 -6.364 9.514 1.00 31.21 H new ATOM 0 HG2 LYS B 5 22.086 -7.704 11.661 1.00 54.34 H new ATOM 0 HG3 LYS B 5 21.968 -9.152 10.679 1.00 54.34 H new ATOM 0 HD2 LYS B 5 24.272 -8.696 9.765 1.00 20.11 H new ATOM 0 HD3 LYS B 5 24.388 -7.283 10.795 1.00 20.11 H new ATOM 0 HE2 LYS B 5 24.058 -8.799 12.807 1.00 65.41 H new ATOM 0 HE3 LYS B 5 24.117 -10.177 11.725 1.00 65.41 H new ATOM 0 HZ1 LYS B 5 26.268 -9.750 12.719 1.00 15.42 H new ATOM 0 HZ2 LYS B 5 26.347 -9.508 11.040 1.00 15.42 H new ATOM 0 HZ3 LYS B 5 26.290 -8.174 12.089 1.00 15.42 H new ATOM 1894 N LEU B 6 18.818 -5.424 8.618 1.00 52.31 N ATOM 1895 CA LEU B 6 18.199 -4.583 7.589 1.00 4.11 C ATOM 1896 C LEU B 6 18.979 -3.273 7.460 1.00 54.40 C ATOM 1897 O LEU B 6 18.778 -2.336 8.245 1.00 22.25 O ATOM 1898 CB LEU B 6 16.716 -4.317 7.944 1.00 61.01 C ATOM 1899 CG LEU B 6 15.822 -5.585 8.083 1.00 43.23 C ATOM 1900 CD1 LEU B 6 14.391 -5.197 8.487 1.00 72.14 C ATOM 1901 CD2 LEU B 6 15.836 -6.439 6.790 1.00 22.41 C ATOM 0 H LEU B 6 18.368 -5.348 9.530 1.00 52.31 H new ATOM 0 HA LEU B 6 18.229 -5.098 6.629 1.00 4.11 H new ATOM 0 HB2 LEU B 6 16.679 -3.763 8.882 1.00 61.01 H new ATOM 0 HB3 LEU B 6 16.287 -3.673 7.176 1.00 61.01 H new ATOM 0 HG LEU B 6 16.240 -6.204 8.877 1.00 43.23 H new ATOM 0 HD11 LEU B 6 13.782 -6.097 8.579 1.00 72.14 H new ATOM 0 HD12 LEU B 6 14.412 -4.674 9.443 1.00 72.14 H new ATOM 0 HD13 LEU B 6 13.962 -4.545 7.726 1.00 72.14 H new ATOM 0 HD21 LEU B 6 15.201 -7.315 6.925 1.00 22.41 H new ATOM 0 HD22 LEU B 6 15.461 -5.844 5.957 1.00 22.41 H new ATOM 0 HD23 LEU B 6 16.856 -6.760 6.577 1.00 22.41 H new ATOM 1913 N GLU B 7 19.915 -3.249 6.511 1.00 21.21 N ATOM 1914 CA GLU B 7 20.706 -2.061 6.204 1.00 32.10 C ATOM 1915 C GLU B 7 19.864 -1.105 5.333 1.00 74.22 C ATOM 1916 O GLU B 7 19.219 -1.542 4.385 1.00 54.43 O ATOM 1917 CB GLU B 7 22.010 -2.461 5.475 1.00 24.40 C ATOM 1918 CG GLU B 7 22.940 -1.272 5.153 1.00 74.34 C ATOM 1919 CD GLU B 7 24.143 -1.667 4.290 1.00 32.30 C ATOM 1920 OE1 GLU B 7 24.096 -1.462 3.055 1.00 3.11 O ATOM 1921 OE2 GLU B 7 25.130 -2.194 4.841 1.00 43.24 O ATOM 0 H GLU B 7 20.145 -4.057 5.932 1.00 21.21 H new ATOM 0 HA GLU B 7 20.980 -1.553 7.129 1.00 32.10 H new ATOM 0 HB2 GLU B 7 22.553 -3.177 6.091 1.00 24.40 H new ATOM 0 HB3 GLU B 7 21.753 -2.970 4.546 1.00 24.40 H new ATOM 0 HG2 GLU B 7 22.368 -0.500 4.637 1.00 74.34 H new ATOM 0 HG3 GLU B 7 23.297 -0.835 6.085 1.00 74.34 H new ATOM 1928 N SER B 8 19.869 0.181 5.681 1.00 23.41 N ATOM 1929 CA SER B 8 19.150 1.231 4.943 1.00 24.11 C ATOM 1930 C SER B 8 20.001 1.768 3.777 1.00 65.31 C ATOM 1931 O SER B 8 21.160 1.369 3.608 1.00 43.04 O ATOM 1932 CB SER B 8 18.800 2.358 5.934 1.00 11.02 C ATOM 1933 OG SER B 8 19.952 2.830 6.614 1.00 61.03 O ATOM 0 H SER B 8 20.377 0.532 6.493 1.00 23.41 H new ATOM 0 HA SER B 8 18.238 0.821 4.509 1.00 24.11 H new ATOM 0 HB2 SER B 8 18.330 3.182 5.398 1.00 11.02 H new ATOM 0 HB3 SER B 8 18.072 1.993 6.659 1.00 11.02 H new ATOM 0 HG SER B 8 20.443 3.450 6.035 1.00 61.03 H new ATOM 1939 N SER B 9 19.410 2.673 2.983 1.00 5.42 N ATOM 1940 CA SER B 9 20.108 3.389 1.894 1.00 55.25 C ATOM 1941 C SER B 9 21.161 4.366 2.462 1.00 51.13 C ATOM 1942 O SER B 9 22.132 4.722 1.783 1.00 44.10 O ATOM 1943 CB SER B 9 19.060 4.120 1.018 1.00 53.24 C ATOM 1944 OG SER B 9 18.251 4.990 1.793 1.00 15.31 O ATOM 0 H SER B 9 18.428 2.933 3.075 1.00 5.42 H new ATOM 0 HA SER B 9 20.647 2.674 1.272 1.00 55.25 H new ATOM 0 HB2 SER B 9 19.568 4.690 0.240 1.00 53.24 H new ATOM 0 HB3 SER B 9 18.430 3.387 0.515 1.00 53.24 H new ATOM 0 HG SER B 9 17.601 5.437 1.211 1.00 15.31 H new ATOM 1950 N ASP B 10 20.956 4.773 3.735 1.00 33.04 N ATOM 1951 CA ASP B 10 21.908 5.604 4.513 1.00 73.24 C ATOM 1952 C ASP B 10 23.005 4.711 5.178 1.00 23.12 C ATOM 1953 O ASP B 10 23.844 5.193 5.962 1.00 14.01 O ATOM 1954 CB ASP B 10 21.095 6.404 5.561 1.00 4.12 C ATOM 1955 CG ASP B 10 21.921 7.427 6.370 1.00 24.01 C ATOM 1956 OD1 ASP B 10 22.199 7.198 7.567 1.00 13.40 O ATOM 1957 OD2 ASP B 10 22.294 8.469 5.806 1.00 43.23 O ATOM 0 H ASP B 10 20.115 4.532 4.259 1.00 33.04 H new ATOM 0 HA ASP B 10 22.434 6.300 3.859 1.00 73.24 H new ATOM 0 HB2 ASP B 10 20.288 6.930 5.051 1.00 4.12 H new ATOM 0 HB3 ASP B 10 20.630 5.702 6.254 1.00 4.12 H new ATOM 1962 N GLU B 11 22.966 3.395 4.848 1.00 55.23 N ATOM 1963 CA GLU B 11 23.969 2.371 5.239 1.00 14.22 C ATOM 1964 C GLU B 11 23.958 2.067 6.753 1.00 44.35 C ATOM 1965 O GLU B 11 24.919 1.504 7.287 1.00 54.02 O ATOM 1966 CB GLU B 11 25.397 2.754 4.734 1.00 73.21 C ATOM 1967 CG GLU B 11 25.519 2.898 3.202 1.00 40.33 C ATOM 1968 CD GLU B 11 26.957 3.214 2.745 1.00 41.51 C ATOM 1969 OE1 GLU B 11 27.681 2.295 2.313 1.00 43.34 O ATOM 1970 OE2 GLU B 11 27.379 4.383 2.839 1.00 43.00 O ATOM 0 H GLU B 11 22.211 3.005 4.284 1.00 55.23 H new ATOM 0 HA GLU B 11 23.678 1.445 4.744 1.00 14.22 H new ATOM 0 HB2 GLU B 11 25.692 3.695 5.199 1.00 73.21 H new ATOM 0 HB3 GLU B 11 26.103 1.996 5.072 1.00 73.21 H new ATOM 0 HG2 GLU B 11 25.186 1.975 2.727 1.00 40.33 H new ATOM 0 HG3 GLU B 11 24.852 3.690 2.862 1.00 40.33 H new ATOM 1977 N LYS B 12 22.847 2.403 7.434 1.00 12.02 N ATOM 1978 CA LYS B 12 22.661 2.073 8.859 1.00 11.01 C ATOM 1979 C LYS B 12 22.028 0.684 8.983 1.00 60.35 C ATOM 1980 O LYS B 12 20.942 0.443 8.451 1.00 5.15 O ATOM 1981 CB LYS B 12 21.788 3.143 9.563 1.00 20.20 C ATOM 1982 CG LYS B 12 22.419 4.547 9.590 1.00 63.34 C ATOM 1983 CD LYS B 12 23.763 4.594 10.355 1.00 11.21 C ATOM 1984 CE LYS B 12 24.429 5.976 10.296 1.00 3.41 C ATOM 1985 NZ LYS B 12 24.701 6.398 8.899 1.00 72.33 N ATOM 0 H LYS B 12 22.062 2.905 7.018 1.00 12.02 H new ATOM 0 HA LYS B 12 23.633 2.065 9.352 1.00 11.01 H new ATOM 0 HB2 LYS B 12 20.823 3.199 9.059 1.00 20.20 H new ATOM 0 HB3 LYS B 12 21.594 2.823 10.587 1.00 20.20 H new ATOM 0 HG2 LYS B 12 22.578 4.887 8.567 1.00 63.34 H new ATOM 0 HG3 LYS B 12 21.720 5.244 10.052 1.00 63.34 H new ATOM 0 HD2 LYS B 12 23.594 4.321 11.397 1.00 11.21 H new ATOM 0 HD3 LYS B 12 24.441 3.850 9.937 1.00 11.21 H new ATOM 0 HE2 LYS B 12 23.785 6.711 10.779 1.00 3.41 H new ATOM 0 HE3 LYS B 12 25.363 5.954 10.857 1.00 3.41 H new ATOM 0 HZ1 LYS B 12 25.353 7.208 8.902 1.00 72.33 H new ATOM 0 HZ2 LYS B 12 25.131 5.609 8.376 1.00 72.33 H new ATOM 0 HZ3 LYS B 12 23.809 6.673 8.440 1.00 72.33 H new ATOM 1999 N VAL B 13 22.726 -0.214 9.687 1.00 40.23 N ATOM 2000 CA VAL B 13 22.335 -1.616 9.851 1.00 3.42 C ATOM 2001 C VAL B 13 21.455 -1.761 11.104 1.00 22.14 C ATOM 2002 O VAL B 13 21.946 -1.619 12.228 1.00 21.42 O ATOM 2003 CB VAL B 13 23.619 -2.521 9.960 1.00 20.23 C ATOM 2004 CG1 VAL B 13 23.267 -4.021 10.061 1.00 73.44 C ATOM 2005 CG2 VAL B 13 24.578 -2.241 8.778 1.00 1.33 C ATOM 0 H VAL B 13 23.595 0.019 10.167 1.00 40.23 H new ATOM 0 HA VAL B 13 21.761 -1.940 8.983 1.00 3.42 H new ATOM 0 HB VAL B 13 24.131 -2.260 10.887 1.00 20.23 H new ATOM 0 HG11 VAL B 13 24.184 -4.606 10.134 1.00 73.44 H new ATOM 0 HG12 VAL B 13 22.656 -4.192 10.947 1.00 73.44 H new ATOM 0 HG13 VAL B 13 22.713 -4.325 9.173 1.00 73.44 H new ATOM 0 HG21 VAL B 13 25.461 -2.874 8.868 1.00 1.33 H new ATOM 0 HG22 VAL B 13 24.070 -2.457 7.838 1.00 1.33 H new ATOM 0 HG23 VAL B 13 24.880 -1.194 8.794 1.00 1.33 H new ATOM 2015 N PHE B 14 20.150 -1.978 10.891 1.00 63.24 N ATOM 2016 CA PHE B 14 19.170 -2.195 11.964 1.00 32.23 C ATOM 2017 C PHE B 14 18.982 -3.707 12.177 1.00 21.23 C ATOM 2018 O PHE B 14 18.320 -4.382 11.376 1.00 62.30 O ATOM 2019 CB PHE B 14 17.826 -1.505 11.602 1.00 43.52 C ATOM 2020 CG PHE B 14 17.932 0.015 11.439 1.00 43.02 C ATOM 2021 CD1 PHE B 14 17.821 0.864 12.545 1.00 65.45 C ATOM 2022 CD2 PHE B 14 18.156 0.594 10.189 1.00 22.01 C ATOM 2023 CE1 PHE B 14 17.924 2.233 12.400 1.00 50.40 C ATOM 2024 CE2 PHE B 14 18.257 1.964 10.048 1.00 52.54 C ATOM 2025 CZ PHE B 14 18.145 2.780 11.151 1.00 63.40 C ATOM 0 H PHE B 14 19.740 -2.008 9.957 1.00 63.24 H new ATOM 0 HA PHE B 14 19.531 -1.754 12.893 1.00 32.23 H new ATOM 0 HB2 PHE B 14 17.447 -1.934 10.675 1.00 43.52 H new ATOM 0 HB3 PHE B 14 17.094 -1.727 12.379 1.00 43.52 H new ATOM 0 HD1 PHE B 14 17.653 0.443 13.525 1.00 65.45 H new ATOM 0 HD2 PHE B 14 18.252 -0.039 9.319 1.00 22.01 H new ATOM 0 HE1 PHE B 14 17.832 2.876 13.263 1.00 50.40 H new ATOM 0 HE2 PHE B 14 18.424 2.395 9.072 1.00 52.54 H new ATOM 0 HZ PHE B 14 18.230 3.851 11.040 1.00 63.40 H new ATOM 2035 N GLU B 15 19.610 -4.229 13.239 1.00 44.02 N ATOM 2036 CA GLU B 15 19.576 -5.658 13.588 1.00 1.23 C ATOM 2037 C GLU B 15 18.285 -5.961 14.375 1.00 12.40 C ATOM 2038 O GLU B 15 18.291 -6.040 15.611 1.00 41.13 O ATOM 2039 CB GLU B 15 20.841 -6.036 14.406 1.00 21.43 C ATOM 2040 CG GLU B 15 22.172 -5.637 13.737 1.00 52.14 C ATOM 2041 CD GLU B 15 23.396 -6.001 14.591 1.00 62.24 C ATOM 2042 OE1 GLU B 15 23.644 -5.323 15.611 1.00 3.42 O ATOM 2043 OE2 GLU B 15 24.116 -6.958 14.252 1.00 71.10 O ATOM 0 H GLU B 15 20.162 -3.667 13.887 1.00 44.02 H new ATOM 0 HA GLU B 15 19.576 -6.261 12.680 1.00 1.23 H new ATOM 0 HB2 GLU B 15 20.782 -5.559 15.385 1.00 21.43 H new ATOM 0 HB3 GLU B 15 20.841 -7.113 14.575 1.00 21.43 H new ATOM 0 HG2 GLU B 15 22.250 -6.131 12.768 1.00 52.14 H new ATOM 0 HG3 GLU B 15 22.172 -4.563 13.548 1.00 52.14 H new ATOM 2050 N ILE B 16 17.172 -6.058 13.645 1.00 1.33 N ATOM 2051 CA ILE B 16 15.837 -6.316 14.220 1.00 11.41 C ATOM 2052 C ILE B 16 15.560 -7.827 14.213 1.00 61.42 C ATOM 2053 O ILE B 16 16.094 -8.553 13.374 1.00 44.43 O ATOM 2054 CB ILE B 16 14.724 -5.526 13.421 1.00 73.11 C ATOM 2055 CG1 ILE B 16 13.321 -5.664 14.095 1.00 0.45 C ATOM 2056 CG2 ILE B 16 14.688 -5.966 11.938 1.00 63.22 C ATOM 2057 CD1 ILE B 16 12.201 -4.903 13.414 1.00 4.12 C ATOM 0 H ILE B 16 17.165 -5.960 12.630 1.00 1.33 H new ATOM 0 HA ILE B 16 15.814 -5.962 15.250 1.00 11.41 H new ATOM 0 HB ILE B 16 14.988 -4.469 13.448 1.00 73.11 H new ATOM 0 HG12 ILE B 16 13.054 -6.720 14.128 1.00 0.45 H new ATOM 0 HG13 ILE B 16 13.396 -5.322 15.127 1.00 0.45 H new ATOM 0 HG21 ILE B 16 13.914 -5.407 11.411 1.00 63.22 H new ATOM 0 HG22 ILE B 16 15.656 -5.769 11.476 1.00 63.22 H new ATOM 0 HG23 ILE B 16 14.469 -7.032 11.880 1.00 63.22 H new ATOM 0 HD11 ILE B 16 11.270 -5.063 13.957 1.00 4.12 H new ATOM 0 HD12 ILE B 16 12.437 -3.839 13.405 1.00 4.12 H new ATOM 0 HD13 ILE B 16 12.089 -5.259 12.390 1.00 4.12 H new ATOM 2069 N GLU B 17 14.747 -8.287 15.173 1.00 24.21 N ATOM 2070 CA GLU B 17 14.401 -9.702 15.338 1.00 60.43 C ATOM 2071 C GLU B 17 13.590 -10.188 14.114 1.00 63.34 C ATOM 2072 O GLU B 17 12.715 -9.461 13.617 1.00 45.25 O ATOM 2073 CB GLU B 17 13.622 -9.895 16.686 1.00 2.45 C ATOM 2074 CG GLU B 17 14.089 -11.087 17.539 1.00 60.25 C ATOM 2075 CD GLU B 17 13.931 -12.445 16.838 1.00 31.23 C ATOM 2076 OE1 GLU B 17 14.905 -12.937 16.233 1.00 61.11 O ATOM 2077 OE2 GLU B 17 12.828 -13.017 16.881 1.00 23.30 O ATOM 0 H GLU B 17 14.307 -7.679 15.864 1.00 24.21 H new ATOM 0 HA GLU B 17 15.304 -10.310 15.389 1.00 60.43 H new ATOM 0 HB2 GLU B 17 13.717 -8.984 17.277 1.00 2.45 H new ATOM 0 HB3 GLU B 17 12.563 -10.020 16.462 1.00 2.45 H new ATOM 0 HG2 GLU B 17 15.136 -10.945 17.805 1.00 60.25 H new ATOM 0 HG3 GLU B 17 13.523 -11.100 18.470 1.00 60.25 H new ATOM 2084 N LYS B 18 13.905 -11.415 13.639 1.00 72.15 N ATOM 2085 CA LYS B 18 13.266 -12.012 12.453 1.00 52.22 C ATOM 2086 C LYS B 18 11.742 -12.135 12.642 1.00 43.33 C ATOM 2087 O LYS B 18 10.987 -11.907 11.696 1.00 3.05 O ATOM 2088 CB LYS B 18 13.862 -13.407 12.125 1.00 22.12 C ATOM 2089 CG LYS B 18 13.263 -14.062 10.853 1.00 53.22 C ATOM 2090 CD LYS B 18 13.680 -15.539 10.666 1.00 71.23 C ATOM 2091 CE LYS B 18 12.921 -16.211 9.510 1.00 25.01 C ATOM 2092 NZ LYS B 18 13.215 -17.663 9.410 1.00 0.33 N ATOM 0 H LYS B 18 14.609 -12.015 14.069 1.00 72.15 H new ATOM 0 HA LYS B 18 13.466 -11.342 11.617 1.00 52.22 H new ATOM 0 HB2 LYS B 18 14.940 -13.310 11.999 1.00 22.12 H new ATOM 0 HB3 LYS B 18 13.699 -14.070 12.975 1.00 22.12 H new ATOM 0 HG2 LYS B 18 12.176 -14.003 10.901 1.00 53.22 H new ATOM 0 HG3 LYS B 18 13.575 -13.491 9.978 1.00 53.22 H new ATOM 0 HD2 LYS B 18 14.752 -15.591 10.475 1.00 71.23 H new ATOM 0 HD3 LYS B 18 13.494 -16.088 11.589 1.00 71.23 H new ATOM 0 HE2 LYS B 18 11.850 -16.069 9.651 1.00 25.01 H new ATOM 0 HE3 LYS B 18 13.187 -15.724 8.572 1.00 25.01 H new ATOM 0 HZ1 LYS B 18 12.681 -18.072 8.617 1.00 0.33 H new ATOM 0 HZ2 LYS B 18 14.233 -17.801 9.249 1.00 0.33 H new ATOM 0 HZ3 LYS B 18 12.937 -18.135 10.294 1.00 0.33 H new ATOM 2106 N GLU B 19 11.320 -12.477 13.883 1.00 42.34 N ATOM 2107 CA GLU B 19 9.894 -12.627 14.262 1.00 40.31 C ATOM 2108 C GLU B 19 9.076 -11.353 13.938 1.00 74.41 C ATOM 2109 O GLU B 19 7.917 -11.422 13.510 1.00 63.42 O ATOM 2110 CB GLU B 19 9.795 -12.973 15.773 1.00 70.02 C ATOM 2111 CG GLU B 19 8.364 -13.109 16.325 1.00 50.30 C ATOM 2112 CD GLU B 19 8.284 -13.576 17.785 1.00 21.44 C ATOM 2113 OE1 GLU B 19 7.519 -12.975 18.572 1.00 55.31 O ATOM 2114 OE2 GLU B 19 8.995 -14.532 18.161 1.00 1.10 O ATOM 0 H GLU B 19 11.963 -12.658 14.654 1.00 42.34 H new ATOM 0 HA GLU B 19 9.466 -13.439 13.674 1.00 40.31 H new ATOM 0 HB2 GLU B 19 10.325 -13.909 15.950 1.00 70.02 H new ATOM 0 HB3 GLU B 19 10.314 -12.200 16.340 1.00 70.02 H new ATOM 0 HG2 GLU B 19 7.862 -12.146 16.237 1.00 50.30 H new ATOM 0 HG3 GLU B 19 7.813 -13.813 15.701 1.00 50.30 H new ATOM 2121 N ILE B 20 9.726 -10.197 14.113 1.00 65.10 N ATOM 2122 CA ILE B 20 9.121 -8.881 13.861 1.00 13.24 C ATOM 2123 C ILE B 20 9.120 -8.589 12.345 1.00 31.32 C ATOM 2124 O ILE B 20 8.154 -8.046 11.796 1.00 21.15 O ATOM 2125 CB ILE B 20 9.897 -7.746 14.627 1.00 33.30 C ATOM 2126 CG1 ILE B 20 10.202 -8.173 16.096 1.00 21.13 C ATOM 2127 CG2 ILE B 20 9.098 -6.424 14.593 1.00 35.15 C ATOM 2128 CD1 ILE B 20 10.898 -7.121 16.940 1.00 53.01 C ATOM 0 H ILE B 20 10.692 -10.146 14.435 1.00 65.10 H new ATOM 0 HA ILE B 20 8.095 -8.898 14.229 1.00 13.24 H new ATOM 0 HB ILE B 20 10.849 -7.583 14.121 1.00 33.30 H new ATOM 0 HG12 ILE B 20 9.264 -8.444 16.581 1.00 21.13 H new ATOM 0 HG13 ILE B 20 10.822 -9.069 16.076 1.00 21.13 H new ATOM 0 HG21 ILE B 20 9.650 -5.651 15.128 1.00 35.15 H new ATOM 0 HG22 ILE B 20 8.950 -6.115 13.558 1.00 35.15 H new ATOM 0 HG23 ILE B 20 8.129 -6.572 15.069 1.00 35.15 H new ATOM 0 HD11 ILE B 20 11.066 -7.512 17.943 1.00 53.01 H new ATOM 0 HD12 ILE B 20 11.855 -6.864 16.485 1.00 53.01 H new ATOM 0 HD13 ILE B 20 10.273 -6.230 16.998 1.00 53.01 H new ATOM 2140 N ALA B 21 10.219 -8.999 11.681 1.00 60.35 N ATOM 2141 CA ALA B 21 10.426 -8.812 10.232 1.00 21.42 C ATOM 2142 C ALA B 21 9.574 -9.780 9.383 1.00 22.21 C ATOM 2143 O ALA B 21 9.520 -9.646 8.159 1.00 21.44 O ATOM 2144 CB ALA B 21 11.917 -8.973 9.911 1.00 62.50 C ATOM 0 H ALA B 21 10.996 -9.474 12.141 1.00 60.35 H new ATOM 0 HA ALA B 21 10.098 -7.806 9.971 1.00 21.42 H new ATOM 0 HB1 ALA B 21 12.076 -8.836 8.841 1.00 62.50 H new ATOM 0 HB2 ALA B 21 12.490 -8.227 10.462 1.00 62.50 H new ATOM 0 HB3 ALA B 21 12.246 -9.971 10.202 1.00 62.50 H new ATOM 2150 N CYS B 22 8.933 -10.767 10.048 1.00 45.23 N ATOM 2151 CA CYS B 22 7.966 -11.675 9.404 1.00 11.21 C ATOM 2152 C CYS B 22 6.662 -10.928 9.051 1.00 40.10 C ATOM 2153 O CYS B 22 6.013 -11.253 8.054 1.00 51.22 O ATOM 2154 CB CYS B 22 7.671 -12.887 10.313 1.00 21.44 C ATOM 2155 SG CYS B 22 9.117 -13.922 10.659 1.00 4.35 S ATOM 0 H CYS B 22 9.072 -10.954 11.041 1.00 45.23 H new ATOM 0 HA CYS B 22 8.408 -12.041 8.477 1.00 11.21 H new ATOM 0 HB2 CYS B 22 7.260 -12.528 11.257 1.00 21.44 H new ATOM 0 HB3 CYS B 22 6.902 -13.501 9.844 1.00 21.44 H new ATOM 0 HG CYS B 22 10.109 -13.170 11.035 1.00 4.35 H new ATOM 2161 N MET B 23 6.301 -9.912 9.879 1.00 31.15 N ATOM 2162 CA MET B 23 5.112 -9.049 9.635 1.00 41.34 C ATOM 2163 C MET B 23 5.293 -8.243 8.335 1.00 23.24 C ATOM 2164 O MET B 23 4.321 -7.911 7.645 1.00 4.31 O ATOM 2165 CB MET B 23 4.862 -8.072 10.820 1.00 1.15 C ATOM 2166 CG MET B 23 4.751 -8.727 12.207 1.00 64.24 C ATOM 2167 SD MET B 23 4.079 -7.614 13.469 1.00 64.23 S ATOM 2168 CE MET B 23 5.108 -6.152 13.306 1.00 55.04 C ATOM 0 H MET B 23 6.818 -9.669 10.724 1.00 31.15 H new ATOM 0 HA MET B 23 4.246 -9.704 9.542 1.00 41.34 H new ATOM 0 HB2 MET B 23 5.673 -7.344 10.845 1.00 1.15 H new ATOM 0 HB3 MET B 23 3.943 -7.519 10.624 1.00 1.15 H new ATOM 0 HG2 MET B 23 4.116 -9.610 12.135 1.00 64.24 H new ATOM 0 HG3 MET B 23 5.737 -9.068 12.521 1.00 64.24 H new ATOM 0 HE1 MET B 23 5.233 -5.684 14.283 1.00 55.04 H new ATOM 0 HE2 MET B 23 6.084 -6.436 12.912 1.00 55.04 H new ATOM 0 HE3 MET B 23 4.633 -5.447 12.624 1.00 55.04 H new ATOM 2178 N SER B 24 6.561 -7.923 8.042 1.00 63.52 N ATOM 2179 CA SER B 24 6.971 -7.367 6.760 1.00 43.23 C ATOM 2180 C SER B 24 7.001 -8.508 5.733 1.00 15.44 C ATOM 2181 O SER B 24 7.898 -9.356 5.772 1.00 15.34 O ATOM 2182 CB SER B 24 8.353 -6.698 6.893 1.00 22.35 C ATOM 2183 OG SER B 24 8.733 -6.082 5.681 1.00 34.25 O ATOM 0 H SER B 24 7.332 -8.047 8.698 1.00 63.52 H new ATOM 0 HA SER B 24 6.268 -6.602 6.430 1.00 43.23 H new ATOM 0 HB2 SER B 24 8.327 -5.955 7.690 1.00 22.35 H new ATOM 0 HB3 SER B 24 9.097 -7.443 7.176 1.00 22.35 H new ATOM 0 HG SER B 24 7.972 -6.077 5.064 1.00 34.25 H new ATOM 2189 N VAL B 25 5.996 -8.534 4.843 1.00 63.32 N ATOM 2190 CA VAL B 25 5.779 -9.650 3.907 1.00 55.23 C ATOM 2191 C VAL B 25 6.911 -9.743 2.861 1.00 63.42 C ATOM 2192 O VAL B 25 7.330 -10.843 2.524 1.00 13.34 O ATOM 2193 CB VAL B 25 4.377 -9.543 3.204 1.00 23.34 C ATOM 2194 CG1 VAL B 25 4.126 -10.710 2.210 1.00 51.11 C ATOM 2195 CG2 VAL B 25 3.240 -9.441 4.253 1.00 61.44 C ATOM 0 H VAL B 25 5.312 -7.783 4.752 1.00 63.32 H new ATOM 0 HA VAL B 25 5.793 -10.569 4.494 1.00 55.23 H new ATOM 0 HB VAL B 25 4.381 -8.626 2.615 1.00 23.34 H new ATOM 0 HG11 VAL B 25 3.145 -10.592 1.750 1.00 51.11 H new ATOM 0 HG12 VAL B 25 4.893 -10.700 1.436 1.00 51.11 H new ATOM 0 HG13 VAL B 25 4.163 -11.659 2.746 1.00 51.11 H new ATOM 0 HG21 VAL B 25 2.280 -9.368 3.743 1.00 61.44 H new ATOM 0 HG22 VAL B 25 3.248 -10.328 4.886 1.00 61.44 H new ATOM 0 HG23 VAL B 25 3.392 -8.555 4.869 1.00 61.44 H new ATOM 2205 N THR B 26 7.419 -8.585 2.385 1.00 64.40 N ATOM 2206 CA THR B 26 8.516 -8.546 1.385 1.00 33.15 C ATOM 2207 C THR B 26 9.815 -9.150 1.960 1.00 13.35 C ATOM 2208 O THR B 26 10.482 -9.937 1.285 1.00 0.25 O ATOM 2209 CB THR B 26 8.783 -7.096 0.859 1.00 4.21 C ATOM 2210 OG1 THR B 26 7.587 -6.584 0.253 1.00 72.21 O ATOM 2211 CG2 THR B 26 9.934 -7.024 -0.171 1.00 61.23 C ATOM 0 H THR B 26 7.089 -7.664 2.675 1.00 64.40 H new ATOM 0 HA THR B 26 8.190 -9.152 0.539 1.00 33.15 H new ATOM 0 HB THR B 26 9.080 -6.497 1.720 1.00 4.21 H new ATOM 0 HG1 THR B 26 7.722 -5.646 0.004 1.00 72.21 H new ATOM 0 HG21 THR B 26 10.068 -5.992 -0.496 1.00 61.23 H new ATOM 0 HG22 THR B 26 10.856 -7.382 0.288 1.00 61.23 H new ATOM 0 HG23 THR B 26 9.691 -7.647 -1.032 1.00 61.23 H new ATOM 2219 N ILE B 27 10.137 -8.794 3.219 1.00 51.02 N ATOM 2220 CA ILE B 27 11.343 -9.292 3.918 1.00 34.32 C ATOM 2221 C ILE B 27 11.219 -10.802 4.178 1.00 31.24 C ATOM 2222 O ILE B 27 12.165 -11.551 3.929 1.00 51.42 O ATOM 2223 CB ILE B 27 11.584 -8.522 5.268 1.00 20.32 C ATOM 2224 CG1 ILE B 27 11.813 -7.005 4.978 1.00 35.43 C ATOM 2225 CG2 ILE B 27 12.769 -9.124 6.081 1.00 75.12 C ATOM 2226 CD1 ILE B 27 11.933 -6.140 6.214 1.00 31.44 C ATOM 0 H ILE B 27 9.573 -8.156 3.780 1.00 51.02 H new ATOM 0 HA ILE B 27 12.204 -9.111 3.274 1.00 34.32 H new ATOM 0 HB ILE B 27 10.693 -8.635 5.885 1.00 20.32 H new ATOM 0 HG12 ILE B 27 12.720 -6.895 4.384 1.00 35.43 H new ATOM 0 HG13 ILE B 27 10.987 -6.636 4.370 1.00 35.43 H new ATOM 0 HG21 ILE B 27 12.899 -8.561 7.005 1.00 75.12 H new ATOM 0 HG22 ILE B 27 12.555 -10.166 6.318 1.00 75.12 H new ATOM 0 HG23 ILE B 27 13.683 -9.066 5.489 1.00 75.12 H new ATOM 0 HD11 ILE B 27 12.090 -5.103 5.918 1.00 31.44 H new ATOM 0 HD12 ILE B 27 11.018 -6.215 6.801 1.00 31.44 H new ATOM 0 HD13 ILE B 27 12.778 -6.478 6.814 1.00 31.44 H new ATOM 2238 N LYS B 28 10.030 -11.224 4.656 1.00 23.34 N ATOM 2239 CA LYS B 28 9.695 -12.645 4.883 1.00 21.20 C ATOM 2240 C LYS B 28 9.870 -13.455 3.578 1.00 11.35 C ATOM 2241 O LYS B 28 10.481 -14.529 3.574 1.00 51.11 O ATOM 2242 CB LYS B 28 8.234 -12.765 5.395 1.00 55.30 C ATOM 2243 CG LYS B 28 7.763 -14.212 5.688 1.00 72.12 C ATOM 2244 CD LYS B 28 6.248 -14.305 5.991 1.00 32.23 C ATOM 2245 CE LYS B 28 5.368 -13.831 4.816 1.00 62.23 C ATOM 2246 NZ LYS B 28 5.623 -14.609 3.575 1.00 25.33 N ATOM 0 H LYS B 28 9.272 -10.585 4.896 1.00 23.34 H new ATOM 0 HA LYS B 28 10.372 -13.051 5.635 1.00 21.20 H new ATOM 0 HB2 LYS B 28 8.134 -12.174 6.306 1.00 55.30 H new ATOM 0 HB3 LYS B 28 7.567 -12.324 4.654 1.00 55.30 H new ATOM 0 HG2 LYS B 28 7.996 -14.845 4.831 1.00 72.12 H new ATOM 0 HG3 LYS B 28 8.323 -14.606 6.537 1.00 72.12 H new ATOM 0 HD2 LYS B 28 5.994 -15.337 6.234 1.00 32.23 H new ATOM 0 HD3 LYS B 28 6.022 -13.705 6.872 1.00 32.23 H new ATOM 0 HE2 LYS B 28 4.317 -13.923 5.091 1.00 62.23 H new ATOM 0 HE3 LYS B 28 5.557 -12.774 4.626 1.00 62.23 H new ATOM 0 HZ1 LYS B 28 5.898 -13.961 2.809 1.00 25.33 H new ATOM 0 HZ2 LYS B 28 6.390 -15.291 3.744 1.00 25.33 H new ATOM 0 HZ3 LYS B 28 4.759 -15.120 3.302 1.00 25.33 H new ATOM 2260 N ASN B 29 9.364 -12.876 2.470 1.00 3.25 N ATOM 2261 CA ASN B 29 9.439 -13.479 1.123 1.00 40.40 C ATOM 2262 C ASN B 29 10.887 -13.526 0.615 1.00 72.11 C ATOM 2263 O ASN B 29 11.236 -14.441 -0.113 1.00 41.43 O ATOM 2264 CB ASN B 29 8.531 -12.710 0.108 1.00 25.13 C ATOM 2265 CG ASN B 29 7.028 -12.990 0.279 1.00 35.41 C ATOM 2266 OD1 ASN B 29 6.555 -13.316 1.368 1.00 61.13 O ATOM 2267 ND2 ASN B 29 6.264 -12.852 -0.794 1.00 63.13 N ATOM 0 H ASN B 29 8.890 -11.973 2.484 1.00 3.25 H new ATOM 0 HA ASN B 29 9.072 -14.502 1.203 1.00 40.40 H new ATOM 0 HB2 ASN B 29 8.706 -11.640 0.218 1.00 25.13 H new ATOM 0 HB3 ASN B 29 8.828 -12.979 -0.906 1.00 25.13 H new ATOM 0 HD21 ASN B 29 5.259 -13.017 -0.729 1.00 63.13 H new ATOM 0 HD22 ASN B 29 6.680 -12.581 -1.685 1.00 63.13 H new ATOM 2274 N MET B 30 11.713 -12.523 1.006 1.00 24.41 N ATOM 2275 CA MET B 30 13.157 -12.480 0.657 1.00 73.31 C ATOM 2276 C MET B 30 13.924 -13.601 1.377 1.00 2.10 C ATOM 2277 O MET B 30 14.841 -14.195 0.805 1.00 53.42 O ATOM 2278 CB MET B 30 13.795 -11.095 0.992 1.00 11.42 C ATOM 2279 CG MET B 30 13.428 -9.961 0.023 1.00 21.22 C ATOM 2280 SD MET B 30 14.226 -8.398 0.465 1.00 50.32 S ATOM 2281 CE MET B 30 13.726 -7.341 -0.894 1.00 74.42 C ATOM 0 H MET B 30 11.402 -11.729 1.566 1.00 24.41 H new ATOM 0 HA MET B 30 13.232 -12.631 -0.420 1.00 73.31 H new ATOM 0 HB2 MET B 30 13.491 -10.806 1.998 1.00 11.42 H new ATOM 0 HB3 MET B 30 14.879 -11.205 1.005 1.00 11.42 H new ATOM 0 HG2 MET B 30 13.719 -10.242 -0.989 1.00 21.22 H new ATOM 0 HG3 MET B 30 12.346 -9.826 0.018 1.00 21.22 H new ATOM 0 HE1 MET B 30 13.828 -6.297 -0.599 1.00 74.42 H new ATOM 0 HE2 MET B 30 14.359 -7.537 -1.759 1.00 74.42 H new ATOM 0 HE3 MET B 30 12.687 -7.546 -1.151 1.00 74.42 H new ATOM 2291 N ILE B 31 13.525 -13.877 2.636 1.00 23.42 N ATOM 2292 CA ILE B 31 14.107 -14.962 3.445 1.00 0.12 C ATOM 2293 C ILE B 31 13.797 -16.315 2.783 1.00 64.52 C ATOM 2294 O ILE B 31 14.689 -17.134 2.604 1.00 23.13 O ATOM 2295 CB ILE B 31 13.588 -14.915 4.939 1.00 64.12 C ATOM 2296 CG1 ILE B 31 13.967 -13.548 5.608 1.00 53.22 C ATOM 2297 CG2 ILE B 31 14.143 -16.105 5.763 1.00 52.33 C ATOM 2298 CD1 ILE B 31 13.393 -13.325 6.998 1.00 60.13 C ATOM 0 H ILE B 31 12.793 -13.355 3.117 1.00 23.42 H new ATOM 0 HA ILE B 31 15.188 -14.829 3.486 1.00 0.12 H new ATOM 0 HB ILE B 31 12.502 -15.002 4.923 1.00 64.12 H new ATOM 0 HG12 ILE B 31 15.053 -13.479 5.666 1.00 53.22 H new ATOM 0 HG13 ILE B 31 13.630 -12.739 4.960 1.00 53.22 H new ATOM 0 HG21 ILE B 31 13.769 -16.046 6.785 1.00 52.33 H new ATOM 0 HG22 ILE B 31 13.819 -17.043 5.312 1.00 52.33 H new ATOM 0 HG23 ILE B 31 15.232 -16.065 5.772 1.00 52.33 H new ATOM 0 HD11 ILE B 31 13.713 -12.353 7.372 1.00 60.13 H new ATOM 0 HD12 ILE B 31 12.304 -13.355 6.951 1.00 60.13 H new ATOM 0 HD13 ILE B 31 13.749 -14.107 7.669 1.00 60.13 H new ATOM 2310 N GLU B 32 12.533 -16.488 2.364 1.00 74.21 N ATOM 2311 CA GLU B 32 12.054 -17.712 1.681 1.00 23.33 C ATOM 2312 C GLU B 32 12.654 -17.841 0.257 1.00 5.14 C ATOM 2313 O GLU B 32 12.880 -18.952 -0.234 1.00 11.03 O ATOM 2314 CB GLU B 32 10.507 -17.691 1.605 1.00 44.53 C ATOM 2315 CG GLU B 32 9.807 -17.598 2.979 1.00 45.33 C ATOM 2316 CD GLU B 32 8.282 -17.459 2.861 1.00 45.14 C ATOM 2317 OE1 GLU B 32 7.584 -18.495 2.777 1.00 74.41 O ATOM 2318 OE2 GLU B 32 7.774 -16.315 2.827 1.00 24.53 O ATOM 0 H GLU B 32 11.807 -15.782 2.488 1.00 74.21 H new ATOM 0 HA GLU B 32 12.383 -18.576 2.259 1.00 23.33 H new ATOM 0 HB2 GLU B 32 10.196 -16.844 0.993 1.00 44.53 H new ATOM 0 HB3 GLU B 32 10.167 -18.593 1.097 1.00 44.53 H new ATOM 0 HG2 GLU B 32 10.042 -18.488 3.563 1.00 45.33 H new ATOM 0 HG3 GLU B 32 10.204 -16.743 3.527 1.00 45.33 H new ATOM 2325 N ASP B 33 12.914 -16.681 -0.379 1.00 14.05 N ATOM 2326 CA ASP B 33 13.453 -16.590 -1.761 1.00 11.34 C ATOM 2327 C ASP B 33 14.907 -17.097 -1.810 1.00 10.43 C ATOM 2328 O ASP B 33 15.294 -17.851 -2.712 1.00 25.01 O ATOM 2329 CB ASP B 33 13.363 -15.112 -2.243 1.00 35.24 C ATOM 2330 CG ASP B 33 13.858 -14.891 -3.682 1.00 51.44 C ATOM 2331 OD1 ASP B 33 15.043 -14.535 -3.871 1.00 61.22 O ATOM 2332 OD2 ASP B 33 13.066 -15.072 -4.633 1.00 33.50 O ATOM 0 H ASP B 33 12.756 -15.770 0.052 1.00 14.05 H new ATOM 0 HA ASP B 33 12.862 -17.221 -2.425 1.00 11.34 H new ATOM 0 HB2 ASP B 33 12.327 -14.780 -2.171 1.00 35.24 H new ATOM 0 HB3 ASP B 33 13.946 -14.485 -1.569 1.00 35.24 H new ATOM 2337 N ILE B 34 15.690 -16.662 -0.815 1.00 33.14 N ATOM 2338 CA ILE B 34 17.089 -17.079 -0.609 1.00 44.10 C ATOM 2339 C ILE B 34 17.133 -18.483 0.050 1.00 55.10 C ATOM 2340 O ILE B 34 18.102 -19.235 -0.109 1.00 31.04 O ATOM 2341 CB ILE B 34 17.841 -15.996 0.273 1.00 63.35 C ATOM 2342 CG1 ILE B 34 17.838 -14.607 -0.461 1.00 61.44 C ATOM 2343 CG2 ILE B 34 19.286 -16.425 0.639 1.00 51.11 C ATOM 2344 CD1 ILE B 34 18.488 -13.463 0.307 1.00 21.01 C ATOM 0 H ILE B 34 15.365 -15.996 -0.114 1.00 33.14 H new ATOM 0 HA ILE B 34 17.599 -17.148 -1.570 1.00 44.10 H new ATOM 0 HB ILE B 34 17.297 -15.906 1.213 1.00 63.35 H new ATOM 0 HG12 ILE B 34 18.350 -14.719 -1.417 1.00 61.44 H new ATOM 0 HG13 ILE B 34 16.806 -14.334 -0.683 1.00 61.44 H new ATOM 0 HG21 ILE B 34 19.754 -15.648 1.243 1.00 51.11 H new ATOM 0 HG22 ILE B 34 19.257 -17.356 1.205 1.00 51.11 H new ATOM 0 HG23 ILE B 34 19.864 -16.573 -0.273 1.00 51.11 H new ATOM 0 HD11 ILE B 34 18.434 -12.550 -0.286 1.00 21.01 H new ATOM 0 HD12 ILE B 34 17.964 -13.315 1.251 1.00 21.01 H new ATOM 0 HD13 ILE B 34 19.532 -13.705 0.506 1.00 21.01 H new ATOM 2356 N GLY B 35 16.039 -18.835 0.754 1.00 2.24 N ATOM 2357 CA GLY B 35 15.960 -20.059 1.564 1.00 30.43 C ATOM 2358 C GLY B 35 16.135 -19.731 3.038 1.00 25.33 C ATOM 2359 O GLY B 35 15.402 -20.234 3.900 1.00 62.03 O ATOM 0 H GLY B 35 15.186 -18.276 0.775 1.00 2.24 H new ATOM 0 HA2 GLY B 35 14.998 -20.546 1.405 1.00 30.43 H new ATOM 0 HA3 GLY B 35 16.730 -20.763 1.247 1.00 30.43 H new ATOM 2363 N GLU B 36 17.113 -18.848 3.298 1.00 2.24 N ATOM 2364 CA GLU B 36 17.416 -18.293 4.610 1.00 22.32 C ATOM 2365 C GLU B 36 18.326 -17.074 4.404 1.00 41.51 C ATOM 2366 O GLU B 36 19.484 -17.234 3.991 1.00 53.54 O ATOM 2367 CB GLU B 36 18.113 -19.356 5.497 1.00 25.24 C ATOM 2368 CG GLU B 36 18.590 -18.847 6.869 1.00 41.43 C ATOM 2369 CD GLU B 36 19.369 -19.912 7.651 1.00 25.11 C ATOM 2370 OE1 GLU B 36 20.606 -20.005 7.477 1.00 61.42 O ATOM 2371 OE2 GLU B 36 18.753 -20.680 8.422 1.00 40.41 O ATOM 0 H GLU B 36 17.732 -18.494 2.568 1.00 2.24 H new ATOM 0 HA GLU B 36 16.499 -17.993 5.118 1.00 22.32 H new ATOM 0 HB2 GLU B 36 17.423 -20.185 5.654 1.00 25.24 H new ATOM 0 HB3 GLU B 36 18.971 -19.753 4.955 1.00 25.24 H new ATOM 0 HG2 GLU B 36 19.221 -17.970 6.728 1.00 41.43 H new ATOM 0 HG3 GLU B 36 17.728 -18.529 7.455 1.00 41.43 H new ATOM 2378 N SER B 37 17.791 -15.863 4.634 1.00 60.44 N ATOM 2379 CA SER B 37 18.579 -14.620 4.588 1.00 32.23 C ATOM 2380 C SER B 37 19.441 -14.487 5.862 1.00 44.04 C ATOM 2381 O SER B 37 19.058 -13.814 6.830 1.00 3.35 O ATOM 2382 CB SER B 37 17.653 -13.399 4.418 1.00 41.53 C ATOM 2383 OG SER B 37 16.899 -13.489 3.224 1.00 2.42 O ATOM 0 H SER B 37 16.806 -15.719 4.856 1.00 60.44 H new ATOM 0 HA SER B 37 19.246 -14.659 3.727 1.00 32.23 H new ATOM 0 HB2 SER B 37 16.979 -13.329 5.272 1.00 41.53 H new ATOM 0 HB3 SER B 37 18.249 -12.486 4.407 1.00 41.53 H new ATOM 0 HG SER B 37 16.320 -12.703 3.143 1.00 2.42 H new ATOM 2389 N ASP B 38 20.573 -15.201 5.858 1.00 45.31 N ATOM 2390 CA ASP B 38 21.577 -15.158 6.938 1.00 4.45 C ATOM 2391 C ASP B 38 22.406 -13.865 6.821 1.00 22.00 C ATOM 2392 O ASP B 38 22.743 -13.230 7.827 1.00 75.34 O ATOM 2393 CB ASP B 38 22.489 -16.419 6.860 1.00 31.22 C ATOM 2394 CG ASP B 38 23.619 -16.434 7.911 1.00 73.50 C ATOM 2395 OD1 ASP B 38 23.349 -16.759 9.085 1.00 62.44 O ATOM 2396 OD2 ASP B 38 24.786 -16.128 7.570 1.00 75.42 O ATOM 0 H ASP B 38 20.824 -15.833 5.098 1.00 45.31 H new ATOM 0 HA ASP B 38 21.077 -15.159 7.907 1.00 4.45 H new ATOM 0 HB2 ASP B 38 21.874 -17.310 6.988 1.00 31.22 H new ATOM 0 HB3 ASP B 38 22.930 -16.477 5.865 1.00 31.22 H new ATOM 2401 N SER B 39 22.680 -13.478 5.566 1.00 65.33 N ATOM 2402 CA SER B 39 23.467 -12.283 5.233 1.00 1.04 C ATOM 2403 C SER B 39 22.621 -10.993 5.415 1.00 52.23 C ATOM 2404 O SER B 39 21.386 -11.042 5.259 1.00 44.33 O ATOM 2405 CB SER B 39 23.987 -12.404 3.779 1.00 23.30 C ATOM 2406 OG SER B 39 22.929 -12.634 2.857 1.00 4.20 O ATOM 0 H SER B 39 22.358 -13.992 4.746 1.00 65.33 H new ATOM 0 HA SER B 39 24.317 -12.213 5.912 1.00 1.04 H new ATOM 0 HB2 SER B 39 24.516 -11.491 3.505 1.00 23.30 H new ATOM 0 HB3 SER B 39 24.707 -13.220 3.717 1.00 23.30 H new ATOM 0 HG SER B 39 23.294 -12.703 1.950 1.00 4.20 H new ATOM 2412 N PRO B 40 23.266 -9.830 5.787 1.00 4.13 N ATOM 2413 CA PRO B 40 22.577 -8.516 5.886 1.00 11.44 C ATOM 2414 C PRO B 40 21.883 -8.115 4.570 1.00 74.35 C ATOM 2415 O PRO B 40 22.491 -8.205 3.499 1.00 61.00 O ATOM 2416 CB PRO B 40 23.725 -7.525 6.237 1.00 34.22 C ATOM 2417 CG PRO B 40 24.781 -8.379 6.877 1.00 0.21 C ATOM 2418 CD PRO B 40 24.705 -9.713 6.166 1.00 42.31 C ATOM 0 HA PRO B 40 21.777 -8.530 6.627 1.00 11.44 H new ATOM 0 HB2 PRO B 40 24.105 -7.027 5.345 1.00 34.22 H new ATOM 0 HB3 PRO B 40 23.381 -6.745 6.916 1.00 34.22 H new ATOM 0 HG2 PRO B 40 25.769 -7.931 6.767 1.00 0.21 H new ATOM 0 HG3 PRO B 40 24.600 -8.493 7.946 1.00 0.21 H new ATOM 0 HD2 PRO B 40 25.353 -9.737 5.290 1.00 42.31 H new ATOM 0 HD3 PRO B 40 25.016 -10.531 6.815 1.00 42.31 H new ATOM 2426 N ILE B 41 20.612 -7.698 4.661 1.00 55.22 N ATOM 2427 CA ILE B 41 19.809 -7.294 3.496 1.00 71.32 C ATOM 2428 C ILE B 41 19.944 -5.770 3.279 1.00 44.24 C ATOM 2429 O ILE B 41 19.433 -4.986 4.093 1.00 41.43 O ATOM 2430 CB ILE B 41 18.293 -7.706 3.670 1.00 60.55 C ATOM 2431 CG1 ILE B 41 18.162 -9.248 3.917 1.00 23.04 C ATOM 2432 CG2 ILE B 41 17.442 -7.275 2.444 1.00 20.32 C ATOM 2433 CD1 ILE B 41 18.698 -10.134 2.787 1.00 65.43 C ATOM 0 H ILE B 41 20.110 -7.631 5.546 1.00 55.22 H new ATOM 0 HA ILE B 41 20.186 -7.815 2.616 1.00 71.32 H new ATOM 0 HB ILE B 41 17.907 -7.181 4.544 1.00 60.55 H new ATOM 0 HG12 ILE B 41 18.690 -9.499 4.837 1.00 23.04 H new ATOM 0 HG13 ILE B 41 17.111 -9.487 4.078 1.00 23.04 H new ATOM 0 HG21 ILE B 41 16.405 -7.574 2.598 1.00 20.32 H new ATOM 0 HG22 ILE B 41 17.494 -6.192 2.327 1.00 20.32 H new ATOM 0 HG23 ILE B 41 17.829 -7.756 1.545 1.00 20.32 H new ATOM 0 HD11 ILE B 41 18.563 -11.183 3.052 1.00 65.43 H new ATOM 0 HD12 ILE B 41 18.155 -9.919 1.867 1.00 65.43 H new ATOM 0 HD13 ILE B 41 19.759 -9.932 2.638 1.00 65.43 H new ATOM 2445 N PRO B 42 20.680 -5.320 2.208 1.00 41.53 N ATOM 2446 CA PRO B 42 20.783 -3.894 1.858 1.00 2.21 C ATOM 2447 C PRO B 42 19.488 -3.408 1.173 1.00 54.45 C ATOM 2448 O PRO B 42 19.006 -4.033 0.217 1.00 5.45 O ATOM 2449 CB PRO B 42 22.019 -3.826 0.902 1.00 1.31 C ATOM 2450 CG PRO B 42 22.608 -5.216 0.893 1.00 21.42 C ATOM 2451 CD PRO B 42 21.471 -6.142 1.255 1.00 14.40 C ATOM 0 HA PRO B 42 20.909 -3.246 2.725 1.00 2.21 H new ATOM 0 HB2 PRO B 42 21.721 -3.521 -0.101 1.00 1.31 H new ATOM 0 HB3 PRO B 42 22.747 -3.095 1.255 1.00 1.31 H new ATOM 0 HG2 PRO B 42 23.017 -5.462 -0.087 1.00 21.42 H new ATOM 0 HG3 PRO B 42 23.425 -5.300 1.610 1.00 21.42 H new ATOM 0 HD2 PRO B 42 20.885 -6.427 0.381 1.00 14.40 H new ATOM 0 HD3 PRO B 42 21.828 -7.064 1.713 1.00 14.40 H new ATOM 2459 N LEU B 43 18.941 -2.298 1.670 1.00 32.31 N ATOM 2460 CA LEU B 43 17.698 -1.694 1.169 1.00 14.33 C ATOM 2461 C LEU B 43 18.043 -0.312 0.560 1.00 61.02 C ATOM 2462 O LEU B 43 18.102 0.686 1.288 1.00 54.11 O ATOM 2463 CB LEU B 43 16.658 -1.572 2.330 1.00 33.31 C ATOM 2464 CG LEU B 43 16.303 -2.903 3.086 1.00 23.34 C ATOM 2465 CD1 LEU B 43 15.375 -2.641 4.296 1.00 2.21 C ATOM 2466 CD2 LEU B 43 15.697 -3.960 2.133 1.00 24.03 C ATOM 0 H LEU B 43 19.354 -1.781 2.446 1.00 32.31 H new ATOM 0 HA LEU B 43 17.248 -2.319 0.398 1.00 14.33 H new ATOM 0 HB2 LEU B 43 17.039 -0.856 3.058 1.00 33.31 H new ATOM 0 HB3 LEU B 43 15.738 -1.153 1.923 1.00 33.31 H new ATOM 0 HG LEU B 43 17.238 -3.310 3.471 1.00 23.34 H new ATOM 0 HD11 LEU B 43 15.151 -3.584 4.794 1.00 2.21 H new ATOM 0 HD12 LEU B 43 15.872 -1.970 4.997 1.00 2.21 H new ATOM 0 HD13 LEU B 43 14.448 -2.184 3.951 1.00 2.21 H new ATOM 0 HD21 LEU B 43 15.465 -4.865 2.694 1.00 24.03 H new ATOM 0 HD22 LEU B 43 14.784 -3.566 1.686 1.00 24.03 H new ATOM 0 HD23 LEU B 43 16.414 -4.194 1.346 1.00 24.03 H new ATOM 2478 N PRO B 44 18.302 -0.225 -0.792 1.00 23.31 N ATOM 2479 CA PRO B 44 18.759 1.025 -1.470 1.00 33.33 C ATOM 2480 C PRO B 44 17.594 1.992 -1.806 1.00 71.12 C ATOM 2481 O PRO B 44 17.649 2.734 -2.791 1.00 44.10 O ATOM 2482 CB PRO B 44 19.440 0.459 -2.741 1.00 62.21 C ATOM 2483 CG PRO B 44 18.625 -0.747 -3.096 1.00 74.11 C ATOM 2484 CD PRO B 44 18.163 -1.341 -1.775 1.00 5.10 C ATOM 0 HA PRO B 44 19.414 1.639 -0.851 1.00 33.33 H new ATOM 0 HB2 PRO B 44 19.441 1.190 -3.550 1.00 62.21 H new ATOM 0 HB3 PRO B 44 20.480 0.194 -2.550 1.00 62.21 H new ATOM 0 HG2 PRO B 44 17.774 -0.474 -3.720 1.00 74.11 H new ATOM 0 HG3 PRO B 44 19.217 -1.466 -3.662 1.00 74.11 H new ATOM 0 HD2 PRO B 44 17.132 -1.690 -1.836 1.00 5.10 H new ATOM 0 HD3 PRO B 44 18.773 -2.198 -1.491 1.00 5.10 H new ATOM 2492 N ASN B 45 16.573 2.017 -0.931 1.00 51.12 N ATOM 2493 CA ASN B 45 15.326 2.775 -1.132 1.00 51.12 C ATOM 2494 C ASN B 45 15.000 3.560 0.148 1.00 22.30 C ATOM 2495 O ASN B 45 15.042 4.794 0.168 1.00 50.34 O ATOM 2496 CB ASN B 45 14.171 1.788 -1.490 1.00 15.54 C ATOM 2497 CG ASN B 45 12.798 2.467 -1.660 1.00 70.41 C ATOM 2498 OD1 ASN B 45 12.023 2.586 -0.709 1.00 34.10 O ATOM 2499 ND2 ASN B 45 12.488 2.905 -2.871 1.00 54.24 N ATOM 0 H ASN B 45 16.592 1.503 -0.050 1.00 51.12 H new ATOM 0 HA ASN B 45 15.443 3.481 -1.954 1.00 51.12 H new ATOM 0 HB2 ASN B 45 14.425 1.268 -2.414 1.00 15.54 H new ATOM 0 HB3 ASN B 45 14.097 1.032 -0.708 1.00 15.54 H new ATOM 0 HD21 ASN B 45 11.587 3.355 -3.036 1.00 54.24 H new ATOM 0 HD22 ASN B 45 13.150 2.793 -3.639 1.00 54.24 H new ATOM 2506 N VAL B 46 14.715 2.815 1.227 1.00 13.11 N ATOM 2507 CA VAL B 46 14.291 3.390 2.512 1.00 64.35 C ATOM 2508 C VAL B 46 15.521 3.899 3.303 1.00 32.44 C ATOM 2509 O VAL B 46 16.493 3.162 3.495 1.00 22.14 O ATOM 2510 CB VAL B 46 13.447 2.343 3.347 1.00 3.40 C ATOM 2511 CG1 VAL B 46 14.230 1.037 3.627 1.00 71.25 C ATOM 2512 CG2 VAL B 46 12.902 2.968 4.651 1.00 2.51 C ATOM 0 H VAL B 46 14.772 1.797 1.233 1.00 13.11 H new ATOM 0 HA VAL B 46 13.642 4.244 2.318 1.00 64.35 H new ATOM 0 HB VAL B 46 12.593 2.066 2.728 1.00 3.40 H new ATOM 0 HG11 VAL B 46 13.605 0.354 4.203 1.00 71.25 H new ATOM 0 HG12 VAL B 46 14.505 0.568 2.682 1.00 71.25 H new ATOM 0 HG13 VAL B 46 15.132 1.268 4.194 1.00 71.25 H new ATOM 0 HG21 VAL B 46 12.327 2.222 5.200 1.00 2.51 H new ATOM 0 HG22 VAL B 46 13.734 3.310 5.266 1.00 2.51 H new ATOM 0 HG23 VAL B 46 12.259 3.814 4.408 1.00 2.51 H new ATOM 2522 N THR B 47 15.480 5.181 3.723 1.00 2.24 N ATOM 2523 CA THR B 47 16.563 5.823 4.500 1.00 64.44 C ATOM 2524 C THR B 47 16.578 5.308 5.948 1.00 74.11 C ATOM 2525 O THR B 47 15.646 4.623 6.375 1.00 53.23 O ATOM 2526 CB THR B 47 16.394 7.377 4.495 1.00 54.54 C ATOM 2527 OG1 THR B 47 15.065 7.704 4.940 1.00 13.14 O ATOM 2528 CG2 THR B 47 16.641 7.976 3.095 1.00 52.12 C ATOM 0 H THR B 47 14.693 5.802 3.533 1.00 2.24 H new ATOM 0 HA THR B 47 17.511 5.566 4.028 1.00 64.44 H new ATOM 0 HB THR B 47 17.136 7.806 5.169 1.00 54.54 H new ATOM 0 HG1 THR B 47 15.114 8.174 5.798 1.00 13.14 H new ATOM 0 HG21 THR B 47 16.514 9.058 3.134 1.00 52.12 H new ATOM 0 HG22 THR B 47 17.656 7.741 2.773 1.00 52.12 H new ATOM 0 HG23 THR B 47 15.928 7.552 2.387 1.00 52.12 H new ATOM 2536 N SER B 48 17.646 5.658 6.692 1.00 41.33 N ATOM 2537 CA SER B 48 17.840 5.226 8.087 1.00 53.34 C ATOM 2538 C SER B 48 16.722 5.737 8.991 1.00 43.44 C ATOM 2539 O SER B 48 16.167 4.977 9.777 1.00 35.33 O ATOM 2540 CB SER B 48 19.197 5.727 8.604 1.00 71.22 C ATOM 2541 OG SER B 48 19.312 7.139 8.476 1.00 14.50 O ATOM 0 H SER B 48 18.399 6.249 6.340 1.00 41.33 H new ATOM 0 HA SER B 48 17.818 4.136 8.107 1.00 53.34 H new ATOM 0 HB2 SER B 48 19.317 5.444 9.650 1.00 71.22 H new ATOM 0 HB3 SER B 48 20.001 5.243 8.049 1.00 71.22 H new ATOM 0 HG SER B 48 20.249 7.378 8.320 1.00 14.50 H new ATOM 2547 N THR B 49 16.411 7.031 8.835 1.00 61.32 N ATOM 2548 CA THR B 49 15.399 7.740 9.623 1.00 73.40 C ATOM 2549 C THR B 49 14.024 7.052 9.515 1.00 73.43 C ATOM 2550 O THR B 49 13.394 6.742 10.532 1.00 0.13 O ATOM 2551 CB THR B 49 15.307 9.222 9.136 1.00 55.15 C ATOM 2552 OG1 THR B 49 15.123 9.234 7.709 1.00 5.44 O ATOM 2553 CG2 THR B 49 16.575 10.032 9.495 1.00 42.33 C ATOM 0 H THR B 49 16.867 7.625 8.142 1.00 61.32 H new ATOM 0 HA THR B 49 15.696 7.719 10.672 1.00 73.40 H new ATOM 0 HB THR B 49 14.462 9.691 9.640 1.00 55.15 H new ATOM 0 HG1 THR B 49 15.063 10.160 7.395 1.00 5.44 H new ATOM 0 HG21 THR B 49 16.466 11.056 9.137 1.00 42.33 H new ATOM 0 HG22 THR B 49 16.709 10.038 10.577 1.00 42.33 H new ATOM 0 HG23 THR B 49 17.445 9.574 9.024 1.00 42.33 H new ATOM 2561 N ILE B 50 13.599 6.776 8.270 1.00 61.30 N ATOM 2562 CA ILE B 50 12.279 6.195 7.984 1.00 62.03 C ATOM 2563 C ILE B 50 12.242 4.709 8.378 1.00 30.20 C ATOM 2564 O ILE B 50 11.275 4.262 8.998 1.00 74.40 O ATOM 2565 CB ILE B 50 11.895 6.391 6.469 1.00 24.40 C ATOM 2566 CG1 ILE B 50 11.896 7.912 6.108 1.00 12.00 C ATOM 2567 CG2 ILE B 50 10.532 5.740 6.127 1.00 5.52 C ATOM 2568 CD1 ILE B 50 10.941 8.770 6.940 1.00 5.55 C ATOM 0 H ILE B 50 14.161 6.950 7.436 1.00 61.30 H new ATOM 0 HA ILE B 50 11.538 6.721 8.586 1.00 62.03 H new ATOM 0 HB ILE B 50 12.648 5.884 5.865 1.00 24.40 H new ATOM 0 HG12 ILE B 50 12.908 8.299 6.228 1.00 12.00 H new ATOM 0 HG13 ILE B 50 11.636 8.021 5.055 1.00 12.00 H new ATOM 0 HG21 ILE B 50 10.307 5.899 5.072 1.00 5.52 H new ATOM 0 HG22 ILE B 50 10.579 4.670 6.330 1.00 5.52 H new ATOM 0 HG23 ILE B 50 9.750 6.192 6.737 1.00 5.52 H new ATOM 0 HD11 ILE B 50 11.011 9.809 6.618 1.00 5.55 H new ATOM 0 HD12 ILE B 50 9.920 8.416 6.802 1.00 5.55 H new ATOM 0 HD13 ILE B 50 11.211 8.698 7.994 1.00 5.55 H new ATOM 2580 N LEU B 51 13.325 3.967 8.048 1.00 62.04 N ATOM 2581 CA LEU B 51 13.448 2.528 8.372 1.00 74.14 C ATOM 2582 C LEU B 51 13.442 2.313 9.896 1.00 64.30 C ATOM 2583 O LEU B 51 12.878 1.334 10.385 1.00 53.41 O ATOM 2584 CB LEU B 51 14.735 1.912 7.738 1.00 41.43 C ATOM 2585 CG LEU B 51 14.886 0.353 7.849 1.00 2.14 C ATOM 2586 CD1 LEU B 51 13.671 -0.386 7.239 1.00 22.30 C ATOM 2587 CD2 LEU B 51 16.206 -0.133 7.208 1.00 33.11 C ATOM 0 H LEU B 51 14.132 4.347 7.553 1.00 62.04 H new ATOM 0 HA LEU B 51 12.586 2.016 7.945 1.00 74.14 H new ATOM 0 HB2 LEU B 51 14.761 2.184 6.683 1.00 41.43 H new ATOM 0 HB3 LEU B 51 15.603 2.374 8.208 1.00 41.43 H new ATOM 0 HG LEU B 51 14.919 0.110 8.911 1.00 2.14 H new ATOM 0 HD11 LEU B 51 13.814 -1.462 7.335 1.00 22.30 H new ATOM 0 HD12 LEU B 51 12.764 -0.092 7.767 1.00 22.30 H new ATOM 0 HD13 LEU B 51 13.578 -0.125 6.185 1.00 22.30 H new ATOM 0 HD21 LEU B 51 16.279 -1.216 7.302 1.00 33.11 H new ATOM 0 HD22 LEU B 51 16.221 0.141 6.153 1.00 33.11 H new ATOM 0 HD23 LEU B 51 17.050 0.333 7.716 1.00 33.11 H new ATOM 2599 N GLU B 52 14.040 3.273 10.635 1.00 74.44 N ATOM 2600 CA GLU B 52 14.066 3.268 12.109 1.00 22.35 C ATOM 2601 C GLU B 52 12.639 3.339 12.655 1.00 73.22 C ATOM 2602 O GLU B 52 12.261 2.548 13.512 1.00 10.01 O ATOM 2603 CB GLU B 52 14.894 4.467 12.644 1.00 51.42 C ATOM 2604 CG GLU B 52 15.001 4.541 14.183 1.00 0.05 C ATOM 2605 CD GLU B 52 15.835 5.737 14.664 1.00 41.15 C ATOM 2606 OE1 GLU B 52 15.248 6.798 14.973 1.00 24.21 O ATOM 2607 OE2 GLU B 52 17.080 5.630 14.714 1.00 21.21 O ATOM 0 H GLU B 52 14.519 4.074 10.222 1.00 74.44 H new ATOM 0 HA GLU B 52 14.535 2.343 12.444 1.00 22.35 H new ATOM 0 HB2 GLU B 52 15.899 4.413 12.226 1.00 51.42 H new ATOM 0 HB3 GLU B 52 14.447 5.392 12.279 1.00 51.42 H new ATOM 0 HG2 GLU B 52 14.000 4.607 14.610 1.00 0.05 H new ATOM 0 HG3 GLU B 52 15.447 3.619 14.557 1.00 0.05 H new ATOM 2614 N LYS B 53 11.854 4.276 12.087 1.00 34.31 N ATOM 2615 CA LYS B 53 10.466 4.535 12.501 1.00 21.43 C ATOM 2616 C LYS B 53 9.560 3.330 12.204 1.00 10.00 C ATOM 2617 O LYS B 53 8.753 2.932 13.046 1.00 23.50 O ATOM 2618 CB LYS B 53 9.905 5.784 11.774 1.00 61.41 C ATOM 2619 CG LYS B 53 10.627 7.107 12.098 1.00 13.04 C ATOM 2620 CD LYS B 53 9.924 8.331 11.472 1.00 11.24 C ATOM 2621 CE LYS B 53 8.501 8.528 12.021 1.00 31.22 C ATOM 2622 NZ LYS B 53 8.494 8.673 13.504 1.00 44.43 N ATOM 0 H LYS B 53 12.169 4.876 11.325 1.00 34.31 H new ATOM 0 HA LYS B 53 10.475 4.711 13.577 1.00 21.43 H new ATOM 0 HB2 LYS B 53 9.957 5.613 10.699 1.00 61.41 H new ATOM 0 HB3 LYS B 53 8.851 5.891 12.029 1.00 61.41 H new ATOM 0 HG2 LYS B 53 10.678 7.234 13.179 1.00 13.04 H new ATOM 0 HG3 LYS B 53 11.653 7.056 11.735 1.00 13.04 H new ATOM 0 HD2 LYS B 53 10.514 9.226 11.668 1.00 11.24 H new ATOM 0 HD3 LYS B 53 9.880 8.208 10.390 1.00 11.24 H new ATOM 0 HE2 LYS B 53 8.056 9.414 11.567 1.00 31.22 H new ATOM 0 HE3 LYS B 53 7.881 7.678 11.736 1.00 31.22 H new ATOM 0 HZ1 LYS B 53 7.554 8.987 13.818 1.00 44.43 H new ATOM 0 HZ2 LYS B 53 8.717 7.757 13.943 1.00 44.43 H new ATOM 0 HZ3 LYS B 53 9.206 9.376 13.787 1.00 44.43 H new ATOM 2636 N VAL B 54 9.715 2.775 10.992 1.00 73.41 N ATOM 2637 CA VAL B 54 8.908 1.651 10.503 1.00 4.02 C ATOM 2638 C VAL B 54 9.151 0.398 11.371 1.00 33.54 C ATOM 2639 O VAL B 54 8.194 -0.246 11.829 1.00 14.21 O ATOM 2640 CB VAL B 54 9.219 1.368 8.976 1.00 65.13 C ATOM 2641 CG1 VAL B 54 8.554 0.069 8.475 1.00 64.14 C ATOM 2642 CG2 VAL B 54 8.783 2.566 8.092 1.00 50.34 C ATOM 0 H VAL B 54 10.411 3.098 10.320 1.00 73.41 H new ATOM 0 HA VAL B 54 7.853 1.913 10.583 1.00 4.02 H new ATOM 0 HB VAL B 54 10.298 1.239 8.893 1.00 65.13 H new ATOM 0 HG11 VAL B 54 8.796 -0.082 7.423 1.00 64.14 H new ATOM 0 HG12 VAL B 54 8.922 -0.776 9.057 1.00 64.14 H new ATOM 0 HG13 VAL B 54 7.473 0.146 8.591 1.00 64.14 H new ATOM 0 HG21 VAL B 54 9.007 2.348 7.048 1.00 50.34 H new ATOM 0 HG22 VAL B 54 7.712 2.732 8.207 1.00 50.34 H new ATOM 0 HG23 VAL B 54 9.324 3.461 8.400 1.00 50.34 H new ATOM 2652 N LEU B 55 10.440 0.112 11.650 1.00 64.44 N ATOM 2653 CA LEU B 55 10.853 -1.055 12.450 1.00 35.44 C ATOM 2654 C LEU B 55 10.520 -0.856 13.945 1.00 55.54 C ATOM 2655 O LEU B 55 10.233 -1.828 14.639 1.00 4.51 O ATOM 2656 CB LEU B 55 12.367 -1.358 12.256 1.00 34.10 C ATOM 2657 CG LEU B 55 12.810 -1.754 10.806 1.00 45.11 C ATOM 2658 CD1 LEU B 55 14.309 -2.128 10.762 1.00 44.51 C ATOM 2659 CD2 LEU B 55 11.926 -2.877 10.212 1.00 55.51 C ATOM 0 H LEU B 55 11.221 0.684 11.327 1.00 64.44 H new ATOM 0 HA LEU B 55 10.287 -1.916 12.094 1.00 35.44 H new ATOM 0 HB2 LEU B 55 12.935 -0.479 12.560 1.00 34.10 H new ATOM 0 HB3 LEU B 55 12.645 -2.166 12.932 1.00 34.10 H new ATOM 0 HG LEU B 55 12.668 -0.876 10.176 1.00 45.11 H new ATOM 0 HD11 LEU B 55 14.587 -2.398 9.743 1.00 44.51 H new ATOM 0 HD12 LEU B 55 14.906 -1.276 11.087 1.00 44.51 H new ATOM 0 HD13 LEU B 55 14.493 -2.974 11.424 1.00 44.51 H new ATOM 0 HD21 LEU B 55 12.271 -3.118 9.206 1.00 55.51 H new ATOM 0 HD22 LEU B 55 11.994 -3.765 10.841 1.00 55.51 H new ATOM 0 HD23 LEU B 55 10.890 -2.541 10.170 1.00 55.51 H new ATOM 2671 N ASP B 56 10.548 0.409 14.416 1.00 43.10 N ATOM 2672 CA ASP B 56 10.213 0.772 15.818 1.00 62.23 C ATOM 2673 C ASP B 56 8.704 0.625 16.064 1.00 70.43 C ATOM 2674 O ASP B 56 8.279 0.181 17.132 1.00 70.21 O ATOM 2675 CB ASP B 56 10.679 2.223 16.136 1.00 24.33 C ATOM 2676 CG ASP B 56 10.396 2.713 17.574 1.00 22.21 C ATOM 2677 OD1 ASP B 56 10.197 3.935 17.763 1.00 2.04 O ATOM 2678 OD2 ASP B 56 10.378 1.892 18.516 1.00 53.14 O ATOM 0 H ASP B 56 10.803 1.210 13.839 1.00 43.10 H new ATOM 0 HA ASP B 56 10.740 0.090 16.485 1.00 62.23 H new ATOM 0 HB2 ASP B 56 11.751 2.290 15.953 1.00 24.33 H new ATOM 0 HB3 ASP B 56 10.193 2.903 15.437 1.00 24.33 H new ATOM 2683 N TYR B 57 7.902 0.991 15.051 1.00 24.12 N ATOM 2684 CA TYR B 57 6.443 0.795 15.077 1.00 71.32 C ATOM 2685 C TYR B 57 6.110 -0.707 15.000 1.00 23.44 C ATOM 2686 O TYR B 57 5.101 -1.168 15.550 1.00 34.35 O ATOM 2687 CB TYR B 57 5.755 1.572 13.929 1.00 45.23 C ATOM 2688 CG TYR B 57 4.221 1.523 14.004 1.00 71.53 C ATOM 2689 CD1 TYR B 57 3.482 0.593 13.261 1.00 4.03 C ATOM 2690 CD2 TYR B 57 3.517 2.375 14.862 1.00 73.32 C ATOM 2691 CE1 TYR B 57 2.111 0.516 13.372 1.00 74.33 C ATOM 2692 CE2 TYR B 57 2.141 2.307 14.966 1.00 3.31 C ATOM 2693 CZ TYR B 57 1.445 1.376 14.223 1.00 11.21 C ATOM 2694 OH TYR B 57 0.076 1.292 14.347 1.00 41.33 O ATOM 0 H TYR B 57 8.244 1.429 14.195 1.00 24.12 H new ATOM 0 HA TYR B 57 6.059 1.190 16.018 1.00 71.32 H new ATOM 0 HB2 TYR B 57 6.081 2.612 13.955 1.00 45.23 H new ATOM 0 HB3 TYR B 57 6.080 1.160 12.974 1.00 45.23 H new ATOM 0 HD1 TYR B 57 3.997 -0.077 12.588 1.00 4.03 H new ATOM 0 HD2 TYR B 57 4.059 3.098 15.453 1.00 73.32 H new ATOM 0 HE1 TYR B 57 1.560 -0.213 12.797 1.00 74.33 H new ATOM 0 HE2 TYR B 57 1.613 2.979 15.626 1.00 3.31 H new ATOM 0 HH TYR B 57 -0.237 1.966 14.986 1.00 41.33 H new ATOM 2704 N CYS B 58 6.957 -1.456 14.283 1.00 51.10 N ATOM 2705 CA CYS B 58 6.863 -2.915 14.223 1.00 53.03 C ATOM 2706 C CYS B 58 7.220 -3.545 15.596 1.00 60.33 C ATOM 2707 O CYS B 58 6.611 -4.545 15.986 1.00 15.51 O ATOM 2708 CB CYS B 58 7.755 -3.456 13.086 1.00 64.23 C ATOM 2709 SG CYS B 58 7.201 -2.982 11.432 1.00 63.01 S ATOM 0 H CYS B 58 7.722 -1.068 13.732 1.00 51.10 H new ATOM 0 HA CYS B 58 5.834 -3.199 14.000 1.00 53.03 H new ATOM 0 HB2 CYS B 58 8.773 -3.097 13.234 1.00 64.23 H new ATOM 0 HB3 CYS B 58 7.788 -4.544 13.150 1.00 64.23 H new ATOM 0 HG CYS B 58 7.429 -1.716 11.244 1.00 63.01 H new ATOM 2715 N ARG B 59 8.190 -2.936 16.334 1.00 11.14 N ATOM 2716 CA ARG B 59 8.538 -3.352 17.725 1.00 33.52 C ATOM 2717 C ARG B 59 7.385 -3.021 18.681 1.00 24.45 C ATOM 2718 O ARG B 59 7.136 -3.757 19.642 1.00 0.44 O ATOM 2719 CB ARG B 59 9.835 -2.667 18.250 1.00 32.13 C ATOM 2720 CG ARG B 59 11.116 -2.951 17.442 1.00 24.34 C ATOM 2721 CD ARG B 59 12.379 -2.372 18.115 1.00 73.45 C ATOM 2722 NE ARG B 59 12.236 -0.950 18.516 1.00 21.40 N ATOM 2723 CZ ARG B 59 13.088 -0.293 19.326 1.00 40.14 C ATOM 2724 NH1 ARG B 59 14.160 -0.895 19.838 1.00 4.21 N ATOM 2725 NH2 ARG B 59 12.845 0.969 19.642 1.00 2.23 N ATOM 0 H ARG B 59 8.746 -2.154 15.989 1.00 11.14 H new ATOM 0 HA ARG B 59 8.713 -4.427 17.692 1.00 33.52 H new ATOM 0 HB2 ARG B 59 9.672 -1.589 18.270 1.00 32.13 H new ATOM 0 HB3 ARG B 59 10.000 -2.984 19.280 1.00 32.13 H new ATOM 0 HG2 ARG B 59 11.234 -4.028 17.320 1.00 24.34 H new ATOM 0 HG3 ARG B 59 11.013 -2.527 16.443 1.00 24.34 H new ATOM 0 HD2 ARG B 59 12.617 -2.968 18.996 1.00 73.45 H new ATOM 0 HD3 ARG B 59 13.222 -2.465 17.430 1.00 73.45 H new ATOM 0 HE ARG B 59 11.435 -0.434 18.152 1.00 21.40 H new ATOM 0 HH11 ARG B 59 14.349 -1.873 19.619 1.00 4.21 H new ATOM 0 HH12 ARG B 59 14.792 -0.378 20.449 1.00 4.21 H new ATOM 0 HH21 ARG B 59 12.017 1.437 19.273 1.00 2.23 H new ATOM 0 HH22 ARG B 59 13.485 1.474 20.255 1.00 2.23 H new ATOM 2739 N HIS B 60 6.703 -1.890 18.399 1.00 13.20 N ATOM 2740 CA HIS B 60 5.495 -1.460 19.123 1.00 11.04 C ATOM 2741 C HIS B 60 4.423 -2.540 19.006 1.00 2.14 C ATOM 2742 O HIS B 60 3.856 -2.960 20.003 1.00 0.02 O ATOM 2743 CB HIS B 60 4.962 -0.101 18.564 1.00 53.53 C ATOM 2744 CG HIS B 60 3.636 0.330 19.145 1.00 12.34 C ATOM 2745 ND1 HIS B 60 2.432 -0.208 18.751 1.00 51.11 N ATOM 2746 CD2 HIS B 60 3.329 1.232 20.107 1.00 73.53 C ATOM 2747 CE1 HIS B 60 1.462 0.321 19.455 1.00 15.01 C ATOM 2748 NE2 HIS B 60 1.973 1.201 20.285 1.00 51.31 N ATOM 0 H HIS B 60 6.980 -1.248 17.657 1.00 13.20 H new ATOM 0 HA HIS B 60 5.748 -1.312 20.173 1.00 11.04 H new ATOM 0 HB2 HIS B 60 5.702 0.675 18.761 1.00 53.53 H new ATOM 0 HB3 HIS B 60 4.863 -0.180 17.481 1.00 53.53 H new ATOM 0 HD2 HIS B 60 4.028 1.862 20.638 1.00 73.53 H new ATOM 0 HE1 HIS B 60 0.414 0.074 19.367 1.00 15.01 H new ATOM 0 HE2 HIS B 60 1.447 1.767 20.951 1.00 51.31 H new ATOM 2757 N HIS B 61 4.176 -2.981 17.763 1.00 72.41 N ATOM 2758 CA HIS B 61 3.154 -3.987 17.459 1.00 71.13 C ATOM 2759 C HIS B 61 3.582 -5.387 17.949 1.00 33.33 C ATOM 2760 O HIS B 61 2.737 -6.231 18.220 1.00 3.34 O ATOM 2761 CB HIS B 61 2.870 -4.012 15.937 1.00 13.12 C ATOM 2762 CG HIS B 61 1.702 -4.883 15.562 1.00 21.14 C ATOM 2763 ND1 HIS B 61 1.835 -6.169 15.084 1.00 40.44 N ATOM 2764 CD2 HIS B 61 0.369 -4.650 15.627 1.00 64.32 C ATOM 2765 CE1 HIS B 61 0.643 -6.686 14.878 1.00 74.53 C ATOM 2766 NE2 HIS B 61 -0.261 -5.786 15.199 1.00 45.12 N ATOM 0 H HIS B 61 4.681 -2.648 16.942 1.00 72.41 H new ATOM 0 HA HIS B 61 2.241 -3.714 17.988 1.00 71.13 H new ATOM 0 HB2 HIS B 61 2.681 -2.995 15.593 1.00 13.12 H new ATOM 0 HB3 HIS B 61 3.759 -4.365 15.415 1.00 13.12 H new ATOM 0 HD1 HIS B 61 2.721 -6.646 14.916 1.00 40.44 H new ATOM 0 HD2 HIS B 61 -0.107 -3.738 15.955 1.00 64.32 H new ATOM 0 HE1 HIS B 61 0.441 -7.680 14.508 1.00 74.53 H new ATOM 2775 N HIS B 62 4.903 -5.614 18.039 1.00 20.54 N ATOM 2776 CA HIS B 62 5.474 -6.902 18.481 1.00 5.20 C ATOM 2777 C HIS B 62 5.256 -7.112 19.988 1.00 50.40 C ATOM 2778 O HIS B 62 4.766 -8.157 20.422 1.00 30.20 O ATOM 2779 CB HIS B 62 6.990 -6.938 18.167 1.00 70.24 C ATOM 2780 CG HIS B 62 7.705 -8.184 18.632 1.00 33.41 C ATOM 2781 ND1 HIS B 62 8.870 -8.169 19.377 1.00 54.41 N ATOM 2782 CD2 HIS B 62 7.442 -9.482 18.396 1.00 50.24 C ATOM 2783 CE1 HIS B 62 9.288 -9.409 19.548 1.00 73.42 C ATOM 2784 NE2 HIS B 62 8.441 -10.219 18.970 1.00 32.40 N ATOM 0 H HIS B 62 5.606 -4.912 17.808 1.00 20.54 H new ATOM 0 HA HIS B 62 4.967 -7.703 17.943 1.00 5.20 H new ATOM 0 HB2 HIS B 62 7.126 -6.839 17.090 1.00 70.24 H new ATOM 0 HB3 HIS B 62 7.463 -6.071 18.629 1.00 70.24 H new ATOM 0 HD2 HIS B 62 6.595 -9.872 17.851 1.00 50.24 H new ATOM 0 HE1 HIS B 62 10.181 -9.705 20.078 1.00 73.42 H new ATOM 0 HE2 HIS B 62 8.513 -11.236 18.950 1.00 32.40 H new ATOM 2793 N GLN B 63 5.605 -6.084 20.756 1.00 12.41 N ATOM 2794 CA GLN B 63 5.681 -6.153 22.223 1.00 11.10 C ATOM 2795 C GLN B 63 4.371 -5.655 22.865 1.00 12.25 C ATOM 2796 O GLN B 63 4.092 -5.939 24.035 1.00 51.34 O ATOM 2797 CB GLN B 63 6.910 -5.325 22.677 1.00 20.22 C ATOM 2798 CG GLN B 63 8.262 -5.845 22.094 1.00 1.52 C ATOM 2799 CD GLN B 63 9.468 -4.922 22.349 1.00 44.25 C ATOM 2800 OE1 GLN B 63 10.593 -5.379 22.534 1.00 30.30 O ATOM 2801 NE2 GLN B 63 9.260 -3.617 22.297 1.00 2.43 N ATOM 0 H GLN B 63 5.847 -5.167 20.379 1.00 12.41 H new ATOM 0 HA GLN B 63 5.805 -7.185 22.552 1.00 11.10 H new ATOM 0 HB2 GLN B 63 6.769 -4.287 22.377 1.00 20.22 H new ATOM 0 HB3 GLN B 63 6.964 -5.337 23.766 1.00 20.22 H new ATOM 0 HG2 GLN B 63 8.474 -6.825 22.522 1.00 1.52 H new ATOM 0 HG3 GLN B 63 8.149 -5.985 21.019 1.00 1.52 H new ATOM 0 HE21 GLN B 63 8.318 -3.256 22.142 1.00 2.43 H new ATOM 0 HE22 GLN B 63 10.041 -2.971 22.411 1.00 2.43 H new ATOM 2810 N HIS B 64 3.591 -4.891 22.082 1.00 30.20 N ATOM 2811 CA HIS B 64 2.224 -4.459 22.424 1.00 41.44 C ATOM 2812 C HIS B 64 1.327 -4.736 21.190 1.00 42.41 C ATOM 2813 O HIS B 64 1.119 -3.833 20.363 1.00 71.13 O ATOM 2814 CB HIS B 64 2.184 -2.949 22.815 1.00 15.35 C ATOM 2815 CG HIS B 64 2.886 -2.598 24.106 1.00 61.51 C ATOM 2816 ND1 HIS B 64 2.209 -2.288 25.264 1.00 52.14 N ATOM 2817 CD2 HIS B 64 4.206 -2.480 24.414 1.00 25.12 C ATOM 2818 CE1 HIS B 64 3.070 -1.989 26.211 1.00 24.43 C ATOM 2819 NE2 HIS B 64 4.287 -2.099 25.727 1.00 3.04 N ATOM 0 H HIS B 64 3.900 -4.548 21.172 1.00 30.20 H new ATOM 0 HA HIS B 64 1.863 -5.012 23.291 1.00 41.44 H new ATOM 0 HB2 HIS B 64 2.632 -2.370 22.008 1.00 15.35 H new ATOM 0 HB3 HIS B 64 1.142 -2.638 22.891 1.00 15.35 H new ATOM 0 HD2 HIS B 64 5.037 -2.655 23.746 1.00 25.12 H new ATOM 0 HE1 HIS B 64 2.819 -1.700 27.221 1.00 24.43 H new ATOM 0 HE2 HIS B 64 5.150 -1.929 26.244 1.00 3.04 H new ATOM 2828 N PRO B 65 0.866 -6.024 20.997 1.00 32.41 N ATOM 2829 CA PRO B 65 0.041 -6.423 19.827 1.00 64.04 C ATOM 2830 C PRO B 65 -1.232 -5.556 19.665 1.00 45.50 C ATOM 2831 O PRO B 65 -1.352 -4.814 18.677 1.00 55.43 O ATOM 2832 CB PRO B 65 -0.289 -7.928 20.092 1.00 64.41 C ATOM 2833 CG PRO B 65 0.032 -8.153 21.546 1.00 30.12 C ATOM 2834 CD PRO B 65 1.151 -7.196 21.872 1.00 20.23 C ATOM 0 HA PRO B 65 0.569 -6.275 18.885 1.00 64.04 H new ATOM 0 HB2 PRO B 65 -1.337 -8.144 19.882 1.00 64.41 H new ATOM 0 HB3 PRO B 65 0.306 -8.580 19.452 1.00 64.41 H new ATOM 0 HG2 PRO B 65 -0.839 -7.964 22.173 1.00 30.12 H new ATOM 0 HG3 PRO B 65 0.335 -9.185 21.725 1.00 30.12 H new ATOM 0 HD2 PRO B 65 1.150 -6.920 22.927 1.00 20.23 H new ATOM 0 HD3 PRO B 65 2.127 -7.630 21.657 1.00 20.23 H new ATOM 2842 N GLY B 66 -2.175 -5.669 20.631 1.00 32.43 N ATOM 2843 CA GLY B 66 -3.446 -4.929 20.602 1.00 31.15 C ATOM 2844 C GLY B 66 -4.501 -5.568 19.698 1.00 30.22 C ATOM 2845 O GLY B 66 -5.689 -5.612 20.051 1.00 45.32 O ATOM 0 H GLY B 66 -2.071 -6.274 21.445 1.00 32.43 H new ATOM 0 HA2 GLY B 66 -3.841 -4.860 21.616 1.00 31.15 H new ATOM 0 HA3 GLY B 66 -3.257 -3.910 20.263 1.00 31.15 H new ATOM 2849 N GLY B 67 -4.066 -6.077 18.526 1.00 22.04 N ATOM 2850 CA GLY B 67 -4.967 -6.596 17.504 1.00 62.23 C ATOM 2851 C GLY B 67 -5.543 -5.457 16.684 1.00 74.43 C ATOM 2852 O GLY B 67 -5.194 -5.287 15.510 1.00 21.20 O ATOM 0 H GLY B 67 -3.080 -6.135 18.273 1.00 22.04 H new ATOM 0 HA2 GLY B 67 -4.431 -7.287 16.853 1.00 62.23 H new ATOM 0 HA3 GLY B 67 -5.773 -7.160 17.973 1.00 62.23 H new ATOM 2856 N SER B 68 -6.423 -4.664 17.319 1.00 11.41 N ATOM 2857 CA SER B 68 -7.000 -3.440 16.745 1.00 24.04 C ATOM 2858 C SER B 68 -7.272 -2.432 17.879 1.00 14.13 C ATOM 2859 O SER B 68 -8.246 -2.578 18.633 1.00 4.33 O ATOM 2860 CB SER B 68 -8.302 -3.758 15.962 1.00 23.54 C ATOM 2861 OG SER B 68 -8.052 -4.620 14.862 1.00 43.03 O ATOM 0 H SER B 68 -6.758 -4.861 18.262 1.00 11.41 H new ATOM 0 HA SER B 68 -6.293 -3.004 16.039 1.00 24.04 H new ATOM 0 HB2 SER B 68 -9.026 -4.222 16.632 1.00 23.54 H new ATOM 0 HB3 SER B 68 -8.748 -2.830 15.604 1.00 23.54 H new ATOM 0 HG SER B 68 -8.892 -4.802 14.391 1.00 43.03 H new ATOM 2867 N GLY B 69 -6.369 -1.437 18.022 1.00 62.45 N ATOM 2868 CA GLY B 69 -6.548 -0.313 18.950 1.00 45.20 C ATOM 2869 C GLY B 69 -7.401 0.790 18.334 1.00 51.11 C ATOM 2870 O GLY B 69 -7.016 1.967 18.328 1.00 53.40 O ATOM 0 H GLY B 69 -5.497 -1.396 17.494 1.00 62.45 H new ATOM 0 HA2 GLY B 69 -7.018 -0.668 19.867 1.00 45.20 H new ATOM 0 HA3 GLY B 69 -5.574 0.091 19.227 1.00 45.20 H new ATOM 2874 N LEU B 70 -8.589 0.376 17.844 1.00 51.12 N ATOM 2875 CA LEU B 70 -9.520 1.207 17.052 1.00 5.12 C ATOM 2876 C LEU B 70 -10.127 2.367 17.872 1.00 14.42 C ATOM 2877 O LEU B 70 -10.481 3.408 17.308 1.00 50.31 O ATOM 2878 CB LEU B 70 -10.622 0.298 16.379 1.00 51.12 C ATOM 2879 CG LEU B 70 -11.162 -0.951 17.190 1.00 23.34 C ATOM 2880 CD1 LEU B 70 -11.881 -0.567 18.502 1.00 54.11 C ATOM 2881 CD2 LEU B 70 -12.072 -1.840 16.308 1.00 71.50 C ATOM 0 H LEU B 70 -8.936 -0.572 17.993 1.00 51.12 H new ATOM 0 HA LEU B 70 -8.948 1.687 16.258 1.00 5.12 H new ATOM 0 HB2 LEU B 70 -11.475 0.932 16.138 1.00 51.12 H new ATOM 0 HB3 LEU B 70 -10.220 -0.067 15.434 1.00 51.12 H new ATOM 0 HG LEU B 70 -10.280 -1.524 17.478 1.00 23.34 H new ATOM 0 HD11 LEU B 70 -12.225 -1.470 19.006 1.00 54.11 H new ATOM 0 HD12 LEU B 70 -11.190 -0.029 19.152 1.00 54.11 H new ATOM 0 HD13 LEU B 70 -12.736 0.070 18.275 1.00 54.11 H new ATOM 0 HD21 LEU B 70 -12.427 -2.689 16.892 1.00 71.50 H new ATOM 0 HD22 LEU B 70 -12.924 -1.256 15.961 1.00 71.50 H new ATOM 0 HD23 LEU B 70 -11.506 -2.201 15.450 1.00 71.50 H new ATOM 2893 N ASP B 71 -10.231 2.174 19.193 1.00 23.21 N ATOM 2894 CA ASP B 71 -10.683 3.211 20.137 1.00 11.32 C ATOM 2895 C ASP B 71 -9.714 3.250 21.324 1.00 4.25 C ATOM 2896 O ASP B 71 -10.070 2.886 22.455 1.00 64.14 O ATOM 2897 CB ASP B 71 -12.154 2.966 20.602 1.00 33.22 C ATOM 2898 CG ASP B 71 -13.200 3.254 19.506 1.00 43.44 C ATOM 2899 OD1 ASP B 71 -13.617 2.315 18.796 1.00 62.44 O ATOM 2900 OD2 ASP B 71 -13.603 4.427 19.348 1.00 31.23 O ATOM 0 H ASP B 71 -10.003 1.288 19.643 1.00 23.21 H new ATOM 0 HA ASP B 71 -10.680 4.179 19.637 1.00 11.32 H new ATOM 0 HB2 ASP B 71 -12.256 1.931 20.928 1.00 33.22 H new ATOM 0 HB3 ASP B 71 -12.363 3.595 21.467 1.00 33.22 H new ATOM 2905 N ASP B 72 -8.464 3.644 21.036 1.00 40.24 N ATOM 2906 CA ASP B 72 -7.427 3.830 22.053 1.00 43.01 C ATOM 2907 C ASP B 72 -6.373 4.816 21.521 1.00 74.24 C ATOM 2908 O ASP B 72 -6.366 5.989 21.914 1.00 3.51 O ATOM 2909 CB ASP B 72 -6.782 2.472 22.448 1.00 52.33 C ATOM 2910 CG ASP B 72 -5.757 2.600 23.595 1.00 0.12 C ATOM 2911 OD1 ASP B 72 -4.542 2.457 23.355 1.00 12.11 O ATOM 2912 OD2 ASP B 72 -6.169 2.843 24.751 1.00 4.01 O ATOM 0 H ASP B 72 -8.147 3.842 20.087 1.00 40.24 H new ATOM 0 HA ASP B 72 -7.877 4.243 22.956 1.00 43.01 H new ATOM 0 HB2 ASP B 72 -7.567 1.777 22.746 1.00 52.33 H new ATOM 0 HB3 ASP B 72 -6.290 2.043 21.575 1.00 52.33 H new ATOM 2917 N ILE B 73 -5.546 4.324 20.564 1.00 71.21 N ATOM 2918 CA ILE B 73 -4.402 5.059 19.967 1.00 14.51 C ATOM 2919 C ILE B 73 -3.486 5.663 21.081 1.00 45.31 C ATOM 2920 O ILE B 73 -3.735 6.790 21.546 1.00 54.20 O ATOM 2921 CB ILE B 73 -4.817 6.173 18.900 1.00 1.12 C ATOM 2922 CG1 ILE B 73 -5.646 5.576 17.695 1.00 40.21 C ATOM 2923 CG2 ILE B 73 -3.558 6.918 18.360 1.00 54.24 C ATOM 2924 CD1 ILE B 73 -7.102 5.236 17.998 1.00 21.20 C ATOM 0 H ILE B 73 -5.658 3.386 20.178 1.00 71.21 H new ATOM 0 HA ILE B 73 -3.840 4.315 19.403 1.00 14.51 H new ATOM 0 HB ILE B 73 -5.460 6.881 19.423 1.00 1.12 H new ATOM 0 HG12 ILE B 73 -5.623 6.291 16.872 1.00 40.21 H new ATOM 0 HG13 ILE B 73 -5.146 4.672 17.346 1.00 40.21 H new ATOM 0 HG21 ILE B 73 -3.864 7.672 17.635 1.00 54.24 H new ATOM 0 HG22 ILE B 73 -3.038 7.401 19.188 1.00 54.24 H new ATOM 0 HG23 ILE B 73 -2.890 6.203 17.880 1.00 54.24 H new ATOM 0 HD11 ILE B 73 -7.576 4.834 17.102 1.00 21.20 H new ATOM 0 HD12 ILE B 73 -7.144 4.494 18.795 1.00 21.20 H new ATOM 0 HD13 ILE B 73 -7.628 6.137 18.314 1.00 21.20 H new ATOM 2936 N PRO B 74 -2.452 4.892 21.562 1.00 73.24 N ATOM 2937 CA PRO B 74 -1.470 5.379 22.578 1.00 44.25 C ATOM 2938 C PRO B 74 -0.696 6.651 22.118 1.00 0.21 C ATOM 2939 O PRO B 74 -0.638 6.925 20.909 1.00 23.14 O ATOM 2940 CB PRO B 74 -0.519 4.158 22.773 1.00 53.02 C ATOM 2941 CG PRO B 74 -1.309 2.971 22.318 1.00 23.34 C ATOM 2942 CD PRO B 74 -2.170 3.475 21.182 1.00 51.21 C ATOM 0 HA PRO B 74 -1.957 5.696 23.500 1.00 44.25 H new ATOM 0 HB2 PRO B 74 0.394 4.272 22.188 1.00 53.02 H new ATOM 0 HB3 PRO B 74 -0.218 4.055 23.816 1.00 53.02 H new ATOM 0 HG2 PRO B 74 -0.653 2.166 21.987 1.00 23.34 H new ATOM 0 HG3 PRO B 74 -1.920 2.572 23.127 1.00 23.34 H new ATOM 0 HD2 PRO B 74 -1.651 3.411 20.226 1.00 51.21 H new ATOM 0 HD3 PRO B 74 -3.088 2.895 21.086 1.00 51.21 H new ATOM 2950 N PRO B 75 -0.112 7.457 23.090 1.00 43.14 N ATOM 2951 CA PRO B 75 0.634 8.713 22.789 1.00 63.03 C ATOM 2952 C PRO B 75 1.637 8.577 21.625 1.00 75.33 C ATOM 2953 O PRO B 75 1.585 9.363 20.680 1.00 12.02 O ATOM 2954 CB PRO B 75 1.350 9.026 24.125 1.00 60.42 C ATOM 2955 CG PRO B 75 0.429 8.476 25.171 1.00 3.02 C ATOM 2956 CD PRO B 75 -0.171 7.219 24.565 1.00 43.24 C ATOM 0 HA PRO B 75 -0.033 9.506 22.451 1.00 63.03 H new ATOM 0 HB2 PRO B 75 2.332 8.555 24.171 1.00 60.42 H new ATOM 0 HB3 PRO B 75 1.504 10.097 24.253 1.00 60.42 H new ATOM 0 HG2 PRO B 75 0.970 8.249 26.090 1.00 3.02 H new ATOM 0 HG3 PRO B 75 -0.347 9.197 25.428 1.00 3.02 H new ATOM 0 HD2 PRO B 75 0.395 6.331 24.848 1.00 43.24 H new ATOM 0 HD3 PRO B 75 -1.196 7.064 24.903 1.00 43.24 H new ATOM 2964 N TYR B 76 2.492 7.522 21.688 1.00 73.13 N ATOM 2965 CA TYR B 76 3.516 7.238 20.652 1.00 32.05 C ATOM 2966 C TYR B 76 2.904 7.150 19.242 1.00 72.32 C ATOM 2967 O TYR B 76 3.487 7.648 18.288 1.00 31.11 O ATOM 2968 CB TYR B 76 4.304 5.928 20.980 1.00 41.22 C ATOM 2969 CG TYR B 76 5.162 5.382 19.815 1.00 43.32 C ATOM 2970 CD1 TYR B 76 4.728 4.290 19.050 1.00 62.31 C ATOM 2971 CD2 TYR B 76 6.374 5.980 19.453 1.00 24.03 C ATOM 2972 CE1 TYR B 76 5.462 3.820 17.979 1.00 23.53 C ATOM 2973 CE2 TYR B 76 7.117 5.505 18.383 1.00 41.01 C ATOM 2974 CZ TYR B 76 6.653 4.428 17.647 1.00 24.41 C ATOM 2975 OH TYR B 76 7.378 3.965 16.569 1.00 62.42 O ATOM 0 H TYR B 76 2.490 6.849 22.455 1.00 73.13 H new ATOM 0 HA TYR B 76 4.212 8.077 20.661 1.00 32.05 H new ATOM 0 HB2 TYR B 76 4.954 6.115 21.835 1.00 41.22 H new ATOM 0 HB3 TYR B 76 3.593 5.159 21.282 1.00 41.22 H new ATOM 0 HD1 TYR B 76 3.797 3.805 19.305 1.00 62.31 H new ATOM 0 HD2 TYR B 76 6.737 6.826 20.017 1.00 24.03 H new ATOM 0 HE1 TYR B 76 5.104 2.979 17.404 1.00 23.53 H new ATOM 0 HE2 TYR B 76 8.055 5.974 18.124 1.00 41.01 H new ATOM 0 HH TYR B 76 8.334 4.109 16.732 1.00 62.42 H new ATOM 2985 N ASP B 77 1.729 6.507 19.140 1.00 74.32 N ATOM 2986 CA ASP B 77 1.053 6.252 17.851 1.00 52.40 C ATOM 2987 C ASP B 77 0.540 7.559 17.225 1.00 21.53 C ATOM 2988 O ASP B 77 0.575 7.718 15.999 1.00 13.11 O ATOM 2989 CB ASP B 77 -0.100 5.239 18.049 1.00 45.53 C ATOM 2990 CG ASP B 77 0.401 3.871 18.544 1.00 74.04 C ATOM 2991 OD1 ASP B 77 0.287 2.863 17.810 1.00 45.22 O ATOM 2992 OD2 ASP B 77 0.925 3.801 19.682 1.00 34.14 O ATOM 0 H ASP B 77 1.219 6.148 19.947 1.00 74.32 H new ATOM 0 HA ASP B 77 1.778 5.823 17.159 1.00 52.40 H new ATOM 0 HB2 ASP B 77 -0.815 5.642 18.766 1.00 45.53 H new ATOM 0 HB3 ASP B 77 -0.632 5.109 17.107 1.00 45.53 H new ATOM 2997 N ARG B 78 0.076 8.492 18.088 1.00 54.55 N ATOM 2998 CA ARG B 78 -0.274 9.863 17.663 1.00 74.10 C ATOM 2999 C ARG B 78 0.971 10.578 17.119 1.00 32.13 C ATOM 3000 O ARG B 78 0.970 11.047 15.982 1.00 71.30 O ATOM 3001 CB ARG B 78 -0.898 10.686 18.828 1.00 62.43 C ATOM 3002 CG ARG B 78 -2.339 10.290 19.186 1.00 72.12 C ATOM 3003 CD ARG B 78 -2.931 11.163 20.311 1.00 33.35 C ATOM 3004 NE ARG B 78 -4.379 10.943 20.485 1.00 33.32 N ATOM 3005 CZ ARG B 78 -5.162 11.569 21.384 1.00 24.23 C ATOM 3006 NH1 ARG B 78 -4.662 12.471 22.231 1.00 62.24 N ATOM 3007 NH2 ARG B 78 -6.462 11.294 21.415 1.00 4.14 N ATOM 0 H ARG B 78 -0.064 8.318 19.083 1.00 54.55 H new ATOM 0 HA ARG B 78 -1.023 9.786 16.874 1.00 74.10 H new ATOM 0 HB2 ARG B 78 -0.272 10.571 19.713 1.00 62.43 H new ATOM 0 HB3 ARG B 78 -0.881 11.742 18.560 1.00 62.43 H new ATOM 0 HG2 ARG B 78 -2.966 10.373 18.298 1.00 72.12 H new ATOM 0 HG3 ARG B 78 -2.359 9.244 19.494 1.00 72.12 H new ATOM 0 HD2 ARG B 78 -2.417 10.944 21.247 1.00 33.35 H new ATOM 0 HD3 ARG B 78 -2.750 12.214 20.086 1.00 33.35 H new ATOM 0 HE ARG B 78 -4.825 10.259 19.873 1.00 33.32 H new ATOM 0 HH11 ARG B 78 -3.668 12.698 22.206 1.00 62.24 H new ATOM 0 HH12 ARG B 78 -5.274 12.933 22.904 1.00 62.24 H new ATOM 0 HH21 ARG B 78 -6.855 10.616 20.763 1.00 4.14 H new ATOM 0 HH22 ARG B 78 -7.066 11.761 22.091 1.00 4.14 H new ATOM 3021 N ASP B 79 2.043 10.589 17.937 1.00 21.23 N ATOM 3022 CA ASP B 79 3.317 11.271 17.610 1.00 33.50 C ATOM 3023 C ASP B 79 3.987 10.681 16.354 1.00 34.21 C ATOM 3024 O ASP B 79 4.663 11.402 15.610 1.00 1.21 O ATOM 3025 CB ASP B 79 4.294 11.206 18.816 1.00 65.04 C ATOM 3026 CG ASP B 79 3.844 12.085 19.996 1.00 32.15 C ATOM 3027 OD1 ASP B 79 3.271 11.563 20.968 1.00 74.02 O ATOM 3028 OD2 ASP B 79 4.047 13.315 19.942 1.00 61.33 O ATOM 0 H ASP B 79 2.052 10.125 18.845 1.00 21.23 H new ATOM 0 HA ASP B 79 3.077 12.312 17.396 1.00 33.50 H new ATOM 0 HB2 ASP B 79 4.382 10.173 19.151 1.00 65.04 H new ATOM 0 HB3 ASP B 79 5.286 11.521 18.492 1.00 65.04 H new ATOM 3033 N PHE B 80 3.770 9.369 16.137 1.00 24.41 N ATOM 3034 CA PHE B 80 4.310 8.623 14.985 1.00 24.43 C ATOM 3035 C PHE B 80 3.675 9.136 13.686 1.00 65.15 C ATOM 3036 O PHE B 80 4.354 9.302 12.664 1.00 34.11 O ATOM 3037 CB PHE B 80 4.047 7.091 15.156 1.00 74.50 C ATOM 3038 CG PHE B 80 4.602 6.248 14.014 1.00 64.13 C ATOM 3039 CD1 PHE B 80 5.956 5.942 13.964 1.00 33.13 C ATOM 3040 CD2 PHE B 80 3.781 5.796 12.976 1.00 13.25 C ATOM 3041 CE1 PHE B 80 6.474 5.219 12.918 1.00 41.12 C ATOM 3042 CE2 PHE B 80 4.303 5.064 11.932 1.00 21.34 C ATOM 3043 CZ PHE B 80 5.653 4.781 11.904 1.00 5.25 C ATOM 0 H PHE B 80 3.209 8.792 16.764 1.00 24.41 H new ATOM 0 HA PHE B 80 5.387 8.781 14.935 1.00 24.43 H new ATOM 0 HB2 PHE B 80 4.491 6.756 16.093 1.00 74.50 H new ATOM 0 HB3 PHE B 80 2.973 6.921 15.234 1.00 74.50 H new ATOM 0 HD1 PHE B 80 6.609 6.277 14.757 1.00 33.13 H new ATOM 0 HD2 PHE B 80 2.725 6.023 12.993 1.00 13.25 H new ATOM 0 HE1 PHE B 80 7.530 4.993 12.891 1.00 41.12 H new ATOM 0 HE2 PHE B 80 3.659 4.713 11.139 1.00 21.34 H new ATOM 0 HZ PHE B 80 6.067 4.214 11.083 1.00 5.25 H new ATOM 3053 N CYS B 81 2.357 9.370 13.756 1.00 65.01 N ATOM 3054 CA CYS B 81 1.569 9.905 12.643 1.00 30.31 C ATOM 3055 C CYS B 81 1.820 11.418 12.457 1.00 3.24 C ATOM 3056 O CYS B 81 1.709 11.935 11.341 1.00 64.22 O ATOM 3057 CB CYS B 81 0.082 9.623 12.922 1.00 31.22 C ATOM 3058 SG CYS B 81 -0.291 7.868 13.143 1.00 63.23 S ATOM 0 H CYS B 81 1.806 9.191 14.595 1.00 65.01 H new ATOM 0 HA CYS B 81 1.869 9.418 11.715 1.00 30.31 H new ATOM 0 HB2 CYS B 81 -0.221 10.166 13.817 1.00 31.22 H new ATOM 0 HB3 CYS B 81 -0.514 10.012 12.097 1.00 31.22 H new ATOM 0 HG CYS B 81 -0.198 7.560 14.402 1.00 63.23 H new ATOM 3064 N LYS B 82 2.194 12.110 13.557 1.00 12.24 N ATOM 3065 CA LYS B 82 2.499 13.552 13.538 1.00 4.21 C ATOM 3066 C LYS B 82 3.939 13.774 13.036 1.00 51.30 C ATOM 3067 O LYS B 82 4.868 13.992 13.825 1.00 22.33 O ATOM 3068 CB LYS B 82 2.298 14.182 14.945 1.00 61.41 C ATOM 3069 CG LYS B 82 0.837 14.190 15.442 1.00 0.54 C ATOM 3070 CD LYS B 82 0.678 14.885 16.818 1.00 13.23 C ATOM 3071 CE LYS B 82 1.085 16.369 16.774 1.00 22.30 C ATOM 3072 NZ LYS B 82 0.860 17.059 18.068 1.00 12.23 N ATOM 0 H LYS B 82 2.292 11.683 14.478 1.00 12.24 H new ATOM 0 HA LYS B 82 1.809 14.047 12.855 1.00 4.21 H new ATOM 0 HB2 LYS B 82 2.910 13.637 15.664 1.00 61.41 H new ATOM 0 HB3 LYS B 82 2.667 15.207 14.926 1.00 61.41 H new ATOM 0 HG2 LYS B 82 0.211 14.698 14.708 1.00 0.54 H new ATOM 0 HG3 LYS B 82 0.476 13.164 15.514 1.00 0.54 H new ATOM 0 HD2 LYS B 82 -0.359 14.804 17.145 1.00 13.23 H new ATOM 0 HD3 LYS B 82 1.287 14.365 17.558 1.00 13.23 H new ATOM 0 HE2 LYS B 82 2.138 16.446 16.504 1.00 22.30 H new ATOM 0 HE3 LYS B 82 0.518 16.875 15.993 1.00 22.30 H new ATOM 0 HZ1 LYS B 82 1.150 18.054 17.986 1.00 12.23 H new ATOM 0 HZ2 LYS B 82 -0.149 17.011 18.316 1.00 12.23 H new ATOM 0 HZ3 LYS B 82 1.421 16.596 18.811 1.00 12.23 H new ATOM 3086 N VAL B 83 4.116 13.630 11.716 1.00 1.51 N ATOM 3087 CA VAL B 83 5.384 13.881 11.013 1.00 62.11 C ATOM 3088 C VAL B 83 5.135 14.863 9.862 1.00 21.21 C ATOM 3089 O VAL B 83 3.980 15.168 9.533 1.00 52.33 O ATOM 3090 CB VAL B 83 6.040 12.541 10.483 1.00 42.31 C ATOM 3091 CG1 VAL B 83 6.468 11.622 11.648 1.00 3.11 C ATOM 3092 CG2 VAL B 83 5.100 11.790 9.506 1.00 22.54 C ATOM 0 H VAL B 83 3.367 13.329 11.093 1.00 1.51 H new ATOM 0 HA VAL B 83 6.091 14.318 11.718 1.00 62.11 H new ATOM 0 HB VAL B 83 6.936 12.822 9.930 1.00 42.31 H new ATOM 0 HG11 VAL B 83 6.914 10.711 11.248 1.00 3.11 H new ATOM 0 HG12 VAL B 83 7.197 12.140 12.271 1.00 3.11 H new ATOM 0 HG13 VAL B 83 5.595 11.365 12.248 1.00 3.11 H new ATOM 0 HG21 VAL B 83 5.586 10.876 9.164 1.00 22.54 H new ATOM 0 HG22 VAL B 83 4.171 11.538 10.017 1.00 22.54 H new ATOM 0 HG23 VAL B 83 4.882 12.427 8.649 1.00 22.54 H new ATOM 3102 N ASP B 84 6.226 15.345 9.253 1.00 61.35 N ATOM 3103 CA ASP B 84 6.175 16.387 8.219 1.00 11.45 C ATOM 3104 C ASP B 84 5.521 15.847 6.922 1.00 64.43 C ATOM 3105 O ASP B 84 5.469 14.627 6.718 1.00 30.11 O ATOM 3106 CB ASP B 84 7.610 16.933 7.968 1.00 12.34 C ATOM 3107 CG ASP B 84 7.659 18.244 7.165 1.00 14.32 C ATOM 3108 OD1 ASP B 84 8.606 18.441 6.376 1.00 32.33 O ATOM 3109 OD2 ASP B 84 6.750 19.089 7.321 1.00 54.42 O ATOM 0 H ASP B 84 7.171 15.023 9.464 1.00 61.35 H new ATOM 0 HA ASP B 84 5.551 17.212 8.562 1.00 11.45 H new ATOM 0 HB2 ASP B 84 8.099 17.091 8.929 1.00 12.34 H new ATOM 0 HB3 ASP B 84 8.187 16.175 7.438 1.00 12.34 H new ATOM 3114 N GLN B 85 5.038 16.774 6.067 1.00 31.13 N ATOM 3115 CA GLN B 85 4.263 16.462 4.843 1.00 31.55 C ATOM 3116 C GLN B 85 4.985 15.452 3.892 1.00 54.25 C ATOM 3117 O GLN B 85 4.366 14.443 3.525 1.00 53.52 O ATOM 3118 CB GLN B 85 3.859 17.779 4.098 1.00 54.12 C ATOM 3119 CG GLN B 85 3.001 17.582 2.824 1.00 3.31 C ATOM 3120 CD GLN B 85 1.657 16.885 3.078 1.00 30.35 C ATOM 3121 OE1 GLN B 85 1.059 17.009 4.146 1.00 65.31 O ATOM 3122 NE2 GLN B 85 1.169 16.156 2.090 1.00 65.21 N ATOM 0 H GLN B 85 5.177 17.775 6.208 1.00 31.13 H new ATOM 0 HA GLN B 85 3.354 15.955 5.166 1.00 31.55 H new ATOM 0 HB2 GLN B 85 3.309 18.415 4.792 1.00 54.12 H new ATOM 0 HB3 GLN B 85 4.768 18.316 3.825 1.00 54.12 H new ATOM 0 HG2 GLN B 85 2.814 18.555 2.370 1.00 3.31 H new ATOM 0 HG3 GLN B 85 3.571 16.998 2.101 1.00 3.31 H new ATOM 0 HE21 GLN B 85 1.687 16.071 1.215 1.00 65.21 H new ATOM 0 HE22 GLN B 85 0.275 15.678 2.202 1.00 65.21 H new ATOM 3131 N PRO B 86 6.297 15.666 3.487 1.00 22.25 N ATOM 3132 CA PRO B 86 7.031 14.665 2.668 1.00 25.33 C ATOM 3133 C PRO B 86 7.250 13.338 3.425 1.00 63.41 C ATOM 3134 O PRO B 86 7.159 12.269 2.819 1.00 50.54 O ATOM 3135 CB PRO B 86 8.381 15.364 2.338 1.00 34.21 C ATOM 3136 CG PRO B 86 8.551 16.380 3.426 1.00 12.41 C ATOM 3137 CD PRO B 86 7.153 16.864 3.739 1.00 60.52 C ATOM 0 HA PRO B 86 6.475 14.382 1.774 1.00 25.33 H new ATOM 0 HB2 PRO B 86 9.205 14.651 2.328 1.00 34.21 H new ATOM 0 HB3 PRO B 86 8.355 15.835 1.355 1.00 34.21 H new ATOM 0 HG2 PRO B 86 9.021 15.940 4.305 1.00 12.41 H new ATOM 0 HG3 PRO B 86 9.189 17.202 3.101 1.00 12.41 H new ATOM 0 HD2 PRO B 86 7.069 17.206 4.771 1.00 60.52 H new ATOM 0 HD3 PRO B 86 6.867 17.701 3.102 1.00 60.52 H new ATOM 3145 N THR B 87 7.481 13.435 4.760 1.00 32.02 N ATOM 3146 CA THR B 87 7.791 12.284 5.632 1.00 42.32 C ATOM 3147 C THR B 87 6.628 11.266 5.677 1.00 50.53 C ATOM 3148 O THR B 87 6.856 10.056 5.805 1.00 1.01 O ATOM 3149 CB THR B 87 8.129 12.771 7.080 1.00 62.25 C ATOM 3150 OG1 THR B 87 9.051 13.873 7.016 1.00 44.31 O ATOM 3151 CG2 THR B 87 8.722 11.646 7.957 1.00 62.00 C ATOM 0 H THR B 87 7.456 14.324 5.260 1.00 32.02 H new ATOM 0 HA THR B 87 8.660 11.781 5.208 1.00 42.32 H new ATOM 0 HB THR B 87 7.195 13.087 7.545 1.00 62.25 H new ATOM 0 HG1 THR B 87 9.260 14.178 7.924 1.00 44.31 H new ATOM 0 HG21 THR B 87 8.939 12.036 8.951 1.00 62.00 H new ATOM 0 HG22 THR B 87 8.004 10.830 8.036 1.00 62.00 H new ATOM 0 HG23 THR B 87 9.642 11.277 7.503 1.00 62.00 H new ATOM 3159 N LEU B 88 5.390 11.784 5.561 1.00 50.32 N ATOM 3160 CA LEU B 88 4.161 10.974 5.437 1.00 4.13 C ATOM 3161 C LEU B 88 4.253 10.034 4.216 1.00 51.13 C ATOM 3162 O LEU B 88 4.030 8.828 4.332 1.00 32.24 O ATOM 3163 CB LEU B 88 2.929 11.916 5.328 1.00 11.12 C ATOM 3164 CG LEU B 88 2.556 12.686 6.638 1.00 30.20 C ATOM 3165 CD1 LEU B 88 1.581 13.850 6.368 1.00 0.01 C ATOM 3166 CD2 LEU B 88 1.981 11.715 7.697 1.00 32.31 C ATOM 0 H LEU B 88 5.212 12.788 5.551 1.00 50.32 H new ATOM 0 HA LEU B 88 4.048 10.351 6.324 1.00 4.13 H new ATOM 0 HB2 LEU B 88 3.118 12.645 4.540 1.00 11.12 H new ATOM 0 HB3 LEU B 88 2.068 11.325 5.016 1.00 11.12 H new ATOM 0 HG LEU B 88 3.474 13.123 7.031 1.00 30.20 H new ATOM 0 HD11 LEU B 88 1.350 14.356 7.305 1.00 0.01 H new ATOM 0 HD12 LEU B 88 2.041 14.557 5.678 1.00 0.01 H new ATOM 0 HD13 LEU B 88 0.662 13.461 5.930 1.00 0.01 H new ATOM 0 HD21 LEU B 88 1.728 12.270 8.600 1.00 32.31 H new ATOM 0 HD22 LEU B 88 1.085 11.236 7.303 1.00 32.31 H new ATOM 0 HD23 LEU B 88 2.725 10.954 7.935 1.00 32.31 H new ATOM 3178 N PHE B 89 4.644 10.609 3.064 1.00 32.15 N ATOM 3179 CA PHE B 89 4.809 9.857 1.804 1.00 34.31 C ATOM 3180 C PHE B 89 6.004 8.898 1.869 1.00 50.24 C ATOM 3181 O PHE B 89 5.984 7.857 1.234 1.00 61.42 O ATOM 3182 CB PHE B 89 4.961 10.819 0.605 1.00 71.20 C ATOM 3183 CG PHE B 89 3.757 11.732 0.392 1.00 60.14 C ATOM 3184 CD1 PHE B 89 3.824 13.096 0.677 1.00 42.42 C ATOM 3185 CD2 PHE B 89 2.559 11.221 -0.091 1.00 30.50 C ATOM 3186 CE1 PHE B 89 2.734 13.916 0.479 1.00 35.30 C ATOM 3187 CE2 PHE B 89 1.471 12.041 -0.289 1.00 44.03 C ATOM 3188 CZ PHE B 89 1.558 13.389 -0.005 1.00 61.40 C ATOM 0 H PHE B 89 4.854 11.604 2.979 1.00 32.15 H new ATOM 0 HA PHE B 89 3.908 9.261 1.663 1.00 34.31 H new ATOM 0 HB2 PHE B 89 5.849 11.433 0.754 1.00 71.20 H new ATOM 0 HB3 PHE B 89 5.126 10.234 -0.300 1.00 71.20 H new ATOM 0 HD1 PHE B 89 4.743 13.515 1.058 1.00 42.42 H new ATOM 0 HD2 PHE B 89 2.480 10.167 -0.314 1.00 30.50 H new ATOM 0 HE1 PHE B 89 2.802 14.970 0.703 1.00 35.30 H new ATOM 0 HE2 PHE B 89 0.547 11.629 -0.667 1.00 44.03 H new ATOM 0 HZ PHE B 89 0.703 14.030 -0.163 1.00 61.40 H new ATOM 3198 N GLU B 90 7.036 9.272 2.643 1.00 32.44 N ATOM 3199 CA GLU B 90 8.221 8.418 2.879 1.00 14.43 C ATOM 3200 C GLU B 90 7.825 7.126 3.619 1.00 63.53 C ATOM 3201 O GLU B 90 8.351 6.046 3.328 1.00 62.00 O ATOM 3202 CB GLU B 90 9.278 9.189 3.701 1.00 73.23 C ATOM 3203 CG GLU B 90 9.803 10.472 3.039 1.00 21.02 C ATOM 3204 CD GLU B 90 10.635 10.219 1.772 1.00 72.12 C ATOM 3205 OE1 GLU B 90 11.837 9.896 1.905 1.00 42.22 O ATOM 3206 OE2 GLU B 90 10.104 10.364 0.644 1.00 74.53 O ATOM 0 H GLU B 90 7.076 10.171 3.123 1.00 32.44 H new ATOM 0 HA GLU B 90 8.645 8.149 1.912 1.00 14.43 H new ATOM 0 HB2 GLU B 90 8.847 9.447 4.668 1.00 73.23 H new ATOM 0 HB3 GLU B 90 10.121 8.526 3.894 1.00 73.23 H new ATOM 0 HG2 GLU B 90 8.957 11.111 2.786 1.00 21.02 H new ATOM 0 HG3 GLU B 90 10.412 11.019 3.759 1.00 21.02 H new ATOM 3213 N LEU B 91 6.897 7.271 4.590 1.00 71.44 N ATOM 3214 CA LEU B 91 6.327 6.141 5.350 1.00 63.44 C ATOM 3215 C LEU B 91 5.431 5.269 4.439 1.00 32.03 C ATOM 3216 O LEU B 91 5.388 4.053 4.605 1.00 21.24 O ATOM 3217 CB LEU B 91 5.522 6.660 6.578 1.00 21.20 C ATOM 3218 CG LEU B 91 6.330 7.428 7.683 1.00 64.53 C ATOM 3219 CD1 LEU B 91 5.386 7.988 8.780 1.00 63.43 C ATOM 3220 CD2 LEU B 91 7.432 6.534 8.297 1.00 35.14 C ATOM 0 H LEU B 91 6.522 8.178 4.868 1.00 71.44 H new ATOM 0 HA LEU B 91 7.147 5.523 5.714 1.00 63.44 H new ATOM 0 HB2 LEU B 91 4.735 7.320 6.213 1.00 21.20 H new ATOM 0 HB3 LEU B 91 5.032 5.807 7.047 1.00 21.20 H new ATOM 0 HG LEU B 91 6.822 8.275 7.204 1.00 64.53 H new ATOM 0 HD11 LEU B 91 5.974 8.515 9.532 1.00 63.43 H new ATOM 0 HD12 LEU B 91 4.672 8.677 8.329 1.00 63.43 H new ATOM 0 HD13 LEU B 91 4.848 7.166 9.251 1.00 63.43 H new ATOM 0 HD21 LEU B 91 7.973 7.095 9.059 1.00 35.14 H new ATOM 0 HD22 LEU B 91 6.976 5.654 8.750 1.00 35.14 H new ATOM 0 HD23 LEU B 91 8.125 6.222 7.515 1.00 35.14 H new ATOM 3232 N ILE B 92 4.722 5.915 3.482 1.00 43.14 N ATOM 3233 CA ILE B 92 3.882 5.223 2.472 1.00 22.31 C ATOM 3234 C ILE B 92 4.774 4.396 1.508 1.00 53.11 C ATOM 3235 O ILE B 92 4.478 3.226 1.225 1.00 61.44 O ATOM 3236 CB ILE B 92 2.980 6.250 1.658 1.00 44.22 C ATOM 3237 CG1 ILE B 92 1.974 6.978 2.613 1.00 12.23 C ATOM 3238 CG2 ILE B 92 2.227 5.562 0.483 1.00 64.41 C ATOM 3239 CD1 ILE B 92 1.111 8.050 1.956 1.00 54.31 C ATOM 0 H ILE B 92 4.716 6.931 3.388 1.00 43.14 H new ATOM 0 HA ILE B 92 3.211 4.546 3.001 1.00 22.31 H new ATOM 0 HB ILE B 92 3.647 6.993 1.221 1.00 44.22 H new ATOM 0 HG12 ILE B 92 1.318 6.231 3.061 1.00 12.23 H new ATOM 0 HG13 ILE B 92 2.537 7.436 3.426 1.00 12.23 H new ATOM 0 HG21 ILE B 92 1.624 6.301 -0.045 1.00 64.41 H new ATOM 0 HG22 ILE B 92 2.950 5.125 -0.206 1.00 64.41 H new ATOM 0 HG23 ILE B 92 1.579 4.778 0.875 1.00 64.41 H new ATOM 0 HD11 ILE B 92 0.450 8.492 2.701 1.00 54.31 H new ATOM 0 HD12 ILE B 92 1.751 8.824 1.534 1.00 54.31 H new ATOM 0 HD13 ILE B 92 0.514 7.601 1.163 1.00 54.31 H new ATOM 3251 N LEU B 93 5.887 5.015 1.053 1.00 64.32 N ATOM 3252 CA LEU B 93 6.841 4.401 0.102 1.00 32.25 C ATOM 3253 C LEU B 93 7.556 3.199 0.749 1.00 50.30 C ATOM 3254 O LEU B 93 7.727 2.162 0.110 1.00 10.51 O ATOM 3255 CB LEU B 93 7.886 5.456 -0.400 1.00 51.12 C ATOM 3256 CG LEU B 93 7.337 6.597 -1.325 1.00 53.22 C ATOM 3257 CD1 LEU B 93 8.443 7.629 -1.668 1.00 3.21 C ATOM 3258 CD2 LEU B 93 6.694 6.021 -2.608 1.00 55.10 C ATOM 0 H LEU B 93 6.150 5.959 1.337 1.00 64.32 H new ATOM 0 HA LEU B 93 6.277 4.044 -0.759 1.00 32.25 H new ATOM 0 HB2 LEU B 93 8.351 5.917 0.471 1.00 51.12 H new ATOM 0 HB3 LEU B 93 8.672 4.928 -0.939 1.00 51.12 H new ATOM 0 HG LEU B 93 6.558 7.120 -0.770 1.00 53.22 H new ATOM 0 HD11 LEU B 93 8.029 8.406 -2.310 1.00 3.21 H new ATOM 0 HD12 LEU B 93 8.818 8.080 -0.749 1.00 3.21 H new ATOM 0 HD13 LEU B 93 9.261 7.128 -2.186 1.00 3.21 H new ATOM 0 HD21 LEU B 93 6.323 6.838 -3.227 1.00 55.10 H new ATOM 0 HD22 LEU B 93 7.439 5.452 -3.165 1.00 55.10 H new ATOM 0 HD23 LEU B 93 5.866 5.366 -2.337 1.00 55.10 H new ATOM 3270 N ALA B 94 7.948 3.361 2.028 1.00 0.33 N ATOM 3271 CA ALA B 94 8.643 2.318 2.812 1.00 21.41 C ATOM 3272 C ALA B 94 7.703 1.152 3.160 1.00 13.43 C ATOM 3273 O ALA B 94 8.114 -0.011 3.156 1.00 65.24 O ATOM 3274 CB ALA B 94 9.225 2.932 4.094 1.00 3.14 C ATOM 0 H ALA B 94 7.791 4.223 2.550 1.00 0.33 H new ATOM 0 HA ALA B 94 9.452 1.918 2.201 1.00 21.41 H new ATOM 0 HB1 ALA B 94 9.736 2.159 4.668 1.00 3.14 H new ATOM 0 HB2 ALA B 94 9.934 3.718 3.832 1.00 3.14 H new ATOM 0 HB3 ALA B 94 8.419 3.356 4.693 1.00 3.14 H new ATOM 3280 N ALA B 95 6.436 1.487 3.466 1.00 21.31 N ATOM 3281 CA ALA B 95 5.394 0.499 3.810 1.00 3.03 C ATOM 3282 C ALA B 95 4.938 -0.301 2.580 1.00 70.12 C ATOM 3283 O ALA B 95 4.471 -1.423 2.719 1.00 71.22 O ATOM 3284 CB ALA B 95 4.201 1.191 4.472 1.00 21.34 C ATOM 0 H ALA B 95 6.104 2.451 3.482 1.00 21.31 H new ATOM 0 HA ALA B 95 5.830 -0.207 4.516 1.00 3.03 H new ATOM 0 HB1 ALA B 95 3.442 0.449 4.720 1.00 21.34 H new ATOM 0 HB2 ALA B 95 4.530 1.691 5.383 1.00 21.34 H new ATOM 0 HB3 ALA B 95 3.780 1.926 3.786 1.00 21.34 H new ATOM 3290 N ASN B 96 5.027 0.314 1.387 1.00 74.32 N ATOM 3291 CA ASN B 96 4.743 -0.370 0.101 1.00 0.02 C ATOM 3292 C ASN B 96 5.958 -1.237 -0.319 1.00 64.15 C ATOM 3293 O ASN B 96 5.803 -2.354 -0.821 1.00 53.23 O ATOM 3294 CB ASN B 96 4.392 0.688 -0.993 1.00 22.51 C ATOM 3295 CG ASN B 96 3.989 0.089 -2.354 1.00 72.51 C ATOM 3296 OD1 ASN B 96 3.481 -1.030 -2.440 1.00 71.53 O ATOM 3297 ND2 ASN B 96 4.169 0.851 -3.419 1.00 14.24 N ATOM 0 H ASN B 96 5.295 1.292 1.281 1.00 74.32 H new ATOM 0 HA ASN B 96 3.885 -1.032 0.221 1.00 0.02 H new ATOM 0 HB2 ASN B 96 3.576 1.312 -0.629 1.00 22.51 H new ATOM 0 HB3 ASN B 96 5.252 1.341 -1.138 1.00 22.51 H new ATOM 0 HD21 ASN B 96 3.885 0.516 -4.340 1.00 14.24 H new ATOM 0 HD22 ASN B 96 4.592 1.774 -3.320 1.00 14.24 H new ATOM 3304 N TYR B 97 7.168 -0.698 -0.064 1.00 12.34 N ATOM 3305 CA TYR B 97 8.462 -1.346 -0.396 1.00 42.25 C ATOM 3306 C TYR B 97 8.682 -2.640 0.424 1.00 55.13 C ATOM 3307 O TYR B 97 9.153 -3.650 -0.110 1.00 44.22 O ATOM 3308 CB TYR B 97 9.618 -0.323 -0.162 1.00 20.15 C ATOM 3309 CG TYR B 97 11.048 -0.877 -0.297 1.00 22.24 C ATOM 3310 CD1 TYR B 97 11.937 -0.845 0.783 1.00 21.30 C ATOM 3311 CD2 TYR B 97 11.503 -1.441 -1.495 1.00 35.23 C ATOM 3312 CE1 TYR B 97 13.212 -1.354 0.678 1.00 64.13 C ATOM 3313 CE2 TYR B 97 12.788 -1.950 -1.601 1.00 71.12 C ATOM 3314 CZ TYR B 97 13.635 -1.900 -0.509 1.00 11.50 C ATOM 3315 OH TYR B 97 14.906 -2.422 -0.584 1.00 33.34 O ATOM 0 H TYR B 97 7.280 0.211 0.384 1.00 12.34 H new ATOM 0 HA TYR B 97 8.449 -1.643 -1.445 1.00 42.25 H new ATOM 0 HB2 TYR B 97 9.499 0.497 -0.870 1.00 20.15 H new ATOM 0 HB3 TYR B 97 9.506 0.099 0.837 1.00 20.15 H new ATOM 0 HD1 TYR B 97 11.616 -0.412 1.719 1.00 21.30 H new ATOM 0 HD2 TYR B 97 10.843 -1.480 -2.349 1.00 35.23 H new ATOM 0 HE1 TYR B 97 13.878 -1.324 1.528 1.00 64.13 H new ATOM 0 HE2 TYR B 97 13.126 -2.383 -2.531 1.00 71.12 H new ATOM 0 HH TYR B 97 15.063 -2.773 -1.485 1.00 33.34 H new ATOM 3325 N LEU B 98 8.348 -2.589 1.722 1.00 33.32 N ATOM 3326 CA LEU B 98 8.513 -3.725 2.652 1.00 14.52 C ATOM 3327 C LEU B 98 7.200 -4.529 2.808 1.00 74.33 C ATOM 3328 O LEU B 98 7.215 -5.630 3.373 1.00 62.34 O ATOM 3329 CB LEU B 98 9.007 -3.201 4.029 1.00 1.44 C ATOM 3330 CG LEU B 98 10.403 -2.495 4.041 1.00 43.24 C ATOM 3331 CD1 LEU B 98 10.757 -1.982 5.459 1.00 35.55 C ATOM 3332 CD2 LEU B 98 11.505 -3.428 3.478 1.00 61.30 C ATOM 0 H LEU B 98 7.954 -1.757 2.162 1.00 33.32 H new ATOM 0 HA LEU B 98 9.257 -4.405 2.238 1.00 14.52 H new ATOM 0 HB2 LEU B 98 8.266 -2.501 4.415 1.00 1.44 H new ATOM 0 HB3 LEU B 98 9.042 -4.041 4.722 1.00 1.44 H new ATOM 0 HG LEU B 98 10.346 -1.626 3.386 1.00 43.24 H new ATOM 0 HD11 LEU B 98 11.732 -1.496 5.437 1.00 35.55 H new ATOM 0 HD12 LEU B 98 10.002 -1.267 5.786 1.00 35.55 H new ATOM 0 HD13 LEU B 98 10.786 -2.822 6.153 1.00 35.55 H new ATOM 0 HD21 LEU B 98 12.465 -2.911 3.498 1.00 61.30 H new ATOM 0 HD22 LEU B 98 11.565 -4.329 4.088 1.00 61.30 H new ATOM 0 HD23 LEU B 98 11.261 -3.701 2.451 1.00 61.30 H new ATOM 3344 N ASP B 99 6.094 -3.979 2.256 1.00 2.43 N ATOM 3345 CA ASP B 99 4.721 -4.517 2.394 1.00 53.03 C ATOM 3346 C ASP B 99 4.366 -4.772 3.876 1.00 14.01 C ATOM 3347 O ASP B 99 4.317 -5.915 4.353 1.00 73.23 O ATOM 3348 CB ASP B 99 4.466 -5.768 1.497 1.00 2.54 C ATOM 3349 CG ASP B 99 2.992 -6.275 1.492 1.00 54.24 C ATOM 3350 OD1 ASP B 99 2.773 -7.486 1.262 1.00 72.44 O ATOM 3351 OD2 ASP B 99 2.052 -5.467 1.670 1.00 30.40 O ATOM 0 H ASP B 99 6.132 -3.131 1.690 1.00 2.43 H new ATOM 0 HA ASP B 99 4.042 -3.749 2.024 1.00 53.03 H new ATOM 0 HB2 ASP B 99 4.758 -5.531 0.474 1.00 2.54 H new ATOM 0 HB3 ASP B 99 5.114 -6.578 1.833 1.00 2.54 H new ATOM 3356 N ILE B 100 4.246 -3.659 4.610 1.00 45.41 N ATOM 3357 CA ILE B 100 3.774 -3.634 5.998 1.00 24.51 C ATOM 3358 C ILE B 100 2.490 -2.801 6.018 1.00 72.24 C ATOM 3359 O ILE B 100 2.540 -1.572 6.088 1.00 21.52 O ATOM 3360 CB ILE B 100 4.845 -3.036 7.002 1.00 40.52 C ATOM 3361 CG1 ILE B 100 6.230 -3.707 6.783 1.00 72.20 C ATOM 3362 CG2 ILE B 100 4.373 -3.202 8.479 1.00 35.11 C ATOM 3363 CD1 ILE B 100 7.350 -3.191 7.665 1.00 25.01 C ATOM 0 H ILE B 100 4.479 -2.734 4.248 1.00 45.41 H new ATOM 0 HA ILE B 100 3.595 -4.654 6.337 1.00 24.51 H new ATOM 0 HB ILE B 100 4.947 -1.970 6.801 1.00 40.52 H new ATOM 0 HG12 ILE B 100 6.125 -4.779 6.948 1.00 72.20 H new ATOM 0 HG13 ILE B 100 6.519 -3.572 5.741 1.00 72.20 H new ATOM 0 HG21 ILE B 100 5.124 -2.785 9.150 1.00 35.11 H new ATOM 0 HG22 ILE B 100 3.428 -2.677 8.620 1.00 35.11 H new ATOM 0 HG23 ILE B 100 4.237 -4.260 8.701 1.00 35.11 H new ATOM 0 HD11 ILE B 100 8.272 -3.724 7.432 1.00 25.01 H new ATOM 0 HD12 ILE B 100 7.493 -2.125 7.486 1.00 25.01 H new ATOM 0 HD13 ILE B 100 7.092 -3.352 8.712 1.00 25.01 H new ATOM 3375 N LYS B 101 1.357 -3.491 5.869 1.00 11.23 N ATOM 3376 CA LYS B 101 0.011 -2.889 5.907 1.00 43.30 C ATOM 3377 C LYS B 101 -0.343 -2.273 7.297 1.00 41.45 C ATOM 3378 O LYS B 101 -1.027 -1.253 7.325 1.00 52.32 O ATOM 3379 CB LYS B 101 -1.041 -3.934 5.462 1.00 22.12 C ATOM 3380 CG LYS B 101 -0.799 -4.457 4.028 1.00 73.14 C ATOM 3381 CD LYS B 101 -1.782 -5.581 3.628 1.00 22.13 C ATOM 3382 CE LYS B 101 -1.540 -6.092 2.197 1.00 44.35 C ATOM 3383 NZ LYS B 101 -2.550 -7.118 1.796 1.00 1.33 N ATOM 0 H LYS B 101 1.343 -4.499 5.716 1.00 11.23 H new ATOM 0 HA LYS B 101 0.003 -2.054 5.207 1.00 43.30 H new ATOM 0 HB2 LYS B 101 -1.028 -4.774 6.157 1.00 22.12 H new ATOM 0 HB3 LYS B 101 -2.034 -3.489 5.518 1.00 22.12 H new ATOM 0 HG2 LYS B 101 -0.893 -3.630 3.324 1.00 73.14 H new ATOM 0 HG3 LYS B 101 0.223 -4.829 3.949 1.00 73.14 H new ATOM 0 HD2 LYS B 101 -1.685 -6.411 4.328 1.00 22.13 H new ATOM 0 HD3 LYS B 101 -2.804 -5.212 3.711 1.00 22.13 H new ATOM 0 HE2 LYS B 101 -1.577 -5.254 1.501 1.00 44.35 H new ATOM 0 HE3 LYS B 101 -0.540 -6.520 2.128 1.00 44.35 H new ATOM 0 HZ1 LYS B 101 -2.406 -7.376 0.799 1.00 1.33 H new ATOM 0 HZ2 LYS B 101 -2.441 -7.964 2.392 1.00 1.33 H new ATOM 0 HZ3 LYS B 101 -3.507 -6.729 1.918 1.00 1.33 H new ATOM 3397 N PRO B 102 0.082 -2.877 8.484 1.00 32.41 N ATOM 3398 CA PRO B 102 0.022 -2.174 9.808 1.00 63.43 C ATOM 3399 C PRO B 102 0.659 -0.754 9.800 1.00 75.41 C ATOM 3400 O PRO B 102 0.204 0.136 10.515 1.00 44.04 O ATOM 3401 CB PRO B 102 0.808 -3.129 10.748 1.00 24.25 C ATOM 3402 CG PRO B 102 0.566 -4.492 10.169 1.00 61.44 C ATOM 3403 CD PRO B 102 0.541 -4.298 8.668 1.00 3.41 C ATOM 0 HA PRO B 102 -1.008 -1.990 10.113 1.00 63.43 H new ATOM 0 HB2 PRO B 102 1.870 -2.886 10.765 1.00 24.25 H new ATOM 0 HB3 PRO B 102 0.449 -3.062 11.775 1.00 24.25 H new ATOM 0 HG2 PRO B 102 1.353 -5.187 10.461 1.00 61.44 H new ATOM 0 HG3 PRO B 102 -0.376 -4.908 10.526 1.00 61.44 H new ATOM 0 HD2 PRO B 102 1.526 -4.458 8.230 1.00 3.41 H new ATOM 0 HD3 PRO B 102 -0.139 -5.001 8.187 1.00 3.41 H new ATOM 3411 N LEU B 103 1.719 -0.571 8.993 1.00 25.52 N ATOM 3412 CA LEU B 103 2.394 0.738 8.826 1.00 42.54 C ATOM 3413 C LEU B 103 1.585 1.605 7.836 1.00 34.21 C ATOM 3414 O LEU B 103 1.231 2.755 8.142 1.00 14.22 O ATOM 3415 CB LEU B 103 3.862 0.511 8.306 1.00 72.44 C ATOM 3416 CG LEU B 103 4.935 1.612 8.622 1.00 44.44 C ATOM 3417 CD1 LEU B 103 4.669 2.970 7.917 1.00 22.53 C ATOM 3418 CD2 LEU B 103 5.090 1.786 10.146 1.00 54.53 C ATOM 0 H LEU B 103 2.134 -1.320 8.438 1.00 25.52 H new ATOM 0 HA LEU B 103 2.446 1.257 9.783 1.00 42.54 H new ATOM 0 HB2 LEU B 103 4.220 -0.432 8.719 1.00 72.44 H new ATOM 0 HB3 LEU B 103 3.818 0.389 7.224 1.00 72.44 H new ATOM 0 HG LEU B 103 5.877 1.255 8.206 1.00 44.44 H new ATOM 0 HD11 LEU B 103 5.453 3.679 8.185 1.00 22.53 H new ATOM 0 HD12 LEU B 103 4.665 2.824 6.837 1.00 22.53 H new ATOM 0 HD13 LEU B 103 3.702 3.361 8.234 1.00 22.53 H new ATOM 0 HD21 LEU B 103 5.837 2.553 10.351 1.00 54.53 H new ATOM 0 HD22 LEU B 103 4.135 2.086 10.577 1.00 54.53 H new ATOM 0 HD23 LEU B 103 5.408 0.842 10.590 1.00 54.53 H new ATOM 3430 N LEU B 104 1.278 1.002 6.666 1.00 61.44 N ATOM 3431 CA LEU B 104 0.681 1.686 5.502 1.00 42.02 C ATOM 3432 C LEU B 104 -0.670 2.319 5.845 1.00 44.13 C ATOM 3433 O LEU B 104 -0.868 3.515 5.629 1.00 31.35 O ATOM 3434 CB LEU B 104 0.502 0.680 4.323 1.00 0.41 C ATOM 3435 CG LEU B 104 -0.067 1.256 2.981 1.00 34.24 C ATOM 3436 CD1 LEU B 104 0.875 2.327 2.373 1.00 65.32 C ATOM 3437 CD2 LEU B 104 -0.356 0.117 1.971 1.00 63.45 C ATOM 0 H LEU B 104 1.442 0.008 6.503 1.00 61.44 H new ATOM 0 HA LEU B 104 1.362 2.484 5.207 1.00 42.02 H new ATOM 0 HB2 LEU B 104 1.471 0.226 4.114 1.00 0.41 H new ATOM 0 HB3 LEU B 104 -0.159 -0.120 4.657 1.00 0.41 H new ATOM 0 HG LEU B 104 -1.011 1.752 3.207 1.00 34.24 H new ATOM 0 HD11 LEU B 104 0.447 2.703 1.444 1.00 65.32 H new ATOM 0 HD12 LEU B 104 0.992 3.150 3.077 1.00 65.32 H new ATOM 0 HD13 LEU B 104 1.849 1.882 2.170 1.00 65.32 H new ATOM 0 HD21 LEU B 104 -0.750 0.541 1.047 1.00 63.45 H new ATOM 0 HD22 LEU B 104 0.567 -0.423 1.758 1.00 63.45 H new ATOM 0 HD23 LEU B 104 -1.088 -0.569 2.396 1.00 63.45 H new ATOM 3449 N ASP B 105 -1.559 1.494 6.429 1.00 14.43 N ATOM 3450 CA ASP B 105 -2.958 1.854 6.707 1.00 30.15 C ATOM 3451 C ASP B 105 -3.052 2.989 7.741 1.00 3.32 C ATOM 3452 O ASP B 105 -3.884 3.883 7.607 1.00 3.54 O ATOM 3453 CB ASP B 105 -3.748 0.607 7.191 1.00 61.23 C ATOM 3454 CG ASP B 105 -5.261 0.875 7.282 1.00 22.51 C ATOM 3455 OD1 ASP B 105 -5.935 0.888 6.225 1.00 34.43 O ATOM 3456 OD2 ASP B 105 -5.788 1.111 8.396 1.00 1.51 O ATOM 0 H ASP B 105 -1.321 0.547 6.724 1.00 14.43 H new ATOM 0 HA ASP B 105 -3.403 2.215 5.780 1.00 30.15 H new ATOM 0 HB2 ASP B 105 -3.568 -0.222 6.507 1.00 61.23 H new ATOM 0 HB3 ASP B 105 -3.376 0.300 8.169 1.00 61.23 H new ATOM 3461 N VAL B 106 -2.169 2.941 8.751 1.00 65.53 N ATOM 3462 CA VAL B 106 -2.077 3.974 9.804 1.00 50.04 C ATOM 3463 C VAL B 106 -1.662 5.335 9.195 1.00 61.11 C ATOM 3464 O VAL B 106 -2.272 6.370 9.496 1.00 32.33 O ATOM 3465 CB VAL B 106 -1.075 3.514 10.934 1.00 53.14 C ATOM 3466 CG1 VAL B 106 -0.684 4.659 11.904 1.00 1.31 C ATOM 3467 CG2 VAL B 106 -1.666 2.316 11.714 1.00 44.23 C ATOM 0 H VAL B 106 -1.495 2.184 8.864 1.00 65.53 H new ATOM 0 HA VAL B 106 -3.059 4.104 10.260 1.00 50.04 H new ATOM 0 HB VAL B 106 -0.155 3.207 10.436 1.00 53.14 H new ATOM 0 HG11 VAL B 106 0.006 4.278 12.657 1.00 1.31 H new ATOM 0 HG12 VAL B 106 -0.204 5.462 11.344 1.00 1.31 H new ATOM 0 HG13 VAL B 106 -1.579 5.043 12.393 1.00 1.31 H new ATOM 0 HG21 VAL B 106 -0.967 2.007 12.491 1.00 44.23 H new ATOM 0 HG22 VAL B 106 -2.610 2.610 12.172 1.00 44.23 H new ATOM 0 HG23 VAL B 106 -1.838 1.485 11.029 1.00 44.23 H new ATOM 3477 N THR B 107 -0.649 5.309 8.313 1.00 61.14 N ATOM 3478 CA THR B 107 -0.177 6.511 7.595 1.00 2.14 C ATOM 3479 C THR B 107 -1.236 6.996 6.568 1.00 11.52 C ATOM 3480 O THR B 107 -1.374 8.202 6.322 1.00 63.34 O ATOM 3481 CB THR B 107 1.194 6.232 6.895 1.00 15.34 C ATOM 3482 OG1 THR B 107 2.104 5.658 7.852 1.00 51.22 O ATOM 3483 CG2 THR B 107 1.828 7.511 6.314 1.00 32.50 C ATOM 0 H THR B 107 -0.135 4.460 8.077 1.00 61.14 H new ATOM 0 HA THR B 107 -0.030 7.307 8.325 1.00 2.14 H new ATOM 0 HB THR B 107 1.006 5.547 6.069 1.00 15.34 H new ATOM 0 HG1 THR B 107 1.887 4.711 7.983 1.00 51.22 H new ATOM 0 HG21 THR B 107 2.777 7.263 5.839 1.00 32.50 H new ATOM 0 HG22 THR B 107 1.156 7.947 5.575 1.00 32.50 H new ATOM 0 HG23 THR B 107 2.000 8.229 7.116 1.00 32.50 H new ATOM 3491 N CYS B 108 -2.009 6.036 6.015 1.00 70.13 N ATOM 3492 CA CYS B 108 -3.102 6.314 5.063 1.00 74.03 C ATOM 3493 C CYS B 108 -4.283 7.001 5.777 1.00 32.55 C ATOM 3494 O CYS B 108 -4.961 7.833 5.179 1.00 11.20 O ATOM 3495 CB CYS B 108 -3.571 5.014 4.359 1.00 23.24 C ATOM 3496 SG CYS B 108 -2.344 4.296 3.241 1.00 74.45 S ATOM 0 H CYS B 108 -1.890 5.044 6.218 1.00 70.13 H new ATOM 0 HA CYS B 108 -2.719 6.992 4.300 1.00 74.03 H new ATOM 0 HB2 CYS B 108 -3.831 4.276 5.118 1.00 23.24 H new ATOM 0 HB3 CYS B 108 -4.480 5.226 3.796 1.00 23.24 H new ATOM 0 HG CYS B 108 -1.369 3.788 3.935 1.00 74.45 H new ATOM 3502 N LYS B 109 -4.509 6.649 7.062 1.00 44.31 N ATOM 3503 CA LYS B 109 -5.536 7.300 7.905 1.00 54.44 C ATOM 3504 C LYS B 109 -5.107 8.728 8.255 1.00 1.20 C ATOM 3505 O LYS B 109 -5.939 9.625 8.274 1.00 61.31 O ATOM 3506 CB LYS B 109 -5.830 6.472 9.209 1.00 20.03 C ATOM 3507 CG LYS B 109 -7.097 5.589 9.146 1.00 2.12 C ATOM 3508 CD LYS B 109 -7.019 4.481 8.076 1.00 23.01 C ATOM 3509 CE LYS B 109 -8.297 3.635 8.022 1.00 61.23 C ATOM 3510 NZ LYS B 109 -8.181 2.530 7.040 1.00 54.33 N ATOM 0 H LYS B 109 -3.990 5.913 7.540 1.00 44.31 H new ATOM 0 HA LYS B 109 -6.462 7.340 7.331 1.00 54.44 H new ATOM 0 HB2 LYS B 109 -4.971 5.835 9.419 1.00 20.03 H new ATOM 0 HB3 LYS B 109 -5.927 7.163 10.047 1.00 20.03 H new ATOM 0 HG2 LYS B 109 -7.260 5.131 10.121 1.00 2.12 H new ATOM 0 HG3 LYS B 109 -7.961 6.221 8.942 1.00 2.12 H new ATOM 0 HD2 LYS B 109 -6.843 4.933 7.100 1.00 23.01 H new ATOM 0 HD3 LYS B 109 -6.167 3.835 8.286 1.00 23.01 H new ATOM 0 HE2 LYS B 109 -8.503 3.224 9.010 1.00 61.23 H new ATOM 0 HE3 LYS B 109 -9.143 4.270 7.758 1.00 61.23 H new ATOM 0 HZ1 LYS B 109 -8.801 2.721 6.227 1.00 54.33 H new ATOM 0 HZ2 LYS B 109 -7.196 2.457 6.714 1.00 54.33 H new ATOM 0 HZ3 LYS B 109 -8.465 1.636 7.489 1.00 54.33 H new ATOM 3524 N THR B 110 -3.802 8.911 8.520 1.00 41.34 N ATOM 3525 CA THR B 110 -3.229 10.220 8.879 1.00 4.32 C ATOM 3526 C THR B 110 -3.414 11.240 7.737 1.00 32.10 C ATOM 3527 O THR B 110 -3.965 12.331 7.947 1.00 13.33 O ATOM 3528 CB THR B 110 -1.714 10.084 9.221 1.00 60.24 C ATOM 3529 OG1 THR B 110 -1.545 9.058 10.208 1.00 22.12 O ATOM 3530 CG2 THR B 110 -1.110 11.408 9.740 1.00 1.41 C ATOM 0 H THR B 110 -3.116 8.157 8.491 1.00 41.34 H new ATOM 0 HA THR B 110 -3.761 10.582 9.759 1.00 4.32 H new ATOM 0 HB THR B 110 -1.186 9.824 8.303 1.00 60.24 H new ATOM 0 HG1 THR B 110 -1.723 8.183 9.804 1.00 22.12 H new ATOM 0 HG21 THR B 110 -0.053 11.263 9.965 1.00 1.41 H new ATOM 0 HG22 THR B 110 -1.216 12.180 8.978 1.00 1.41 H new ATOM 0 HG23 THR B 110 -1.634 11.717 10.645 1.00 1.41 H new ATOM 3538 N VAL B 111 -2.972 10.845 6.521 1.00 74.35 N ATOM 3539 CA VAL B 111 -3.042 11.700 5.322 1.00 72.13 C ATOM 3540 C VAL B 111 -4.507 11.950 4.897 1.00 12.52 C ATOM 3541 O VAL B 111 -4.838 13.034 4.391 1.00 32.02 O ATOM 3542 CB VAL B 111 -2.185 11.118 4.124 1.00 31.01 C ATOM 3543 CG1 VAL B 111 -0.683 11.024 4.499 1.00 31.14 C ATOM 3544 CG2 VAL B 111 -2.714 9.751 3.637 1.00 35.13 C ATOM 0 H VAL B 111 -2.559 9.928 6.348 1.00 74.35 H new ATOM 0 HA VAL B 111 -2.603 12.661 5.589 1.00 72.13 H new ATOM 0 HB VAL B 111 -2.288 11.819 3.296 1.00 31.01 H new ATOM 0 HG11 VAL B 111 -0.122 10.621 3.656 1.00 31.14 H new ATOM 0 HG12 VAL B 111 -0.306 12.017 4.744 1.00 31.14 H new ATOM 0 HG13 VAL B 111 -0.564 10.368 5.361 1.00 31.14 H new ATOM 0 HG21 VAL B 111 -2.094 9.393 2.815 1.00 35.13 H new ATOM 0 HG22 VAL B 111 -2.679 9.034 4.457 1.00 35.13 H new ATOM 0 HG23 VAL B 111 -3.743 9.860 3.295 1.00 35.13 H new ATOM 3554 N ALA B 112 -5.379 10.940 5.138 1.00 35.44 N ATOM 3555 CA ALA B 112 -6.827 11.045 4.883 1.00 30.35 C ATOM 3556 C ALA B 112 -7.475 12.061 5.841 1.00 33.00 C ATOM 3557 O ALA B 112 -8.295 12.873 5.417 1.00 72.11 O ATOM 3558 CB ALA B 112 -7.500 9.673 5.018 1.00 51.30 C ATOM 0 H ALA B 112 -5.094 10.035 5.513 1.00 35.44 H new ATOM 0 HA ALA B 112 -6.969 11.398 3.862 1.00 30.35 H new ATOM 0 HB1 ALA B 112 -8.568 9.771 4.826 1.00 51.30 H new ATOM 0 HB2 ALA B 112 -7.064 8.981 4.297 1.00 51.30 H new ATOM 0 HB3 ALA B 112 -7.346 9.290 6.027 1.00 51.30 H new ATOM 3564 N ASN B 113 -7.053 12.025 7.127 1.00 22.42 N ATOM 3565 CA ASN B 113 -7.585 12.913 8.190 1.00 10.41 C ATOM 3566 C ASN B 113 -7.211 14.386 7.944 1.00 31.42 C ATOM 3567 O ASN B 113 -7.922 15.280 8.404 1.00 35.13 O ATOM 3568 CB ASN B 113 -7.115 12.458 9.612 1.00 42.15 C ATOM 3569 CG ASN B 113 -7.858 11.216 10.143 1.00 24.42 C ATOM 3570 OD1 ASN B 113 -9.040 11.001 9.855 1.00 52.41 O ATOM 3571 ND2 ASN B 113 -7.175 10.396 10.931 1.00 3.00 N ATOM 0 H ASN B 113 -6.335 11.380 7.457 1.00 22.42 H new ATOM 0 HA ASN B 113 -8.671 12.832 8.151 1.00 10.41 H new ATOM 0 HB2 ASN B 113 -6.046 12.245 9.581 1.00 42.15 H new ATOM 0 HB3 ASN B 113 -7.256 13.281 10.312 1.00 42.15 H new ATOM 0 HD21 ASN B 113 -7.625 9.565 11.315 1.00 3.00 H new ATOM 0 HD22 ASN B 113 -6.200 10.597 11.153 1.00 3.00 H new ATOM 3578 N MET B 114 -6.101 14.625 7.220 1.00 43.01 N ATOM 3579 CA MET B 114 -5.674 15.994 6.848 1.00 1.43 C ATOM 3580 C MET B 114 -6.636 16.594 5.807 1.00 70.23 C ATOM 3581 O MET B 114 -7.124 17.718 5.966 1.00 13.44 O ATOM 3582 CB MET B 114 -4.229 16.004 6.278 1.00 50.31 C ATOM 3583 CG MET B 114 -3.148 15.450 7.213 1.00 13.11 C ATOM 3584 SD MET B 114 -1.474 15.779 6.605 1.00 44.23 S ATOM 3585 CE MET B 114 -1.547 15.164 4.916 1.00 72.12 C ATOM 0 H MET B 114 -5.481 13.890 6.879 1.00 43.01 H new ATOM 0 HA MET B 114 -5.693 16.598 7.755 1.00 1.43 H new ATOM 0 HB2 MET B 114 -4.217 15.426 5.354 1.00 50.31 H new ATOM 0 HB3 MET B 114 -3.967 17.029 6.016 1.00 50.31 H new ATOM 0 HG2 MET B 114 -3.266 15.892 8.202 1.00 13.11 H new ATOM 0 HG3 MET B 114 -3.286 14.375 7.326 1.00 13.11 H new ATOM 0 HE1 MET B 114 -0.639 14.604 4.693 1.00 72.12 H new ATOM 0 HE2 MET B 114 -2.413 14.512 4.803 1.00 72.12 H new ATOM 0 HE3 MET B 114 -1.633 16.004 4.226 1.00 72.12 H new ATOM 3595 N ILE B 115 -6.920 15.807 4.754 1.00 73.15 N ATOM 3596 CA ILE B 115 -7.775 16.243 3.623 1.00 52.12 C ATOM 3597 C ILE B 115 -9.275 16.016 3.916 1.00 4.53 C ATOM 3598 O ILE B 115 -10.134 16.386 3.109 1.00 35.41 O ATOM 3599 CB ILE B 115 -7.376 15.505 2.288 1.00 11.54 C ATOM 3600 CG1 ILE B 115 -7.653 13.969 2.384 1.00 33.35 C ATOM 3601 CG2 ILE B 115 -5.896 15.780 1.937 1.00 13.14 C ATOM 3602 CD1 ILE B 115 -7.470 13.207 1.087 1.00 62.13 C ATOM 0 H ILE B 115 -6.568 14.855 4.658 1.00 73.15 H new ATOM 0 HA ILE B 115 -7.609 17.313 3.499 1.00 52.12 H new ATOM 0 HB ILE B 115 -7.998 15.901 1.485 1.00 11.54 H new ATOM 0 HG12 ILE B 115 -6.991 13.541 3.137 1.00 33.35 H new ATOM 0 HG13 ILE B 115 -8.674 13.820 2.736 1.00 33.35 H new ATOM 0 HG21 ILE B 115 -5.639 15.262 1.013 1.00 13.14 H new ATOM 0 HG22 ILE B 115 -5.746 16.852 1.807 1.00 13.14 H new ATOM 0 HG23 ILE B 115 -5.258 15.420 2.744 1.00 13.14 H new ATOM 0 HD11 ILE B 115 -7.684 12.151 1.252 1.00 62.13 H new ATOM 0 HD12 ILE B 115 -8.152 13.602 0.334 1.00 62.13 H new ATOM 0 HD13 ILE B 115 -6.442 13.319 0.741 1.00 62.13 H new ATOM 3614 N ARG B 116 -9.562 15.404 5.076 1.00 21.55 N ATOM 3615 CA ARG B 116 -10.921 15.051 5.526 1.00 41.41 C ATOM 3616 C ARG B 116 -11.783 16.314 5.722 1.00 20.02 C ATOM 3617 O ARG B 116 -11.665 17.026 6.726 1.00 54.15 O ATOM 3618 CB ARG B 116 -10.803 14.234 6.834 1.00 13.40 C ATOM 3619 CG ARG B 116 -12.105 13.662 7.435 1.00 4.01 C ATOM 3620 CD ARG B 116 -11.799 12.796 8.674 1.00 33.44 C ATOM 3621 NE ARG B 116 -13.006 12.265 9.335 1.00 12.43 N ATOM 3622 CZ ARG B 116 -12.981 11.458 10.413 1.00 42.31 C ATOM 3623 NH1 ARG B 116 -11.828 11.074 10.960 1.00 61.24 N ATOM 3624 NH2 ARG B 116 -14.128 11.046 10.949 1.00 25.41 N ATOM 0 H ARG B 116 -8.840 15.134 5.744 1.00 21.55 H new ATOM 0 HA ARG B 116 -11.420 14.448 4.767 1.00 41.41 H new ATOM 0 HB2 ARG B 116 -10.123 13.402 6.651 1.00 13.40 H new ATOM 0 HB3 ARG B 116 -10.335 14.869 7.587 1.00 13.40 H new ATOM 0 HG2 ARG B 116 -12.773 14.478 7.711 1.00 4.01 H new ATOM 0 HG3 ARG B 116 -12.625 13.064 6.687 1.00 4.01 H new ATOM 0 HD2 ARG B 116 -11.161 11.963 8.377 1.00 33.44 H new ATOM 0 HD3 ARG B 116 -11.233 13.390 9.392 1.00 33.44 H new ATOM 0 HE ARG B 116 -13.915 12.525 8.952 1.00 12.43 H new ATOM 0 HH11 ARG B 116 -10.944 11.392 10.562 1.00 61.24 H new ATOM 0 HH12 ARG B 116 -11.829 10.462 11.776 1.00 61.24 H new ATOM 0 HH21 ARG B 116 -15.016 11.342 10.543 1.00 25.41 H new ATOM 0 HH22 ARG B 116 -14.119 10.435 11.765 1.00 25.41 H new ATOM 3638 N GLY B 117 -12.582 16.614 4.695 1.00 54.23 N ATOM 3639 CA GLY B 117 -13.556 17.706 4.723 1.00 65.12 C ATOM 3640 C GLY B 117 -14.990 17.186 4.834 1.00 52.12 C ATOM 3641 O GLY B 117 -15.244 16.311 5.683 1.00 52.25 O ATOM 3642 OXT GLY B 117 -15.863 17.617 4.049 1.00 37.94 O ATOM 0 H GLY B 117 -12.570 16.101 3.814 1.00 54.23 H new ATOM 0 HA2 GLY B 117 -13.341 18.363 5.566 1.00 65.12 H new ATOM 0 HA3 GLY B 117 -13.456 18.306 3.818 1.00 65.12 H new TER 3646 GLY B 117