USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 145 SER OG : rot 129:sc= 0.973 USER MOD Set 1.2: A 148 THR OG1 : rot 170:sc= 0.46 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.474 K(o=-0.87,f=-6.2!) USER MOD Set 2.2: A 137 TYR OH : rot -20:sc= -1.34 USER MOD Set 3.1: A 86 ASN : amide:sc= -0.551 X(o=-1.1,f=-0.66) USER MOD Set 3.2: A 89 SER OG : rot -60:sc= -0.523 USER MOD Set 4.1: A 87 THR OG1 : rot 180:sc= 0.997 USER MOD Set 4.2: A 124 THR OG1 : rot 131:sc= 0.844 USER MOD Set 5.1: A 67 MET CE :methyl -111:sc= -1.48 (180deg=-0.823) USER MOD Set 5.2: A 71 TYR OH : rot 180:sc= -0.904 USER MOD Set 6.1: A 16 LYS NZ :NH3+ -116:sc= 0.243 (180deg=0) USER MOD Set 6.2: A 58 THR OG1 : rot -170:sc= 0 USER MOD Set 7.1: A 1 MET CE :methyl -140:sc= -1 (180deg=-1.26) USER MOD Set 7.2: A 43 GLN : amide:sc= -0.709 K(o=-1.7,f=-5.2!) USER MOD Single : A 1 MET N :NH3+ -132:sc= 1.46 (180deg=-0.0157) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.142) USER MOD Single : A 17 SER OG : rot 180:sc= 0.0433 USER MOD Single : A 20 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 22 GLN : amide:sc= -0.876 K(o=-0.88,f=-2.4) USER MOD Single : A 25 GLN :FLIP amide:sc= -0.538 F(o=-1.4,f=-0.54) USER MOD Single : A 40 TYR OH : rot -60:sc= -0.123 USER MOD Single : A 42 LYS NZ :NH3+ 158:sc= 0.754 (180deg=0.433) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 8:sc= -0.565 USER MOD Single : A 70 GLN : amide:sc= -0.112 X(o=-0.11,f=-0.11) USER MOD Single : A 72 MET CE :methyl -149:sc= -0.132 (180deg=-0.891) USER MOD Single : A 74 THR OG1 : rot -172:sc= -1.11 USER MOD Single : A 80 CYS SG : rot 170:sc= -0.459 USER MOD Single : A 85 ASN : amide:sc= -3.54! C(o=-3.5!,f=-6.7!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.886 K(o=-0.89,f=-3.6!) USER MOD Single : A 96 TYR OH : rot 150:sc= -0.277 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 101 LYS NZ :NH3+ -169:sc= -1.37 (180deg=-2.43) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl -160:sc= -4.61! (180deg=-4.81!) USER MOD Single : A 116 ASN : amide:sc= -4.73 K(o=-4.7,f=-7.4!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.0145 X(o=-0.014,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot -15:sc= -0.921 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 66:sc= 0.413 USER MOD Single : A 165 GLN : amide:sc= 0.663 K(o=0.66,f=0) USER MOD Single : A 166 HIS : no HE2:sc= 0.649 K(o=0.65,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.410 -5.575 22.308 1.00 32.21 N ATOM 2 CA MET A 1 -1.873 -4.793 21.132 1.00 64.42 C ATOM 3 C MET A 1 -2.409 -5.710 20.037 1.00 64.24 C ATOM 4 O MET A 1 -2.336 -6.934 20.148 1.00 41.14 O ATOM 5 CB MET A 1 -0.700 -3.967 20.601 1.00 24.40 C ATOM 6 CG MET A 1 0.451 -4.809 20.074 1.00 61.10 C ATOM 7 SD MET A 1 1.555 -5.372 21.384 1.00 62.51 S ATOM 8 CE MET A 1 2.159 -3.807 22.012 1.00 11.41 C ATOM 0 H1 MET A 1 -1.801 -5.159 23.177 1.00 32.21 H new ATOM 0 H2 MET A 1 -1.734 -6.559 22.220 1.00 32.21 H new ATOM 0 H3 MET A 1 -0.371 -5.555 22.351 1.00 32.21 H new ATOM 0 HA MET A 1 -2.687 -4.136 21.438 1.00 64.42 H new ATOM 0 HB2 MET A 1 -1.057 -3.316 19.803 1.00 24.40 H new ATOM 0 HB3 MET A 1 -0.331 -3.322 21.398 1.00 24.40 H new ATOM 0 HG2 MET A 1 0.051 -5.674 19.544 1.00 61.10 H new ATOM 0 HG3 MET A 1 1.020 -4.227 19.349 1.00 61.10 H new ATOM 0 HE1 MET A 1 3.222 -3.892 22.238 1.00 11.41 H new ATOM 0 HE2 MET A 1 2.008 -3.031 21.261 1.00 11.41 H new ATOM 0 HE3 MET A 1 1.615 -3.545 22.919 1.00 11.41 H new ATOM 18 N THR A 2 -2.946 -5.111 18.979 1.00 0.12 N ATOM 19 CA THR A 2 -3.493 -5.874 17.864 1.00 20.43 C ATOM 20 C THR A 2 -2.488 -5.947 16.715 1.00 61.40 C ATOM 21 O THR A 2 -1.684 -5.036 16.522 1.00 41.42 O ATOM 22 CB THR A 2 -4.820 -5.252 17.399 1.00 34.13 C ATOM 23 OG1 THR A 2 -5.879 -6.183 17.534 1.00 50.22 O ATOM 24 CG2 THR A 2 -4.817 -4.775 15.959 1.00 32.51 C ATOM 0 H THR A 2 -3.014 -4.099 18.871 1.00 0.12 H new ATOM 0 HA THR A 2 -3.690 -6.893 18.199 1.00 20.43 H new ATOM 0 HB THR A 2 -4.957 -4.382 18.041 1.00 34.13 H new ATOM 0 HG1 THR A 2 -6.717 -5.771 17.236 1.00 50.22 H new ATOM 0 HG21 THR A 2 -5.791 -4.351 15.714 1.00 32.51 H new ATOM 0 HG22 THR A 2 -4.047 -4.015 15.829 1.00 32.51 H new ATOM 0 HG23 THR A 2 -4.611 -5.616 15.297 1.00 32.51 H new ATOM 32 N GLU A 3 -2.543 -7.037 15.957 1.00 73.44 N ATOM 33 CA GLU A 3 -1.640 -7.229 14.828 1.00 31.11 C ATOM 34 C GLU A 3 -2.314 -6.829 13.519 1.00 4.21 C ATOM 35 O GLU A 3 -3.321 -7.416 13.123 1.00 13.45 O ATOM 36 CB GLU A 3 -1.181 -8.688 14.759 1.00 10.54 C ATOM 37 CG GLU A 3 0.279 -8.884 15.133 1.00 35.44 C ATOM 38 CD GLU A 3 0.705 -10.338 15.074 1.00 15.04 C ATOM 39 OE1 GLU A 3 0.168 -11.080 14.226 1.00 42.42 O ATOM 40 OE2 GLU A 3 1.576 -10.734 15.878 1.00 45.43 O ATOM 0 H GLU A 3 -3.203 -7.801 16.104 1.00 73.44 H new ATOM 0 HA GLU A 3 -0.770 -6.590 14.975 1.00 31.11 H new ATOM 0 HB2 GLU A 3 -1.802 -9.287 15.425 1.00 10.54 H new ATOM 0 HB3 GLU A 3 -1.342 -9.064 13.749 1.00 10.54 H new ATOM 0 HG2 GLU A 3 0.905 -8.298 14.460 1.00 35.44 H new ATOM 0 HG3 GLU A 3 0.447 -8.500 16.139 1.00 35.44 H new ATOM 47 N TYR A 4 -1.753 -5.824 12.853 1.00 23.52 N ATOM 48 CA TYR A 4 -2.301 -5.345 11.590 1.00 1.53 C ATOM 49 C TYR A 4 -1.379 -5.692 10.427 1.00 34.31 C ATOM 50 O TYR A 4 -0.331 -5.072 10.246 1.00 13.00 O ATOM 51 CB TYR A 4 -2.518 -3.832 11.644 1.00 44.12 C ATOM 52 CG TYR A 4 -3.839 -3.428 12.256 1.00 65.45 C ATOM 53 CD1 TYR A 4 -5.031 -3.989 11.815 1.00 75.01 C ATOM 54 CD2 TYR A 4 -3.895 -2.485 13.275 1.00 14.11 C ATOM 55 CE1 TYR A 4 -6.241 -3.621 12.372 1.00 50.43 C ATOM 56 CE2 TYR A 4 -5.101 -2.113 13.837 1.00 41.34 C ATOM 57 CZ TYR A 4 -6.271 -2.683 13.382 1.00 40.51 C ATOM 58 OH TYR A 4 -7.474 -2.315 13.940 1.00 72.35 O ATOM 0 H TYR A 4 -0.920 -5.326 13.167 1.00 23.52 H new ATOM 0 HA TYR A 4 -3.259 -5.840 11.432 1.00 1.53 H new ATOM 0 HB2 TYR A 4 -1.709 -3.378 12.216 1.00 44.12 H new ATOM 0 HB3 TYR A 4 -2.458 -3.429 10.633 1.00 44.12 H new ATOM 0 HD1 TYR A 4 -5.012 -4.724 11.024 1.00 75.01 H new ATOM 0 HD2 TYR A 4 -2.981 -2.035 13.634 1.00 14.11 H new ATOM 0 HE1 TYR A 4 -7.159 -4.066 12.018 1.00 50.43 H new ATOM 0 HE2 TYR A 4 -5.127 -1.379 14.629 1.00 41.34 H new ATOM 0 HH TYR A 4 -7.319 -1.645 14.639 1.00 72.35 H new ATOM 68 N LYS A 5 -1.777 -6.684 9.638 1.00 62.42 N ATOM 69 CA LYS A 5 -0.986 -7.109 8.489 1.00 45.44 C ATOM 70 C LYS A 5 -1.282 -6.231 7.278 1.00 65.42 C ATOM 71 O LYS A 5 -2.280 -6.427 6.585 1.00 1.25 O ATOM 72 CB LYS A 5 -1.276 -8.575 8.158 1.00 30.52 C ATOM 73 CG LYS A 5 -0.086 -9.494 8.379 1.00 32.53 C ATOM 74 CD LYS A 5 0.563 -9.893 7.063 1.00 44.32 C ATOM 75 CE LYS A 5 1.142 -11.296 7.130 1.00 42.25 C ATOM 76 NZ LYS A 5 2.048 -11.468 8.300 1.00 32.14 N ATOM 0 H LYS A 5 -2.642 -7.208 9.773 1.00 62.42 H new ATOM 0 HA LYS A 5 0.069 -7.006 8.743 1.00 45.44 H new ATOM 0 HB2 LYS A 5 -2.109 -8.919 8.770 1.00 30.52 H new ATOM 0 HB3 LYS A 5 -1.593 -8.648 7.118 1.00 30.52 H new ATOM 0 HG2 LYS A 5 0.648 -8.994 9.011 1.00 32.53 H new ATOM 0 HG3 LYS A 5 -0.410 -10.388 8.912 1.00 32.53 H new ATOM 0 HD2 LYS A 5 -0.174 -9.841 6.262 1.00 44.32 H new ATOM 0 HD3 LYS A 5 1.353 -9.184 6.816 1.00 44.32 H new ATOM 0 HE2 LYS A 5 0.330 -12.021 7.190 1.00 42.25 H new ATOM 0 HE3 LYS A 5 1.691 -11.507 6.212 1.00 42.25 H new ATOM 0 HZ1 LYS A 5 2.589 -12.350 8.193 1.00 32.14 H new ATOM 0 HZ2 LYS A 5 2.704 -10.663 8.352 1.00 32.14 H new ATOM 0 HZ3 LYS A 5 1.484 -11.512 9.173 1.00 32.14 H new ATOM 90 N LEU A 6 -0.410 -5.260 7.031 1.00 44.53 N ATOM 91 CA LEU A 6 -0.580 -4.349 5.906 1.00 1.33 C ATOM 92 C LEU A 6 0.104 -4.888 4.653 1.00 54.05 C ATOM 93 O LEU A 6 1.322 -4.789 4.508 1.00 35.21 O ATOM 94 CB LEU A 6 -0.019 -2.969 6.254 1.00 14.14 C ATOM 95 CG LEU A 6 -0.834 -2.178 7.279 1.00 1.30 C ATOM 96 CD1 LEU A 6 -2.286 -2.072 6.839 1.00 21.14 C ATOM 97 CD2 LEU A 6 -0.737 -2.828 8.651 1.00 53.23 C ATOM 0 H LEU A 6 0.422 -5.084 7.595 1.00 44.53 H new ATOM 0 HA LEU A 6 -1.647 -4.262 5.702 1.00 1.33 H new ATOM 0 HB2 LEU A 6 0.995 -3.091 6.635 1.00 14.14 H new ATOM 0 HB3 LEU A 6 0.053 -2.382 5.339 1.00 14.14 H new ATOM 0 HG LEU A 6 -0.422 -1.171 7.345 1.00 1.30 H new ATOM 0 HD11 LEU A 6 -2.850 -1.506 7.580 1.00 21.14 H new ATOM 0 HD12 LEU A 6 -2.338 -1.563 5.877 1.00 21.14 H new ATOM 0 HD13 LEU A 6 -2.711 -3.071 6.744 1.00 21.14 H new ATOM 0 HD21 LEU A 6 -1.322 -2.253 9.368 1.00 53.23 H new ATOM 0 HD22 LEU A 6 -1.124 -3.846 8.600 1.00 53.23 H new ATOM 0 HD23 LEU A 6 0.305 -2.852 8.969 1.00 53.23 H new ATOM 109 N VAL A 7 -0.689 -5.455 3.750 1.00 60.51 N ATOM 110 CA VAL A 7 -0.166 -6.005 2.509 1.00 21.33 C ATOM 111 C VAL A 7 -0.106 -4.936 1.422 1.00 11.31 C ATOM 112 O VAL A 7 -1.137 -4.499 0.912 1.00 45.30 O ATOM 113 CB VAL A 7 -1.030 -7.180 2.016 1.00 24.13 C ATOM 114 CG1 VAL A 7 -0.404 -7.830 0.795 1.00 64.40 C ATOM 115 CG2 VAL A 7 -1.230 -8.199 3.128 1.00 63.01 C ATOM 0 H VAL A 7 -1.699 -5.545 3.857 1.00 60.51 H new ATOM 0 HA VAL A 7 0.842 -6.366 2.714 1.00 21.33 H new ATOM 0 HB VAL A 7 -2.007 -6.792 1.729 1.00 24.13 H new ATOM 0 HG11 VAL A 7 -1.030 -8.658 0.462 1.00 64.40 H new ATOM 0 HG12 VAL A 7 -0.319 -7.095 -0.005 1.00 64.40 H new ATOM 0 HG13 VAL A 7 0.587 -8.204 1.050 1.00 64.40 H new ATOM 0 HG21 VAL A 7 -1.843 -9.022 2.761 1.00 63.01 H new ATOM 0 HG22 VAL A 7 -0.261 -8.583 3.449 1.00 63.01 H new ATOM 0 HG23 VAL A 7 -1.729 -7.723 3.972 1.00 63.01 H new ATOM 125 N VAL A 8 1.106 -4.517 1.075 1.00 2.40 N ATOM 126 CA VAL A 8 1.297 -3.498 0.054 1.00 62.23 C ATOM 127 C VAL A 8 1.451 -4.128 -1.327 1.00 22.12 C ATOM 128 O VAL A 8 2.117 -5.152 -1.483 1.00 5.22 O ATOM 129 CB VAL A 8 2.535 -2.634 0.361 1.00 41.41 C ATOM 130 CG1 VAL A 8 2.693 -1.536 -0.676 1.00 15.30 C ATOM 131 CG2 VAL A 8 2.439 -2.043 1.760 1.00 42.24 C ATOM 0 H VAL A 8 1.970 -4.869 1.487 1.00 2.40 H new ATOM 0 HA VAL A 8 0.410 -2.864 0.059 1.00 62.23 H new ATOM 0 HB VAL A 8 3.418 -3.272 0.318 1.00 41.41 H new ATOM 0 HG11 VAL A 8 3.573 -0.937 -0.441 1.00 15.30 H new ATOM 0 HG12 VAL A 8 2.811 -1.982 -1.663 1.00 15.30 H new ATOM 0 HG13 VAL A 8 1.808 -0.899 -0.669 1.00 15.30 H new ATOM 0 HG21 VAL A 8 3.322 -1.436 1.960 1.00 42.24 H new ATOM 0 HG22 VAL A 8 1.547 -1.421 1.832 1.00 42.24 H new ATOM 0 HG23 VAL A 8 2.379 -2.848 2.492 1.00 42.24 H new ATOM 141 N VAL A 9 0.832 -3.508 -2.326 1.00 22.22 N ATOM 142 CA VAL A 9 0.900 -4.006 -3.695 1.00 44.12 C ATOM 143 C VAL A 9 1.112 -2.863 -4.684 1.00 2.21 C ATOM 144 O VAL A 9 0.656 -1.742 -4.458 1.00 34.44 O ATOM 145 CB VAL A 9 -0.380 -4.779 -4.077 1.00 74.12 C ATOM 146 CG1 VAL A 9 -0.631 -5.917 -3.100 1.00 45.33 C ATOM 147 CG2 VAL A 9 -1.581 -3.845 -4.133 1.00 22.34 C ATOM 0 H VAL A 9 0.277 -2.659 -2.213 1.00 22.22 H new ATOM 0 HA VAL A 9 1.750 -4.686 -3.745 1.00 44.12 H new ATOM 0 HB VAL A 9 -0.235 -5.205 -5.070 1.00 74.12 H new ATOM 0 HG11 VAL A 9 -1.538 -6.449 -3.387 1.00 45.33 H new ATOM 0 HG12 VAL A 9 0.214 -6.605 -3.118 1.00 45.33 H new ATOM 0 HG13 VAL A 9 -0.750 -5.514 -2.094 1.00 45.33 H new ATOM 0 HG21 VAL A 9 -2.471 -4.413 -4.404 1.00 22.34 H new ATOM 0 HG22 VAL A 9 -1.729 -3.383 -3.157 1.00 22.34 H new ATOM 0 HG23 VAL A 9 -1.404 -3.069 -4.878 1.00 22.34 H new ATOM 157 N GLY A 10 1.806 -3.153 -5.780 1.00 52.01 N ATOM 158 CA GLY A 10 2.063 -2.136 -6.784 1.00 43.32 C ATOM 159 C GLY A 10 3.068 -2.584 -7.827 1.00 62.53 C ATOM 160 O GLY A 10 3.654 -3.661 -7.713 1.00 11.31 O ATOM 0 H GLY A 10 2.194 -4.072 -5.991 1.00 52.01 H new ATOM 0 HA2 GLY A 10 1.127 -1.873 -7.277 1.00 43.32 H new ATOM 0 HA3 GLY A 10 2.430 -1.234 -6.295 1.00 43.32 H new ATOM 164 N ALA A 11 3.267 -1.755 -8.848 1.00 23.35 N ATOM 165 CA ALA A 11 4.206 -2.069 -9.919 1.00 72.32 C ATOM 166 C ALA A 11 5.602 -1.544 -9.599 1.00 3.22 C ATOM 167 O ALA A 11 5.761 -0.615 -8.808 1.00 24.21 O ATOM 168 CB ALA A 11 3.713 -1.490 -11.237 1.00 63.01 C ATOM 0 H ALA A 11 2.790 -0.860 -8.956 1.00 23.35 H new ATOM 0 HA ALA A 11 4.267 -3.154 -10.009 1.00 72.32 H new ATOM 0 HB1 ALA A 11 4.423 -1.731 -12.028 1.00 63.01 H new ATOM 0 HB2 ALA A 11 2.740 -1.916 -11.480 1.00 63.01 H new ATOM 0 HB3 ALA A 11 3.623 -0.407 -11.148 1.00 63.01 H new ATOM 174 N GLY A 12 6.612 -2.146 -10.220 1.00 23.02 N ATOM 175 CA GLY A 12 7.982 -1.725 -9.989 1.00 40.02 C ATOM 176 C GLY A 12 8.221 -0.282 -10.386 1.00 41.23 C ATOM 177 O GLY A 12 8.288 0.040 -11.572 1.00 33.41 O ATOM 0 H GLY A 12 6.506 -2.918 -10.879 1.00 23.02 H new ATOM 0 HA2 GLY A 12 8.225 -1.853 -8.934 1.00 40.02 H new ATOM 0 HA3 GLY A 12 8.657 -2.370 -10.552 1.00 40.02 H new ATOM 181 N GLY A 13 8.348 0.590 -9.391 1.00 15.11 N ATOM 182 CA GLY A 13 8.579 1.998 -9.662 1.00 70.02 C ATOM 183 C GLY A 13 7.533 2.894 -9.026 1.00 41.23 C ATOM 184 O GLY A 13 7.763 4.088 -8.837 1.00 31.32 O ATOM 0 H GLY A 13 8.295 0.347 -8.402 1.00 15.11 H new ATOM 0 HA2 GLY A 13 9.565 2.278 -9.292 1.00 70.02 H new ATOM 0 HA3 GLY A 13 8.585 2.161 -10.740 1.00 70.02 H new ATOM 188 N VAL A 14 6.380 2.318 -8.696 1.00 71.42 N ATOM 189 CA VAL A 14 5.295 3.074 -8.079 1.00 34.04 C ATOM 190 C VAL A 14 5.770 3.805 -6.826 1.00 21.13 C ATOM 191 O VAL A 14 5.193 4.819 -6.432 1.00 4.24 O ATOM 192 CB VAL A 14 4.114 2.157 -7.706 1.00 51.35 C ATOM 193 CG1 VAL A 14 3.466 1.584 -8.958 1.00 24.23 C ATOM 194 CG2 VAL A 14 4.574 1.044 -6.778 1.00 5.11 C ATOM 0 H VAL A 14 6.173 1.330 -8.846 1.00 71.42 H new ATOM 0 HA VAL A 14 4.963 3.805 -8.816 1.00 34.04 H new ATOM 0 HB VAL A 14 3.368 2.752 -7.179 1.00 51.35 H new ATOM 0 HG11 VAL A 14 2.634 0.939 -8.675 1.00 24.23 H new ATOM 0 HG12 VAL A 14 3.098 2.398 -9.582 1.00 24.23 H new ATOM 0 HG13 VAL A 14 4.201 1.004 -9.515 1.00 24.23 H new ATOM 0 HG21 VAL A 14 3.726 0.407 -6.526 1.00 5.11 H new ATOM 0 HG22 VAL A 14 5.340 0.449 -7.275 1.00 5.11 H new ATOM 0 HG23 VAL A 14 4.986 1.477 -5.867 1.00 5.11 H new ATOM 204 N GLY A 15 6.823 3.285 -6.202 1.00 45.10 N ATOM 205 CA GLY A 15 7.354 3.903 -5.001 1.00 74.11 C ATOM 206 C GLY A 15 6.690 3.384 -3.740 1.00 33.03 C ATOM 207 O GLY A 15 6.645 4.078 -2.724 1.00 51.43 O ATOM 0 H GLY A 15 7.318 2.447 -6.507 1.00 45.10 H new ATOM 0 HA2 GLY A 15 8.427 3.719 -4.945 1.00 74.11 H new ATOM 0 HA3 GLY A 15 7.219 4.983 -5.061 1.00 74.11 H new ATOM 211 N LYS A 16 6.174 2.161 -3.806 1.00 61.32 N ATOM 212 CA LYS A 16 5.509 1.548 -2.661 1.00 33.32 C ATOM 213 C LYS A 16 6.476 1.385 -1.494 1.00 4.10 C ATOM 214 O LYS A 16 6.089 1.513 -0.332 1.00 32.50 O ATOM 215 CB LYS A 16 4.927 0.188 -3.050 1.00 3.04 C ATOM 216 CG LYS A 16 5.895 -0.690 -3.827 1.00 0.43 C ATOM 217 CD LYS A 16 5.394 -2.121 -3.925 1.00 71.02 C ATOM 218 CE LYS A 16 5.715 -2.732 -5.279 1.00 21.11 C ATOM 219 NZ LYS A 16 5.450 -4.197 -5.304 1.00 14.42 N ATOM 0 H LYS A 16 6.203 1.575 -4.640 1.00 61.32 H new ATOM 0 HA LYS A 16 4.698 2.206 -2.349 1.00 33.32 H new ATOM 0 HB2 LYS A 16 4.619 -0.338 -2.146 1.00 3.04 H new ATOM 0 HB3 LYS A 16 4.030 0.344 -3.650 1.00 3.04 H new ATOM 0 HG2 LYS A 16 6.033 -0.283 -4.828 1.00 0.43 H new ATOM 0 HG3 LYS A 16 6.870 -0.677 -3.340 1.00 0.43 H new ATOM 0 HD2 LYS A 16 5.848 -2.721 -3.137 1.00 71.02 H new ATOM 0 HD3 LYS A 16 4.317 -2.142 -3.761 1.00 71.02 H new ATOM 0 HE2 LYS A 16 5.119 -2.242 -6.049 1.00 21.11 H new ATOM 0 HE3 LYS A 16 6.762 -2.548 -5.521 1.00 21.11 H new ATOM 0 HZ1 LYS A 16 6.343 -4.709 -5.454 1.00 14.42 H new ATOM 0 HZ2 LYS A 16 5.031 -4.490 -4.398 1.00 14.42 H new ATOM 0 HZ3 LYS A 16 4.790 -4.417 -6.077 1.00 14.42 H new ATOM 233 N SER A 17 7.736 1.102 -1.810 1.00 24.43 N ATOM 234 CA SER A 17 8.758 0.922 -0.785 1.00 51.45 C ATOM 235 C SER A 17 9.133 2.258 -0.152 1.00 32.31 C ATOM 236 O SER A 17 9.464 2.325 1.031 1.00 55.14 O ATOM 237 CB SER A 17 10.000 0.261 -1.385 1.00 64.23 C ATOM 238 OG SER A 17 10.289 0.783 -2.671 1.00 52.43 O ATOM 0 H SER A 17 8.073 0.993 -2.766 1.00 24.43 H new ATOM 0 HA SER A 17 8.350 0.274 -0.009 1.00 51.45 H new ATOM 0 HB2 SER A 17 10.853 0.419 -0.726 1.00 64.23 H new ATOM 0 HB3 SER A 17 9.845 -0.816 -1.453 1.00 64.23 H new ATOM 0 HG SER A 17 11.088 0.344 -3.030 1.00 52.43 H new ATOM 244 N ALA A 18 9.078 3.320 -0.950 1.00 70.35 N ATOM 245 CA ALA A 18 9.412 4.656 -0.469 1.00 11.11 C ATOM 246 C ALA A 18 8.432 5.114 0.607 1.00 54.14 C ATOM 247 O ALA A 18 8.834 5.475 1.713 1.00 62.43 O ATOM 248 CB ALA A 18 9.427 5.644 -1.625 1.00 23.22 C ATOM 0 H ALA A 18 8.805 3.281 -1.932 1.00 70.35 H new ATOM 0 HA ALA A 18 10.407 4.617 -0.025 1.00 11.11 H new ATOM 0 HB1 ALA A 18 9.678 6.637 -1.252 1.00 23.22 H new ATOM 0 HB2 ALA A 18 10.171 5.334 -2.359 1.00 23.22 H new ATOM 0 HB3 ALA A 18 8.443 5.670 -2.094 1.00 23.22 H new ATOM 254 N LEU A 19 7.145 5.097 0.275 1.00 5.21 N ATOM 255 CA LEU A 19 6.107 5.511 1.212 1.00 73.43 C ATOM 256 C LEU A 19 6.168 4.689 2.496 1.00 3.33 C ATOM 257 O LEU A 19 5.810 5.170 3.571 1.00 22.15 O ATOM 258 CB LEU A 19 4.725 5.371 0.571 1.00 10.41 C ATOM 259 CG LEU A 19 4.314 6.525 -0.344 1.00 54.42 C ATOM 260 CD1 LEU A 19 3.027 6.189 -1.082 1.00 35.20 C ATOM 261 CD2 LEU A 19 4.150 7.807 0.458 1.00 52.22 C ATOM 0 H LEU A 19 6.796 4.801 -0.636 1.00 5.21 H new ATOM 0 HA LEU A 19 6.281 6.557 1.464 1.00 73.43 H new ATOM 0 HB2 LEU A 19 4.701 4.445 -0.004 1.00 10.41 H new ATOM 0 HB3 LEU A 19 3.982 5.274 1.363 1.00 10.41 H new ATOM 0 HG LEU A 19 5.102 6.678 -1.081 1.00 54.42 H new ATOM 0 HD11 LEU A 19 2.750 7.022 -1.728 1.00 35.20 H new ATOM 0 HD12 LEU A 19 3.177 5.295 -1.687 1.00 35.20 H new ATOM 0 HD13 LEU A 19 2.230 6.009 -0.360 1.00 35.20 H new ATOM 0 HD21 LEU A 19 3.857 8.618 -0.209 1.00 52.22 H new ATOM 0 HD22 LEU A 19 3.381 7.665 1.217 1.00 52.22 H new ATOM 0 HD23 LEU A 19 5.094 8.057 0.941 1.00 52.22 H new ATOM 273 N THR A 20 6.622 3.445 2.376 1.00 74.40 N ATOM 274 CA THR A 20 6.728 2.555 3.527 1.00 75.23 C ATOM 275 C THR A 20 7.754 3.075 4.529 1.00 3.03 C ATOM 276 O THR A 20 7.430 3.327 5.689 1.00 44.04 O ATOM 277 CB THR A 20 7.110 1.145 3.074 1.00 65.15 C ATOM 278 OG1 THR A 20 6.177 0.652 2.129 1.00 10.04 O ATOM 279 CG2 THR A 20 7.180 0.150 4.211 1.00 52.51 C ATOM 0 H THR A 20 6.922 3.031 1.494 1.00 74.40 H new ATOM 0 HA THR A 20 5.755 2.522 4.017 1.00 75.23 H new ATOM 0 HB THR A 20 8.103 1.242 2.635 1.00 65.15 H new ATOM 0 HG1 THR A 20 6.454 0.917 1.227 1.00 10.04 H new ATOM 0 HG21 THR A 20 7.456 -0.830 3.821 1.00 52.51 H new ATOM 0 HG22 THR A 20 7.927 0.476 4.934 1.00 52.51 H new ATOM 0 HG23 THR A 20 6.207 0.086 4.699 1.00 52.51 H new ATOM 287 N ILE A 21 8.994 3.232 4.074 1.00 3.14 N ATOM 288 CA ILE A 21 10.069 3.720 4.933 1.00 12.24 C ATOM 289 C ILE A 21 9.688 5.037 5.603 1.00 2.31 C ATOM 290 O ILE A 21 10.138 5.334 6.710 1.00 51.10 O ATOM 291 CB ILE A 21 11.379 3.917 4.141 1.00 72.12 C ATOM 292 CG1 ILE A 21 11.761 2.634 3.401 1.00 53.23 C ATOM 293 CG2 ILE A 21 12.505 4.342 5.069 1.00 12.22 C ATOM 294 CD1 ILE A 21 11.840 1.418 4.298 1.00 54.21 C ATOM 0 H ILE A 21 9.279 3.029 3.116 1.00 3.14 H new ATOM 0 HA ILE A 21 10.228 2.961 5.699 1.00 12.24 H new ATOM 0 HB ILE A 21 11.216 4.705 3.406 1.00 72.12 H new ATOM 0 HG12 ILE A 21 11.031 2.447 2.614 1.00 53.23 H new ATOM 0 HG13 ILE A 21 12.725 2.779 2.914 1.00 53.23 H new ATOM 0 HG21 ILE A 21 13.420 4.476 4.493 1.00 12.22 H new ATOM 0 HG22 ILE A 21 12.241 5.281 5.555 1.00 12.22 H new ATOM 0 HG23 ILE A 21 12.662 3.574 5.826 1.00 12.22 H new ATOM 0 HD11 ILE A 21 12.116 0.546 3.705 1.00 54.21 H new ATOM 0 HD12 ILE A 21 12.591 1.584 5.070 1.00 54.21 H new ATOM 0 HD13 ILE A 21 10.870 1.247 4.766 1.00 54.21 H new ATOM 306 N GLN A 22 8.857 5.823 4.926 1.00 72.13 N ATOM 307 CA GLN A 22 8.417 7.107 5.459 1.00 32.32 C ATOM 308 C GLN A 22 7.664 6.922 6.773 1.00 41.31 C ATOM 309 O GLN A 22 7.948 7.594 7.764 1.00 30.43 O ATOM 310 CB GLN A 22 7.527 7.827 4.444 1.00 1.14 C ATOM 311 CG GLN A 22 8.298 8.441 3.287 1.00 60.54 C ATOM 312 CD GLN A 22 9.399 9.375 3.750 1.00 74.10 C ATOM 313 OE1 GLN A 22 9.322 9.955 4.833 1.00 10.11 O ATOM 314 NE2 GLN A 22 10.432 9.525 2.929 1.00 41.15 N ATOM 0 H GLN A 22 8.475 5.594 4.008 1.00 72.13 H new ATOM 0 HA GLN A 22 9.302 7.714 5.651 1.00 32.32 H new ATOM 0 HB2 GLN A 22 6.796 7.121 4.049 1.00 1.14 H new ATOM 0 HB3 GLN A 22 6.969 8.612 4.955 1.00 1.14 H new ATOM 0 HG2 GLN A 22 8.732 7.645 2.682 1.00 60.54 H new ATOM 0 HG3 GLN A 22 7.608 8.989 2.645 1.00 60.54 H new ATOM 0 HE21 GLN A 22 10.454 9.024 2.041 1.00 41.15 H new ATOM 0 HE22 GLN A 22 11.203 10.141 3.187 1.00 41.15 H new ATOM 323 N LEU A 23 6.702 6.006 6.773 1.00 53.52 N ATOM 324 CA LEU A 23 5.909 5.732 7.966 1.00 62.11 C ATOM 325 C LEU A 23 6.691 4.893 8.977 1.00 62.00 C ATOM 326 O LEU A 23 6.246 4.699 10.108 1.00 64.12 O ATOM 327 CB LEU A 23 4.612 5.016 7.585 1.00 71.41 C ATOM 328 CG LEU A 23 3.647 4.764 8.747 1.00 23.11 C ATOM 329 CD1 LEU A 23 2.216 5.073 8.332 1.00 53.52 C ATOM 330 CD2 LEU A 23 3.766 3.329 9.236 1.00 32.45 C ATOM 0 H LEU A 23 6.452 5.441 5.961 1.00 53.52 H new ATOM 0 HA LEU A 23 5.670 6.687 8.434 1.00 62.11 H new ATOM 0 HB2 LEU A 23 4.098 5.607 6.827 1.00 71.41 H new ATOM 0 HB3 LEU A 23 4.864 4.059 7.127 1.00 71.41 H new ATOM 0 HG LEU A 23 3.915 5.430 9.567 1.00 23.11 H new ATOM 0 HD11 LEU A 23 1.546 4.888 9.171 1.00 53.52 H new ATOM 0 HD12 LEU A 23 2.142 6.118 8.032 1.00 53.52 H new ATOM 0 HD13 LEU A 23 1.934 4.435 7.495 1.00 53.52 H new ATOM 0 HD21 LEU A 23 3.073 3.167 10.062 1.00 32.45 H new ATOM 0 HD22 LEU A 23 3.525 2.646 8.421 1.00 32.45 H new ATOM 0 HD23 LEU A 23 4.785 3.144 9.576 1.00 32.45 H new ATOM 342 N ILE A 24 7.855 4.393 8.566 1.00 23.32 N ATOM 343 CA ILE A 24 8.685 3.576 9.443 1.00 33.04 C ATOM 344 C ILE A 24 9.783 4.409 10.100 1.00 54.52 C ATOM 345 O ILE A 24 9.728 4.690 11.297 1.00 24.25 O ATOM 346 CB ILE A 24 9.324 2.399 8.674 1.00 22.21 C ATOM 347 CG1 ILE A 24 8.236 1.505 8.076 1.00 35.40 C ATOM 348 CG2 ILE A 24 10.238 1.591 9.587 1.00 34.20 C ATOM 349 CD1 ILE A 24 7.478 0.697 9.108 1.00 24.15 C ATOM 0 H ILE A 24 8.242 4.540 7.634 1.00 23.32 H new ATOM 0 HA ILE A 24 8.031 3.177 10.219 1.00 33.04 H new ATOM 0 HB ILE A 24 9.928 2.804 7.862 1.00 22.21 H new ATOM 0 HG12 ILE A 24 7.531 2.126 7.524 1.00 35.40 H new ATOM 0 HG13 ILE A 24 8.692 0.824 7.357 1.00 35.40 H new ATOM 0 HG21 ILE A 24 10.678 0.767 9.025 1.00 34.20 H new ATOM 0 HG22 ILE A 24 11.031 2.234 9.969 1.00 34.20 H new ATOM 0 HG23 ILE A 24 9.660 1.194 10.421 1.00 34.20 H new ATOM 0 HD11 ILE A 24 6.723 0.088 8.611 1.00 24.15 H new ATOM 0 HD12 ILE A 24 8.172 0.049 9.644 1.00 24.15 H new ATOM 0 HD13 ILE A 24 6.992 1.371 9.813 1.00 24.15 H new ATOM 361 N GLN A 25 10.782 4.798 9.313 1.00 4.13 N ATOM 362 CA GLN A 25 11.892 5.594 9.827 1.00 35.34 C ATOM 363 C GLN A 25 11.773 7.059 9.407 1.00 65.01 C ATOM 364 O GLN A 25 12.505 7.914 9.906 1.00 63.51 O ATOM 365 CB GLN A 25 13.224 5.019 9.340 1.00 25.10 C ATOM 366 CG GLN A 25 13.519 3.629 9.880 1.00 34.31 C ATOM 367 CD GLN A 25 14.005 2.675 8.806 1.00 63.14 C ATOM 368 OE1 GLN A 25 13.175 2.451 7.794 1.00 23.44 O flip ATOM 369 NE2 GLN A 25 15.114 2.147 8.884 1.00 10.14 N flip ATOM 0 H GLN A 25 10.846 4.576 8.320 1.00 4.13 H new ATOM 0 HA GLN A 25 11.855 5.551 10.916 1.00 35.34 H new ATOM 0 HB2 GLN A 25 13.218 4.983 8.251 1.00 25.10 H new ATOM 0 HB3 GLN A 25 14.030 5.692 9.633 1.00 25.10 H new ATOM 0 HG2 GLN A 25 14.272 3.701 10.664 1.00 34.31 H new ATOM 0 HG3 GLN A 25 12.618 3.223 10.340 1.00 34.31 H new ATOM 0 HE21 GLN A 25 15.720 2.348 9.680 1.00 10.14 H new ATOM 0 HE22 GLN A 25 15.428 1.509 8.153 1.00 10.14 H new ATOM 588 N TYR A 40 8.699 -4.079 7.097 1.00 24.13 N ATOM 589 CA TYR A 40 8.968 -3.354 8.335 1.00 42.23 C ATOM 590 C TYR A 40 7.725 -3.300 9.216 1.00 62.41 C ATOM 591 O TYR A 40 6.606 -3.495 8.740 1.00 63.20 O ATOM 592 CB TYR A 40 9.448 -1.935 8.026 1.00 40.24 C ATOM 593 CG TYR A 40 10.405 -1.863 6.858 1.00 33.11 C ATOM 594 CD1 TYR A 40 11.773 -2.003 7.048 1.00 33.22 C ATOM 595 CD2 TYR A 40 9.938 -1.659 5.567 1.00 63.33 C ATOM 596 CE1 TYR A 40 12.650 -1.941 5.982 1.00 54.51 C ATOM 597 CE2 TYR A 40 10.808 -1.596 4.496 1.00 31.42 C ATOM 598 CZ TYR A 40 12.163 -1.738 4.708 1.00 0.14 C ATOM 599 OH TYR A 40 13.033 -1.676 3.644 1.00 3.34 O ATOM 0 HA TYR A 40 9.751 -3.887 8.874 1.00 42.23 H new ATOM 0 HB2 TYR A 40 8.583 -1.305 7.816 1.00 40.24 H new ATOM 0 HB3 TYR A 40 9.935 -1.524 8.910 1.00 40.24 H new ATOM 0 HD1 TYR A 40 12.158 -2.163 8.044 1.00 33.22 H new ATOM 0 HD2 TYR A 40 8.877 -1.548 5.397 1.00 63.33 H new ATOM 0 HE1 TYR A 40 13.712 -2.051 6.146 1.00 54.51 H new ATOM 0 HE2 TYR A 40 10.429 -1.436 3.497 1.00 31.42 H new ATOM 0 HH TYR A 40 13.662 -0.936 3.778 1.00 3.34 H new ATOM 609 N ARG A 41 7.927 -3.032 10.502 1.00 5.33 N ATOM 610 CA ARG A 41 6.819 -2.950 11.446 1.00 51.00 C ATOM 611 C ARG A 41 7.039 -1.820 12.448 1.00 4.01 C ATOM 612 O ARG A 41 8.174 -1.425 12.714 1.00 45.41 O ATOM 613 CB ARG A 41 6.645 -4.282 12.182 1.00 14.42 C ATOM 614 CG ARG A 41 7.722 -4.555 13.222 1.00 12.43 C ATOM 615 CD ARG A 41 8.222 -5.989 13.150 1.00 72.14 C ATOM 616 NE ARG A 41 9.217 -6.274 14.181 1.00 12.20 N ATOM 617 CZ ARG A 41 10.035 -7.324 14.152 1.00 42.44 C ATOM 618 NH1 ARG A 41 9.982 -8.187 13.145 1.00 75.24 N ATOM 619 NH2 ARG A 41 10.909 -7.511 15.131 1.00 42.04 N ATOM 0 H ARG A 41 8.846 -2.868 10.913 1.00 5.33 H new ATOM 0 HA ARG A 41 5.910 -2.737 10.883 1.00 51.00 H new ATOM 0 HB2 ARG A 41 5.671 -4.292 12.671 1.00 14.42 H new ATOM 0 HB3 ARG A 41 6.644 -5.092 11.453 1.00 14.42 H new ATOM 0 HG2 ARG A 41 8.557 -3.870 13.070 1.00 12.43 H new ATOM 0 HG3 ARG A 41 7.325 -4.358 14.218 1.00 12.43 H new ATOM 0 HD2 ARG A 41 7.380 -6.672 13.260 1.00 72.14 H new ATOM 0 HD3 ARG A 41 8.656 -6.173 12.167 1.00 72.14 H new ATOM 0 HE ARG A 41 9.289 -5.631 14.969 1.00 12.20 H new ATOM 0 HH11 ARG A 41 9.312 -8.047 12.388 1.00 75.24 H new ATOM 0 HH12 ARG A 41 10.611 -8.990 13.128 1.00 75.24 H new ATOM 0 HH21 ARG A 41 10.955 -6.850 15.907 1.00 42.04 H new ATOM 0 HH22 ARG A 41 11.536 -8.316 15.109 1.00 42.04 H new ATOM 633 N LYS A 42 5.946 -1.303 12.999 1.00 5.41 N ATOM 634 CA LYS A 42 6.020 -0.219 13.971 1.00 41.42 C ATOM 635 C LYS A 42 4.799 -0.221 14.884 1.00 40.11 C ATOM 636 O LYS A 42 3.704 -0.604 14.472 1.00 32.02 O ATOM 637 CB LYS A 42 6.137 1.129 13.254 1.00 4.04 C ATOM 638 CG LYS A 42 7.322 1.962 13.713 1.00 34.01 C ATOM 639 CD LYS A 42 7.548 3.159 12.803 1.00 31.11 C ATOM 640 CE LYS A 42 7.111 4.458 13.464 1.00 52.20 C ATOM 641 NZ LYS A 42 8.263 5.364 13.724 1.00 30.35 N ATOM 0 H LYS A 42 4.999 -1.617 12.789 1.00 5.41 H new ATOM 0 HA LYS A 42 6.907 -0.374 14.585 1.00 41.42 H new ATOM 0 HB2 LYS A 42 6.220 0.954 12.181 1.00 4.04 H new ATOM 0 HB3 LYS A 42 5.221 1.697 13.414 1.00 4.04 H new ATOM 0 HG2 LYS A 42 7.153 2.306 14.733 1.00 34.01 H new ATOM 0 HG3 LYS A 42 8.219 1.342 13.730 1.00 34.01 H new ATOM 0 HD2 LYS A 42 8.604 3.222 12.540 1.00 31.11 H new ATOM 0 HD3 LYS A 42 6.995 3.019 11.874 1.00 31.11 H new ATOM 0 HE2 LYS A 42 6.388 4.965 12.825 1.00 52.20 H new ATOM 0 HE3 LYS A 42 6.605 4.235 14.404 1.00 52.20 H new ATOM 0 HZ1 LYS A 42 7.922 6.342 13.816 1.00 30.35 H new ATOM 0 HZ2 LYS A 42 8.737 5.079 14.605 1.00 30.35 H new ATOM 0 HZ3 LYS A 42 8.936 5.305 12.934 1.00 30.35 H new ATOM 655 N GLN A 43 4.994 0.210 16.125 1.00 71.34 N ATOM 656 CA GLN A 43 3.907 0.260 17.095 1.00 23.11 C ATOM 657 C GLN A 43 3.415 1.691 17.283 1.00 22.14 C ATOM 658 O GLN A 43 4.171 2.568 17.702 1.00 60.24 O ATOM 659 CB GLN A 43 4.364 -0.314 18.437 1.00 11.14 C ATOM 660 CG GLN A 43 3.231 -0.535 19.422 1.00 65.01 C ATOM 661 CD GLN A 43 3.732 -0.789 20.823 1.00 2.14 C ATOM 662 OE1 GLN A 43 4.151 -1.897 21.159 1.00 61.53 O ATOM 663 NE2 GLN A 43 3.689 0.242 21.649 1.00 11.10 N ATOM 0 H GLN A 43 5.894 0.530 16.483 1.00 71.34 H new ATOM 0 HA GLN A 43 3.084 -0.343 16.713 1.00 23.11 H new ATOM 0 HB2 GLN A 43 4.872 -1.262 18.263 1.00 11.14 H new ATOM 0 HB3 GLN A 43 5.094 0.362 18.882 1.00 11.14 H new ATOM 0 HG2 GLN A 43 2.579 0.338 19.424 1.00 65.01 H new ATOM 0 HG3 GLN A 43 2.628 -1.382 19.095 1.00 65.01 H new ATOM 0 HE21 GLN A 43 3.333 1.141 21.324 1.00 11.10 H new ATOM 0 HE22 GLN A 43 4.012 0.139 22.611 1.00 11.10 H new ATOM 672 N VAL A 44 2.146 1.920 16.966 1.00 61.30 N ATOM 673 CA VAL A 44 1.554 3.245 17.097 1.00 32.41 C ATOM 674 C VAL A 44 0.229 3.184 17.849 1.00 51.53 C ATOM 675 O VAL A 44 -0.198 2.117 18.291 1.00 55.10 O ATOM 676 CB VAL A 44 1.324 3.895 15.718 1.00 43.43 C ATOM 677 CG1 VAL A 44 2.642 4.053 14.977 1.00 53.12 C ATOM 678 CG2 VAL A 44 0.338 3.077 14.896 1.00 51.24 C ATOM 0 H VAL A 44 1.508 1.205 16.617 1.00 61.30 H new ATOM 0 HA VAL A 44 2.259 3.853 17.663 1.00 32.41 H new ATOM 0 HB VAL A 44 0.897 4.886 15.872 1.00 43.43 H new ATOM 0 HG11 VAL A 44 2.460 4.513 14.006 1.00 53.12 H new ATOM 0 HG12 VAL A 44 3.313 4.685 15.559 1.00 53.12 H new ATOM 0 HG13 VAL A 44 3.099 3.074 14.835 1.00 53.12 H new ATOM 0 HG21 VAL A 44 0.190 3.553 13.927 1.00 51.24 H new ATOM 0 HG22 VAL A 44 0.732 2.071 14.750 1.00 51.24 H new ATOM 0 HG23 VAL A 44 -0.615 3.020 15.422 1.00 51.24 H new ATOM 688 N VAL A 45 -0.418 4.336 17.992 1.00 72.42 N ATOM 689 CA VAL A 45 -1.695 4.414 18.691 1.00 40.23 C ATOM 690 C VAL A 45 -2.803 4.895 17.760 1.00 12.34 C ATOM 691 O VAL A 45 -2.907 6.086 17.466 1.00 52.14 O ATOM 692 CB VAL A 45 -1.615 5.358 19.904 1.00 44.03 C ATOM 693 CG1 VAL A 45 -2.893 5.283 20.726 1.00 70.34 C ATOM 694 CG2 VAL A 45 -0.401 5.026 20.759 1.00 33.11 C ATOM 0 H VAL A 45 -0.079 5.228 17.633 1.00 72.42 H new ATOM 0 HA VAL A 45 -1.927 3.407 19.038 1.00 40.23 H new ATOM 0 HB VAL A 45 -1.506 6.380 19.540 1.00 44.03 H new ATOM 0 HG11 VAL A 45 -2.817 5.957 21.579 1.00 70.34 H new ATOM 0 HG12 VAL A 45 -3.741 5.575 20.107 1.00 70.34 H new ATOM 0 HG13 VAL A 45 -3.037 4.263 21.082 1.00 70.34 H new ATOM 0 HG21 VAL A 45 -0.360 5.703 21.612 1.00 33.11 H new ATOM 0 HG22 VAL A 45 -0.477 3.999 21.115 1.00 33.11 H new ATOM 0 HG23 VAL A 45 0.505 5.138 20.163 1.00 33.11 H new ATOM 704 N ILE A 46 -3.629 3.961 17.300 1.00 53.13 N ATOM 705 CA ILE A 46 -4.731 4.289 16.403 1.00 32.31 C ATOM 706 C ILE A 46 -6.076 4.086 17.095 1.00 50.30 C ATOM 707 O ILE A 46 -6.290 3.083 17.776 1.00 10.12 O ATOM 708 CB ILE A 46 -4.684 3.436 15.118 1.00 54.34 C ATOM 709 CG1 ILE A 46 -3.323 3.586 14.433 1.00 4.32 C ATOM 710 CG2 ILE A 46 -5.808 3.832 14.171 1.00 44.24 C ATOM 711 CD1 ILE A 46 -3.226 2.859 13.109 1.00 61.11 C ATOM 0 H ILE A 46 -3.556 2.971 17.534 1.00 53.13 H new ATOM 0 HA ILE A 46 -4.621 5.339 16.131 1.00 32.31 H new ATOM 0 HB ILE A 46 -4.822 2.390 15.390 1.00 54.34 H new ATOM 0 HG12 ILE A 46 -3.122 4.645 14.272 1.00 4.32 H new ATOM 0 HG13 ILE A 46 -2.547 3.212 15.101 1.00 4.32 H new ATOM 0 HG21 ILE A 46 -5.758 3.219 13.271 1.00 44.24 H new ATOM 0 HG22 ILE A 46 -6.769 3.678 14.662 1.00 44.24 H new ATOM 0 HG23 ILE A 46 -5.703 4.883 13.901 1.00 44.24 H new ATOM 0 HD11 ILE A 46 -2.234 3.010 12.683 1.00 61.11 H new ATOM 0 HD12 ILE A 46 -3.395 1.794 13.266 1.00 61.11 H new ATOM 0 HD13 ILE A 46 -3.979 3.249 12.424 1.00 61.11 H new ATOM 723 N ASP A 47 -6.978 5.046 16.917 1.00 2.10 N ATOM 724 CA ASP A 47 -8.303 4.979 17.524 1.00 1.51 C ATOM 725 C ASP A 47 -8.220 5.071 19.047 1.00 14.53 C ATOM 726 O ASP A 47 -9.167 4.719 19.750 1.00 72.30 O ATOM 727 CB ASP A 47 -9.011 3.684 17.119 1.00 2.00 C ATOM 728 CG ASP A 47 -10.508 3.869 16.962 1.00 53.22 C ATOM 729 OD1 ASP A 47 -11.227 3.774 17.979 1.00 52.24 O ATOM 730 OD2 ASP A 47 -10.960 4.108 15.823 1.00 12.03 O ATOM 0 H ASP A 47 -6.815 5.882 16.356 1.00 2.10 H new ATOM 0 HA ASP A 47 -8.878 5.830 17.160 1.00 1.51 H new ATOM 0 HB2 ASP A 47 -8.592 3.322 16.180 1.00 2.00 H new ATOM 0 HB3 ASP A 47 -8.819 2.918 17.870 1.00 2.00 H new ATOM 735 N GLY A 48 -7.085 5.549 19.552 1.00 12.14 N ATOM 736 CA GLY A 48 -6.911 5.679 20.987 1.00 42.40 C ATOM 737 C GLY A 48 -6.280 4.453 21.621 1.00 3.12 C ATOM 738 O GLY A 48 -5.754 4.525 22.731 1.00 61.22 O ATOM 0 H GLY A 48 -6.285 5.848 18.994 1.00 12.14 H new ATOM 0 HA2 GLY A 48 -6.289 6.550 21.195 1.00 42.40 H new ATOM 0 HA3 GLY A 48 -7.881 5.862 21.450 1.00 42.40 H new ATOM 742 N GLU A 49 -6.331 3.324 20.919 1.00 75.14 N ATOM 743 CA GLU A 49 -5.760 2.083 21.430 1.00 74.52 C ATOM 744 C GLU A 49 -4.439 1.763 20.738 1.00 25.11 C ATOM 745 O GLU A 49 -4.227 2.128 19.582 1.00 32.33 O ATOM 746 CB GLU A 49 -6.745 0.926 21.242 1.00 10.14 C ATOM 747 CG GLU A 49 -6.950 0.527 19.789 1.00 20.45 C ATOM 748 CD GLU A 49 -8.169 -0.353 19.592 1.00 3.03 C ATOM 749 OE1 GLU A 49 -9.288 0.194 19.500 1.00 23.51 O ATOM 750 OE2 GLU A 49 -8.004 -1.590 19.529 1.00 74.12 O ATOM 0 H GLU A 49 -6.761 3.244 19.997 1.00 75.14 H new ATOM 0 HA GLU A 49 -5.566 2.215 22.495 1.00 74.52 H new ATOM 0 HB2 GLU A 49 -6.386 0.061 21.800 1.00 10.14 H new ATOM 0 HB3 GLU A 49 -7.707 1.206 21.672 1.00 10.14 H new ATOM 0 HG2 GLU A 49 -7.053 1.425 19.181 1.00 20.45 H new ATOM 0 HG3 GLU A 49 -6.065 0.000 19.432 1.00 20.45 H new ATOM 757 N THR A 50 -3.556 1.075 21.453 1.00 2.21 N ATOM 758 CA THR A 50 -2.256 0.701 20.910 1.00 54.41 C ATOM 759 C THR A 50 -2.385 -0.499 19.977 1.00 4.44 C ATOM 760 O THR A 50 -2.985 -1.513 20.334 1.00 53.21 O ATOM 761 CB THR A 50 -1.283 0.379 22.046 1.00 63.13 C ATOM 762 OG1 THR A 50 -1.116 1.500 22.895 1.00 24.54 O ATOM 763 CG2 THR A 50 0.090 -0.038 21.562 1.00 71.20 C ATOM 0 H THR A 50 -3.717 0.765 22.411 1.00 2.21 H new ATOM 0 HA THR A 50 -1.869 1.544 20.337 1.00 54.41 H new ATOM 0 HB THR A 50 -1.731 -0.459 22.580 1.00 63.13 H new ATOM 0 HG1 THR A 50 -0.492 1.274 23.616 1.00 24.54 H new ATOM 0 HG21 THR A 50 0.729 -0.251 22.419 1.00 71.20 H new ATOM 0 HG22 THR A 50 0.002 -0.931 20.944 1.00 71.20 H new ATOM 0 HG23 THR A 50 0.529 0.768 20.974 1.00 71.20 H new ATOM 771 N CYS A 51 -1.820 -0.376 18.781 1.00 43.41 N ATOM 772 CA CYS A 51 -1.874 -1.452 17.798 1.00 25.21 C ATOM 773 C CYS A 51 -0.580 -1.520 16.994 1.00 65.24 C ATOM 774 O CYS A 51 0.080 -0.505 16.773 1.00 60.00 O ATOM 775 CB CYS A 51 -3.062 -1.250 16.856 1.00 4.31 C ATOM 776 SG CYS A 51 -4.675 -1.456 17.648 1.00 1.12 S ATOM 0 H CYS A 51 -1.320 0.457 18.469 1.00 43.41 H new ATOM 0 HA CYS A 51 -1.998 -2.393 18.333 1.00 25.21 H new ATOM 0 HB2 CYS A 51 -3.005 -0.250 16.426 1.00 4.31 H new ATOM 0 HB3 CYS A 51 -2.982 -1.957 16.030 1.00 4.31 H new ATOM 0 HG CYS A 51 -4.515 -1.586 18.931 1.00 1.12 H new ATOM 782 N LEU A 52 -0.226 -2.724 16.556 1.00 12.52 N ATOM 783 CA LEU A 52 0.987 -2.925 15.773 1.00 41.02 C ATOM 784 C LEU A 52 0.748 -2.566 14.310 1.00 73.04 C ATOM 785 O LEU A 52 -0.381 -2.625 13.824 1.00 23.41 O ATOM 786 CB LEU A 52 1.458 -4.378 15.890 1.00 64.44 C ATOM 787 CG LEU A 52 2.869 -4.559 16.456 1.00 41.21 C ATOM 788 CD1 LEU A 52 3.909 -4.060 15.465 1.00 32.20 C ATOM 789 CD2 LEU A 52 3.007 -3.838 17.791 1.00 11.23 C ATOM 0 H LEU A 52 -0.762 -3.574 16.730 1.00 12.52 H new ATOM 0 HA LEU A 52 1.764 -2.269 16.167 1.00 41.02 H new ATOM 0 HB2 LEU A 52 0.757 -4.921 16.523 1.00 64.44 H new ATOM 0 HB3 LEU A 52 1.418 -4.838 14.902 1.00 64.44 H new ATOM 0 HG LEU A 52 3.039 -5.622 16.624 1.00 41.21 H new ATOM 0 HD11 LEU A 52 4.906 -4.196 15.884 1.00 32.20 H new ATOM 0 HD12 LEU A 52 3.826 -4.623 14.536 1.00 32.20 H new ATOM 0 HD13 LEU A 52 3.742 -3.002 15.264 1.00 32.20 H new ATOM 0 HD21 LEU A 52 4.016 -3.978 18.178 1.00 11.23 H new ATOM 0 HD22 LEU A 52 2.816 -2.774 17.651 1.00 11.23 H new ATOM 0 HD23 LEU A 52 2.287 -4.245 18.501 1.00 11.23 H new ATOM 801 N LEU A 53 1.816 -2.194 13.612 1.00 14.32 N ATOM 802 CA LEU A 53 1.716 -1.827 12.204 1.00 24.31 C ATOM 803 C LEU A 53 2.824 -2.488 11.390 1.00 64.45 C ATOM 804 O LEU A 53 3.880 -1.896 11.167 1.00 73.10 O ATOM 805 CB LEU A 53 1.787 -0.307 12.043 1.00 4.04 C ATOM 806 CG LEU A 53 0.524 0.451 12.457 1.00 3.12 C ATOM 807 CD1 LEU A 53 0.657 1.929 12.127 1.00 33.23 C ATOM 808 CD2 LEU A 53 -0.701 -0.141 11.775 1.00 2.22 C ATOM 0 H LEU A 53 2.759 -2.139 13.997 1.00 14.32 H new ATOM 0 HA LEU A 53 0.754 -2.180 11.831 1.00 24.31 H new ATOM 0 HB2 LEU A 53 2.625 0.066 12.632 1.00 4.04 H new ATOM 0 HB3 LEU A 53 2.004 -0.078 11.000 1.00 4.04 H new ATOM 0 HG LEU A 53 0.400 0.350 13.535 1.00 3.12 H new ATOM 0 HD11 LEU A 53 -0.250 2.452 12.428 1.00 33.23 H new ATOM 0 HD12 LEU A 53 1.511 2.346 12.662 1.00 33.23 H new ATOM 0 HD13 LEU A 53 0.806 2.050 11.054 1.00 33.23 H new ATOM 0 HD21 LEU A 53 -1.590 0.410 12.081 1.00 2.22 H new ATOM 0 HD22 LEU A 53 -0.585 -0.071 10.693 1.00 2.22 H new ATOM 0 HD23 LEU A 53 -0.807 -1.187 12.061 1.00 2.22 H new ATOM 820 N ASP A 54 2.575 -3.716 10.949 1.00 31.31 N ATOM 821 CA ASP A 54 3.553 -4.457 10.160 1.00 55.34 C ATOM 822 C ASP A 54 3.338 -4.222 8.669 1.00 72.34 C ATOM 823 O ASP A 54 2.502 -4.873 8.042 1.00 75.12 O ATOM 824 CB ASP A 54 3.464 -5.952 10.471 1.00 23.31 C ATOM 825 CG ASP A 54 4.179 -6.319 11.756 1.00 53.44 C ATOM 826 OD1 ASP A 54 3.711 -5.902 12.836 1.00 2.43 O ATOM 827 OD2 ASP A 54 5.208 -7.023 11.683 1.00 51.40 O ATOM 0 H ASP A 54 1.705 -4.219 11.124 1.00 31.31 H new ATOM 0 HA ASP A 54 4.546 -4.097 10.427 1.00 55.34 H new ATOM 0 HB2 ASP A 54 2.416 -6.243 10.546 1.00 23.31 H new ATOM 0 HB3 ASP A 54 3.894 -6.518 9.645 1.00 23.31 H new ATOM 832 N ILE A 55 4.098 -3.289 8.106 1.00 2.41 N ATOM 833 CA ILE A 55 3.990 -2.969 6.688 1.00 15.42 C ATOM 834 C ILE A 55 4.871 -3.886 5.848 1.00 72.25 C ATOM 835 O ILE A 55 6.097 -3.781 5.873 1.00 31.11 O ATOM 836 CB ILE A 55 4.378 -1.505 6.405 1.00 62.02 C ATOM 837 CG1 ILE A 55 3.732 -0.570 7.431 1.00 2.21 C ATOM 838 CG2 ILE A 55 3.969 -1.114 4.993 1.00 24.31 C ATOM 839 CD1 ILE A 55 2.234 -0.749 7.556 1.00 3.13 C ATOM 0 H ILE A 55 4.795 -2.741 8.610 1.00 2.41 H new ATOM 0 HA ILE A 55 2.946 -3.118 6.413 1.00 15.42 H new ATOM 0 HB ILE A 55 5.461 -1.410 6.491 1.00 62.02 H new ATOM 0 HG12 ILE A 55 4.192 -0.739 8.405 1.00 2.21 H new ATOM 0 HG13 ILE A 55 3.944 0.462 7.153 1.00 2.21 H new ATOM 0 HG21 ILE A 55 4.249 -0.077 4.807 1.00 24.31 H new ATOM 0 HG22 ILE A 55 4.474 -1.761 4.276 1.00 24.31 H new ATOM 0 HG23 ILE A 55 2.890 -1.223 4.883 1.00 24.31 H new ATOM 0 HD11 ILE A 55 1.845 -0.054 8.300 1.00 3.13 H new ATOM 0 HD12 ILE A 55 1.762 -0.551 6.594 1.00 3.13 H new ATOM 0 HD13 ILE A 55 2.014 -1.771 7.864 1.00 3.13 H new ATOM 851 N LEU A 56 4.236 -4.783 5.101 1.00 34.32 N ATOM 852 CA LEU A 56 4.959 -5.717 4.250 1.00 13.41 C ATOM 853 C LEU A 56 5.208 -5.107 2.874 1.00 54.35 C ATOM 854 O LEU A 56 4.303 -4.542 2.260 1.00 33.21 O ATOM 855 CB LEU A 56 4.170 -7.025 4.121 1.00 2.34 C ATOM 856 CG LEU A 56 4.504 -7.881 2.893 1.00 14.14 C ATOM 857 CD1 LEU A 56 4.899 -9.286 3.311 1.00 42.12 C ATOM 858 CD2 LEU A 56 3.323 -7.922 1.937 1.00 53.24 C ATOM 0 H LEU A 56 3.221 -4.882 5.069 1.00 34.32 H new ATOM 0 HA LEU A 56 5.925 -5.931 4.707 1.00 13.41 H new ATOM 0 HB2 LEU A 56 4.343 -7.623 5.016 1.00 2.34 H new ATOM 0 HB3 LEU A 56 3.107 -6.786 4.097 1.00 2.34 H new ATOM 0 HG LEU A 56 5.350 -7.427 2.378 1.00 14.14 H new ATOM 0 HD11 LEU A 56 5.132 -9.877 2.425 1.00 42.12 H new ATOM 0 HD12 LEU A 56 5.775 -9.240 3.958 1.00 42.12 H new ATOM 0 HD13 LEU A 56 4.074 -9.751 3.851 1.00 42.12 H new ATOM 0 HD21 LEU A 56 3.577 -8.533 1.071 1.00 53.24 H new ATOM 0 HD22 LEU A 56 2.459 -8.352 2.444 1.00 53.24 H new ATOM 0 HD23 LEU A 56 3.085 -6.910 1.609 1.00 53.24 H new ATOM 870 N ASP A 57 6.439 -5.233 2.392 1.00 0.10 N ATOM 871 CA ASP A 57 6.806 -4.703 1.087 1.00 52.24 C ATOM 872 C ASP A 57 7.345 -5.809 0.187 1.00 1.33 C ATOM 873 O ASP A 57 8.479 -6.259 0.351 1.00 51.35 O ATOM 874 CB ASP A 57 7.848 -3.593 1.235 1.00 51.35 C ATOM 875 CG ASP A 57 7.603 -2.439 0.282 1.00 63.25 C ATOM 876 OD1 ASP A 57 6.745 -1.586 0.591 1.00 61.32 O ATOM 877 OD2 ASP A 57 8.269 -2.389 -0.773 1.00 1.22 O ATOM 0 H ASP A 57 7.200 -5.698 2.887 1.00 0.10 H new ATOM 0 HA ASP A 57 5.910 -4.286 0.626 1.00 52.24 H new ATOM 0 HB2 ASP A 57 7.837 -3.223 2.260 1.00 51.35 H new ATOM 0 HB3 ASP A 57 8.841 -4.004 1.055 1.00 51.35 H new ATOM 882 N THR A 58 6.528 -6.239 -0.768 1.00 21.30 N ATOM 883 CA THR A 58 6.925 -7.290 -1.697 1.00 14.21 C ATOM 884 C THR A 58 7.907 -6.736 -2.726 1.00 3.04 C ATOM 885 O THR A 58 8.340 -5.589 -2.625 1.00 54.03 O ATOM 886 CB THR A 58 5.697 -7.866 -2.404 1.00 71.30 C ATOM 887 OG1 THR A 58 5.241 -6.985 -3.416 1.00 21.23 O ATOM 888 CG2 THR A 58 4.536 -8.131 -1.469 1.00 41.11 C ATOM 0 H THR A 58 5.587 -5.876 -0.919 1.00 21.30 H new ATOM 0 HA THR A 58 7.412 -8.087 -1.135 1.00 14.21 H new ATOM 0 HB THR A 58 6.027 -8.816 -2.826 1.00 71.30 H new ATOM 0 HG1 THR A 58 4.371 -7.290 -3.748 1.00 21.23 H new ATOM 0 HG21 THR A 58 3.698 -8.538 -2.035 1.00 41.11 H new ATOM 0 HG22 THR A 58 4.840 -8.847 -0.705 1.00 41.11 H new ATOM 0 HG23 THR A 58 4.232 -7.199 -0.993 1.00 41.11 H new ATOM 896 N ALA A 59 8.256 -7.551 -3.715 1.00 51.14 N ATOM 897 CA ALA A 59 9.188 -7.128 -4.755 1.00 54.21 C ATOM 898 C ALA A 59 8.587 -7.305 -6.141 1.00 15.51 C ATOM 899 O ALA A 59 7.612 -8.036 -6.318 1.00 61.14 O ATOM 900 CB ALA A 59 10.491 -7.902 -4.648 1.00 32.04 C ATOM 0 H ALA A 59 7.910 -8.505 -3.819 1.00 51.14 H new ATOM 0 HA ALA A 59 9.392 -6.068 -4.607 1.00 54.21 H new ATOM 0 HB1 ALA A 59 11.174 -7.574 -5.431 1.00 32.04 H new ATOM 0 HB2 ALA A 59 10.943 -7.721 -3.673 1.00 32.04 H new ATOM 0 HB3 ALA A 59 10.292 -8.967 -4.763 1.00 32.04 H new ATOM 1002 N MET A 67 4.212 -15.842 -4.796 1.00 63.22 N ATOM 1003 CA MET A 67 4.232 -15.749 -3.341 1.00 45.02 C ATOM 1004 C MET A 67 3.233 -14.703 -2.854 1.00 14.42 C ATOM 1005 O MET A 67 2.723 -14.789 -1.737 1.00 12.10 O ATOM 1006 CB MET A 67 5.640 -15.396 -2.855 1.00 43.22 C ATOM 1007 CG MET A 67 6.559 -16.601 -2.739 1.00 0.53 C ATOM 1008 SD MET A 67 8.228 -16.160 -2.222 1.00 4.22 S ATOM 1009 CE MET A 67 7.893 -15.370 -0.651 1.00 53.12 C ATOM 0 HA MET A 67 3.946 -16.717 -2.930 1.00 45.02 H new ATOM 0 HB2 MET A 67 6.083 -14.675 -3.542 1.00 43.22 H new ATOM 0 HB3 MET A 67 5.569 -14.908 -1.883 1.00 43.22 H new ATOM 0 HG2 MET A 67 6.137 -17.307 -2.024 1.00 0.53 H new ATOM 0 HG3 MET A 67 6.605 -17.111 -3.701 1.00 0.53 H new ATOM 0 HE1 MET A 67 8.099 -14.303 -0.729 1.00 53.12 H new ATOM 0 HE2 MET A 67 6.847 -15.519 -0.385 1.00 53.12 H new ATOM 0 HE3 MET A 67 8.529 -15.807 0.119 1.00 53.12 H new ATOM 1019 N ARG A 68 2.959 -13.714 -3.703 1.00 3.51 N ATOM 1020 CA ARG A 68 2.021 -12.647 -3.365 1.00 50.42 C ATOM 1021 C ARG A 68 0.688 -13.215 -2.888 1.00 33.11 C ATOM 1022 O ARG A 68 0.177 -12.822 -1.840 1.00 12.02 O ATOM 1023 CB ARG A 68 1.799 -11.737 -4.576 1.00 41.22 C ATOM 1024 CG ARG A 68 2.609 -10.452 -4.527 1.00 60.02 C ATOM 1025 CD ARG A 68 2.169 -9.473 -5.603 1.00 54.33 C ATOM 1026 NE ARG A 68 3.252 -8.578 -6.003 1.00 13.33 N ATOM 1027 CZ ARG A 68 3.270 -7.903 -7.150 1.00 45.10 C ATOM 1028 NH1 ARG A 68 2.263 -8.011 -8.007 1.00 35.51 N ATOM 1029 NH2 ARG A 68 4.297 -7.115 -7.439 1.00 11.10 N ATOM 0 H ARG A 68 3.374 -13.630 -4.631 1.00 3.51 H new ATOM 0 HA ARG A 68 2.453 -12.064 -2.551 1.00 50.42 H new ATOM 0 HB2 ARG A 68 2.056 -12.284 -5.483 1.00 41.22 H new ATOM 0 HB3 ARG A 68 0.740 -11.487 -4.643 1.00 41.22 H new ATOM 0 HG2 ARG A 68 2.500 -9.989 -3.546 1.00 60.02 H new ATOM 0 HG3 ARG A 68 3.667 -10.683 -4.654 1.00 60.02 H new ATOM 0 HD2 ARG A 68 1.815 -10.026 -6.473 1.00 54.33 H new ATOM 0 HD3 ARG A 68 1.329 -8.884 -5.236 1.00 54.33 H new ATOM 0 HE ARG A 68 4.040 -8.464 -5.366 1.00 13.33 H new ATOM 0 HH11 ARG A 68 1.470 -8.614 -7.788 1.00 35.51 H new ATOM 0 HH12 ARG A 68 2.282 -7.491 -8.884 1.00 35.51 H new ATOM 0 HH21 ARG A 68 5.073 -7.027 -6.782 1.00 11.10 H new ATOM 0 HH22 ARG A 68 4.311 -6.598 -8.318 1.00 11.10 H new ATOM 1043 N ASP A 69 0.129 -14.142 -3.663 1.00 21.43 N ATOM 1044 CA ASP A 69 -1.146 -14.765 -3.317 1.00 13.11 C ATOM 1045 C ASP A 69 -1.132 -15.274 -1.879 1.00 31.44 C ATOM 1046 O ASP A 69 -2.163 -15.298 -1.206 1.00 54.12 O ATOM 1047 CB ASP A 69 -1.453 -15.917 -4.277 1.00 21.21 C ATOM 1048 CG ASP A 69 -2.737 -15.697 -5.053 1.00 43.00 C ATOM 1049 OD1 ASP A 69 -2.847 -14.658 -5.737 1.00 35.11 O ATOM 1050 OD2 ASP A 69 -3.633 -16.564 -4.976 1.00 51.31 O ATOM 0 H ASP A 69 0.539 -14.478 -4.534 1.00 21.43 H new ATOM 0 HA ASP A 69 -1.926 -14.009 -3.407 1.00 13.11 H new ATOM 0 HB2 ASP A 69 -0.625 -16.034 -4.976 1.00 21.21 H new ATOM 0 HB3 ASP A 69 -1.528 -16.846 -3.713 1.00 21.21 H new ATOM 1055 N GLN A 70 0.046 -15.674 -1.414 1.00 23.31 N ATOM 1056 CA GLN A 70 0.199 -16.178 -0.056 1.00 43.42 C ATOM 1057 C GLN A 70 0.016 -15.053 0.957 1.00 43.33 C ATOM 1058 O GLN A 70 -0.714 -15.199 1.938 1.00 44.54 O ATOM 1059 CB GLN A 70 1.577 -16.818 0.119 1.00 62.10 C ATOM 1060 CG GLN A 70 1.608 -17.914 1.170 1.00 2.13 C ATOM 1061 CD GLN A 70 0.873 -19.167 0.730 1.00 73.30 C ATOM 1062 OE1 GLN A 70 1.319 -19.879 -0.170 1.00 14.52 O ATOM 1063 NE2 GLN A 70 -0.261 -19.441 1.364 1.00 23.35 N ATOM 0 H GLN A 70 0.909 -15.659 -1.958 1.00 23.31 H new ATOM 0 HA GLN A 70 -0.568 -16.933 0.118 1.00 43.42 H new ATOM 0 HB2 GLN A 70 1.900 -17.232 -0.836 1.00 62.10 H new ATOM 0 HB3 GLN A 70 2.296 -16.045 0.391 1.00 62.10 H new ATOM 0 HG2 GLN A 70 2.644 -18.166 1.396 1.00 2.13 H new ATOM 0 HG3 GLN A 70 1.162 -17.541 2.092 1.00 2.13 H new ATOM 0 HE21 GLN A 70 -0.594 -18.823 2.104 1.00 23.35 H new ATOM 0 HE22 GLN A 70 -0.800 -20.269 1.111 1.00 23.35 H new ATOM 1072 N TYR A 71 0.681 -13.929 0.710 1.00 25.34 N ATOM 1073 CA TYR A 71 0.591 -12.776 1.596 1.00 62.32 C ATOM 1074 C TYR A 71 -0.852 -12.291 1.717 1.00 2.32 C ATOM 1075 O TYR A 71 -1.214 -11.627 2.688 1.00 43.24 O ATOM 1076 CB TYR A 71 1.494 -11.646 1.087 1.00 41.04 C ATOM 1077 CG TYR A 71 2.965 -12.017 1.021 1.00 25.54 C ATOM 1078 CD1 TYR A 71 3.423 -13.235 1.516 1.00 12.53 C ATOM 1079 CD2 TYR A 71 3.895 -11.149 0.461 1.00 23.20 C ATOM 1080 CE1 TYR A 71 4.761 -13.575 1.454 1.00 62.11 C ATOM 1081 CE2 TYR A 71 5.236 -11.484 0.396 1.00 5.23 C ATOM 1082 CZ TYR A 71 5.662 -12.697 0.894 1.00 55.51 C ATOM 1083 OH TYR A 71 6.994 -13.033 0.831 1.00 12.51 O ATOM 0 H TYR A 71 1.289 -13.793 -0.098 1.00 25.34 H new ATOM 0 HA TYR A 71 0.930 -13.079 2.587 1.00 62.32 H new ATOM 0 HB2 TYR A 71 1.160 -11.347 0.094 1.00 41.04 H new ATOM 0 HB3 TYR A 71 1.377 -10.779 1.737 1.00 41.04 H new ATOM 0 HD1 TYR A 71 2.720 -13.927 1.956 1.00 12.53 H new ATOM 0 HD2 TYR A 71 3.566 -10.198 0.070 1.00 23.20 H new ATOM 0 HE1 TYR A 71 5.098 -14.524 1.843 1.00 62.11 H new ATOM 0 HE2 TYR A 71 5.946 -10.798 -0.043 1.00 5.23 H new ATOM 0 HH TYR A 71 7.495 -12.306 0.406 1.00 12.51 H new ATOM 1093 N MET A 72 -1.676 -12.636 0.729 1.00 21.53 N ATOM 1094 CA MET A 72 -3.080 -12.244 0.733 1.00 71.52 C ATOM 1095 C MET A 72 -3.863 -13.062 1.754 1.00 42.02 C ATOM 1096 O MET A 72 -4.704 -12.531 2.479 1.00 70.10 O ATOM 1097 CB MET A 72 -3.690 -12.430 -0.659 1.00 75.33 C ATOM 1098 CG MET A 72 -2.810 -11.918 -1.787 1.00 20.31 C ATOM 1099 SD MET A 72 -3.717 -11.698 -3.329 1.00 3.21 S ATOM 1100 CE MET A 72 -3.116 -10.093 -3.852 1.00 2.45 C ATOM 0 H MET A 72 -1.394 -13.186 -0.083 1.00 21.53 H new ATOM 0 HA MET A 72 -3.138 -11.191 1.008 1.00 71.52 H new ATOM 0 HB2 MET A 72 -3.890 -13.489 -0.819 1.00 75.33 H new ATOM 0 HB3 MET A 72 -4.650 -11.915 -0.697 1.00 75.33 H new ATOM 0 HG2 MET A 72 -2.365 -10.967 -1.493 1.00 20.31 H new ATOM 0 HG3 MET A 72 -1.990 -12.617 -1.949 1.00 20.31 H new ATOM 0 HE1 MET A 72 -3.897 -9.577 -4.411 1.00 2.45 H new ATOM 0 HE2 MET A 72 -2.846 -9.503 -2.976 1.00 2.45 H new ATOM 0 HE3 MET A 72 -2.240 -10.222 -4.487 1.00 2.45 H new ATOM 1110 N ARG A 73 -3.576 -14.359 1.806 1.00 72.43 N ATOM 1111 CA ARG A 73 -4.249 -15.255 2.739 1.00 74.23 C ATOM 1112 C ARG A 73 -3.707 -15.082 4.156 1.00 3.30 C ATOM 1113 O ARG A 73 -4.339 -15.502 5.126 1.00 65.21 O ATOM 1114 CB ARG A 73 -4.083 -16.709 2.291 1.00 1.54 C ATOM 1115 CG ARG A 73 -4.407 -16.935 0.824 1.00 12.41 C ATOM 1116 CD ARG A 73 -4.069 -18.352 0.391 1.00 73.24 C ATOM 1117 NE ARG A 73 -4.850 -19.347 1.123 1.00 75.42 N ATOM 1118 CZ ARG A 73 -4.667 -20.661 1.014 1.00 65.40 C ATOM 1119 NH1 ARG A 73 -3.729 -21.143 0.208 1.00 72.12 N ATOM 1120 NH2 ARG A 73 -5.424 -21.495 1.713 1.00 42.41 N ATOM 0 H ARG A 73 -2.882 -14.813 1.213 1.00 72.43 H new ATOM 0 HA ARG A 73 -5.309 -15.000 2.744 1.00 74.23 H new ATOM 0 HB2 ARG A 73 -3.057 -17.024 2.480 1.00 1.54 H new ATOM 0 HB3 ARG A 73 -4.728 -17.343 2.899 1.00 1.54 H new ATOM 0 HG2 ARG A 73 -5.466 -16.743 0.650 1.00 12.41 H new ATOM 0 HG3 ARG A 73 -3.850 -16.224 0.214 1.00 12.41 H new ATOM 0 HD2 ARG A 73 -4.255 -18.459 -0.678 1.00 73.24 H new ATOM 0 HD3 ARG A 73 -3.006 -18.536 0.550 1.00 73.24 H new ATOM 0 HE ARG A 73 -5.579 -19.015 1.755 1.00 75.42 H new ATOM 0 HH11 ARG A 73 -3.144 -20.506 -0.332 1.00 72.12 H new ATOM 0 HH12 ARG A 73 -3.593 -22.151 0.129 1.00 72.12 H new ATOM 0 HH21 ARG A 73 -6.146 -21.130 2.334 1.00 42.41 H new ATOM 0 HH22 ARG A 73 -5.284 -22.502 1.630 1.00 42.41 H new ATOM 1134 N THR A 74 -2.536 -14.460 4.273 1.00 20.20 N ATOM 1135 CA THR A 74 -1.918 -14.232 5.573 1.00 12.43 C ATOM 1136 C THR A 74 -2.138 -12.794 6.040 1.00 54.34 C ATOM 1137 O THR A 74 -1.943 -12.478 7.214 1.00 55.42 O ATOM 1138 CB THR A 74 -0.419 -14.533 5.511 1.00 14.41 C ATOM 1139 OG1 THR A 74 0.231 -13.659 4.605 1.00 31.14 O ATOM 1140 CG2 THR A 74 -0.106 -15.951 5.085 1.00 62.41 C ATOM 0 H THR A 74 -1.998 -14.106 3.482 1.00 20.20 H new ATOM 0 HA THR A 74 -2.389 -14.905 6.290 1.00 12.43 H new ATOM 0 HB THR A 74 -0.056 -14.390 6.529 1.00 14.41 H new ATOM 0 HG1 THR A 74 1.160 -13.946 4.483 1.00 31.14 H new ATOM 0 HG21 THR A 74 0.974 -16.094 5.063 1.00 62.41 H new ATOM 0 HG22 THR A 74 -0.550 -16.650 5.793 1.00 62.41 H new ATOM 0 HG23 THR A 74 -0.516 -16.131 4.091 1.00 62.41 H new ATOM 1148 N GLY A 75 -2.540 -11.924 5.115 1.00 71.45 N ATOM 1149 CA GLY A 75 -2.772 -10.535 5.457 1.00 4.50 C ATOM 1150 C GLY A 75 -4.221 -10.247 5.793 1.00 42.32 C ATOM 1151 O GLY A 75 -5.111 -11.032 5.466 1.00 20.11 O ATOM 0 H GLY A 75 -2.708 -12.159 4.137 1.00 71.45 H new ATOM 0 HA2 GLY A 75 -2.146 -10.266 6.308 1.00 4.50 H new ATOM 0 HA3 GLY A 75 -2.465 -9.904 4.623 1.00 4.50 H new ATOM 1155 N GLU A 76 -4.457 -9.115 6.449 1.00 54.42 N ATOM 1156 CA GLU A 76 -5.807 -8.719 6.832 1.00 32.13 C ATOM 1157 C GLU A 76 -6.349 -7.634 5.904 1.00 25.21 C ATOM 1158 O GLU A 76 -7.552 -7.382 5.874 1.00 63.40 O ATOM 1159 CB GLU A 76 -5.825 -8.220 8.279 1.00 13.32 C ATOM 1160 CG GLU A 76 -5.065 -9.118 9.242 1.00 1.05 C ATOM 1161 CD GLU A 76 -5.891 -9.505 10.454 1.00 2.30 C ATOM 1162 OE1 GLU A 76 -6.063 -8.652 11.350 1.00 2.12 O ATOM 1163 OE2 GLU A 76 -6.366 -10.658 10.505 1.00 61.22 O ATOM 0 H GLU A 76 -3.730 -8.456 6.726 1.00 54.42 H new ATOM 0 HA GLU A 76 -6.448 -9.596 6.746 1.00 32.13 H new ATOM 0 HB2 GLU A 76 -5.397 -7.218 8.314 1.00 13.32 H new ATOM 0 HB3 GLU A 76 -6.859 -8.136 8.613 1.00 13.32 H new ATOM 0 HG2 GLU A 76 -4.749 -10.021 8.719 1.00 1.05 H new ATOM 0 HG3 GLU A 76 -4.160 -8.608 9.572 1.00 1.05 H new ATOM 1170 N GLY A 77 -5.456 -6.994 5.151 1.00 51.03 N ATOM 1171 CA GLY A 77 -5.872 -5.944 4.238 1.00 71.34 C ATOM 1172 C GLY A 77 -4.948 -5.816 3.043 1.00 32.13 C ATOM 1173 O GLY A 77 -4.083 -6.666 2.825 1.00 13.01 O ATOM 0 H GLY A 77 -4.454 -7.184 5.158 1.00 51.03 H new ATOM 0 HA2 GLY A 77 -6.885 -6.149 3.890 1.00 71.34 H new ATOM 0 HA3 GLY A 77 -5.904 -4.994 4.772 1.00 71.34 H new ATOM 1177 N PHE A 78 -5.129 -4.753 2.265 1.00 71.12 N ATOM 1178 CA PHE A 78 -4.302 -4.519 1.087 1.00 70.32 C ATOM 1179 C PHE A 78 -4.234 -3.033 0.749 1.00 30.23 C ATOM 1180 O PHE A 78 -5.241 -2.327 0.803 1.00 61.11 O ATOM 1181 CB PHE A 78 -4.848 -5.299 -0.110 1.00 15.32 C ATOM 1182 CG PHE A 78 -4.903 -6.781 0.117 1.00 65.30 C ATOM 1183 CD1 PHE A 78 -3.773 -7.563 -0.058 1.00 51.34 C ATOM 1184 CD2 PHE A 78 -6.083 -7.393 0.508 1.00 20.52 C ATOM 1185 CE1 PHE A 78 -3.819 -8.927 0.151 1.00 23.20 C ATOM 1186 CE2 PHE A 78 -6.135 -8.757 0.720 1.00 3.43 C ATOM 1187 CZ PHE A 78 -5.001 -9.526 0.541 1.00 24.25 C ATOM 0 H PHE A 78 -5.841 -4.041 2.429 1.00 71.12 H new ATOM 0 HA PHE A 78 -3.294 -4.867 1.312 1.00 70.32 H new ATOM 0 HB2 PHE A 78 -5.850 -4.938 -0.343 1.00 15.32 H new ATOM 0 HB3 PHE A 78 -4.225 -5.096 -0.981 1.00 15.32 H new ATOM 0 HD1 PHE A 78 -2.845 -7.100 -0.361 1.00 51.34 H new ATOM 0 HD2 PHE A 78 -6.972 -6.797 0.649 1.00 20.52 H new ATOM 0 HE1 PHE A 78 -2.931 -9.525 0.010 1.00 23.20 H new ATOM 0 HE2 PHE A 78 -7.061 -9.222 1.025 1.00 3.43 H new ATOM 0 HZ PHE A 78 -5.039 -10.593 0.706 1.00 24.25 H new ATOM 1197 N LEU A 79 -3.041 -2.567 0.397 1.00 30.43 N ATOM 1198 CA LEU A 79 -2.838 -1.167 0.046 1.00 11.31 C ATOM 1199 C LEU A 79 -2.268 -1.042 -1.364 1.00 14.34 C ATOM 1200 O LEU A 79 -1.215 -1.602 -1.670 1.00 72.31 O ATOM 1201 CB LEU A 79 -1.899 -0.496 1.053 1.00 12.44 C ATOM 1202 CG LEU A 79 -2.393 0.842 1.609 1.00 22.44 C ATOM 1203 CD1 LEU A 79 -3.110 0.637 2.934 1.00 75.51 C ATOM 1204 CD2 LEU A 79 -1.233 1.813 1.773 1.00 25.34 C ATOM 0 H LEU A 79 -2.198 -3.140 0.347 1.00 30.43 H new ATOM 0 HA LEU A 79 -3.805 -0.664 0.075 1.00 11.31 H new ATOM 0 HB2 LEU A 79 -1.736 -1.180 1.886 1.00 12.44 H new ATOM 0 HB3 LEU A 79 -0.932 -0.339 0.576 1.00 12.44 H new ATOM 0 HG LEU A 79 -3.100 1.270 0.899 1.00 22.44 H new ATOM 0 HD11 LEU A 79 -3.454 1.599 3.314 1.00 75.51 H new ATOM 0 HD12 LEU A 79 -3.966 -0.022 2.787 1.00 75.51 H new ATOM 0 HD13 LEU A 79 -2.425 0.187 3.653 1.00 75.51 H new ATOM 0 HD21 LEU A 79 -1.603 2.759 2.169 1.00 25.34 H new ATOM 0 HD22 LEU A 79 -0.501 1.392 2.463 1.00 25.34 H new ATOM 0 HD23 LEU A 79 -0.763 1.985 0.805 1.00 25.34 H new ATOM 1216 N CYS A 80 -2.971 -0.306 -2.218 1.00 51.14 N ATOM 1217 CA CYS A 80 -2.534 -0.111 -3.596 1.00 52.03 C ATOM 1218 C CYS A 80 -1.764 1.197 -3.745 1.00 0.23 C ATOM 1219 O CYS A 80 -2.297 2.276 -3.482 1.00 74.30 O ATOM 1220 CB CYS A 80 -3.737 -0.118 -4.540 1.00 15.45 C ATOM 1221 SG CYS A 80 -4.213 -1.764 -5.117 1.00 51.43 S ATOM 0 H CYS A 80 -3.844 0.165 -1.981 1.00 51.14 H new ATOM 0 HA CYS A 80 -1.869 -0.934 -3.859 1.00 52.03 H new ATOM 0 HB2 CYS A 80 -4.587 0.337 -4.031 1.00 15.45 H new ATOM 0 HB3 CYS A 80 -3.511 0.507 -5.404 1.00 15.45 H new ATOM 0 HG CYS A 80 -5.357 -1.695 -5.731 1.00 51.43 H new ATOM 1227 N VAL A 81 -0.509 1.094 -4.171 1.00 55.22 N ATOM 1228 CA VAL A 81 0.335 2.268 -4.357 1.00 33.45 C ATOM 1229 C VAL A 81 0.644 2.490 -5.834 1.00 30.41 C ATOM 1230 O VAL A 81 1.283 1.656 -6.477 1.00 22.33 O ATOM 1231 CB VAL A 81 1.658 2.137 -3.578 1.00 71.32 C ATOM 1232 CG1 VAL A 81 2.502 3.395 -3.731 1.00 34.23 C ATOM 1233 CG2 VAL A 81 1.386 1.847 -2.111 1.00 63.14 C ATOM 0 H VAL A 81 -0.054 0.209 -4.394 1.00 55.22 H new ATOM 0 HA VAL A 81 -0.219 3.124 -3.972 1.00 33.45 H new ATOM 0 HB VAL A 81 2.219 1.301 -3.995 1.00 71.32 H new ATOM 0 HG11 VAL A 81 3.431 3.280 -3.173 1.00 34.23 H new ATOM 0 HG12 VAL A 81 2.729 3.555 -4.785 1.00 34.23 H new ATOM 0 HG13 VAL A 81 1.951 4.252 -3.345 1.00 34.23 H new ATOM 0 HG21 VAL A 81 2.332 1.758 -1.576 1.00 63.14 H new ATOM 0 HG22 VAL A 81 0.802 2.661 -1.681 1.00 63.14 H new ATOM 0 HG23 VAL A 81 0.829 0.914 -2.022 1.00 63.14 H new ATOM 1243 N PHE A 82 0.190 3.619 -6.367 1.00 23.11 N ATOM 1244 CA PHE A 82 0.421 3.949 -7.768 1.00 2.33 C ATOM 1245 C PHE A 82 0.869 5.400 -7.919 1.00 41.41 C ATOM 1246 O PHE A 82 0.439 6.274 -7.166 1.00 1.42 O ATOM 1247 CB PHE A 82 -0.847 3.694 -8.592 1.00 62.21 C ATOM 1248 CG PHE A 82 -1.876 4.786 -8.484 1.00 74.32 C ATOM 1249 CD1 PHE A 82 -2.609 4.954 -7.321 1.00 21.43 C ATOM 1250 CD2 PHE A 82 -2.106 5.645 -9.547 1.00 34.10 C ATOM 1251 CE1 PHE A 82 -3.554 5.958 -7.220 1.00 1.32 C ATOM 1252 CE2 PHE A 82 -3.049 6.650 -9.452 1.00 0.41 C ATOM 1253 CZ PHE A 82 -3.774 6.807 -8.287 1.00 22.12 C ATOM 0 H PHE A 82 -0.340 4.321 -5.850 1.00 23.11 H new ATOM 0 HA PHE A 82 1.218 3.306 -8.142 1.00 2.33 H new ATOM 0 HB2 PHE A 82 -0.569 3.573 -9.639 1.00 62.21 H new ATOM 0 HB3 PHE A 82 -1.295 2.754 -8.270 1.00 62.21 H new ATOM 0 HD1 PHE A 82 -2.440 4.293 -6.484 1.00 21.43 H new ATOM 0 HD2 PHE A 82 -1.541 5.527 -10.460 1.00 34.10 H new ATOM 0 HE1 PHE A 82 -4.120 6.078 -6.308 1.00 1.32 H new ATOM 0 HE2 PHE A 82 -3.219 7.312 -10.288 1.00 0.41 H new ATOM 0 HZ PHE A 82 -4.512 7.592 -8.210 1.00 22.12 H new ATOM 1263 N ALA A 83 1.733 5.648 -8.897 1.00 62.34 N ATOM 1264 CA ALA A 83 2.235 6.993 -9.148 1.00 60.55 C ATOM 1265 C ALA A 83 1.352 7.727 -10.151 1.00 15.44 C ATOM 1266 O ALA A 83 1.130 7.249 -11.263 1.00 62.40 O ATOM 1267 CB ALA A 83 3.671 6.936 -9.647 1.00 74.31 C ATOM 0 H ALA A 83 2.100 4.936 -9.528 1.00 62.34 H new ATOM 0 HA ALA A 83 2.212 7.546 -8.209 1.00 60.55 H new ATOM 0 HB1 ALA A 83 4.033 7.948 -9.830 1.00 74.31 H new ATOM 0 HB2 ALA A 83 4.299 6.457 -8.896 1.00 74.31 H new ATOM 0 HB3 ALA A 83 3.712 6.363 -10.573 1.00 74.31 H new ATOM 1273 N ILE A 84 0.849 8.890 -9.750 1.00 53.04 N ATOM 1274 CA ILE A 84 -0.011 9.689 -10.614 1.00 44.52 C ATOM 1275 C ILE A 84 0.693 10.042 -11.920 1.00 74.43 C ATOM 1276 O ILE A 84 0.046 10.248 -12.948 1.00 42.11 O ATOM 1277 CB ILE A 84 -0.460 10.988 -9.916 1.00 12.35 C ATOM 1278 CG1 ILE A 84 0.737 11.684 -9.266 1.00 5.12 C ATOM 1279 CG2 ILE A 84 -1.533 10.689 -8.880 1.00 60.51 C ATOM 1280 CD1 ILE A 84 0.625 13.193 -9.250 1.00 43.44 C ATOM 0 H ILE A 84 1.022 9.300 -8.832 1.00 53.04 H new ATOM 0 HA ILE A 84 -0.889 9.081 -10.833 1.00 44.52 H new ATOM 0 HB ILE A 84 -0.882 11.658 -10.665 1.00 12.35 H new ATOM 0 HG12 ILE A 84 0.843 11.325 -8.242 1.00 5.12 H new ATOM 0 HG13 ILE A 84 1.645 11.401 -9.799 1.00 5.12 H new ATOM 0 HG21 ILE A 84 -1.840 11.616 -8.396 1.00 60.51 H new ATOM 0 HG22 ILE A 84 -2.394 10.233 -9.369 1.00 60.51 H new ATOM 0 HG23 ILE A 84 -1.135 10.003 -8.132 1.00 60.51 H new ATOM 0 HD11 ILE A 84 1.509 13.618 -8.774 1.00 43.44 H new ATOM 0 HD12 ILE A 84 0.550 13.563 -10.272 1.00 43.44 H new ATOM 0 HD13 ILE A 84 -0.264 13.486 -8.692 1.00 43.44 H new ATOM 1292 N ASN A 85 2.020 10.111 -11.875 1.00 4.32 N ATOM 1293 CA ASN A 85 2.808 10.439 -13.058 1.00 72.04 C ATOM 1294 C ASN A 85 2.876 9.251 -14.018 1.00 1.32 C ATOM 1295 O ASN A 85 3.067 9.424 -15.221 1.00 62.04 O ATOM 1296 CB ASN A 85 4.219 10.879 -12.652 1.00 72.30 C ATOM 1297 CG ASN A 85 5.102 9.716 -12.243 1.00 22.24 C ATOM 1298 OD1 ASN A 85 4.965 9.170 -11.149 1.00 41.41 O ATOM 1299 ND2 ASN A 85 6.017 9.332 -13.125 1.00 13.31 N ATOM 0 H ASN A 85 2.571 9.944 -11.033 1.00 4.32 H new ATOM 0 HA ASN A 85 2.318 11.264 -13.575 1.00 72.04 H new ATOM 0 HB2 ASN A 85 4.684 11.407 -13.485 1.00 72.30 H new ATOM 0 HB3 ASN A 85 4.150 11.586 -11.825 1.00 72.30 H new ATOM 0 HD21 ASN A 85 6.641 8.555 -12.907 1.00 13.31 H new ATOM 0 HD22 ASN A 85 6.096 9.813 -14.021 1.00 13.31 H new ATOM 1306 N ASN A 86 2.720 8.046 -13.476 1.00 71.15 N ATOM 1307 CA ASN A 86 2.765 6.833 -14.285 1.00 21.21 C ATOM 1308 C ASN A 86 1.370 6.238 -14.456 1.00 31.32 C ATOM 1309 O ASN A 86 0.758 5.779 -13.492 1.00 61.35 O ATOM 1310 CB ASN A 86 3.698 5.803 -13.643 1.00 20.13 C ATOM 1311 CG ASN A 86 4.615 5.143 -14.655 1.00 21.25 C ATOM 1312 OD1 ASN A 86 5.389 5.814 -15.338 1.00 33.03 O ATOM 1313 ND2 ASN A 86 4.531 3.822 -14.756 1.00 61.50 N ATOM 0 H ASN A 86 2.562 7.884 -12.481 1.00 71.15 H new ATOM 0 HA ASN A 86 3.149 7.097 -15.270 1.00 21.21 H new ATOM 0 HB2 ASN A 86 4.299 6.290 -12.875 1.00 20.13 H new ATOM 0 HB3 ASN A 86 3.102 5.039 -13.144 1.00 20.13 H new ATOM 0 HD21 ASN A 86 5.123 3.323 -15.420 1.00 61.50 H new ATOM 0 HD22 ASN A 86 3.875 3.306 -14.169 1.00 61.50 H new ATOM 1320 N THR A 87 0.873 6.251 -15.689 1.00 61.13 N ATOM 1321 CA THR A 87 -0.450 5.713 -15.986 1.00 13.02 C ATOM 1322 C THR A 87 -0.451 4.188 -15.918 1.00 1.32 C ATOM 1323 O THR A 87 -1.482 3.571 -15.653 1.00 22.43 O ATOM 1324 CB THR A 87 -0.912 6.172 -17.370 1.00 35.31 C ATOM 1325 OG1 THR A 87 -0.725 7.568 -17.524 1.00 4.32 O ATOM 1326 CG2 THR A 87 -2.370 5.871 -17.644 1.00 71.23 C ATOM 0 H THR A 87 1.366 6.628 -16.498 1.00 61.13 H new ATOM 0 HA THR A 87 -1.142 6.091 -15.234 1.00 13.02 H new ATOM 0 HB THR A 87 -0.302 5.612 -18.079 1.00 35.31 H new ATOM 0 HG1 THR A 87 -1.025 7.842 -18.416 1.00 4.32 H new ATOM 0 HG21 THR A 87 -2.633 6.222 -18.642 1.00 71.23 H new ATOM 0 HG22 THR A 87 -2.537 4.796 -17.582 1.00 71.23 H new ATOM 0 HG23 THR A 87 -2.991 6.378 -16.906 1.00 71.23 H new ATOM 1334 N LYS A 88 0.710 3.586 -16.159 1.00 61.24 N ATOM 1335 CA LYS A 88 0.841 2.139 -16.126 1.00 13.33 C ATOM 1336 C LYS A 88 0.523 1.600 -14.733 1.00 21.44 C ATOM 1337 O LYS A 88 -0.169 0.592 -14.590 1.00 43.25 O ATOM 1338 CB LYS A 88 2.259 1.741 -16.546 1.00 22.52 C ATOM 1339 CG LYS A 88 2.611 0.300 -16.229 1.00 43.22 C ATOM 1340 CD LYS A 88 3.400 -0.347 -17.356 1.00 71.31 C ATOM 1341 CE LYS A 88 2.481 -0.989 -18.382 1.00 10.05 C ATOM 1342 NZ LYS A 88 3.094 -2.199 -18.998 1.00 41.45 N ATOM 0 H LYS A 88 1.574 4.082 -16.379 1.00 61.24 H new ATOM 0 HA LYS A 88 0.127 1.704 -16.826 1.00 13.33 H new ATOM 0 HB2 LYS A 88 2.369 1.905 -17.618 1.00 22.52 H new ATOM 0 HB3 LYS A 88 2.973 2.397 -16.048 1.00 22.52 H new ATOM 0 HG2 LYS A 88 3.193 0.262 -15.308 1.00 43.22 H new ATOM 0 HG3 LYS A 88 1.697 -0.267 -16.052 1.00 43.22 H new ATOM 0 HD2 LYS A 88 4.023 0.403 -17.843 1.00 71.31 H new ATOM 0 HD3 LYS A 88 4.072 -1.101 -16.945 1.00 71.31 H new ATOM 0 HE2 LYS A 88 1.539 -1.262 -17.905 1.00 10.05 H new ATOM 0 HE3 LYS A 88 2.245 -0.265 -19.162 1.00 10.05 H new ATOM 0 HZ1 LYS A 88 2.435 -2.607 -19.692 1.00 41.45 H new ATOM 0 HZ2 LYS A 88 3.980 -1.935 -19.475 1.00 41.45 H new ATOM 0 HZ3 LYS A 88 3.296 -2.901 -18.258 1.00 41.45 H new ATOM 1356 N SER A 89 1.029 2.281 -13.710 1.00 31.12 N ATOM 1357 CA SER A 89 0.796 1.872 -12.330 1.00 35.23 C ATOM 1358 C SER A 89 -0.696 1.876 -12.009 1.00 23.24 C ATOM 1359 O SER A 89 -1.194 0.995 -11.308 1.00 71.42 O ATOM 1360 CB SER A 89 1.540 2.800 -11.368 1.00 43.12 C ATOM 1361 OG SER A 89 2.875 3.010 -11.794 1.00 34.25 O ATOM 0 H SER A 89 1.603 3.118 -13.811 1.00 31.12 H new ATOM 0 HA SER A 89 1.174 0.857 -12.208 1.00 35.23 H new ATOM 0 HB2 SER A 89 1.020 3.756 -11.305 1.00 43.12 H new ATOM 0 HB3 SER A 89 1.538 2.369 -10.367 1.00 43.12 H new ATOM 0 HG SER A 89 3.347 2.152 -11.827 1.00 34.25 H new ATOM 1367 N PHE A 90 -1.403 2.874 -12.530 1.00 70.42 N ATOM 1368 CA PHE A 90 -2.839 2.996 -12.304 1.00 35.41 C ATOM 1369 C PHE A 90 -3.577 1.763 -12.820 1.00 65.12 C ATOM 1370 O PHE A 90 -4.633 1.398 -12.304 1.00 12.51 O ATOM 1371 CB PHE A 90 -3.374 4.257 -12.989 1.00 52.11 C ATOM 1372 CG PHE A 90 -4.869 4.401 -12.912 1.00 14.44 C ATOM 1373 CD1 PHE A 90 -5.497 4.618 -11.696 1.00 12.40 C ATOM 1374 CD2 PHE A 90 -5.644 4.320 -14.058 1.00 60.12 C ATOM 1375 CE1 PHE A 90 -6.870 4.751 -11.624 1.00 2.04 C ATOM 1376 CE2 PHE A 90 -7.018 4.453 -13.992 1.00 61.21 C ATOM 1377 CZ PHE A 90 -7.632 4.668 -12.774 1.00 35.33 C ATOM 0 H PHE A 90 -1.004 3.611 -13.112 1.00 70.42 H new ATOM 0 HA PHE A 90 -3.012 3.073 -11.231 1.00 35.41 H new ATOM 0 HB2 PHE A 90 -2.910 5.132 -12.533 1.00 52.11 H new ATOM 0 HB3 PHE A 90 -3.073 4.246 -14.036 1.00 52.11 H new ATOM 0 HD1 PHE A 90 -4.906 4.684 -10.794 1.00 12.40 H new ATOM 0 HD2 PHE A 90 -5.169 4.151 -15.013 1.00 60.12 H new ATOM 0 HE1 PHE A 90 -7.348 4.920 -10.670 1.00 2.04 H new ATOM 0 HE2 PHE A 90 -7.611 4.389 -14.892 1.00 61.21 H new ATOM 0 HZ PHE A 90 -8.706 4.771 -12.720 1.00 35.33 H new ATOM 1387 N GLU A 91 -3.014 1.127 -13.843 1.00 0.04 N ATOM 1388 CA GLU A 91 -3.619 -0.063 -14.429 1.00 2.34 C ATOM 1389 C GLU A 91 -3.515 -1.253 -13.480 1.00 73.12 C ATOM 1390 O GLU A 91 -4.461 -2.028 -13.335 1.00 62.53 O ATOM 1391 CB GLU A 91 -2.944 -0.398 -15.761 1.00 62.32 C ATOM 1392 CG GLU A 91 -2.773 0.804 -16.674 1.00 63.13 C ATOM 1393 CD GLU A 91 -2.508 0.409 -18.114 1.00 23.22 C ATOM 1394 OE1 GLU A 91 -1.483 -0.258 -18.368 1.00 20.05 O ATOM 1395 OE2 GLU A 91 -3.325 0.768 -18.988 1.00 53.02 O ATOM 0 H GLU A 91 -2.140 1.416 -14.283 1.00 0.04 H new ATOM 0 HA GLU A 91 -4.674 0.146 -14.604 1.00 2.34 H new ATOM 0 HB2 GLU A 91 -1.966 -0.836 -15.563 1.00 62.32 H new ATOM 0 HB3 GLU A 91 -3.534 -1.155 -16.277 1.00 62.32 H new ATOM 0 HG2 GLU A 91 -3.671 1.420 -16.629 1.00 63.13 H new ATOM 0 HG3 GLU A 91 -1.948 1.417 -16.311 1.00 63.13 H new ATOM 1402 N ASP A 92 -2.361 -1.393 -12.837 1.00 53.02 N ATOM 1403 CA ASP A 92 -2.134 -2.489 -11.902 1.00 62.32 C ATOM 1404 C ASP A 92 -3.130 -2.436 -10.747 1.00 52.14 C ATOM 1405 O ASP A 92 -3.559 -3.471 -10.237 1.00 61.52 O ATOM 1406 CB ASP A 92 -0.704 -2.439 -11.362 1.00 62.31 C ATOM 1407 CG ASP A 92 0.330 -2.366 -12.469 1.00 22.34 C ATOM 1408 OD1 ASP A 92 0.744 -3.434 -12.966 1.00 21.13 O ATOM 1409 OD2 ASP A 92 0.724 -1.240 -12.841 1.00 64.12 O ATOM 0 H ASP A 92 -1.568 -0.761 -12.946 1.00 53.02 H new ATOM 0 HA ASP A 92 -2.279 -3.427 -12.439 1.00 62.32 H new ATOM 0 HB2 ASP A 92 -0.595 -1.573 -10.709 1.00 62.31 H new ATOM 0 HB3 ASP A 92 -0.518 -3.323 -10.752 1.00 62.31 H new ATOM 1414 N ILE A 93 -3.495 -1.225 -10.341 1.00 32.21 N ATOM 1415 CA ILE A 93 -4.442 -1.041 -9.248 1.00 4.11 C ATOM 1416 C ILE A 93 -5.785 -1.691 -9.569 1.00 1.10 C ATOM 1417 O ILE A 93 -6.534 -2.069 -8.667 1.00 54.25 O ATOM 1418 CB ILE A 93 -4.664 0.456 -8.943 1.00 53.00 C ATOM 1419 CG1 ILE A 93 -3.332 1.161 -8.697 1.00 63.45 C ATOM 1420 CG2 ILE A 93 -5.573 0.631 -7.740 1.00 43.44 C ATOM 1421 CD1 ILE A 93 -2.423 0.436 -7.726 1.00 43.22 C ATOM 0 H ILE A 93 -3.150 -0.357 -10.752 1.00 32.21 H new ATOM 0 HA ILE A 93 -4.011 -1.522 -8.370 1.00 4.11 H new ATOM 0 HB ILE A 93 -5.143 0.907 -9.812 1.00 53.00 H new ATOM 0 HG12 ILE A 93 -2.812 1.277 -9.648 1.00 63.45 H new ATOM 0 HG13 ILE A 93 -3.528 2.164 -8.317 1.00 63.45 H new ATOM 0 HG21 ILE A 93 -5.716 1.694 -7.543 1.00 43.44 H new ATOM 0 HG22 ILE A 93 -6.538 0.167 -7.943 1.00 43.44 H new ATOM 0 HG23 ILE A 93 -5.119 0.159 -6.869 1.00 43.44 H new ATOM 0 HD11 ILE A 93 -1.498 0.999 -7.604 1.00 43.22 H new ATOM 0 HD12 ILE A 93 -2.921 0.343 -6.761 1.00 43.22 H new ATOM 0 HD13 ILE A 93 -2.195 -0.557 -8.113 1.00 43.22 H new ATOM 1433 N HIS A 94 -6.085 -1.819 -10.858 1.00 31.33 N ATOM 1434 CA HIS A 94 -7.338 -2.423 -11.296 1.00 60.00 C ATOM 1435 C HIS A 94 -7.276 -3.945 -11.183 1.00 2.32 C ATOM 1436 O HIS A 94 -8.120 -4.563 -10.535 1.00 60.20 O ATOM 1437 CB HIS A 94 -7.645 -2.011 -12.741 1.00 12.21 C ATOM 1438 CG HIS A 94 -8.764 -2.785 -13.370 1.00 43.12 C ATOM 1439 ND1 HIS A 94 -10.096 -2.515 -13.132 1.00 61.55 N ATOM 1440 CD2 HIS A 94 -8.743 -3.827 -14.235 1.00 51.21 C ATOM 1441 CE1 HIS A 94 -10.844 -3.357 -13.821 1.00 52.40 C ATOM 1442 NE2 HIS A 94 -10.048 -4.163 -14.499 1.00 65.11 N ATOM 0 H HIS A 94 -5.477 -1.512 -11.617 1.00 31.33 H new ATOM 0 HA HIS A 94 -8.137 -2.065 -10.647 1.00 60.00 H new ATOM 0 HB2 HIS A 94 -7.895 -0.950 -12.760 1.00 12.21 H new ATOM 0 HB3 HIS A 94 -6.745 -2.138 -13.343 1.00 12.21 H new ATOM 0 HD1 HIS A 94 -10.448 -1.779 -12.519 1.00 61.55 H new ATOM 0 HD2 HIS A 94 -7.864 -4.305 -14.641 1.00 51.21 H new ATOM 0 HE1 HIS A 94 -11.924 -3.382 -13.829 1.00 52.40 H new ATOM 1451 N GLN A 95 -6.274 -4.542 -11.820 1.00 52.13 N ATOM 1452 CA GLN A 95 -6.108 -5.991 -11.792 1.00 22.42 C ATOM 1453 C GLN A 95 -5.816 -6.483 -10.377 1.00 54.04 C ATOM 1454 O GLN A 95 -6.180 -7.600 -10.011 1.00 40.45 O ATOM 1455 CB GLN A 95 -4.984 -6.418 -12.737 1.00 1.10 C ATOM 1456 CG GLN A 95 -3.650 -5.760 -12.433 1.00 34.32 C ATOM 1457 CD GLN A 95 -2.806 -6.571 -11.470 1.00 63.22 C ATOM 1458 OE1 GLN A 95 -3.200 -7.657 -11.045 1.00 12.31 O ATOM 1459 NE2 GLN A 95 -1.638 -6.045 -11.119 1.00 73.50 N ATOM 0 H GLN A 95 -5.566 -4.046 -12.361 1.00 52.13 H new ATOM 0 HA GLN A 95 -7.043 -6.442 -12.126 1.00 22.42 H new ATOM 0 HB2 GLN A 95 -4.866 -7.500 -12.682 1.00 1.10 H new ATOM 0 HB3 GLN A 95 -5.272 -6.180 -13.761 1.00 1.10 H new ATOM 0 HG2 GLN A 95 -3.099 -5.618 -13.363 1.00 34.32 H new ATOM 0 HG3 GLN A 95 -3.825 -4.770 -12.012 1.00 34.32 H new ATOM 0 HE21 GLN A 95 -1.352 -5.142 -11.496 1.00 73.50 H new ATOM 0 HE22 GLN A 95 -1.027 -6.544 -10.472 1.00 73.50 H new ATOM 1468 N TYR A 96 -5.158 -5.642 -9.585 1.00 52.12 N ATOM 1469 CA TYR A 96 -4.820 -5.995 -8.210 1.00 10.32 C ATOM 1470 C TYR A 96 -6.080 -6.288 -7.401 1.00 71.44 C ATOM 1471 O TYR A 96 -6.107 -7.209 -6.585 1.00 51.53 O ATOM 1472 CB TYR A 96 -4.027 -4.865 -7.550 1.00 64.53 C ATOM 1473 CG TYR A 96 -2.532 -4.977 -7.746 1.00 13.01 C ATOM 1474 CD1 TYR A 96 -1.866 -6.168 -7.484 1.00 75.10 C ATOM 1475 CD2 TYR A 96 -1.787 -3.893 -8.192 1.00 13.24 C ATOM 1476 CE1 TYR A 96 -0.499 -6.275 -7.661 1.00 74.40 C ATOM 1477 CE2 TYR A 96 -0.420 -3.992 -8.373 1.00 1.24 C ATOM 1478 CZ TYR A 96 0.218 -5.185 -8.106 1.00 71.24 C ATOM 1479 OH TYR A 96 1.579 -5.288 -8.284 1.00 12.53 O ATOM 0 H TYR A 96 -4.849 -4.713 -9.871 1.00 52.12 H new ATOM 0 HA TYR A 96 -4.205 -6.895 -8.232 1.00 10.32 H new ATOM 0 HB2 TYR A 96 -4.367 -3.911 -7.953 1.00 64.53 H new ATOM 0 HB3 TYR A 96 -4.245 -4.856 -6.482 1.00 64.53 H new ATOM 0 HD1 TYR A 96 -2.425 -7.024 -7.136 1.00 75.10 H new ATOM 0 HD2 TYR A 96 -2.284 -2.957 -8.401 1.00 13.24 H new ATOM 0 HE1 TYR A 96 0.004 -7.207 -7.452 1.00 74.40 H new ATOM 0 HE2 TYR A 96 0.145 -3.140 -8.721 1.00 1.24 H new ATOM 0 HH TYR A 96 1.862 -4.683 -9.002 1.00 12.53 H new ATOM 1489 N ARG A 97 -7.122 -5.497 -7.636 1.00 45.11 N ATOM 1490 CA ARG A 97 -8.389 -5.667 -6.935 1.00 22.01 C ATOM 1491 C ARG A 97 -8.976 -7.051 -7.205 1.00 15.12 C ATOM 1492 O ARG A 97 -9.562 -7.671 -6.318 1.00 73.41 O ATOM 1493 CB ARG A 97 -9.375 -4.573 -7.363 1.00 44.34 C ATOM 1494 CG ARG A 97 -10.831 -4.888 -7.049 1.00 73.44 C ATOM 1495 CD ARG A 97 -11.568 -5.393 -8.280 1.00 0.45 C ATOM 1496 NE ARG A 97 -12.650 -6.313 -7.935 1.00 60.12 N ATOM 1497 CZ ARG A 97 -13.863 -5.922 -7.550 1.00 15.31 C ATOM 1498 NH1 ARG A 97 -14.152 -4.631 -7.449 1.00 10.33 N ATOM 1499 NH2 ARG A 97 -14.789 -6.826 -7.263 1.00 45.45 N ATOM 0 H ARG A 97 -7.113 -4.730 -8.308 1.00 45.11 H new ATOM 0 HA ARG A 97 -8.208 -5.580 -5.864 1.00 22.01 H new ATOM 0 HB2 ARG A 97 -9.102 -3.640 -6.870 1.00 44.34 H new ATOM 0 HB3 ARG A 97 -9.274 -4.408 -8.436 1.00 44.34 H new ATOM 0 HG2 ARG A 97 -10.880 -5.639 -6.260 1.00 73.44 H new ATOM 0 HG3 ARG A 97 -11.325 -3.993 -6.669 1.00 73.44 H new ATOM 0 HD2 ARG A 97 -11.976 -4.545 -8.831 1.00 0.45 H new ATOM 0 HD3 ARG A 97 -10.863 -5.895 -8.943 1.00 0.45 H new ATOM 0 HE ARG A 97 -12.465 -7.314 -7.993 1.00 60.12 H new ATOM 0 HH11 ARG A 97 -13.443 -3.931 -7.667 1.00 10.33 H new ATOM 0 HH12 ARG A 97 -15.083 -4.338 -7.153 1.00 10.33 H new ATOM 0 HH21 ARG A 97 -14.572 -7.820 -7.337 1.00 45.45 H new ATOM 0 HH22 ARG A 97 -15.719 -6.528 -6.968 1.00 45.45 H new ATOM 1513 N GLU A 98 -8.817 -7.526 -8.436 1.00 11.13 N ATOM 1514 CA GLU A 98 -9.335 -8.834 -8.822 1.00 43.14 C ATOM 1515 C GLU A 98 -8.582 -9.954 -8.110 1.00 2.53 C ATOM 1516 O GLU A 98 -9.176 -10.952 -7.701 1.00 14.14 O ATOM 1517 CB GLU A 98 -9.231 -9.018 -10.337 1.00 2.11 C ATOM 1518 CG GLU A 98 -10.185 -8.134 -11.124 1.00 14.13 C ATOM 1519 CD GLU A 98 -11.323 -8.915 -11.752 1.00 32.30 C ATOM 1520 OE1 GLU A 98 -11.082 -9.605 -12.764 1.00 3.34 O ATOM 1521 OE2 GLU A 98 -12.456 -8.835 -11.231 1.00 71.11 O ATOM 0 H GLU A 98 -8.334 -7.026 -9.183 1.00 11.13 H new ATOM 0 HA GLU A 98 -10.383 -8.882 -8.526 1.00 43.14 H new ATOM 0 HB2 GLU A 98 -8.209 -8.805 -10.651 1.00 2.11 H new ATOM 0 HB3 GLU A 98 -9.429 -10.061 -10.582 1.00 2.11 H new ATOM 0 HG2 GLU A 98 -10.595 -7.370 -10.463 1.00 14.13 H new ATOM 0 HG3 GLU A 98 -9.631 -7.615 -11.906 1.00 14.13 H new ATOM 1528 N GLN A 99 -7.272 -9.783 -7.965 1.00 11.33 N ATOM 1529 CA GLN A 99 -6.440 -10.781 -7.304 1.00 53.33 C ATOM 1530 C GLN A 99 -6.890 -11.001 -5.862 1.00 22.24 C ATOM 1531 O GLN A 99 -6.992 -12.138 -5.401 1.00 15.20 O ATOM 1532 CB GLN A 99 -4.971 -10.351 -7.333 1.00 64.33 C ATOM 1533 CG GLN A 99 -4.181 -10.967 -8.476 1.00 32.41 C ATOM 1534 CD GLN A 99 -3.571 -12.306 -8.108 1.00 63.35 C ATOM 1535 OE1 GLN A 99 -4.282 -13.258 -7.787 1.00 74.14 O ATOM 1536 NE2 GLN A 99 -2.246 -12.385 -8.154 1.00 73.03 N ATOM 0 H GLN A 99 -6.764 -8.963 -8.296 1.00 11.33 H new ATOM 0 HA GLN A 99 -6.548 -11.721 -7.845 1.00 53.33 H new ATOM 0 HB2 GLN A 99 -4.920 -9.265 -7.411 1.00 64.33 H new ATOM 0 HB3 GLN A 99 -4.502 -10.625 -6.388 1.00 64.33 H new ATOM 0 HG2 GLN A 99 -4.836 -11.095 -9.338 1.00 32.41 H new ATOM 0 HG3 GLN A 99 -3.389 -10.281 -8.776 1.00 32.41 H new ATOM 0 HE21 GLN A 99 -1.696 -11.570 -8.426 1.00 73.03 H new ATOM 0 HE22 GLN A 99 -1.779 -13.260 -7.918 1.00 73.03 H new ATOM 1545 N ILE A 100 -7.158 -9.907 -5.157 1.00 25.44 N ATOM 1546 CA ILE A 100 -7.596 -9.981 -3.768 1.00 13.30 C ATOM 1547 C ILE A 100 -8.938 -10.702 -3.652 1.00 74.21 C ATOM 1548 O ILE A 100 -9.102 -11.597 -2.823 1.00 3.03 O ATOM 1549 CB ILE A 100 -7.715 -8.573 -3.143 1.00 41.31 C ATOM 1550 CG1 ILE A 100 -6.349 -7.884 -3.131 1.00 55.13 C ATOM 1551 CG2 ILE A 100 -8.284 -8.653 -1.731 1.00 20.32 C ATOM 1552 CD1 ILE A 100 -6.431 -6.375 -3.200 1.00 4.52 C ATOM 0 H ILE A 100 -7.080 -8.959 -5.525 1.00 25.44 H new ATOM 0 HA ILE A 100 -6.840 -10.547 -3.223 1.00 13.30 H new ATOM 0 HB ILE A 100 -8.400 -7.983 -3.751 1.00 41.31 H new ATOM 0 HG12 ILE A 100 -5.815 -8.169 -2.224 1.00 55.13 H new ATOM 0 HG13 ILE A 100 -5.761 -8.246 -3.974 1.00 55.13 H new ATOM 0 HG21 ILE A 100 -8.359 -7.650 -1.311 1.00 20.32 H new ATOM 0 HG22 ILE A 100 -9.274 -9.107 -1.763 1.00 20.32 H new ATOM 0 HG23 ILE A 100 -7.627 -9.259 -1.108 1.00 20.32 H new ATOM 0 HD11 ILE A 100 -5.425 -5.955 -3.187 1.00 4.52 H new ATOM 0 HD12 ILE A 100 -6.936 -6.080 -4.120 1.00 4.52 H new ATOM 0 HD13 ILE A 100 -6.991 -6.001 -2.343 1.00 4.52 H new ATOM 1564 N LYS A 101 -9.894 -10.304 -4.485 1.00 11.21 N ATOM 1565 CA LYS A 101 -11.221 -10.912 -4.472 1.00 62.41 C ATOM 1566 C LYS A 101 -11.135 -12.424 -4.663 1.00 5.41 C ATOM 1567 O LYS A 101 -11.914 -13.177 -4.079 1.00 53.23 O ATOM 1568 CB LYS A 101 -12.098 -10.291 -5.562 1.00 4.13 C ATOM 1569 CG LYS A 101 -13.087 -9.262 -5.036 1.00 23.02 C ATOM 1570 CD LYS A 101 -12.402 -8.214 -4.169 1.00 60.22 C ATOM 1571 CE LYS A 101 -12.753 -6.803 -4.614 1.00 2.50 C ATOM 1572 NZ LYS A 101 -14.215 -6.538 -4.518 1.00 12.42 N ATOM 0 H LYS A 101 -9.776 -9.564 -5.177 1.00 11.21 H new ATOM 0 HA LYS A 101 -11.672 -10.718 -3.499 1.00 62.41 H new ATOM 0 HB2 LYS A 101 -11.457 -9.819 -6.307 1.00 4.13 H new ATOM 0 HB3 LYS A 101 -12.647 -11.084 -6.070 1.00 4.13 H new ATOM 0 HG2 LYS A 101 -13.583 -8.773 -5.874 1.00 23.02 H new ATOM 0 HG3 LYS A 101 -13.861 -9.765 -4.456 1.00 23.02 H new ATOM 0 HD2 LYS A 101 -12.697 -8.352 -3.129 1.00 60.22 H new ATOM 0 HD3 LYS A 101 -11.322 -8.352 -4.215 1.00 60.22 H new ATOM 0 HE2 LYS A 101 -12.212 -6.083 -3.999 1.00 2.50 H new ATOM 0 HE3 LYS A 101 -12.424 -6.654 -5.642 1.00 2.50 H new ATOM 0 HZ1 LYS A 101 -14.438 -5.644 -5.000 1.00 12.42 H new ATOM 0 HZ2 LYS A 101 -14.739 -7.315 -4.970 1.00 12.42 H new ATOM 0 HZ3 LYS A 101 -14.491 -6.471 -3.517 1.00 12.42 H new ATOM 1586 N ARG A 102 -10.182 -12.862 -5.480 1.00 11.23 N ATOM 1587 CA ARG A 102 -9.997 -14.286 -5.741 1.00 20.31 C ATOM 1588 C ARG A 102 -9.507 -15.004 -4.487 1.00 23.44 C ATOM 1589 O ARG A 102 -10.155 -15.927 -3.995 1.00 51.42 O ATOM 1590 CB ARG A 102 -9.004 -14.492 -6.886 1.00 33.32 C ATOM 1591 CG ARG A 102 -9.381 -15.631 -7.820 1.00 24.25 C ATOM 1592 CD ARG A 102 -8.886 -15.380 -9.235 1.00 4.41 C ATOM 1593 NE ARG A 102 -8.323 -16.584 -9.840 1.00 0.12 N ATOM 1594 CZ ARG A 102 -9.057 -17.584 -10.324 1.00 2.53 C ATOM 1595 NH1 ARG A 102 -10.382 -17.527 -10.276 1.00 23.21 N ATOM 1596 NH2 ARG A 102 -8.464 -18.644 -10.857 1.00 71.23 N ATOM 0 H ARG A 102 -9.527 -12.254 -5.972 1.00 11.23 H new ATOM 0 HA ARG A 102 -10.960 -14.709 -6.029 1.00 20.31 H new ATOM 0 HB2 ARG A 102 -8.930 -13.570 -7.462 1.00 33.32 H new ATOM 0 HB3 ARG A 102 -8.016 -14.687 -6.469 1.00 33.32 H new ATOM 0 HG2 ARG A 102 -8.959 -16.564 -7.446 1.00 24.25 H new ATOM 0 HG3 ARG A 102 -10.464 -15.752 -7.829 1.00 24.25 H new ATOM 0 HD2 ARG A 102 -9.711 -15.018 -9.849 1.00 4.41 H new ATOM 0 HD3 ARG A 102 -8.131 -14.594 -9.221 1.00 4.41 H new ATOM 0 HE ARG A 102 -7.308 -16.664 -9.895 1.00 0.12 H new ATOM 0 HH11 ARG A 102 -10.843 -16.714 -9.867 1.00 23.21 H new ATOM 0 HH12 ARG A 102 -10.939 -18.296 -10.648 1.00 23.21 H new ATOM 0 HH21 ARG A 102 -7.446 -18.693 -10.896 1.00 71.23 H new ATOM 0 HH22 ARG A 102 -9.026 -19.410 -11.228 1.00 71.23 H new ATOM 1610 N VAL A 103 -8.361 -14.569 -3.974 1.00 24.43 N ATOM 1611 CA VAL A 103 -7.783 -15.162 -2.774 1.00 63.50 C ATOM 1612 C VAL A 103 -8.756 -15.086 -1.606 1.00 42.43 C ATOM 1613 O VAL A 103 -9.222 -16.106 -1.097 1.00 51.30 O ATOM 1614 CB VAL A 103 -6.481 -14.446 -2.376 1.00 63.20 C ATOM 1615 CG1 VAL A 103 -5.837 -15.127 -1.178 1.00 61.31 C ATOM 1616 CG2 VAL A 103 -5.524 -14.390 -3.555 1.00 72.10 C ATOM 0 H VAL A 103 -7.813 -13.806 -4.372 1.00 24.43 H new ATOM 0 HA VAL A 103 -7.569 -16.206 -3.004 1.00 63.50 H new ATOM 0 HB VAL A 103 -6.722 -13.423 -2.088 1.00 63.20 H new ATOM 0 HG11 VAL A 103 -4.918 -14.605 -0.913 1.00 61.31 H new ATOM 0 HG12 VAL A 103 -6.525 -15.103 -0.333 1.00 61.31 H new ATOM 0 HG13 VAL A 103 -5.607 -16.163 -1.429 1.00 61.31 H new ATOM 0 HG21 VAL A 103 -4.608 -13.880 -3.256 1.00 72.10 H new ATOM 0 HG22 VAL A 103 -5.286 -15.403 -3.879 1.00 72.10 H new ATOM 0 HG23 VAL A 103 -5.990 -13.846 -4.377 1.00 72.10 H new ATOM 1626 N LYS A 104 -9.055 -13.864 -1.189 1.00 1.22 N ATOM 1627 CA LYS A 104 -9.971 -13.631 -0.080 1.00 75.32 C ATOM 1628 C LYS A 104 -11.341 -14.236 -0.369 1.00 31.53 C ATOM 1629 O LYS A 104 -12.081 -14.588 0.550 1.00 24.44 O ATOM 1630 CB LYS A 104 -10.118 -12.130 0.181 1.00 33.12 C ATOM 1631 CG LYS A 104 -8.794 -11.404 0.361 1.00 23.15 C ATOM 1632 CD LYS A 104 -8.015 -11.950 1.547 1.00 11.40 C ATOM 1633 CE LYS A 104 -7.987 -10.955 2.694 1.00 23.14 C ATOM 1634 NZ LYS A 104 -8.269 -11.608 4.002 1.00 35.33 N ATOM 0 H LYS A 104 -8.674 -13.014 -1.604 1.00 1.22 H new ATOM 0 HA LYS A 104 -9.556 -14.112 0.805 1.00 75.32 H new ATOM 0 HB2 LYS A 104 -10.659 -11.678 -0.650 1.00 33.12 H new ATOM 0 HB3 LYS A 104 -10.726 -11.984 1.074 1.00 33.12 H new ATOM 0 HG2 LYS A 104 -8.197 -11.505 -0.545 1.00 23.15 H new ATOM 0 HG3 LYS A 104 -8.978 -10.339 0.505 1.00 23.15 H new ATOM 0 HD2 LYS A 104 -8.467 -12.883 1.883 1.00 11.40 H new ATOM 0 HD3 LYS A 104 -6.995 -12.182 1.239 1.00 11.40 H new ATOM 0 HE2 LYS A 104 -7.010 -10.472 2.732 1.00 23.14 H new ATOM 0 HE3 LYS A 104 -8.723 -10.172 2.513 1.00 23.14 H new ATOM 0 HZ1 LYS A 104 -8.241 -10.895 4.759 1.00 35.33 H new ATOM 0 HZ2 LYS A 104 -9.211 -12.047 3.975 1.00 35.33 H new ATOM 0 HZ3 LYS A 104 -7.552 -12.338 4.187 1.00 35.33 H new ATOM 1648 N ASP A 105 -11.673 -14.356 -1.651 1.00 22.44 N ATOM 1649 CA ASP A 105 -12.955 -14.919 -2.056 1.00 2.21 C ATOM 1650 C ASP A 105 -14.108 -14.101 -1.486 1.00 71.11 C ATOM 1651 O ASP A 105 -15.001 -14.636 -0.828 1.00 74.42 O ATOM 1652 CB ASP A 105 -13.063 -16.374 -1.595 1.00 24.12 C ATOM 1653 CG ASP A 105 -14.139 -17.138 -2.341 1.00 31.13 C ATOM 1654 OD1 ASP A 105 -13.954 -17.396 -3.549 1.00 35.20 O ATOM 1655 OD2 ASP A 105 -15.166 -17.480 -1.718 1.00 1.35 O ATOM 0 H ASP A 105 -11.073 -14.071 -2.425 1.00 22.44 H new ATOM 0 HA ASP A 105 -13.015 -14.887 -3.144 1.00 2.21 H new ATOM 0 HB2 ASP A 105 -12.103 -16.870 -1.739 1.00 24.12 H new ATOM 0 HB3 ASP A 105 -13.278 -16.399 -0.527 1.00 24.12 H new ATOM 1660 N SER A 106 -14.080 -12.798 -1.742 1.00 44.43 N ATOM 1661 CA SER A 106 -15.120 -11.902 -1.255 1.00 45.02 C ATOM 1662 C SER A 106 -14.917 -10.491 -1.793 1.00 12.54 C ATOM 1663 O SER A 106 -13.788 -10.008 -1.890 1.00 32.21 O ATOM 1664 CB SER A 106 -15.124 -11.883 0.275 1.00 24.44 C ATOM 1665 OG SER A 106 -16.441 -12.001 0.783 1.00 12.32 O ATOM 0 H SER A 106 -13.348 -12.339 -2.284 1.00 44.43 H new ATOM 0 HA SER A 106 -16.082 -12.270 -1.611 1.00 45.02 H new ATOM 0 HB2 SER A 106 -14.510 -12.700 0.654 1.00 24.44 H new ATOM 0 HB3 SER A 106 -14.675 -10.956 0.631 1.00 24.44 H new ATOM 0 HG SER A 106 -16.416 -11.988 1.763 1.00 12.32 H new ATOM 1671 N ASP A 107 -16.017 -9.833 -2.140 1.00 64.24 N ATOM 1672 CA ASP A 107 -15.961 -8.476 -2.666 1.00 14.24 C ATOM 1673 C ASP A 107 -15.664 -7.477 -1.553 1.00 33.54 C ATOM 1674 O ASP A 107 -15.030 -6.446 -1.783 1.00 60.30 O ATOM 1675 CB ASP A 107 -17.280 -8.117 -3.352 1.00 42.02 C ATOM 1676 CG ASP A 107 -17.286 -8.490 -4.821 1.00 53.24 C ATOM 1677 OD1 ASP A 107 -16.597 -9.465 -5.190 1.00 11.02 O ATOM 1678 OD2 ASP A 107 -17.980 -7.808 -5.604 1.00 71.12 O ATOM 0 H ASP A 107 -16.959 -10.218 -2.066 1.00 64.24 H new ATOM 0 HA ASP A 107 -15.156 -8.428 -3.399 1.00 14.24 H new ATOM 0 HB2 ASP A 107 -18.100 -8.627 -2.847 1.00 42.02 H new ATOM 0 HB3 ASP A 107 -17.460 -7.047 -3.251 1.00 42.02 H new ATOM 1683 N ASP A 108 -16.125 -7.789 -0.347 1.00 51.05 N ATOM 1684 CA ASP A 108 -15.909 -6.920 0.803 1.00 1.03 C ATOM 1685 C ASP A 108 -14.553 -7.196 1.445 1.00 52.13 C ATOM 1686 O ASP A 108 -14.419 -8.098 2.273 1.00 34.52 O ATOM 1687 CB ASP A 108 -17.024 -7.114 1.833 1.00 1.22 C ATOM 1688 CG ASP A 108 -16.901 -6.161 3.006 1.00 52.14 C ATOM 1689 OD1 ASP A 108 -16.389 -5.039 2.809 1.00 30.33 O ATOM 1690 OD2 ASP A 108 -17.317 -6.537 4.122 1.00 42.15 O ATOM 0 H ASP A 108 -16.651 -8.638 -0.141 1.00 51.05 H new ATOM 0 HA ASP A 108 -15.923 -5.887 0.455 1.00 1.03 H new ATOM 0 HB2 ASP A 108 -17.990 -6.968 1.350 1.00 1.22 H new ATOM 0 HB3 ASP A 108 -17.002 -8.141 2.199 1.00 1.22 H new ATOM 1695 N VAL A 109 -13.552 -6.411 1.062 1.00 0.10 N ATOM 1696 CA VAL A 109 -12.211 -6.565 1.600 1.00 42.41 C ATOM 1697 C VAL A 109 -11.635 -5.212 2.011 1.00 30.04 C ATOM 1698 O VAL A 109 -11.766 -4.224 1.289 1.00 63.32 O ATOM 1699 CB VAL A 109 -11.261 -7.233 0.586 1.00 12.42 C ATOM 1700 CG1 VAL A 109 -9.882 -7.435 1.195 1.00 10.23 C ATOM 1701 CG2 VAL A 109 -11.836 -8.558 0.111 1.00 74.14 C ATOM 0 H VAL A 109 -13.647 -5.660 0.378 1.00 0.10 H new ATOM 0 HA VAL A 109 -12.292 -7.210 2.475 1.00 42.41 H new ATOM 0 HB VAL A 109 -11.160 -6.573 -0.276 1.00 12.42 H new ATOM 0 HG11 VAL A 109 -9.227 -7.908 0.463 1.00 10.23 H new ATOM 0 HG12 VAL A 109 -9.467 -6.469 1.484 1.00 10.23 H new ATOM 0 HG13 VAL A 109 -9.963 -8.073 2.075 1.00 10.23 H new ATOM 0 HG21 VAL A 109 -11.153 -9.016 -0.604 1.00 74.14 H new ATOM 0 HG22 VAL A 109 -11.968 -9.224 0.964 1.00 74.14 H new ATOM 0 HG23 VAL A 109 -12.800 -8.386 -0.368 1.00 74.14 H new ATOM 1711 N PRO A 110 -10.987 -5.156 3.182 1.00 70.52 N ATOM 1712 CA PRO A 110 -10.385 -3.924 3.700 1.00 32.50 C ATOM 1713 C PRO A 110 -9.121 -3.536 2.943 1.00 21.24 C ATOM 1714 O PRO A 110 -8.049 -4.094 3.178 1.00 20.24 O ATOM 1715 CB PRO A 110 -10.050 -4.279 5.148 1.00 22.21 C ATOM 1716 CG PRO A 110 -9.853 -5.755 5.137 1.00 63.33 C ATOM 1717 CD PRO A 110 -10.794 -6.294 4.094 1.00 40.43 C ATOM 0 HA PRO A 110 -11.052 -3.068 3.598 1.00 32.50 H new ATOM 0 HB2 PRO A 110 -9.152 -3.762 5.485 1.00 22.21 H new ATOM 0 HB3 PRO A 110 -10.856 -3.992 5.823 1.00 22.21 H new ATOM 0 HG2 PRO A 110 -8.820 -6.008 4.898 1.00 63.33 H new ATOM 0 HG3 PRO A 110 -10.069 -6.184 6.115 1.00 63.33 H new ATOM 0 HD2 PRO A 110 -10.369 -7.155 3.577 1.00 40.43 H new ATOM 0 HD3 PRO A 110 -11.737 -6.620 4.534 1.00 40.43 H new ATOM 1725 N MET A 111 -9.251 -2.576 2.035 1.00 10.04 N ATOM 1726 CA MET A 111 -8.116 -2.113 1.247 1.00 62.44 C ATOM 1727 C MET A 111 -8.208 -0.614 0.989 1.00 23.41 C ATOM 1728 O MET A 111 -9.273 -0.013 1.127 1.00 54.00 O ATOM 1729 CB MET A 111 -8.045 -2.867 -0.081 1.00 71.54 C ATOM 1730 CG MET A 111 -9.257 -2.648 -0.973 1.00 42.04 C ATOM 1731 SD MET A 111 -10.237 -4.143 -1.197 1.00 3.13 S ATOM 1732 CE MET A 111 -9.161 -5.077 -2.278 1.00 44.21 C ATOM 0 H MET A 111 -10.131 -2.104 1.827 1.00 10.04 H new ATOM 0 HA MET A 111 -7.208 -2.311 1.817 1.00 62.44 H new ATOM 0 HB2 MET A 111 -7.149 -2.556 -0.618 1.00 71.54 H new ATOM 0 HB3 MET A 111 -7.942 -3.933 0.121 1.00 71.54 H new ATOM 0 HG2 MET A 111 -9.885 -1.869 -0.541 1.00 42.04 H new ATOM 0 HG3 MET A 111 -8.926 -2.287 -1.947 1.00 42.04 H new ATOM 0 HE1 MET A 111 -9.739 -5.845 -2.792 1.00 44.21 H new ATOM 0 HE2 MET A 111 -8.713 -4.408 -3.012 1.00 44.21 H new ATOM 0 HE3 MET A 111 -8.374 -5.549 -1.689 1.00 44.21 H new ATOM 1742 N VAL A 112 -7.082 -0.016 0.616 1.00 1.12 N ATOM 1743 CA VAL A 112 -7.031 1.412 0.341 1.00 22.35 C ATOM 1744 C VAL A 112 -6.098 1.716 -0.826 1.00 44.13 C ATOM 1745 O VAL A 112 -5.083 1.045 -1.015 1.00 54.15 O ATOM 1746 CB VAL A 112 -6.564 2.198 1.580 1.00 22.32 C ATOM 1747 CG1 VAL A 112 -6.587 3.694 1.308 1.00 50.41 C ATOM 1748 CG2 VAL A 112 -7.429 1.853 2.781 1.00 74.00 C ATOM 0 H VAL A 112 -6.192 -0.500 0.497 1.00 1.12 H new ATOM 0 HA VAL A 112 -8.042 1.724 0.079 1.00 22.35 H new ATOM 0 HB VAL A 112 -5.536 1.913 1.804 1.00 22.32 H new ATOM 0 HG11 VAL A 112 -6.254 4.230 2.196 1.00 50.41 H new ATOM 0 HG12 VAL A 112 -5.922 3.923 0.475 1.00 50.41 H new ATOM 0 HG13 VAL A 112 -7.602 4.003 1.057 1.00 50.41 H new ATOM 0 HG21 VAL A 112 -7.087 2.416 3.649 1.00 74.00 H new ATOM 0 HG22 VAL A 112 -8.467 2.110 2.568 1.00 74.00 H new ATOM 0 HG23 VAL A 112 -7.354 0.786 2.988 1.00 74.00 H new ATOM 1758 N LEU A 113 -6.449 2.734 -1.603 1.00 42.52 N ATOM 1759 CA LEU A 113 -5.647 3.134 -2.751 1.00 44.40 C ATOM 1760 C LEU A 113 -4.919 4.445 -2.471 1.00 43.11 C ATOM 1761 O LEU A 113 -5.544 5.495 -2.321 1.00 5.52 O ATOM 1762 CB LEU A 113 -6.535 3.280 -3.991 1.00 70.53 C ATOM 1763 CG LEU A 113 -5.840 3.848 -5.230 1.00 13.12 C ATOM 1764 CD1 LEU A 113 -4.479 3.198 -5.426 1.00 35.14 C ATOM 1765 CD2 LEU A 113 -6.709 3.651 -6.463 1.00 75.23 C ATOM 0 H LEU A 113 -7.286 3.298 -1.458 1.00 42.52 H new ATOM 0 HA LEU A 113 -4.903 2.359 -2.936 1.00 44.40 H new ATOM 0 HB2 LEU A 113 -6.945 2.302 -4.241 1.00 70.53 H new ATOM 0 HB3 LEU A 113 -7.378 3.924 -3.740 1.00 70.53 H new ATOM 0 HG LEU A 113 -5.689 4.917 -5.081 1.00 13.12 H new ATOM 0 HD11 LEU A 113 -4.001 3.615 -6.312 1.00 35.14 H new ATOM 0 HD12 LEU A 113 -3.855 3.389 -4.553 1.00 35.14 H new ATOM 0 HD13 LEU A 113 -4.604 2.123 -5.554 1.00 35.14 H new ATOM 0 HD21 LEU A 113 -6.200 4.060 -7.336 1.00 75.23 H new ATOM 0 HD22 LEU A 113 -6.890 2.587 -6.614 1.00 75.23 H new ATOM 0 HD23 LEU A 113 -7.660 4.164 -6.323 1.00 75.23 H new ATOM 1777 N VAL A 114 -3.594 4.375 -2.398 1.00 74.14 N ATOM 1778 CA VAL A 114 -2.780 5.555 -2.133 1.00 75.14 C ATOM 1779 C VAL A 114 -2.165 6.102 -3.417 1.00 32.03 C ATOM 1780 O VAL A 114 -1.834 5.345 -4.329 1.00 23.32 O ATOM 1781 CB VAL A 114 -1.653 5.246 -1.130 1.00 1.14 C ATOM 1782 CG1 VAL A 114 -0.974 6.529 -0.679 1.00 74.31 C ATOM 1783 CG2 VAL A 114 -2.194 4.473 0.063 1.00 24.31 C ATOM 0 H VAL A 114 -3.061 3.514 -2.519 1.00 74.14 H new ATOM 0 HA VAL A 114 -3.444 6.305 -1.704 1.00 75.14 H new ATOM 0 HB VAL A 114 -0.910 4.624 -1.628 1.00 1.14 H new ATOM 0 HG11 VAL A 114 -0.180 6.291 0.029 1.00 74.31 H new ATOM 0 HG12 VAL A 114 -0.548 7.039 -1.543 1.00 74.31 H new ATOM 0 HG13 VAL A 114 -1.706 7.179 -0.199 1.00 74.31 H new ATOM 0 HG21 VAL A 114 -1.382 4.264 0.760 1.00 24.31 H new ATOM 0 HG22 VAL A 114 -2.959 5.066 0.564 1.00 24.31 H new ATOM 0 HG23 VAL A 114 -2.629 3.534 -0.279 1.00 24.31 H new ATOM 1793 N GLY A 115 -2.015 7.421 -3.479 1.00 31.44 N ATOM 1794 CA GLY A 115 -1.438 8.047 -4.654 1.00 43.33 C ATOM 1795 C GLY A 115 -0.009 8.501 -4.425 1.00 52.43 C ATOM 1796 O GLY A 115 0.229 9.623 -3.978 1.00 3.25 O ATOM 0 H GLY A 115 -2.283 8.067 -2.737 1.00 31.44 H new ATOM 0 HA2 GLY A 115 -1.464 7.344 -5.487 1.00 43.33 H new ATOM 0 HA3 GLY A 115 -2.047 8.904 -4.942 1.00 43.33 H new ATOM 1800 N ASN A 116 0.943 7.626 -4.730 1.00 4.41 N ATOM 1801 CA ASN A 116 2.357 7.939 -4.554 1.00 33.03 C ATOM 1802 C ASN A 116 2.804 9.024 -5.530 1.00 40.44 C ATOM 1803 O ASN A 116 2.201 9.210 -6.587 1.00 45.14 O ATOM 1804 CB ASN A 116 3.205 6.678 -4.749 1.00 22.11 C ATOM 1805 CG ASN A 116 4.690 6.945 -4.598 1.00 34.24 C ATOM 1806 OD1 ASN A 116 5.304 7.599 -5.441 1.00 31.24 O ATOM 1807 ND2 ASN A 116 5.277 6.437 -3.520 1.00 53.34 N ATOM 0 H ASN A 116 0.761 6.693 -5.101 1.00 4.41 H new ATOM 0 HA ASN A 116 2.497 8.312 -3.540 1.00 33.03 H new ATOM 0 HB2 ASN A 116 2.900 5.924 -4.024 1.00 22.11 H new ATOM 0 HB3 ASN A 116 3.013 6.265 -5.739 1.00 22.11 H new ATOM 0 HD21 ASN A 116 6.275 6.583 -3.366 1.00 53.34 H new ATOM 0 HD22 ASN A 116 4.730 5.901 -2.846 1.00 53.34 H new ATOM 1814 N LYS A 117 3.866 9.735 -5.166 1.00 63.40 N ATOM 1815 CA LYS A 117 4.401 10.800 -6.006 1.00 15.41 C ATOM 1816 C LYS A 117 3.356 11.885 -6.247 1.00 75.25 C ATOM 1817 O LYS A 117 2.780 11.979 -7.331 1.00 14.22 O ATOM 1818 CB LYS A 117 4.884 10.231 -7.341 1.00 44.45 C ATOM 1819 CG LYS A 117 6.307 9.697 -7.292 1.00 11.11 C ATOM 1820 CD LYS A 117 6.529 8.602 -8.323 1.00 53.25 C ATOM 1821 CE LYS A 117 7.974 8.566 -8.794 1.00 13.43 C ATOM 1822 NZ LYS A 117 8.392 7.196 -9.202 1.00 40.44 N ATOM 0 H LYS A 117 4.374 9.592 -4.293 1.00 63.40 H new ATOM 0 HA LYS A 117 5.246 11.249 -5.484 1.00 15.41 H new ATOM 0 HB2 LYS A 117 4.213 9.429 -7.649 1.00 44.45 H new ATOM 0 HB3 LYS A 117 4.822 11.009 -8.102 1.00 44.45 H new ATOM 0 HG2 LYS A 117 7.009 10.512 -7.469 1.00 11.11 H new ATOM 0 HG3 LYS A 117 6.516 9.307 -6.296 1.00 11.11 H new ATOM 0 HD2 LYS A 117 6.261 7.637 -7.894 1.00 53.25 H new ATOM 0 HD3 LYS A 117 5.871 8.765 -9.176 1.00 53.25 H new ATOM 0 HE2 LYS A 117 8.099 9.249 -9.634 1.00 13.43 H new ATOM 0 HE3 LYS A 117 8.625 8.921 -7.995 1.00 13.43 H new ATOM 0 HZ1 LYS A 117 9.383 7.215 -9.516 1.00 40.44 H new ATOM 0 HZ2 LYS A 117 8.297 6.549 -8.393 1.00 40.44 H new ATOM 0 HZ3 LYS A 117 7.788 6.866 -9.982 1.00 40.44 H new ATOM 1836 N CYS A 118 3.119 12.704 -5.228 1.00 62.14 N ATOM 1837 CA CYS A 118 2.145 13.786 -5.324 1.00 62.45 C ATOM 1838 C CYS A 118 2.831 15.121 -5.606 1.00 44.04 C ATOM 1839 O CYS A 118 2.201 16.063 -6.088 1.00 13.51 O ATOM 1840 CB CYS A 118 1.332 13.884 -4.031 1.00 40.01 C ATOM 1841 SG CYS A 118 -0.268 14.704 -4.225 1.00 20.34 S ATOM 0 H CYS A 118 3.589 12.639 -4.325 1.00 62.14 H new ATOM 0 HA CYS A 118 1.475 13.561 -6.154 1.00 62.45 H new ATOM 0 HB2 CYS A 118 1.168 12.880 -3.640 1.00 40.01 H new ATOM 0 HB3 CYS A 118 1.917 14.424 -3.287 1.00 40.01 H new ATOM 0 HG CYS A 118 -0.881 14.736 -3.079 1.00 20.34 H new ATOM 1847 N ASP A 119 4.124 15.199 -5.301 1.00 73.22 N ATOM 1848 CA ASP A 119 4.890 16.422 -5.521 1.00 64.23 C ATOM 1849 C ASP A 119 5.350 16.534 -6.973 1.00 21.24 C ATOM 1850 O ASP A 119 5.615 17.631 -7.464 1.00 52.32 O ATOM 1851 CB ASP A 119 6.100 16.463 -4.583 1.00 23.44 C ATOM 1852 CG ASP A 119 6.973 17.682 -4.809 1.00 64.04 C ATOM 1853 OD1 ASP A 119 6.523 18.803 -4.489 1.00 12.31 O ATOM 1854 OD2 ASP A 119 8.107 17.516 -5.307 1.00 0.14 O ATOM 0 H ASP A 119 4.662 14.430 -4.901 1.00 73.22 H new ATOM 0 HA ASP A 119 4.239 17.269 -5.306 1.00 64.23 H new ATOM 0 HB2 ASP A 119 5.754 16.455 -3.549 1.00 23.44 H new ATOM 0 HB3 ASP A 119 6.697 15.562 -4.726 1.00 23.44 H new ATOM 1859 N LEU A 120 5.447 15.396 -7.656 1.00 65.42 N ATOM 1860 CA LEU A 120 5.879 15.374 -9.051 1.00 71.25 C ATOM 1861 C LEU A 120 5.134 16.422 -9.876 1.00 12.35 C ATOM 1862 O LEU A 120 3.934 16.627 -9.699 1.00 75.13 O ATOM 1863 CB LEU A 120 5.657 13.984 -9.652 1.00 25.44 C ATOM 1864 CG LEU A 120 6.814 13.001 -9.462 1.00 42.51 C ATOM 1865 CD1 LEU A 120 7.993 13.388 -10.341 1.00 74.31 C ATOM 1866 CD2 LEU A 120 7.233 12.943 -8.000 1.00 12.33 C ATOM 0 H LEU A 120 5.233 14.478 -7.267 1.00 65.42 H new ATOM 0 HA LEU A 120 6.943 15.611 -9.077 1.00 71.25 H new ATOM 0 HB2 LEU A 120 4.759 13.553 -9.209 1.00 25.44 H new ATOM 0 HB3 LEU A 120 5.465 14.093 -10.719 1.00 25.44 H new ATOM 0 HG LEU A 120 6.474 12.009 -9.760 1.00 42.51 H new ATOM 0 HD11 LEU A 120 8.806 12.678 -10.192 1.00 74.31 H new ATOM 0 HD12 LEU A 120 7.687 13.375 -11.387 1.00 74.31 H new ATOM 0 HD13 LEU A 120 8.332 14.389 -10.075 1.00 74.31 H new ATOM 0 HD21 LEU A 120 8.057 12.239 -7.885 1.00 12.33 H new ATOM 0 HD22 LEU A 120 7.553 13.932 -7.674 1.00 12.33 H new ATOM 0 HD23 LEU A 120 6.389 12.616 -7.392 1.00 12.33 H new ATOM 1878 N ALA A 121 5.856 17.082 -10.776 1.00 75.24 N ATOM 1879 CA ALA A 121 5.265 18.109 -11.627 1.00 1.11 C ATOM 1880 C ALA A 121 4.856 17.537 -12.981 1.00 45.32 C ATOM 1881 O ALA A 121 4.802 18.258 -13.978 1.00 61.45 O ATOM 1882 CB ALA A 121 6.239 19.263 -11.812 1.00 41.32 C ATOM 0 H ALA A 121 6.851 16.924 -10.935 1.00 75.24 H new ATOM 0 HA ALA A 121 4.366 18.480 -11.135 1.00 1.11 H new ATOM 0 HB1 ALA A 121 5.786 20.023 -12.449 1.00 41.32 H new ATOM 0 HB2 ALA A 121 6.476 19.698 -10.841 1.00 41.32 H new ATOM 0 HB3 ALA A 121 7.153 18.896 -12.279 1.00 41.32 H new ATOM 1888 N ALA A 122 4.568 16.240 -13.010 1.00 43.24 N ATOM 1889 CA ALA A 122 4.163 15.574 -14.241 1.00 43.23 C ATOM 1890 C ALA A 122 3.090 14.526 -13.964 1.00 4.21 C ATOM 1891 O ALA A 122 3.339 13.325 -14.061 1.00 73.54 O ATOM 1892 CB ALA A 122 5.368 14.936 -14.916 1.00 55.11 C ATOM 0 H ALA A 122 4.608 15.629 -12.194 1.00 43.24 H new ATOM 0 HA ALA A 122 3.741 16.322 -14.912 1.00 43.23 H new ATOM 0 HB1 ALA A 122 5.051 14.442 -15.834 1.00 55.11 H new ATOM 0 HB2 ALA A 122 6.102 15.706 -15.153 1.00 55.11 H new ATOM 0 HB3 ALA A 122 5.815 14.202 -14.245 1.00 55.11 H new ATOM 1898 N ARG A 123 1.895 14.992 -13.614 1.00 32.42 N ATOM 1899 CA ARG A 123 0.783 14.100 -13.318 1.00 13.31 C ATOM 1900 C ARG A 123 0.034 13.723 -14.595 1.00 73.25 C ATOM 1901 O ARG A 123 -0.579 14.573 -15.241 1.00 54.55 O ATOM 1902 CB ARG A 123 -0.166 14.766 -12.312 1.00 40.11 C ATOM 1903 CG ARG A 123 -1.569 14.178 -12.294 1.00 74.35 C ATOM 1904 CD ARG A 123 -2.530 15.012 -13.126 1.00 54.33 C ATOM 1905 NE ARG A 123 -3.397 15.842 -12.293 1.00 34.43 N ATOM 1906 CZ ARG A 123 -4.367 16.616 -12.774 1.00 15.44 C ATOM 1907 NH1 ARG A 123 -4.598 16.669 -14.080 1.00 5.24 N ATOM 1908 NH2 ARG A 123 -5.109 17.340 -11.947 1.00 13.14 N ATOM 0 H ARG A 123 1.673 15.984 -13.529 1.00 32.42 H new ATOM 0 HA ARG A 123 1.178 13.184 -12.878 1.00 13.31 H new ATOM 0 HB2 ARG A 123 0.264 14.682 -11.314 1.00 40.11 H new ATOM 0 HB3 ARG A 123 -0.233 15.829 -12.542 1.00 40.11 H new ATOM 0 HG2 ARG A 123 -1.543 13.158 -12.678 1.00 74.35 H new ATOM 0 HG3 ARG A 123 -1.929 14.122 -11.267 1.00 74.35 H new ATOM 0 HD2 ARG A 123 -1.963 15.648 -13.806 1.00 54.33 H new ATOM 0 HD3 ARG A 123 -3.142 14.353 -13.742 1.00 54.33 H new ATOM 0 HE ARG A 123 -3.250 15.827 -11.284 1.00 34.43 H new ATOM 0 HH11 ARG A 123 -4.031 16.115 -14.721 1.00 5.24 H new ATOM 0 HH12 ARG A 123 -5.343 17.264 -14.442 1.00 5.24 H new ATOM 0 HH21 ARG A 123 -4.936 17.304 -10.942 1.00 13.14 H new ATOM 0 HH22 ARG A 123 -5.852 17.933 -12.316 1.00 13.14 H new ATOM 1922 N THR A 124 0.088 12.444 -14.949 1.00 12.42 N ATOM 1923 CA THR A 124 -0.587 11.951 -16.144 1.00 14.31 C ATOM 1924 C THR A 124 -2.020 11.542 -15.822 1.00 21.53 C ATOM 1925 O THR A 124 -2.961 11.947 -16.504 1.00 20.21 O ATOM 1926 CB THR A 124 0.177 10.764 -16.733 1.00 71.31 C ATOM 1927 OG1 THR A 124 0.063 9.629 -15.895 1.00 62.23 O ATOM 1928 CG2 THR A 124 1.651 11.041 -16.934 1.00 51.30 C ATOM 0 H THR A 124 0.593 11.729 -14.425 1.00 12.42 H new ATOM 0 HA THR A 124 -0.613 12.755 -16.879 1.00 14.31 H new ATOM 0 HB THR A 124 -0.278 10.583 -17.707 1.00 71.31 H new ATOM 0 HG1 THR A 124 -0.188 8.849 -16.433 1.00 62.23 H new ATOM 0 HG21 THR A 124 2.133 10.158 -17.354 1.00 51.30 H new ATOM 0 HG22 THR A 124 1.773 11.881 -17.617 1.00 51.30 H new ATOM 0 HG23 THR A 124 2.110 11.283 -15.975 1.00 51.30 H new ATOM 1936 N VAL A 125 -2.177 10.740 -14.774 1.00 3.52 N ATOM 1937 CA VAL A 125 -3.490 10.278 -14.354 1.00 31.34 C ATOM 1938 C VAL A 125 -4.133 11.272 -13.392 1.00 2.11 C ATOM 1939 O VAL A 125 -3.863 11.252 -12.191 1.00 22.42 O ATOM 1940 CB VAL A 125 -3.402 8.899 -13.673 1.00 61.32 C ATOM 1941 CG1 VAL A 125 -4.784 8.401 -13.287 1.00 62.41 C ATOM 1942 CG2 VAL A 125 -2.704 7.898 -14.581 1.00 35.43 C ATOM 0 H VAL A 125 -1.407 10.397 -14.200 1.00 3.52 H new ATOM 0 HA VAL A 125 -4.105 10.193 -15.250 1.00 31.34 H new ATOM 0 HB VAL A 125 -2.812 9.004 -12.762 1.00 61.32 H new ATOM 0 HG11 VAL A 125 -4.699 7.426 -12.808 1.00 62.41 H new ATOM 0 HG12 VAL A 125 -5.245 9.106 -12.595 1.00 62.41 H new ATOM 0 HG13 VAL A 125 -5.402 8.313 -14.181 1.00 62.41 H new ATOM 0 HG21 VAL A 125 -2.651 6.930 -14.083 1.00 35.43 H new ATOM 0 HG22 VAL A 125 -3.264 7.798 -15.511 1.00 35.43 H new ATOM 0 HG23 VAL A 125 -1.696 8.248 -14.801 1.00 35.43 H new ATOM 1952 N GLU A 126 -4.981 12.144 -13.928 1.00 12.41 N ATOM 1953 CA GLU A 126 -5.660 13.149 -13.117 1.00 35.24 C ATOM 1954 C GLU A 126 -6.404 12.502 -11.952 1.00 11.42 C ATOM 1955 O GLU A 126 -6.741 11.319 -11.998 1.00 52.54 O ATOM 1956 CB GLU A 126 -6.637 13.954 -13.977 1.00 32.32 C ATOM 1957 CG GLU A 126 -7.530 13.090 -14.851 1.00 45.15 C ATOM 1958 CD GLU A 126 -8.670 13.873 -15.473 1.00 21.25 C ATOM 1959 OE1 GLU A 126 -9.116 14.863 -14.856 1.00 42.13 O ATOM 1960 OE2 GLU A 126 -9.117 13.496 -16.576 1.00 21.13 O ATOM 0 H GLU A 126 -5.215 12.175 -14.920 1.00 12.41 H new ATOM 0 HA GLU A 126 -4.904 13.821 -12.711 1.00 35.24 H new ATOM 0 HB2 GLU A 126 -7.262 14.566 -13.327 1.00 32.32 H new ATOM 0 HB3 GLU A 126 -6.072 14.637 -14.612 1.00 32.32 H new ATOM 0 HG2 GLU A 126 -6.931 12.638 -15.641 1.00 45.15 H new ATOM 0 HG3 GLU A 126 -7.938 12.274 -14.254 1.00 45.15 H new ATOM 1967 N SER A 127 -6.655 13.287 -10.910 1.00 4.31 N ATOM 1968 CA SER A 127 -7.358 12.792 -9.730 1.00 62.11 C ATOM 1969 C SER A 127 -8.729 12.237 -10.102 1.00 4.53 C ATOM 1970 O SER A 127 -9.243 11.333 -9.444 1.00 73.53 O ATOM 1971 CB SER A 127 -7.510 13.909 -8.696 1.00 23.34 C ATOM 1972 OG SER A 127 -6.245 14.390 -8.275 1.00 12.41 O ATOM 0 H SER A 127 -6.383 14.269 -10.858 1.00 4.31 H new ATOM 0 HA SER A 127 -6.766 11.984 -9.299 1.00 62.11 H new ATOM 0 HB2 SER A 127 -8.090 14.727 -9.123 1.00 23.34 H new ATOM 0 HB3 SER A 127 -8.067 13.539 -7.835 1.00 23.34 H new ATOM 0 HG SER A 127 -6.370 15.104 -7.616 1.00 12.41 H new ATOM 1978 N ARG A 128 -9.318 12.784 -11.162 1.00 45.22 N ATOM 1979 CA ARG A 128 -10.630 12.342 -11.621 1.00 23.53 C ATOM 1980 C ARG A 128 -10.618 10.854 -11.955 1.00 64.42 C ATOM 1981 O ARG A 128 -11.500 10.106 -11.534 1.00 12.43 O ATOM 1982 CB ARG A 128 -11.062 13.150 -12.846 1.00 22.31 C ATOM 1983 CG ARG A 128 -12.424 12.747 -13.392 1.00 2.30 C ATOM 1984 CD ARG A 128 -13.467 13.825 -13.145 1.00 33.40 C ATOM 1985 NE ARG A 128 -14.581 13.735 -14.087 1.00 3.22 N ATOM 1986 CZ ARG A 128 -15.552 14.640 -14.175 1.00 52.43 C ATOM 1987 NH1 ARG A 128 -15.551 15.705 -13.383 1.00 22.40 N ATOM 1988 NH2 ARG A 128 -16.528 14.481 -15.060 1.00 44.13 N ATOM 0 H ARG A 128 -8.907 13.534 -11.718 1.00 45.22 H new ATOM 0 HA ARG A 128 -11.345 12.507 -10.815 1.00 23.53 H new ATOM 0 HB2 ARG A 128 -11.083 14.208 -12.584 1.00 22.31 H new ATOM 0 HB3 ARG A 128 -10.315 13.031 -13.631 1.00 22.31 H new ATOM 0 HG2 ARG A 128 -12.345 12.554 -14.462 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -12.744 11.816 -12.923 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -13.845 13.737 -12.127 1.00 33.40 H new ATOM 0 HD3 ARG A 128 -13.001 14.807 -13.228 1.00 33.40 H new ATOM 0 HE ARG A 128 -14.616 12.931 -14.714 1.00 3.22 H new ATOM 0 HH11 ARG A 128 -14.803 15.833 -12.702 1.00 22.40 H new ATOM 0 HH12 ARG A 128 -16.298 16.395 -13.456 1.00 22.40 H new ATOM 0 HH21 ARG A 128 -16.533 13.665 -15.672 1.00 44.13 H new ATOM 0 HH22 ARG A 128 -17.273 15.175 -15.128 1.00 44.13 H new ATOM 2002 N GLN A 129 -9.613 10.431 -12.715 1.00 14.31 N ATOM 2003 CA GLN A 129 -9.485 9.032 -13.106 1.00 53.22 C ATOM 2004 C GLN A 129 -9.192 8.153 -11.895 1.00 4.34 C ATOM 2005 O GLN A 129 -9.735 7.057 -11.765 1.00 75.03 O ATOM 2006 CB GLN A 129 -8.377 8.871 -14.149 1.00 22.15 C ATOM 2007 CG GLN A 129 -8.422 9.918 -15.250 1.00 51.12 C ATOM 2008 CD GLN A 129 -8.426 9.307 -16.638 1.00 54.13 C ATOM 2009 OE1 GLN A 129 -9.343 9.533 -17.427 1.00 61.44 O ATOM 2010 NE2 GLN A 129 -7.396 8.525 -16.943 1.00 62.30 N ATOM 0 H GLN A 129 -8.875 11.038 -13.072 1.00 14.31 H new ATOM 0 HA GLN A 129 -10.432 8.714 -13.541 1.00 53.22 H new ATOM 0 HB2 GLN A 129 -7.409 8.922 -13.650 1.00 22.15 H new ATOM 0 HB3 GLN A 129 -8.453 7.880 -14.598 1.00 22.15 H new ATOM 0 HG2 GLN A 129 -9.314 10.533 -15.125 1.00 51.12 H new ATOM 0 HG3 GLN A 129 -7.562 10.580 -15.151 1.00 51.12 H new ATOM 0 HE21 GLN A 129 -6.657 8.365 -16.258 1.00 62.30 H new ATOM 0 HE22 GLN A 129 -7.344 8.085 -17.862 1.00 62.30 H new ATOM 2019 N ALA A 130 -8.328 8.643 -11.011 1.00 72.32 N ATOM 2020 CA ALA A 130 -7.963 7.902 -9.810 1.00 23.24 C ATOM 2021 C ALA A 130 -9.145 7.789 -8.854 1.00 21.43 C ATOM 2022 O ALA A 130 -9.284 6.799 -8.136 1.00 32.32 O ATOM 2023 CB ALA A 130 -6.784 8.569 -9.117 1.00 50.02 C ATOM 0 H ALA A 130 -7.869 9.549 -11.104 1.00 72.32 H new ATOM 0 HA ALA A 130 -7.673 6.895 -10.109 1.00 23.24 H new ATOM 0 HB1 ALA A 130 -6.522 8.005 -8.222 1.00 50.02 H new ATOM 0 HB2 ALA A 130 -5.930 8.593 -9.794 1.00 50.02 H new ATOM 0 HB3 ALA A 130 -7.054 9.587 -8.838 1.00 50.02 H new ATOM 2029 N GLN A 131 -9.996 8.810 -8.851 1.00 24.54 N ATOM 2030 CA GLN A 131 -11.168 8.826 -7.984 1.00 23.32 C ATOM 2031 C GLN A 131 -12.292 7.981 -8.575 1.00 44.31 C ATOM 2032 O GLN A 131 -12.980 7.256 -7.856 1.00 33.21 O ATOM 2033 CB GLN A 131 -11.649 10.263 -7.769 1.00 55.43 C ATOM 2034 CG GLN A 131 -11.143 10.886 -6.477 1.00 52.51 C ATOM 2035 CD GLN A 131 -12.258 11.171 -5.490 1.00 61.51 C ATOM 2036 OE1 GLN A 131 -12.707 12.309 -5.355 1.00 62.00 O ATOM 2037 NE2 GLN A 131 -12.709 10.136 -4.793 1.00 44.20 N ATOM 0 H GLN A 131 -9.896 9.637 -9.439 1.00 24.54 H new ATOM 0 HA GLN A 131 -10.885 8.399 -7.022 1.00 23.32 H new ATOM 0 HB2 GLN A 131 -11.324 10.876 -8.610 1.00 55.43 H new ATOM 0 HB3 GLN A 131 -12.739 10.276 -7.767 1.00 55.43 H new ATOM 0 HG2 GLN A 131 -10.417 10.217 -6.016 1.00 52.51 H new ATOM 0 HG3 GLN A 131 -10.620 11.814 -6.706 1.00 52.51 H new ATOM 0 HE21 GLN A 131 -12.307 9.210 -4.938 1.00 44.20 H new ATOM 0 HE22 GLN A 131 -13.458 10.267 -4.113 1.00 44.20 H new ATOM 2046 N ASP A 132 -12.473 8.080 -9.888 1.00 14.32 N ATOM 2047 CA ASP A 132 -13.513 7.323 -10.574 1.00 74.15 C ATOM 2048 C ASP A 132 -13.301 5.823 -10.393 1.00 51.52 C ATOM 2049 O ASP A 132 -14.259 5.055 -10.319 1.00 5.22 O ATOM 2050 CB ASP A 132 -13.530 7.672 -12.064 1.00 44.34 C ATOM 2051 CG ASP A 132 -14.938 7.794 -12.613 1.00 22.21 C ATOM 2052 OD1 ASP A 132 -15.712 6.822 -12.483 1.00 43.34 O ATOM 2053 OD2 ASP A 132 -15.266 8.860 -13.174 1.00 54.04 O ATOM 0 H ASP A 132 -11.913 8.677 -10.497 1.00 14.32 H new ATOM 0 HA ASP A 132 -14.474 7.592 -10.135 1.00 74.15 H new ATOM 0 HB2 ASP A 132 -12.999 8.611 -12.220 1.00 44.34 H new ATOM 0 HB3 ASP A 132 -12.991 6.905 -12.620 1.00 44.34 H new ATOM 2058 N LEU A 133 -12.038 5.415 -10.321 1.00 5.21 N ATOM 2059 CA LEU A 133 -11.699 4.008 -10.147 1.00 53.34 C ATOM 2060 C LEU A 133 -11.902 3.576 -8.699 1.00 22.15 C ATOM 2061 O LEU A 133 -12.568 2.578 -8.425 1.00 35.23 O ATOM 2062 CB LEU A 133 -10.250 3.755 -10.568 1.00 34.53 C ATOM 2063 CG LEU A 133 -9.741 2.333 -10.320 1.00 41.45 C ATOM 2064 CD1 LEU A 133 -10.320 1.371 -11.347 1.00 54.43 C ATOM 2065 CD2 LEU A 133 -8.220 2.300 -10.349 1.00 42.44 C ATOM 0 H LEU A 133 -11.233 6.039 -10.380 1.00 5.21 H new ATOM 0 HA LEU A 133 -12.362 3.419 -10.780 1.00 53.34 H new ATOM 0 HB2 LEU A 133 -10.152 3.979 -11.630 1.00 34.53 H new ATOM 0 HB3 LEU A 133 -9.606 4.453 -10.034 1.00 34.53 H new ATOM 0 HG LEU A 133 -10.072 2.015 -9.331 1.00 41.45 H new ATOM 0 HD11 LEU A 133 -9.947 0.365 -11.154 1.00 54.43 H new ATOM 0 HD12 LEU A 133 -11.408 1.374 -11.276 1.00 54.43 H new ATOM 0 HD13 LEU A 133 -10.021 1.684 -12.347 1.00 54.43 H new ATOM 0 HD21 LEU A 133 -7.875 1.282 -10.171 1.00 42.44 H new ATOM 0 HD22 LEU A 133 -7.867 2.638 -11.324 1.00 42.44 H new ATOM 0 HD23 LEU A 133 -7.827 2.957 -9.573 1.00 42.44 H new ATOM 2077 N ALA A 134 -11.322 4.334 -7.774 1.00 41.21 N ATOM 2078 CA ALA A 134 -11.439 4.029 -6.354 1.00 31.12 C ATOM 2079 C ALA A 134 -12.887 4.134 -5.888 1.00 63.52 C ATOM 2080 O ALA A 134 -13.390 3.253 -5.191 1.00 2.41 O ATOM 2081 CB ALA A 134 -10.552 4.959 -5.540 1.00 4.22 C ATOM 0 H ALA A 134 -10.767 5.164 -7.983 1.00 41.21 H new ATOM 0 HA ALA A 134 -11.108 3.002 -6.199 1.00 31.12 H new ATOM 0 HB1 ALA A 134 -10.649 4.720 -4.481 1.00 4.22 H new ATOM 0 HB2 ALA A 134 -9.514 4.832 -5.847 1.00 4.22 H new ATOM 0 HB3 ALA A 134 -10.857 5.992 -5.708 1.00 4.22 H new ATOM 2087 N ARG A 135 -13.553 5.216 -6.279 1.00 44.41 N ATOM 2088 CA ARG A 135 -14.945 5.436 -5.902 1.00 53.32 C ATOM 2089 C ARG A 135 -15.826 4.283 -6.376 1.00 64.30 C ATOM 2090 O ARG A 135 -16.836 3.963 -5.750 1.00 24.10 O ATOM 2091 CB ARG A 135 -15.452 6.755 -6.488 1.00 35.51 C ATOM 2092 CG ARG A 135 -16.901 7.060 -6.141 1.00 5.23 C ATOM 2093 CD ARG A 135 -17.327 8.423 -6.664 1.00 72.13 C ATOM 2094 NE ARG A 135 -18.603 8.363 -7.373 1.00 1.54 N ATOM 2095 CZ ARG A 135 -19.112 9.376 -8.070 1.00 3.51 C ATOM 2096 NH1 ARG A 135 -18.458 10.528 -8.154 1.00 33.53 N ATOM 2097 NH2 ARG A 135 -20.278 9.237 -8.686 1.00 11.13 N ATOM 0 H ARG A 135 -13.151 5.954 -6.857 1.00 44.41 H new ATOM 0 HA ARG A 135 -14.997 5.486 -4.814 1.00 53.32 H new ATOM 0 HB2 ARG A 135 -14.822 7.568 -6.128 1.00 35.51 H new ATOM 0 HB3 ARG A 135 -15.346 6.726 -7.572 1.00 35.51 H new ATOM 0 HG2 ARG A 135 -17.547 6.290 -6.563 1.00 5.23 H new ATOM 0 HG3 ARG A 135 -17.031 7.028 -5.059 1.00 5.23 H new ATOM 0 HD2 ARG A 135 -17.407 9.122 -5.831 1.00 72.13 H new ATOM 0 HD3 ARG A 135 -16.559 8.811 -7.333 1.00 72.13 H new ATOM 0 HE ARG A 135 -19.135 7.494 -7.331 1.00 1.54 H new ATOM 0 HH11 ARG A 135 -17.560 10.640 -7.683 1.00 33.53 H new ATOM 0 HH12 ARG A 135 -18.853 11.301 -8.690 1.00 33.53 H new ATOM 0 HH21 ARG A 135 -20.785 8.354 -8.626 1.00 11.13 H new ATOM 0 HH22 ARG A 135 -20.668 10.013 -9.220 1.00 11.13 H new ATOM 2111 N SER A 136 -15.435 3.663 -7.485 1.00 12.25 N ATOM 2112 CA SER A 136 -16.188 2.545 -8.041 1.00 52.43 C ATOM 2113 C SER A 136 -15.998 1.292 -7.194 1.00 4.13 C ATOM 2114 O SER A 136 -16.927 0.504 -7.014 1.00 10.20 O ATOM 2115 CB SER A 136 -15.750 2.275 -9.482 1.00 43.43 C ATOM 2116 OG SER A 136 -16.167 0.991 -9.911 1.00 34.30 O ATOM 0 H SER A 136 -14.602 3.916 -8.016 1.00 12.25 H new ATOM 0 HA SER A 136 -17.245 2.809 -8.036 1.00 52.43 H new ATOM 0 HB2 SER A 136 -16.169 3.036 -10.141 1.00 43.43 H new ATOM 0 HB3 SER A 136 -14.665 2.352 -9.556 1.00 43.43 H new ATOM 0 HG SER A 136 -15.876 0.844 -10.835 1.00 34.30 H new ATOM 2122 N TYR A 137 -14.788 1.115 -6.674 1.00 23.41 N ATOM 2123 CA TYR A 137 -14.473 -0.041 -5.843 1.00 44.13 C ATOM 2124 C TYR A 137 -15.097 0.094 -4.457 1.00 71.22 C ATOM 2125 O TYR A 137 -15.291 -0.899 -3.755 1.00 71.00 O ATOM 2126 CB TYR A 137 -12.957 -0.204 -5.714 1.00 54.21 C ATOM 2127 CG TYR A 137 -12.273 -0.611 -7.001 1.00 0.50 C ATOM 2128 CD1 TYR A 137 -12.856 -1.535 -7.861 1.00 62.22 C ATOM 2129 CD2 TYR A 137 -11.043 -0.072 -7.354 1.00 15.35 C ATOM 2130 CE1 TYR A 137 -12.231 -1.909 -9.036 1.00 15.22 C ATOM 2131 CE2 TYR A 137 -10.412 -0.441 -8.527 1.00 34.53 C ATOM 2132 CZ TYR A 137 -11.010 -1.359 -9.364 1.00 71.22 C ATOM 2133 OH TYR A 137 -10.385 -1.731 -10.533 1.00 4.21 O ATOM 0 H TYR A 137 -14.009 1.758 -6.814 1.00 23.41 H new ATOM 0 HA TYR A 137 -14.890 -0.925 -6.325 1.00 44.13 H new ATOM 0 HB2 TYR A 137 -12.528 0.736 -5.368 1.00 54.21 H new ATOM 0 HB3 TYR A 137 -12.745 -0.951 -4.949 1.00 54.21 H new ATOM 0 HD1 TYR A 137 -13.812 -1.967 -7.607 1.00 62.22 H new ATOM 0 HD2 TYR A 137 -10.572 0.648 -6.701 1.00 15.35 H new ATOM 0 HE1 TYR A 137 -12.697 -2.628 -9.694 1.00 15.22 H new ATOM 0 HE2 TYR A 137 -9.455 -0.012 -8.787 1.00 34.53 H new ATOM 0 HH TYR A 137 -10.749 -2.587 -10.841 1.00 4.21 H new ATOM 2143 N GLY A 138 -15.405 1.327 -4.065 1.00 14.34 N ATOM 2144 CA GLY A 138 -15.997 1.563 -2.762 1.00 53.54 C ATOM 2145 C GLY A 138 -14.953 1.732 -1.675 1.00 65.11 C ATOM 2146 O GLY A 138 -15.266 1.646 -0.487 1.00 1.33 O ATOM 0 H GLY A 138 -15.255 2.165 -4.626 1.00 14.34 H new ATOM 0 HA2 GLY A 138 -16.620 2.456 -2.805 1.00 53.54 H new ATOM 0 HA3 GLY A 138 -16.652 0.730 -2.507 1.00 53.54 H new ATOM 2150 N ILE A 139 -13.709 1.972 -2.080 1.00 53.11 N ATOM 2151 CA ILE A 139 -12.617 2.154 -1.131 1.00 2.24 C ATOM 2152 C ILE A 139 -12.135 3.601 -1.109 1.00 75.43 C ATOM 2153 O ILE A 139 -12.325 4.342 -2.074 1.00 52.51 O ATOM 2154 CB ILE A 139 -11.430 1.234 -1.448 1.00 31.13 C ATOM 2155 CG1 ILE A 139 -11.173 1.190 -2.949 1.00 12.10 C ATOM 2156 CG2 ILE A 139 -11.686 -0.165 -0.908 1.00 71.25 C ATOM 2157 CD1 ILE A 139 -9.974 0.355 -3.309 1.00 13.35 C ATOM 0 H ILE A 139 -13.433 2.045 -3.059 1.00 53.11 H new ATOM 0 HA ILE A 139 -13.013 1.893 -0.150 1.00 2.24 H new ATOM 0 HB ILE A 139 -10.541 1.635 -0.961 1.00 31.13 H new ATOM 0 HG12 ILE A 139 -12.053 0.790 -3.453 1.00 12.10 H new ATOM 0 HG13 ILE A 139 -11.028 2.205 -3.318 1.00 12.10 H new ATOM 0 HG21 ILE A 139 -10.836 -0.806 -1.140 1.00 71.25 H new ATOM 0 HG22 ILE A 139 -11.821 -0.119 0.173 1.00 71.25 H new ATOM 0 HG23 ILE A 139 -12.585 -0.574 -1.369 1.00 71.25 H new ATOM 0 HD11 ILE A 139 -9.839 0.360 -4.391 1.00 13.35 H new ATOM 0 HD12 ILE A 139 -9.086 0.768 -2.831 1.00 13.35 H new ATOM 0 HD13 ILE A 139 -10.127 -0.668 -2.967 1.00 13.35 H new ATOM 2169 N PRO A 140 -11.501 4.026 -0.002 1.00 53.01 N ATOM 2170 CA PRO A 140 -10.991 5.393 0.140 1.00 61.31 C ATOM 2171 C PRO A 140 -9.780 5.657 -0.748 1.00 51.30 C ATOM 2172 O PRO A 140 -9.105 4.727 -1.189 1.00 51.24 O ATOM 2173 CB PRO A 140 -10.598 5.473 1.617 1.00 3.52 C ATOM 2174 CG PRO A 140 -10.302 4.066 2.006 1.00 71.13 C ATOM 2175 CD PRO A 140 -11.233 3.207 1.195 1.00 24.13 C ATOM 0 HA PRO A 140 -11.730 6.136 -0.160 1.00 61.31 H new ATOM 0 HB2 PRO A 140 -9.729 6.115 1.761 1.00 3.52 H new ATOM 0 HB3 PRO A 140 -11.405 5.889 2.220 1.00 3.52 H new ATOM 0 HG2 PRO A 140 -9.261 3.815 1.801 1.00 71.13 H new ATOM 0 HG3 PRO A 140 -10.462 3.914 3.074 1.00 71.13 H new ATOM 0 HD2 PRO A 140 -10.774 2.253 0.934 1.00 24.13 H new ATOM 0 HD3 PRO A 140 -12.149 2.982 1.741 1.00 24.13 H new ATOM 2183 N TYR A 141 -9.511 6.933 -1.008 1.00 61.32 N ATOM 2184 CA TYR A 141 -8.381 7.322 -1.844 1.00 74.14 C ATOM 2185 C TYR A 141 -7.601 8.467 -1.203 1.00 72.14 C ATOM 2186 O TYR A 141 -8.135 9.558 -0.999 1.00 40.10 O ATOM 2187 CB TYR A 141 -8.869 7.730 -3.238 1.00 71.32 C ATOM 2188 CG TYR A 141 -7.803 8.377 -4.096 1.00 22.25 C ATOM 2189 CD1 TYR A 141 -6.628 7.704 -4.403 1.00 2.41 C ATOM 2190 CD2 TYR A 141 -7.974 9.662 -4.594 1.00 70.53 C ATOM 2191 CE1 TYR A 141 -5.652 8.294 -5.184 1.00 51.23 C ATOM 2192 CE2 TYR A 141 -7.003 10.259 -5.376 1.00 24.54 C ATOM 2193 CZ TYR A 141 -5.844 9.571 -5.668 1.00 23.24 C ATOM 2194 OH TYR A 141 -4.875 10.162 -6.445 1.00 22.03 O ATOM 0 H TYR A 141 -10.060 7.715 -0.652 1.00 61.32 H new ATOM 0 HA TYR A 141 -7.715 6.465 -1.939 1.00 74.14 H new ATOM 0 HB2 TYR A 141 -9.249 6.847 -3.752 1.00 71.32 H new ATOM 0 HB3 TYR A 141 -9.705 8.421 -3.132 1.00 71.32 H new ATOM 0 HD1 TYR A 141 -6.474 6.704 -4.026 1.00 2.41 H new ATOM 0 HD2 TYR A 141 -8.880 10.204 -4.367 1.00 70.53 H new ATOM 0 HE1 TYR A 141 -4.743 7.757 -5.414 1.00 51.23 H new ATOM 0 HE2 TYR A 141 -7.151 11.259 -5.756 1.00 24.54 H new ATOM 0 HH TYR A 141 -5.167 11.061 -6.705 1.00 22.03 H new ATOM 2204 N ILE A 142 -6.335 8.211 -0.891 1.00 61.34 N ATOM 2205 CA ILE A 142 -5.479 9.215 -0.277 1.00 12.34 C ATOM 2206 C ILE A 142 -4.257 9.495 -1.148 1.00 62.34 C ATOM 2207 O ILE A 142 -3.789 8.620 -1.877 1.00 73.12 O ATOM 2208 CB ILE A 142 -5.013 8.768 1.121 1.00 51.43 C ATOM 2209 CG1 ILE A 142 -6.220 8.455 2.008 1.00 54.54 C ATOM 2210 CG2 ILE A 142 -4.146 9.839 1.760 1.00 4.01 C ATOM 2211 CD1 ILE A 142 -6.659 7.009 1.942 1.00 24.50 C ATOM 0 H ILE A 142 -5.879 7.313 -1.055 1.00 61.34 H new ATOM 0 HA ILE A 142 -6.068 10.127 -0.180 1.00 12.34 H new ATOM 0 HB ILE A 142 -4.417 7.862 1.015 1.00 51.43 H new ATOM 0 HG12 ILE A 142 -5.977 8.706 3.041 1.00 54.54 H new ATOM 0 HG13 ILE A 142 -7.053 9.093 1.713 1.00 54.54 H new ATOM 0 HG21 ILE A 142 -3.826 9.506 2.747 1.00 4.01 H new ATOM 0 HG22 ILE A 142 -3.271 10.019 1.136 1.00 4.01 H new ATOM 0 HG23 ILE A 142 -4.719 10.761 1.856 1.00 4.01 H new ATOM 0 HD11 ILE A 142 -7.519 6.860 2.595 1.00 24.50 H new ATOM 0 HD12 ILE A 142 -6.934 6.759 0.917 1.00 24.50 H new ATOM 0 HD13 ILE A 142 -5.841 6.365 2.266 1.00 24.50 H new ATOM 2223 N GLU A 143 -3.745 10.719 -1.066 1.00 22.32 N ATOM 2224 CA GLU A 143 -2.577 11.112 -1.846 1.00 2.22 C ATOM 2225 C GLU A 143 -1.375 11.352 -0.940 1.00 62.43 C ATOM 2226 O GLU A 143 -1.475 12.055 0.066 1.00 63.22 O ATOM 2227 CB GLU A 143 -2.878 12.375 -2.656 1.00 23.32 C ATOM 2228 CG GLU A 143 -4.227 12.341 -3.357 1.00 0.05 C ATOM 2229 CD GLU A 143 -5.181 13.400 -2.839 1.00 11.04 C ATOM 2230 OE1 GLU A 143 -5.099 14.554 -3.311 1.00 21.42 O ATOM 2231 OE2 GLU A 143 -6.009 13.076 -1.963 1.00 1.32 O ATOM 0 H GLU A 143 -4.120 11.455 -0.468 1.00 22.32 H new ATOM 0 HA GLU A 143 -2.339 10.298 -2.531 1.00 2.22 H new ATOM 0 HB2 GLU A 143 -2.844 13.239 -1.992 1.00 23.32 H new ATOM 0 HB3 GLU A 143 -2.094 12.514 -3.401 1.00 23.32 H new ATOM 0 HG2 GLU A 143 -4.079 12.483 -4.428 1.00 0.05 H new ATOM 0 HG3 GLU A 143 -4.676 11.357 -3.225 1.00 0.05 H new ATOM 2238 N THR A 144 -0.240 10.762 -1.300 1.00 44.22 N ATOM 2239 CA THR A 144 0.979 10.914 -0.514 1.00 24.11 C ATOM 2240 C THR A 144 2.195 11.101 -1.415 1.00 12.24 C ATOM 2241 O THR A 144 2.168 10.750 -2.595 1.00 2.12 O ATOM 2242 CB THR A 144 1.182 9.697 0.389 1.00 34.41 C ATOM 2243 OG1 THR A 144 1.427 8.534 -0.382 1.00 20.22 O ATOM 2244 CG2 THR A 144 -0.006 9.414 1.283 1.00 70.11 C ATOM 0 H THR A 144 -0.139 10.176 -2.129 1.00 44.22 H new ATOM 0 HA THR A 144 0.871 11.805 0.104 1.00 24.11 H new ATOM 0 HB THR A 144 2.040 9.941 1.016 1.00 34.41 H new ATOM 0 HG1 THR A 144 1.179 8.702 -1.315 1.00 20.22 H new ATOM 0 HG21 THR A 144 0.202 8.539 1.898 1.00 70.11 H new ATOM 0 HG22 THR A 144 -0.190 10.274 1.926 1.00 70.11 H new ATOM 0 HG23 THR A 144 -0.887 9.225 0.669 1.00 70.11 H new ATOM 2252 N SER A 145 3.261 11.658 -0.849 1.00 54.24 N ATOM 2253 CA SER A 145 4.490 11.894 -1.596 1.00 35.32 C ATOM 2254 C SER A 145 5.701 11.377 -0.826 1.00 12.35 C ATOM 2255 O SER A 145 5.965 11.807 0.297 1.00 52.23 O ATOM 2256 CB SER A 145 4.656 13.387 -1.887 1.00 11.23 C ATOM 2257 OG SER A 145 4.133 14.173 -0.830 1.00 13.15 O ATOM 0 H SER A 145 3.298 11.955 0.126 1.00 54.24 H new ATOM 0 HA SER A 145 4.423 11.352 -2.539 1.00 35.32 H new ATOM 0 HB2 SER A 145 5.712 13.618 -2.028 1.00 11.23 H new ATOM 0 HB3 SER A 145 4.147 13.638 -2.818 1.00 11.23 H new ATOM 0 HG SER A 145 4.806 14.825 -0.543 1.00 13.15 H new ATOM 2263 N ALA A 146 6.434 10.453 -1.437 1.00 51.15 N ATOM 2264 CA ALA A 146 7.617 9.875 -0.811 1.00 14.45 C ATOM 2265 C ALA A 146 8.792 10.852 -0.826 1.00 31.42 C ATOM 2266 O ALA A 146 9.790 10.643 -0.135 1.00 51.25 O ATOM 2267 CB ALA A 146 8.000 8.578 -1.509 1.00 64.55 C ATOM 0 H ALA A 146 6.229 10.088 -2.367 1.00 51.15 H new ATOM 0 HA ALA A 146 7.375 9.662 0.230 1.00 14.45 H new ATOM 0 HB1 ALA A 146 8.885 8.156 -1.033 1.00 64.55 H new ATOM 0 HB2 ALA A 146 7.176 7.869 -1.437 1.00 64.55 H new ATOM 0 HB3 ALA A 146 8.214 8.779 -2.559 1.00 64.55 H new ATOM 2273 N LYS A 147 8.674 11.914 -1.618 1.00 62.20 N ATOM 2274 CA LYS A 147 9.732 12.913 -1.720 1.00 25.01 C ATOM 2275 C LYS A 147 9.512 14.056 -0.733 1.00 15.12 C ATOM 2276 O LYS A 147 10.417 14.425 0.015 1.00 53.32 O ATOM 2277 CB LYS A 147 9.802 13.463 -3.146 1.00 42.12 C ATOM 2278 CG LYS A 147 11.054 14.278 -3.423 1.00 64.24 C ATOM 2279 CD LYS A 147 12.313 13.475 -3.140 1.00 31.34 C ATOM 2280 CE LYS A 147 13.559 14.209 -3.607 1.00 1.34 C ATOM 2281 NZ LYS A 147 14.586 13.274 -4.143 1.00 0.21 N ATOM 0 H LYS A 147 7.857 12.104 -2.198 1.00 62.20 H new ATOM 0 HA LYS A 147 10.676 12.427 -1.473 1.00 25.01 H new ATOM 0 HB2 LYS A 147 9.757 12.632 -3.850 1.00 42.12 H new ATOM 0 HB3 LYS A 147 8.926 14.085 -3.330 1.00 42.12 H new ATOM 0 HG2 LYS A 147 11.055 14.604 -4.463 1.00 64.24 H new ATOM 0 HG3 LYS A 147 11.048 15.177 -2.807 1.00 64.24 H new ATOM 0 HD2 LYS A 147 12.386 13.276 -2.071 1.00 31.34 H new ATOM 0 HD3 LYS A 147 12.250 12.509 -3.641 1.00 31.34 H new ATOM 0 HE2 LYS A 147 13.288 14.931 -4.377 1.00 1.34 H new ATOM 0 HE3 LYS A 147 13.981 14.774 -2.776 1.00 1.34 H new ATOM 0 HZ1 LYS A 147 15.420 13.814 -4.451 1.00 0.21 H new ATOM 0 HZ2 LYS A 147 14.864 12.601 -3.401 1.00 0.21 H new ATOM 0 HZ3 LYS A 147 14.193 12.753 -4.953 1.00 0.21 H new ATOM 2295 N THR A 148 8.307 14.616 -0.740 1.00 54.44 N ATOM 2296 CA THR A 148 7.973 15.722 0.152 1.00 42.31 C ATOM 2297 C THR A 148 7.450 15.216 1.493 1.00 13.44 C ATOM 2298 O THR A 148 7.478 15.938 2.490 1.00 30.12 O ATOM 2299 CB THR A 148 6.932 16.636 -0.497 1.00 23.21 C ATOM 2300 OG1 THR A 148 5.918 15.875 -1.131 1.00 31.33 O ATOM 2301 CG2 THR A 148 7.519 17.575 -1.530 1.00 5.10 C ATOM 0 H THR A 148 7.546 14.323 -1.352 1.00 54.44 H new ATOM 0 HA THR A 148 8.887 16.288 0.332 1.00 42.31 H new ATOM 0 HB THR A 148 6.524 17.231 0.319 1.00 23.21 H new ATOM 0 HG1 THR A 148 5.184 16.466 -1.398 1.00 31.33 H new ATOM 0 HG21 THR A 148 6.727 18.194 -1.951 1.00 5.10 H new ATOM 0 HG22 THR A 148 8.267 18.213 -1.059 1.00 5.10 H new ATOM 0 HG23 THR A 148 7.987 16.995 -2.325 1.00 5.10 H new ATOM 2309 N ARG A 149 6.969 13.976 1.515 1.00 4.22 N ATOM 2310 CA ARG A 149 6.439 13.387 2.739 1.00 73.53 C ATOM 2311 C ARG A 149 5.192 14.137 3.198 1.00 33.15 C ATOM 2312 O ARG A 149 5.207 14.828 4.217 1.00 72.50 O ATOM 2313 CB ARG A 149 7.501 13.403 3.840 1.00 34.20 C ATOM 2314 CG ARG A 149 7.255 12.383 4.939 1.00 62.42 C ATOM 2315 CD ARG A 149 6.459 12.982 6.086 1.00 0.30 C ATOM 2316 NE ARG A 149 7.090 12.731 7.380 1.00 22.32 N ATOM 2317 CZ ARG A 149 8.222 13.308 7.777 1.00 13.15 C ATOM 2318 NH1 ARG A 149 8.850 14.168 6.984 1.00 32.43 N ATOM 2319 NH2 ARG A 149 8.728 13.025 8.969 1.00 51.42 N ATOM 0 H ARG A 149 6.936 13.362 0.701 1.00 4.22 H new ATOM 0 HA ARG A 149 6.164 12.353 2.532 1.00 73.53 H new ATOM 0 HB2 ARG A 149 8.478 13.215 3.394 1.00 34.20 H new ATOM 0 HB3 ARG A 149 7.539 14.399 4.282 1.00 34.20 H new ATOM 0 HG2 ARG A 149 6.718 11.528 4.529 1.00 62.42 H new ATOM 0 HG3 ARG A 149 8.209 12.011 5.312 1.00 62.42 H new ATOM 0 HD2 ARG A 149 6.357 14.057 5.935 1.00 0.30 H new ATOM 0 HD3 ARG A 149 5.452 12.564 6.086 1.00 0.30 H new ATOM 0 HE ARG A 149 6.636 12.075 8.016 1.00 22.32 H new ATOM 0 HH11 ARG A 149 8.465 14.389 6.066 1.00 32.43 H new ATOM 0 HH12 ARG A 149 9.717 14.607 7.293 1.00 32.43 H new ATOM 0 HH21 ARG A 149 8.250 12.365 9.582 1.00 51.42 H new ATOM 0 HH22 ARG A 149 9.595 13.467 9.273 1.00 51.42 H new ATOM 2333 N GLN A 150 4.114 14.000 2.432 1.00 34.14 N ATOM 2334 CA GLN A 150 2.857 14.666 2.751 1.00 75.44 C ATOM 2335 C GLN A 150 1.712 13.659 2.828 1.00 25.33 C ATOM 2336 O GLN A 150 1.364 13.025 1.834 1.00 22.45 O ATOM 2337 CB GLN A 150 2.548 15.737 1.699 1.00 4.52 C ATOM 2338 CG GLN A 150 1.161 16.348 1.828 1.00 35.33 C ATOM 2339 CD GLN A 150 1.152 17.836 1.548 1.00 44.51 C ATOM 2340 OE1 GLN A 150 1.007 18.651 2.460 1.00 70.33 O ATOM 2341 NE2 GLN A 150 1.305 18.198 0.281 1.00 72.30 N ATOM 0 H GLN A 150 4.086 13.433 1.585 1.00 34.14 H new ATOM 0 HA GLN A 150 2.959 15.142 3.726 1.00 75.44 H new ATOM 0 HB2 GLN A 150 3.292 16.530 1.774 1.00 4.52 H new ATOM 0 HB3 GLN A 150 2.649 15.297 0.707 1.00 4.52 H new ATOM 0 HG2 GLN A 150 0.482 15.848 1.137 1.00 35.33 H new ATOM 0 HG3 GLN A 150 0.781 16.169 2.834 1.00 35.33 H new ATOM 0 HE21 GLN A 150 1.422 17.488 -0.442 1.00 72.30 H new ATOM 0 HE22 GLN A 150 1.306 19.187 0.030 1.00 72.30 H new ATOM 2350 N GLY A 151 1.129 13.521 4.014 1.00 13.45 N ATOM 2351 CA GLY A 151 0.028 12.593 4.197 1.00 4.44 C ATOM 2352 C GLY A 151 0.447 11.143 4.037 1.00 1.51 C ATOM 2353 O GLY A 151 -0.400 10.260 3.904 1.00 54.03 O ATOM 0 H GLY A 151 1.399 14.035 4.852 1.00 13.45 H new ATOM 0 HA2 GLY A 151 -0.400 12.735 5.189 1.00 4.44 H new ATOM 0 HA3 GLY A 151 -0.757 12.821 3.476 1.00 4.44 H new ATOM 2357 N VAL A 152 1.754 10.893 4.051 1.00 23.23 N ATOM 2358 CA VAL A 152 2.277 9.538 3.908 1.00 64.34 C ATOM 2359 C VAL A 152 1.627 8.587 4.909 1.00 73.45 C ATOM 2360 O VAL A 152 1.053 7.567 4.529 1.00 0.31 O ATOM 2361 CB VAL A 152 3.806 9.504 4.100 1.00 61.32 C ATOM 2362 CG1 VAL A 152 4.353 8.113 3.811 1.00 11.43 C ATOM 2363 CG2 VAL A 152 4.477 10.545 3.216 1.00 52.32 C ATOM 0 H VAL A 152 2.470 11.611 4.160 1.00 23.23 H new ATOM 0 HA VAL A 152 2.038 9.212 2.896 1.00 64.34 H new ATOM 0 HB VAL A 152 4.029 9.745 5.139 1.00 61.32 H new ATOM 0 HG11 VAL A 152 5.434 8.110 3.952 1.00 11.43 H new ATOM 0 HG12 VAL A 152 3.896 7.394 4.491 1.00 11.43 H new ATOM 0 HG13 VAL A 152 4.121 7.837 2.782 1.00 11.43 H new ATOM 0 HG21 VAL A 152 5.556 10.507 3.364 1.00 52.32 H new ATOM 0 HG22 VAL A 152 4.247 10.338 2.171 1.00 52.32 H new ATOM 0 HG23 VAL A 152 4.109 11.537 3.479 1.00 52.32 H new ATOM 2373 N GLU A 153 1.721 8.931 6.189 1.00 31.25 N ATOM 2374 CA GLU A 153 1.140 8.110 7.245 1.00 54.52 C ATOM 2375 C GLU A 153 -0.384 8.110 7.159 1.00 14.30 C ATOM 2376 O GLU A 153 -1.039 7.161 7.589 1.00 25.31 O ATOM 2377 CB GLU A 153 1.584 8.618 8.618 1.00 22.32 C ATOM 2378 CG GLU A 153 3.087 8.808 8.739 1.00 31.11 C ATOM 2379 CD GLU A 153 3.507 9.268 10.122 1.00 11.42 C ATOM 2380 OE1 GLU A 153 2.698 9.942 10.794 1.00 13.34 O ATOM 2381 OE2 GLU A 153 4.643 8.953 10.532 1.00 10.43 O ATOM 0 H GLU A 153 2.194 9.772 6.520 1.00 31.25 H new ATOM 0 HA GLU A 153 1.494 7.088 7.111 1.00 54.52 H new ATOM 0 HB2 GLU A 153 1.088 9.567 8.823 1.00 22.32 H new ATOM 0 HB3 GLU A 153 1.252 7.914 9.381 1.00 22.32 H new ATOM 0 HG2 GLU A 153 3.588 7.869 8.505 1.00 31.11 H new ATOM 0 HG3 GLU A 153 3.418 9.539 8.001 1.00 31.11 H new ATOM 2388 N ASP A 154 -0.942 9.181 6.601 1.00 4.22 N ATOM 2389 CA ASP A 154 -2.389 9.304 6.460 1.00 12.23 C ATOM 2390 C ASP A 154 -2.959 8.144 5.651 1.00 64.24 C ATOM 2391 O ASP A 154 -3.903 7.480 6.080 1.00 51.13 O ATOM 2392 CB ASP A 154 -2.745 10.632 5.787 1.00 70.41 C ATOM 2393 CG ASP A 154 -4.045 11.213 6.308 1.00 65.43 C ATOM 2394 OD1 ASP A 154 -4.107 11.547 7.510 1.00 72.12 O ATOM 2395 OD2 ASP A 154 -5.001 11.336 5.514 1.00 72.42 O ATOM 0 H ASP A 154 -0.414 9.975 6.240 1.00 4.22 H new ATOM 0 HA ASP A 154 -2.829 9.278 7.457 1.00 12.23 H new ATOM 0 HB2 ASP A 154 -1.939 11.347 5.951 1.00 70.41 H new ATOM 0 HB3 ASP A 154 -2.823 10.481 4.710 1.00 70.41 H new ATOM 2400 N ALA A 155 -2.380 7.905 4.478 1.00 71.54 N ATOM 2401 CA ALA A 155 -2.830 6.824 3.609 1.00 35.33 C ATOM 2402 C ALA A 155 -2.775 5.481 4.330 1.00 21.11 C ATOM 2403 O ALA A 155 -3.699 4.674 4.232 1.00 23.34 O ATOM 2404 CB ALA A 155 -1.988 6.783 2.341 1.00 74.22 C ATOM 0 H ALA A 155 -1.598 8.446 4.108 1.00 71.54 H new ATOM 0 HA ALA A 155 -3.868 7.016 3.336 1.00 35.33 H new ATOM 0 HB1 ALA A 155 -2.334 5.972 1.701 1.00 74.22 H new ATOM 0 HB2 ALA A 155 -2.083 7.730 1.810 1.00 74.22 H new ATOM 0 HB3 ALA A 155 -0.943 6.618 2.603 1.00 74.22 H new ATOM 2410 N PHE A 156 -1.685 5.248 5.054 1.00 64.13 N ATOM 2411 CA PHE A 156 -1.511 4.003 5.793 1.00 45.31 C ATOM 2412 C PHE A 156 -2.549 3.880 6.901 1.00 74.52 C ATOM 2413 O PHE A 156 -3.218 2.854 7.028 1.00 13.12 O ATOM 2414 CB PHE A 156 -0.103 3.931 6.386 1.00 63.51 C ATOM 2415 CG PHE A 156 0.936 3.481 5.401 1.00 62.32 C ATOM 2416 CD1 PHE A 156 1.092 2.137 5.106 1.00 54.43 C ATOM 2417 CD2 PHE A 156 1.756 4.403 4.770 1.00 61.42 C ATOM 2418 CE1 PHE A 156 2.046 1.719 4.198 1.00 5.44 C ATOM 2419 CE2 PHE A 156 2.713 3.991 3.861 1.00 64.44 C ATOM 2420 CZ PHE A 156 2.858 2.647 3.575 1.00 14.35 C ATOM 0 H PHE A 156 -0.910 5.904 5.145 1.00 64.13 H new ATOM 0 HA PHE A 156 -1.648 3.174 5.098 1.00 45.31 H new ATOM 0 HB2 PHE A 156 0.172 4.913 6.770 1.00 63.51 H new ATOM 0 HB3 PHE A 156 -0.109 3.247 7.235 1.00 63.51 H new ATOM 0 HD1 PHE A 156 0.461 1.407 5.591 1.00 54.43 H new ATOM 0 HD2 PHE A 156 1.646 5.455 4.991 1.00 61.42 H new ATOM 0 HE1 PHE A 156 2.157 0.668 3.976 1.00 5.44 H new ATOM 0 HE2 PHE A 156 3.346 4.719 3.375 1.00 64.44 H new ATOM 0 HZ PHE A 156 3.605 2.322 2.866 1.00 14.35 H new ATOM 2430 N TYR A 157 -2.681 4.934 7.701 1.00 25.35 N ATOM 2431 CA TYR A 157 -3.643 4.946 8.799 1.00 14.14 C ATOM 2432 C TYR A 157 -5.049 4.637 8.292 1.00 0.01 C ATOM 2433 O TYR A 157 -5.862 4.052 9.008 1.00 70.21 O ATOM 2434 CB TYR A 157 -3.630 6.303 9.504 1.00 34.34 C ATOM 2435 CG TYR A 157 -2.381 6.554 10.319 1.00 22.40 C ATOM 2436 CD1 TYR A 157 -1.845 5.559 11.128 1.00 71.32 C ATOM 2437 CD2 TYR A 157 -1.738 7.785 10.280 1.00 62.23 C ATOM 2438 CE1 TYR A 157 -0.705 5.785 11.876 1.00 55.42 C ATOM 2439 CE2 TYR A 157 -0.597 8.018 11.024 1.00 23.11 C ATOM 2440 CZ TYR A 157 -0.085 7.016 11.820 1.00 33.25 C ATOM 2441 OH TYR A 157 1.051 7.244 12.563 1.00 1.00 O ATOM 0 H TYR A 157 -2.134 5.790 7.610 1.00 25.35 H new ATOM 0 HA TYR A 157 -3.353 4.173 9.511 1.00 14.14 H new ATOM 0 HB2 TYR A 157 -3.730 7.091 8.758 1.00 34.34 H new ATOM 0 HB3 TYR A 157 -4.499 6.371 10.158 1.00 34.34 H new ATOM 0 HD1 TYR A 157 -2.327 4.594 11.173 1.00 71.32 H new ATOM 0 HD2 TYR A 157 -2.136 8.573 9.658 1.00 62.23 H new ATOM 0 HE1 TYR A 157 -0.302 5.002 12.501 1.00 55.42 H new ATOM 0 HE2 TYR A 157 -0.109 8.980 10.982 1.00 23.11 H new ATOM 0 HH TYR A 157 1.364 8.160 12.410 1.00 1.00 H new ATOM 2451 N THR A 158 -5.326 5.030 7.052 1.00 13.24 N ATOM 2452 CA THR A 158 -6.628 4.794 6.446 1.00 1.21 C ATOM 2453 C THR A 158 -6.966 3.308 6.448 1.00 11.02 C ATOM 2454 O THR A 158 -8.106 2.920 6.708 1.00 55.01 O ATOM 2455 CB THR A 158 -6.644 5.332 5.016 1.00 52.31 C ATOM 2456 OG1 THR A 158 -6.018 6.601 4.950 1.00 4.04 O ATOM 2457 CG2 THR A 158 -8.037 5.478 4.449 1.00 21.52 C ATOM 0 H THR A 158 -4.662 5.515 6.448 1.00 13.24 H new ATOM 0 HA THR A 158 -7.381 5.318 7.035 1.00 1.21 H new ATOM 0 HB THR A 158 -6.103 4.594 4.424 1.00 52.31 H new ATOM 0 HG1 THR A 158 -5.064 6.506 5.155 1.00 4.04 H new ATOM 0 HG21 THR A 158 -7.977 5.864 3.432 1.00 21.52 H new ATOM 0 HG22 THR A 158 -8.530 4.506 4.440 1.00 21.52 H new ATOM 0 HG23 THR A 158 -8.610 6.169 5.066 1.00 21.52 H new ATOM 2465 N LEU A 159 -5.967 2.479 6.161 1.00 60.55 N ATOM 2466 CA LEU A 159 -6.156 1.033 6.134 1.00 52.45 C ATOM 2467 C LEU A 159 -6.689 0.534 7.473 1.00 41.15 C ATOM 2468 O LEU A 159 -7.655 -0.227 7.523 1.00 44.45 O ATOM 2469 CB LEU A 159 -4.837 0.332 5.800 1.00 13.21 C ATOM 2470 CG LEU A 159 -4.981 -1.015 5.089 1.00 33.25 C ATOM 2471 CD1 LEU A 159 -5.672 -2.025 5.991 1.00 22.34 C ATOM 2472 CD2 LEU A 159 -5.747 -0.850 3.785 1.00 51.04 C ATOM 0 H LEU A 159 -5.018 2.784 5.944 1.00 60.55 H new ATOM 0 HA LEU A 159 -6.888 0.798 5.361 1.00 52.45 H new ATOM 0 HB2 LEU A 159 -4.240 0.994 5.173 1.00 13.21 H new ATOM 0 HB3 LEU A 159 -4.280 0.180 6.724 1.00 13.21 H new ATOM 0 HG LEU A 159 -3.984 -1.390 4.857 1.00 33.25 H new ATOM 0 HD11 LEU A 159 -5.765 -2.977 5.467 1.00 22.34 H new ATOM 0 HD12 LEU A 159 -5.083 -2.166 6.898 1.00 22.34 H new ATOM 0 HD13 LEU A 159 -6.664 -1.658 6.256 1.00 22.34 H new ATOM 0 HD21 LEU A 159 -5.840 -1.818 3.293 1.00 51.04 H new ATOM 0 HD22 LEU A 159 -6.740 -0.452 3.994 1.00 51.04 H new ATOM 0 HD23 LEU A 159 -5.210 -0.161 3.133 1.00 51.04 H new ATOM 2484 N VAL A 160 -6.057 0.975 8.557 1.00 74.41 N ATOM 2485 CA VAL A 160 -6.468 0.579 9.900 1.00 31.35 C ATOM 2486 C VAL A 160 -7.957 0.837 10.118 1.00 72.32 C ATOM 2487 O VAL A 160 -8.649 0.042 10.753 1.00 63.11 O ATOM 2488 CB VAL A 160 -5.667 1.337 10.977 1.00 52.12 C ATOM 2489 CG1 VAL A 160 -6.000 0.813 12.366 1.00 30.21 C ATOM 2490 CG2 VAL A 160 -4.172 1.238 10.704 1.00 13.45 C ATOM 0 H VAL A 160 -5.257 1.608 8.531 1.00 74.41 H new ATOM 0 HA VAL A 160 -6.269 -0.489 9.990 1.00 31.35 H new ATOM 0 HB VAL A 160 -5.951 2.389 10.936 1.00 52.12 H new ATOM 0 HG11 VAL A 160 -5.423 1.362 13.110 1.00 30.21 H new ATOM 0 HG12 VAL A 160 -7.064 0.947 12.560 1.00 30.21 H new ATOM 0 HG13 VAL A 160 -5.752 -0.247 12.424 1.00 30.21 H new ATOM 0 HG21 VAL A 160 -3.625 1.780 11.475 1.00 13.45 H new ATOM 0 HG22 VAL A 160 -3.869 0.191 10.712 1.00 13.45 H new ATOM 0 HG23 VAL A 160 -3.951 1.673 9.729 1.00 13.45 H new ATOM 2500 N ARG A 161 -8.441 1.955 9.584 1.00 1.41 N ATOM 2501 CA ARG A 161 -9.847 2.319 9.718 1.00 52.13 C ATOM 2502 C ARG A 161 -10.725 1.422 8.852 1.00 30.13 C ATOM 2503 O ARG A 161 -11.860 1.113 9.212 1.00 31.54 O ATOM 2504 CB ARG A 161 -10.054 3.785 9.329 1.00 20.25 C ATOM 2505 CG ARG A 161 -9.884 4.752 10.490 1.00 32.21 C ATOM 2506 CD ARG A 161 -8.954 5.900 10.132 1.00 41.13 C ATOM 2507 NE ARG A 161 -8.230 6.403 11.297 1.00 54.22 N ATOM 2508 CZ ARG A 161 -8.760 7.222 12.202 1.00 34.01 C ATOM 2509 NH1 ARG A 161 -10.015 7.636 12.079 1.00 2.34 N ATOM 2510 NH2 ARG A 161 -8.033 7.630 13.233 1.00 33.21 N ATOM 0 H ARG A 161 -7.881 2.623 9.055 1.00 1.41 H new ATOM 0 HA ARG A 161 -10.136 2.182 10.760 1.00 52.13 H new ATOM 0 HB2 ARG A 161 -9.347 4.047 8.542 1.00 20.25 H new ATOM 0 HB3 ARG A 161 -11.054 3.904 8.911 1.00 20.25 H new ATOM 0 HG2 ARG A 161 -10.857 5.148 10.779 1.00 32.21 H new ATOM 0 HG3 ARG A 161 -9.488 4.218 11.354 1.00 32.21 H new ATOM 0 HD2 ARG A 161 -8.241 5.567 9.378 1.00 41.13 H new ATOM 0 HD3 ARG A 161 -9.533 6.710 9.687 1.00 41.13 H new ATOM 0 HE ARG A 161 -7.262 6.109 11.424 1.00 54.22 H new ATOM 0 HH11 ARG A 161 -10.579 7.326 11.287 1.00 2.34 H new ATOM 0 HH12 ARG A 161 -10.416 8.264 12.776 1.00 2.34 H new ATOM 0 HH21 ARG A 161 -7.068 7.316 13.332 1.00 33.21 H new ATOM 0 HH22 ARG A 161 -8.439 8.258 13.927 1.00 33.21 H new ATOM 2524 N GLU A 162 -10.190 1.006 7.708 1.00 5.03 N ATOM 2525 CA GLU A 162 -10.924 0.143 6.791 1.00 54.43 C ATOM 2526 C GLU A 162 -11.125 -1.243 7.395 1.00 63.15 C ATOM 2527 O GLU A 162 -12.215 -1.810 7.325 1.00 4.50 O ATOM 2528 CB GLU A 162 -10.182 0.030 5.458 1.00 24.32 C ATOM 2529 CG GLU A 162 -10.499 1.156 4.488 1.00 43.25 C ATOM 2530 CD GLU A 162 -11.916 1.084 3.954 1.00 52.14 C ATOM 2531 OE1 GLU A 162 -12.228 0.119 3.226 1.00 22.23 O ATOM 2532 OE2 GLU A 162 -12.714 1.994 4.265 1.00 31.02 O ATOM 0 H GLU A 162 -9.251 1.253 7.395 1.00 5.03 H new ATOM 0 HA GLU A 162 -11.903 0.589 6.615 1.00 54.43 H new ATOM 0 HB2 GLU A 162 -9.109 0.018 5.649 1.00 24.32 H new ATOM 0 HB3 GLU A 162 -10.434 -0.922 4.991 1.00 24.32 H new ATOM 0 HG2 GLU A 162 -10.351 2.113 4.988 1.00 43.25 H new ATOM 0 HG3 GLU A 162 -9.798 1.120 3.654 1.00 43.25 H new ATOM 2539 N ILE A 163 -10.066 -1.782 7.990 1.00 30.54 N ATOM 2540 CA ILE A 163 -10.120 -3.095 8.608 1.00 35.12 C ATOM 2541 C ILE A 163 -11.139 -3.124 9.743 1.00 32.51 C ATOM 2542 O ILE A 163 -11.938 -4.054 9.850 1.00 41.32 O ATOM 2543 CB ILE A 163 -8.742 -3.500 9.150 1.00 65.01 C ATOM 2544 CG1 ILE A 163 -7.698 -3.428 8.037 1.00 71.34 C ATOM 2545 CG2 ILE A 163 -8.795 -4.898 9.738 1.00 73.42 C ATOM 2546 CD1 ILE A 163 -6.330 -3.893 8.469 1.00 63.12 C ATOM 0 H ILE A 163 -9.157 -1.324 8.056 1.00 30.54 H new ATOM 0 HA ILE A 163 -10.425 -3.806 7.840 1.00 35.12 H new ATOM 0 HB ILE A 163 -8.458 -2.805 9.940 1.00 65.01 H new ATOM 0 HG12 ILE A 163 -8.032 -4.036 7.196 1.00 71.34 H new ATOM 0 HG13 ILE A 163 -7.629 -2.401 7.680 1.00 71.34 H new ATOM 0 HG21 ILE A 163 -7.810 -5.170 10.118 1.00 73.42 H new ATOM 0 HG22 ILE A 163 -9.518 -4.923 10.553 1.00 73.42 H new ATOM 0 HG23 ILE A 163 -9.095 -5.606 8.966 1.00 73.42 H new ATOM 0 HD11 ILE A 163 -5.638 -3.816 7.631 1.00 63.12 H new ATOM 0 HD12 ILE A 163 -5.976 -3.270 9.290 1.00 63.12 H new ATOM 0 HD13 ILE A 163 -6.386 -4.930 8.799 1.00 63.12 H new ATOM 2558 N ARG A 164 -11.102 -2.098 10.587 1.00 40.43 N ATOM 2559 CA ARG A 164 -12.021 -2.002 11.716 1.00 71.25 C ATOM 2560 C ARG A 164 -13.468 -1.966 11.235 1.00 4.40 C ATOM 2561 O ARG A 164 -14.363 -2.500 11.890 1.00 23.54 O ATOM 2562 CB ARG A 164 -11.716 -0.752 12.544 1.00 41.24 C ATOM 2563 CG ARG A 164 -10.731 -0.998 13.676 1.00 54.13 C ATOM 2564 CD ARG A 164 -10.391 0.290 14.408 1.00 72.41 C ATOM 2565 NE ARG A 164 -11.496 0.753 15.243 1.00 45.42 N ATOM 2566 CZ ARG A 164 -11.827 0.201 16.408 1.00 60.35 C ATOM 2567 NH1 ARG A 164 -11.141 -0.834 16.878 1.00 72.15 N ATOM 2568 NH2 ARG A 164 -12.846 0.684 17.105 1.00 71.50 N ATOM 0 H ARG A 164 -10.445 -1.321 10.511 1.00 40.43 H new ATOM 0 HA ARG A 164 -11.885 -2.885 12.341 1.00 71.25 H new ATOM 0 HB2 ARG A 164 -11.316 0.020 11.887 1.00 41.24 H new ATOM 0 HB3 ARG A 164 -12.646 -0.366 12.960 1.00 41.24 H new ATOM 0 HG2 ARG A 164 -11.154 -1.716 14.378 1.00 54.13 H new ATOM 0 HG3 ARG A 164 -9.819 -1.442 13.276 1.00 54.13 H new ATOM 0 HD2 ARG A 164 -9.509 0.132 15.029 1.00 72.41 H new ATOM 0 HD3 ARG A 164 -10.136 1.063 13.683 1.00 72.41 H new ATOM 0 HE ARG A 164 -12.047 1.546 14.914 1.00 45.42 H new ATOM 0 HH11 ARG A 164 -10.356 -1.210 16.346 1.00 72.15 H new ATOM 0 HH12 ARG A 164 -11.399 -1.253 17.771 1.00 72.15 H new ATOM 0 HH21 ARG A 164 -13.377 1.479 16.748 1.00 71.50 H new ATOM 0 HH22 ARG A 164 -13.099 0.261 17.998 1.00 71.50 H new ATOM 2582 N GLN A 165 -13.689 -1.334 10.087 1.00 51.41 N ATOM 2583 CA GLN A 165 -15.027 -1.229 9.519 1.00 13.03 C ATOM 2584 C GLN A 165 -15.260 -2.302 8.457 1.00 34.23 C ATOM 2585 O GLN A 165 -16.076 -2.126 7.553 1.00 15.33 O ATOM 2586 CB GLN A 165 -15.241 0.159 8.922 1.00 12.12 C ATOM 2587 CG GLN A 165 -14.468 0.373 7.644 1.00 52.12 C ATOM 2588 CD GLN A 165 -14.517 1.809 7.158 1.00 11.44 C ATOM 2589 OE1 GLN A 165 -15.207 2.126 6.189 1.00 61.35 O ATOM 2590 NE2 GLN A 165 -13.782 2.686 7.831 1.00 23.33 N ATOM 0 H GLN A 165 -12.959 -0.887 9.532 1.00 51.41 H new ATOM 0 HA GLN A 165 -15.748 -1.385 10.322 1.00 13.03 H new ATOM 0 HB2 GLN A 165 -16.303 0.306 8.727 1.00 12.12 H new ATOM 0 HB3 GLN A 165 -14.944 0.913 9.651 1.00 12.12 H new ATOM 0 HG2 GLN A 165 -13.429 0.083 7.801 1.00 52.12 H new ATOM 0 HG3 GLN A 165 -14.868 -0.281 6.869 1.00 52.12 H new ATOM 0 HE21 GLN A 165 -13.225 2.379 8.628 1.00 23.33 H new ATOM 0 HE22 GLN A 165 -13.774 3.667 7.551 1.00 23.33 H new ATOM 2599 N HIS A 166 -14.538 -3.414 8.573 1.00 62.34 N ATOM 2600 CA HIS A 166 -14.669 -4.512 7.622 1.00 20.22 C ATOM 2601 C HIS A 166 -16.109 -5.014 7.562 1.00 40.24 C ATOM 2602 O HIS A 166 -16.807 -4.931 8.594 1.00 34.01 O ATOM 2603 CB HIS A 166 -13.732 -5.660 8.005 1.00 51.23 C ATOM 2604 CG HIS A 166 -14.074 -6.304 9.313 1.00 40.13 C ATOM 2605 ND1 HIS A 166 -13.802 -5.721 10.534 1.00 62.32 N ATOM 2606 CD2 HIS A 166 -14.671 -7.488 9.589 1.00 63.44 C ATOM 2607 CE1 HIS A 166 -14.215 -6.519 11.502 1.00 1.12 C ATOM 2608 NE2 HIS A 166 -14.746 -7.597 10.956 1.00 11.11 N ATOM 2609 OXT HIS A 166 -16.526 -5.484 6.482 1.00 51.11 O ATOM 0 H HIS A 166 -13.858 -3.577 9.315 1.00 62.34 H new ATOM 0 HA HIS A 166 -14.393 -4.139 6.636 1.00 20.22 H new ATOM 0 HB2 HIS A 166 -13.758 -6.416 7.220 1.00 51.23 H new ATOM 0 HB3 HIS A 166 -12.710 -5.283 8.051 1.00 51.23 H new ATOM 0 HD1 HIS A 166 -13.352 -4.815 10.668 1.00 62.32 H new ATOM 0 HD2 HIS A 166 -15.023 -8.212 8.868 1.00 63.44 H new ATOM 0 HE1 HIS A 166 -14.132 -6.323 12.561 1.00 1.12 H new