USER MOD reduce.3.24.130724 H: found=0, std=0, add=1207, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1208 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 99 THR OG1 : rot 36:sc= 0.802 USER MOD Set 1.2: A 114 LYS NZ :NH3+ 176:sc= 0.681 (180deg=-0.265) USER MOD Set 2.1: A 77 MET CE :methyl 156:sc= -0.346 (180deg=-1.68!) USER MOD Set 2.2: A 111 MET CE :methyl 142:sc= -0.11 (180deg=-1.01) USER MOD Set 3.1: A 46 THR OG1 : rot 119:sc= 0.547 USER MOD Set 3.2: A 72 HIS : no HE2:sc= 0.948 K(o=1.5,f=-4.1!) USER MOD Set 4.1: A 33 ASN : amide:sc= -0.0337 K(o=-0.034,f=-1.2) USER MOD Set 4.2: A 39 THR OG1 : rot -170:sc= 0 USER MOD Set 5.1: A 35 MET CE :methyl -149:sc= -1.07 (180deg=-1.38) USER MOD Set 5.2: A 86 ASN : amide:sc= 0.0525 K(o=-1,f=-4.5) USER MOD Set 6.1: A 14 SER OG : rot 90:sc= 0.161 USER MOD Set 6.2: A 18 HIS : no HE2:sc= -3.02 X(o=-2.9,f=-3.2!) USER MOD Single : A 10 CYS SG : rot 180:sc= -0.0104 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.0342 USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 19 ASN : amide:sc= -2.96! C(o=-3!,f=-3.6!) USER MOD Single : A 23 TYR OH : rot 29:sc= 1.2 USER MOD Single : A 25 SER OG : rot -159:sc= 1.32 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN :FLIP amide:sc= -0.0118 F(o=-2!,f=-0.012) USER MOD Single : A 56 LYS NZ :NH3+ 161:sc= 1.24 (180deg=1.11) USER MOD Single : A 60 TYR OH : rot -119:sc= 1.04 USER MOD Single : A 62 CYS SG : rot 180:sc= -0.369 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -169:sc= -0.0292 (180deg=-0.254) USER MOD Single : A 80 THR OG1 : rot -82:sc= 0.53 USER MOD Single : A 81 SER OG : rot -74:sc= 0.777 USER MOD Single : A 93 ASN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 95 TYR OH : rot 130:sc= -0.956 USER MOD Single : A 107 ASN : amide:sc= -0.916 K(o=-0.92,f=-6.5!) USER MOD Single : A 108 SER OG : rot -28:sc= 0.715 USER MOD Single : A 110 LYS NZ :NH3+ 170:sc= -0.0144 (180deg=-0.146) USER MOD Single : A 115 THR OG1 : rot 72:sc= 0.644 USER MOD Single : A 116 TYR OH : rot -15:sc= 0 USER MOD Single : A 117 MET CE :methyl -137:sc= -1.49 (180deg=-4.74!) USER MOD Single : A 120 ASN : amide:sc= -0.439 X(o=-0.44,f=-0.031) USER MOD Single : A 121 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.15) USER MOD Single : A 126 MET CE :methyl 136:sc= 0 (180deg=-0.838) USER MOD Single : A 131 ASN : amide:sc= -0.0103 X(o=-0.01,f=0) USER MOD Single : A 136 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.122) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -171:sc= 1.3 (180deg=1.18) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -166:sc= 0.913 (180deg=0.516) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -165:sc= -0.0191 (180deg=-0.242) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= -0.033 X(o=-0.033,f=-0.46) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 10 -28.558 -10.027 -27.001 1.00 20.32 N ATOM 2 CA CYS A 10 -28.715 -9.026 -25.975 1.00 30.33 C ATOM 3 C CYS A 10 -27.916 -9.327 -24.703 1.00 51.25 C ATOM 4 O CYS A 10 -28.309 -10.139 -23.871 1.00 70.20 O ATOM 5 CB CYS A 10 -30.200 -8.780 -25.680 1.00 24.22 C ATOM 6 SG CYS A 10 -31.153 -10.264 -25.268 1.00 10.44 S ATOM 0 HA CYS A 10 -28.288 -8.103 -26.368 1.00 30.33 H new ATOM 0 HB2 CYS A 10 -30.279 -8.074 -24.853 1.00 24.22 H new ATOM 0 HB3 CYS A 10 -30.654 -8.304 -26.549 1.00 24.22 H new ATOM 0 HG CYS A 10 -32.389 -9.936 -25.037 1.00 10.44 H new ATOM 12 N SER A 11 -26.776 -8.697 -24.601 1.00 61.15 N ATOM 13 CA SER A 11 -25.917 -8.774 -23.440 1.00 2.13 C ATOM 14 C SER A 11 -25.312 -7.395 -23.208 1.00 13.41 C ATOM 15 O SER A 11 -24.328 -7.231 -22.480 1.00 65.11 O ATOM 16 CB SER A 11 -24.818 -9.811 -23.687 1.00 1.44 C ATOM 17 OG SER A 11 -24.111 -9.523 -24.892 1.00 50.30 O ATOM 0 H SER A 11 -26.406 -8.099 -25.340 1.00 61.15 H new ATOM 0 HA SER A 11 -26.482 -9.079 -22.559 1.00 2.13 H new ATOM 0 HB2 SER A 11 -24.124 -9.820 -22.846 1.00 1.44 H new ATOM 0 HB3 SER A 11 -25.258 -10.806 -23.747 1.00 1.44 H new ATOM 0 HG SER A 11 -23.412 -10.196 -25.030 1.00 50.30 H new ATOM 23 N SER A 12 -25.953 -6.403 -23.806 1.00 74.43 N ATOM 24 CA SER A 12 -25.507 -5.032 -23.780 1.00 41.02 C ATOM 25 C SER A 12 -25.696 -4.380 -22.407 1.00 32.31 C ATOM 26 O SER A 12 -25.059 -3.366 -22.097 1.00 21.35 O ATOM 27 CB SER A 12 -26.234 -4.269 -24.882 1.00 1.12 C ATOM 28 OG SER A 12 -27.637 -4.538 -24.833 1.00 14.11 O ATOM 0 H SER A 12 -26.816 -6.539 -24.333 1.00 74.43 H new ATOM 0 HA SER A 12 -24.433 -5.003 -23.964 1.00 41.02 H new ATOM 0 HB2 SER A 12 -26.058 -3.199 -24.769 1.00 1.12 H new ATOM 0 HB3 SER A 12 -25.836 -4.556 -25.855 1.00 1.12 H new ATOM 0 HG SER A 12 -28.091 -4.040 -25.545 1.00 14.11 H new ATOM 34 N ASP A 13 -26.561 -4.958 -21.597 1.00 73.54 N ATOM 35 CA ASP A 13 -26.784 -4.468 -20.243 1.00 73.32 C ATOM 36 C ASP A 13 -25.868 -5.200 -19.294 1.00 3.21 C ATOM 37 O ASP A 13 -25.084 -6.057 -19.716 1.00 42.21 O ATOM 38 CB ASP A 13 -28.242 -4.661 -19.789 1.00 11.21 C ATOM 39 CG ASP A 13 -29.241 -3.874 -20.592 1.00 13.11 C ATOM 40 OD1 ASP A 13 -29.365 -2.656 -20.382 1.00 73.22 O ATOM 41 OD2 ASP A 13 -29.937 -4.469 -21.430 1.00 4.31 O ATOM 0 H ASP A 13 -27.124 -5.770 -21.850 1.00 73.54 H new ATOM 0 HA ASP A 13 -26.573 -3.399 -20.237 1.00 73.32 H new ATOM 0 HB2 ASP A 13 -28.494 -5.720 -19.851 1.00 11.21 H new ATOM 0 HB3 ASP A 13 -28.327 -4.374 -18.741 1.00 11.21 H new ATOM 46 N SER A 14 -25.960 -4.890 -18.036 1.00 22.54 N ATOM 47 CA SER A 14 -25.154 -5.535 -17.056 1.00 61.13 C ATOM 48 C SER A 14 -25.960 -6.680 -16.427 1.00 44.41 C ATOM 49 O SER A 14 -26.793 -6.459 -15.551 1.00 50.24 O ATOM 50 CB SER A 14 -24.692 -4.509 -15.994 1.00 72.11 C ATOM 51 OG SER A 14 -23.766 -5.071 -15.072 1.00 73.45 O ATOM 0 H SER A 14 -26.596 -4.184 -17.665 1.00 22.54 H new ATOM 0 HA SER A 14 -24.259 -5.953 -17.516 1.00 61.13 H new ATOM 0 HB2 SER A 14 -24.233 -3.655 -16.492 1.00 72.11 H new ATOM 0 HB3 SER A 14 -25.560 -4.134 -15.452 1.00 72.11 H new ATOM 0 HG SER A 14 -22.854 -4.949 -15.409 1.00 73.45 H new ATOM 57 N LEU A 15 -25.766 -7.880 -16.932 1.00 53.41 N ATOM 58 CA LEU A 15 -26.427 -9.030 -16.435 1.00 71.11 C ATOM 59 C LEU A 15 -25.534 -9.814 -15.508 1.00 34.51 C ATOM 60 O LEU A 15 -24.369 -9.424 -15.282 1.00 42.12 O ATOM 61 CB LEU A 15 -26.881 -9.920 -17.562 1.00 13.23 C ATOM 62 CG LEU A 15 -28.013 -9.384 -18.417 1.00 72.31 C ATOM 63 CD1 LEU A 15 -27.544 -8.423 -19.486 1.00 1.14 C ATOM 64 CD2 LEU A 15 -28.834 -10.498 -18.949 1.00 44.41 C ATOM 0 H LEU A 15 -25.133 -8.068 -17.709 1.00 53.41 H new ATOM 0 HA LEU A 15 -27.299 -8.686 -15.878 1.00 71.11 H new ATOM 0 HB2 LEU A 15 -26.026 -10.119 -18.209 1.00 13.23 H new ATOM 0 HB3 LEU A 15 -27.191 -10.876 -17.141 1.00 13.23 H new ATOM 0 HG LEU A 15 -28.657 -8.783 -17.774 1.00 72.31 H new ATOM 0 HD11 LEU A 15 -28.400 -8.075 -20.064 1.00 1.14 H new ATOM 0 HD12 LEU A 15 -27.051 -7.571 -19.018 1.00 1.14 H new ATOM 0 HD13 LEU A 15 -26.842 -8.930 -20.148 1.00 1.14 H new ATOM 0 HD21 LEU A 15 -29.642 -10.095 -19.560 1.00 44.41 H new ATOM 0 HD22 LEU A 15 -28.209 -11.152 -19.558 1.00 44.41 H new ATOM 0 HD23 LEU A 15 -29.255 -11.067 -18.121 1.00 44.41 H new ATOM 76 N GLN A 16 -26.075 -10.923 -14.975 1.00 41.45 N ATOM 77 CA GLN A 16 -25.360 -11.841 -14.063 1.00 40.33 C ATOM 78 C GLN A 16 -25.067 -11.133 -12.747 1.00 41.03 C ATOM 79 O GLN A 16 -25.624 -10.063 -12.467 1.00 61.21 O ATOM 80 CB GLN A 16 -24.040 -12.338 -14.689 1.00 52.30 C ATOM 81 CG GLN A 16 -24.183 -12.990 -16.053 1.00 24.32 C ATOM 82 CD GLN A 16 -22.851 -13.455 -16.603 1.00 43.44 C ATOM 83 OE1 GLN A 16 -21.949 -13.831 -15.857 1.00 4.12 O ATOM 84 NE2 GLN A 16 -22.702 -13.395 -17.897 1.00 33.01 N ATOM 0 H GLN A 16 -27.034 -11.213 -15.166 1.00 41.45 H new ATOM 0 HA GLN A 16 -25.999 -12.706 -13.884 1.00 40.33 H new ATOM 0 HB2 GLN A 16 -23.356 -11.494 -14.776 1.00 52.30 H new ATOM 0 HB3 GLN A 16 -23.579 -13.053 -14.008 1.00 52.30 H new ATOM 0 HG2 GLN A 16 -24.861 -13.840 -15.979 1.00 24.32 H new ATOM 0 HG3 GLN A 16 -24.635 -12.282 -16.748 1.00 24.32 H new ATOM 0 HE21 GLN A 16 -23.473 -13.078 -18.485 1.00 33.01 H new ATOM 0 HE22 GLN A 16 -21.815 -13.665 -18.321 1.00 33.01 H new ATOM 93 N LEU A 17 -24.221 -11.710 -11.939 1.00 51.35 N ATOM 94 CA LEU A 17 -23.834 -11.067 -10.717 1.00 65.20 C ATOM 95 C LEU A 17 -22.770 -10.051 -11.041 1.00 4.41 C ATOM 96 O LEU A 17 -22.047 -10.183 -12.036 1.00 42.41 O ATOM 97 CB LEU A 17 -23.343 -12.061 -9.677 1.00 3.10 C ATOM 98 CG LEU A 17 -24.356 -13.113 -9.219 1.00 2.14 C ATOM 99 CD1 LEU A 17 -23.719 -14.077 -8.240 1.00 14.32 C ATOM 100 CD2 LEU A 17 -25.555 -12.440 -8.579 1.00 70.43 C ATOM 0 H LEU A 17 -23.789 -12.619 -12.104 1.00 51.35 H new ATOM 0 HA LEU A 17 -24.703 -10.577 -10.278 1.00 65.20 H new ATOM 0 HB2 LEU A 17 -22.472 -12.577 -10.080 1.00 3.10 H new ATOM 0 HB3 LEU A 17 -23.007 -11.504 -8.802 1.00 3.10 H new ATOM 0 HG LEU A 17 -24.687 -13.675 -10.092 1.00 2.14 H new ATOM 0 HD11 LEU A 17 -24.455 -14.817 -7.926 1.00 14.32 H new ATOM 0 HD12 LEU A 17 -22.880 -14.581 -8.719 1.00 14.32 H new ATOM 0 HD13 LEU A 17 -23.363 -13.528 -7.368 1.00 14.32 H new ATOM 0 HD21 LEU A 17 -26.269 -13.198 -8.257 1.00 70.43 H new ATOM 0 HD22 LEU A 17 -25.229 -11.859 -7.716 1.00 70.43 H new ATOM 0 HD23 LEU A 17 -26.030 -11.778 -9.303 1.00 70.43 H new ATOM 112 N HIS A 18 -22.670 -9.054 -10.238 1.00 64.23 N ATOM 113 CA HIS A 18 -21.837 -7.935 -10.552 1.00 71.00 C ATOM 114 C HIS A 18 -20.711 -7.853 -9.578 1.00 61.02 C ATOM 115 O HIS A 18 -20.775 -8.428 -8.484 1.00 2.24 O ATOM 116 CB HIS A 18 -22.646 -6.627 -10.475 1.00 34.11 C ATOM 117 CG HIS A 18 -23.969 -6.677 -11.167 1.00 15.11 C ATOM 118 ND1 HIS A 18 -24.188 -6.255 -12.449 1.00 22.55 N ATOM 119 CD2 HIS A 18 -25.157 -7.098 -10.706 1.00 71.10 C ATOM 120 CE1 HIS A 18 -25.457 -6.409 -12.749 1.00 51.43 C ATOM 121 NE2 HIS A 18 -26.073 -6.919 -11.709 1.00 71.31 N ATOM 0 H HIS A 18 -23.159 -8.984 -9.346 1.00 64.23 H new ATOM 0 HA HIS A 18 -21.451 -8.068 -11.562 1.00 71.00 H new ATOM 0 HB2 HIS A 18 -22.807 -6.375 -9.427 1.00 34.11 H new ATOM 0 HB3 HIS A 18 -22.053 -5.822 -10.909 1.00 34.11 H new ATOM 0 HD1 HIS A 18 -23.476 -5.879 -13.075 1.00 22.55 H new ATOM 0 HD2 HIS A 18 -25.355 -7.503 -9.725 1.00 71.10 H new ATOM 0 HE1 HIS A 18 -25.917 -6.158 -13.694 1.00 51.43 H new ATOM 130 N ASN A 19 -19.691 -7.172 -9.971 1.00 73.43 N ATOM 131 CA ASN A 19 -18.556 -6.951 -9.142 1.00 1.33 C ATOM 132 C ASN A 19 -18.190 -5.479 -9.123 1.00 44.22 C ATOM 133 O ASN A 19 -18.180 -4.803 -10.162 1.00 13.25 O ATOM 134 CB ASN A 19 -17.383 -7.894 -9.495 1.00 54.02 C ATOM 135 CG ASN A 19 -17.026 -7.951 -10.968 1.00 75.13 C ATOM 136 OD1 ASN A 19 -17.188 -6.997 -11.701 1.00 15.41 O ATOM 137 ND2 ASN A 19 -16.563 -9.101 -11.406 1.00 14.20 N ATOM 0 H ASN A 19 -19.620 -6.745 -10.895 1.00 73.43 H new ATOM 0 HA ASN A 19 -18.816 -7.214 -8.117 1.00 1.33 H new ATOM 0 HB2 ASN A 19 -16.502 -7.579 -8.935 1.00 54.02 H new ATOM 0 HB3 ASN A 19 -17.632 -8.900 -9.158 1.00 54.02 H new ATOM 0 HD21 ASN A 19 -16.327 -9.213 -12.392 1.00 14.20 H new ATOM 0 HD22 ASN A 19 -16.440 -9.881 -10.760 1.00 14.20 H new ATOM 144 N VAL A 20 -17.954 -4.974 -7.940 1.00 44.35 N ATOM 145 CA VAL A 20 -17.717 -3.561 -7.733 1.00 23.24 C ATOM 146 C VAL A 20 -16.430 -3.353 -6.950 1.00 42.10 C ATOM 147 O VAL A 20 -16.126 -4.116 -6.030 1.00 1.41 O ATOM 148 CB VAL A 20 -18.916 -2.903 -6.952 1.00 62.14 C ATOM 149 CG1 VAL A 20 -18.696 -1.411 -6.721 1.00 0.44 C ATOM 150 CG2 VAL A 20 -20.234 -3.128 -7.686 1.00 0.43 C ATOM 0 H VAL A 20 -17.920 -5.531 -7.086 1.00 44.35 H new ATOM 0 HA VAL A 20 -17.628 -3.086 -8.710 1.00 23.24 H new ATOM 0 HB VAL A 20 -18.965 -3.390 -5.978 1.00 62.14 H new ATOM 0 HG11 VAL A 20 -19.547 -0.997 -6.179 1.00 0.44 H new ATOM 0 HG12 VAL A 20 -17.787 -1.263 -6.137 1.00 0.44 H new ATOM 0 HG13 VAL A 20 -18.597 -0.905 -7.681 1.00 0.44 H new ATOM 0 HG21 VAL A 20 -21.046 -2.664 -7.126 1.00 0.43 H new ATOM 0 HG22 VAL A 20 -20.178 -2.683 -8.680 1.00 0.43 H new ATOM 0 HG23 VAL A 20 -20.421 -4.198 -7.778 1.00 0.43 H new ATOM 160 N PHE A 21 -15.682 -2.351 -7.330 1.00 54.45 N ATOM 161 CA PHE A 21 -14.458 -1.992 -6.656 1.00 0.41 C ATOM 162 C PHE A 21 -14.769 -0.908 -5.639 1.00 53.53 C ATOM 163 O PHE A 21 -15.293 0.160 -5.997 1.00 62.14 O ATOM 164 CB PHE A 21 -13.441 -1.490 -7.703 1.00 51.41 C ATOM 165 CG PHE A 21 -12.109 -1.013 -7.170 1.00 45.40 C ATOM 166 CD1 PHE A 21 -11.159 -1.915 -6.727 1.00 72.30 C ATOM 167 CD2 PHE A 21 -11.805 0.344 -7.133 1.00 73.32 C ATOM 168 CE1 PHE A 21 -9.941 -1.480 -6.257 1.00 34.14 C ATOM 169 CE2 PHE A 21 -10.585 0.782 -6.664 1.00 54.35 C ATOM 170 CZ PHE A 21 -9.652 -0.131 -6.226 1.00 71.33 C ATOM 0 H PHE A 21 -15.906 -1.753 -8.125 1.00 54.45 H new ATOM 0 HA PHE A 21 -14.030 -2.851 -6.139 1.00 0.41 H new ATOM 0 HB2 PHE A 21 -13.256 -2.296 -8.414 1.00 51.41 H new ATOM 0 HB3 PHE A 21 -13.899 -0.673 -8.260 1.00 51.41 H new ATOM 0 HD1 PHE A 21 -11.375 -2.973 -6.750 1.00 72.30 H new ATOM 0 HD2 PHE A 21 -12.534 1.063 -7.476 1.00 73.32 H new ATOM 0 HE1 PHE A 21 -9.210 -2.196 -5.912 1.00 34.14 H new ATOM 0 HE2 PHE A 21 -10.362 1.838 -6.640 1.00 54.35 H new ATOM 0 HZ PHE A 21 -8.695 0.208 -5.859 1.00 71.33 H new ATOM 180 N VAL A 22 -14.455 -1.171 -4.392 1.00 32.53 N ATOM 181 CA VAL A 22 -14.721 -0.224 -3.331 1.00 63.20 C ATOM 182 C VAL A 22 -13.574 0.744 -3.178 1.00 73.01 C ATOM 183 O VAL A 22 -12.406 0.373 -3.316 1.00 65.53 O ATOM 184 CB VAL A 22 -15.095 -0.895 -1.993 1.00 42.41 C ATOM 185 CG1 VAL A 22 -16.406 -1.649 -2.149 1.00 53.44 C ATOM 186 CG2 VAL A 22 -13.995 -1.835 -1.519 1.00 72.41 C ATOM 0 H VAL A 22 -14.013 -2.037 -4.085 1.00 32.53 H new ATOM 0 HA VAL A 22 -15.605 0.340 -3.628 1.00 63.20 H new ATOM 0 HB VAL A 22 -15.213 -0.117 -1.238 1.00 42.41 H new ATOM 0 HG11 VAL A 22 -16.668 -2.122 -1.203 1.00 53.44 H new ATOM 0 HG12 VAL A 22 -17.194 -0.953 -2.437 1.00 53.44 H new ATOM 0 HG13 VAL A 22 -16.297 -2.413 -2.919 1.00 53.44 H new ATOM 0 HG21 VAL A 22 -14.289 -2.292 -0.574 1.00 72.41 H new ATOM 0 HG22 VAL A 22 -13.836 -2.614 -2.265 1.00 72.41 H new ATOM 0 HG23 VAL A 22 -13.072 -1.273 -1.379 1.00 72.41 H new ATOM 196 N TYR A 23 -13.904 1.976 -2.885 1.00 33.21 N ATOM 197 CA TYR A 23 -12.928 3.031 -2.951 1.00 1.01 C ATOM 198 C TYR A 23 -12.718 3.802 -1.640 1.00 52.22 C ATOM 199 O TYR A 23 -11.869 4.704 -1.579 1.00 65.44 O ATOM 200 CB TYR A 23 -13.334 3.980 -4.070 1.00 53.52 C ATOM 201 CG TYR A 23 -14.659 4.722 -3.875 1.00 53.43 C ATOM 202 CD1 TYR A 23 -15.890 4.075 -3.994 1.00 51.43 C ATOM 203 CD2 TYR A 23 -14.665 6.076 -3.589 1.00 54.03 C ATOM 204 CE1 TYR A 23 -17.078 4.767 -3.822 1.00 74.11 C ATOM 205 CE2 TYR A 23 -15.842 6.767 -3.417 1.00 61.43 C ATOM 206 CZ TYR A 23 -17.043 6.116 -3.534 1.00 13.10 C ATOM 207 OH TYR A 23 -18.211 6.819 -3.354 1.00 3.22 O ATOM 0 H TYR A 23 -14.838 2.272 -2.600 1.00 33.21 H new ATOM 0 HA TYR A 23 -11.963 2.563 -3.148 1.00 1.01 H new ATOM 0 HB2 TYR A 23 -12.543 4.719 -4.198 1.00 53.52 H new ATOM 0 HB3 TYR A 23 -13.392 3.411 -4.998 1.00 53.52 H new ATOM 0 HD1 TYR A 23 -15.917 3.020 -4.223 1.00 51.43 H new ATOM 0 HD2 TYR A 23 -13.726 6.601 -3.499 1.00 54.03 H new ATOM 0 HE1 TYR A 23 -18.024 4.254 -3.913 1.00 74.11 H new ATOM 0 HE2 TYR A 23 -15.820 7.823 -3.190 1.00 61.43 H new ATOM 0 HH TYR A 23 -18.904 6.219 -3.007 1.00 3.22 H new ATOM 217 N GLY A 24 -13.458 3.466 -0.608 1.00 54.54 N ATOM 218 CA GLY A 24 -13.300 4.185 0.646 1.00 55.14 C ATOM 219 C GLY A 24 -14.475 4.000 1.569 1.00 42.24 C ATOM 220 O GLY A 24 -14.364 3.335 2.595 1.00 1.03 O ATOM 0 H GLY A 24 -14.157 2.723 -0.603 1.00 54.54 H new ATOM 0 HA2 GLY A 24 -12.393 3.844 1.145 1.00 55.14 H new ATOM 0 HA3 GLY A 24 -13.169 5.247 0.438 1.00 55.14 H new ATOM 224 N SER A 25 -15.604 4.534 1.177 1.00 23.01 N ATOM 225 CA SER A 25 -16.826 4.487 1.968 1.00 34.20 C ATOM 226 C SER A 25 -17.245 3.048 2.277 1.00 72.42 C ATOM 227 O SER A 25 -17.768 2.755 3.344 1.00 34.21 O ATOM 228 CB SER A 25 -17.923 5.208 1.194 1.00 74.33 C ATOM 229 OG SER A 25 -18.021 4.680 -0.128 1.00 63.13 O ATOM 0 H SER A 25 -15.711 5.023 0.288 1.00 23.01 H new ATOM 0 HA SER A 25 -16.652 4.978 2.926 1.00 34.20 H new ATOM 0 HB2 SER A 25 -18.876 5.096 1.710 1.00 74.33 H new ATOM 0 HB3 SER A 25 -17.707 6.276 1.152 1.00 74.33 H new ATOM 0 HG SER A 25 -18.465 5.332 -0.709 1.00 63.13 H new ATOM 235 N PHE A 26 -17.001 2.165 1.342 1.00 23.22 N ATOM 236 CA PHE A 26 -17.326 0.771 1.515 1.00 34.32 C ATOM 237 C PHE A 26 -16.070 -0.083 1.436 1.00 41.01 C ATOM 238 O PHE A 26 -16.135 -1.257 1.135 1.00 33.55 O ATOM 239 CB PHE A 26 -18.329 0.327 0.452 1.00 10.35 C ATOM 240 CG PHE A 26 -19.630 1.083 0.471 1.00 24.20 C ATOM 241 CD1 PHE A 26 -20.324 1.269 1.655 1.00 32.43 C ATOM 242 CD2 PHE A 26 -20.162 1.598 -0.694 1.00 40.24 C ATOM 243 CE1 PHE A 26 -21.514 1.958 1.675 1.00 4.04 C ATOM 244 CE2 PHE A 26 -21.358 2.286 -0.679 1.00 51.34 C ATOM 245 CZ PHE A 26 -22.033 2.468 0.506 1.00 31.01 C ATOM 0 H PHE A 26 -16.574 2.390 0.444 1.00 23.22 H new ATOM 0 HA PHE A 26 -17.774 0.641 2.500 1.00 34.32 H new ATOM 0 HB2 PHE A 26 -17.872 0.439 -0.531 1.00 10.35 H new ATOM 0 HB3 PHE A 26 -18.537 -0.734 0.587 1.00 10.35 H new ATOM 0 HD1 PHE A 26 -19.925 0.868 2.575 1.00 32.43 H new ATOM 0 HD2 PHE A 26 -19.636 1.461 -1.627 1.00 40.24 H new ATOM 0 HE1 PHE A 26 -22.041 2.099 2.607 1.00 4.04 H new ATOM 0 HE2 PHE A 26 -21.764 2.682 -1.598 1.00 51.34 H new ATOM 0 HZ PHE A 26 -22.967 3.009 0.519 1.00 31.01 H new ATOM 255 N GLN A 27 -14.932 0.504 1.792 1.00 65.23 N ATOM 256 CA GLN A 27 -13.629 -0.169 1.714 1.00 34.53 C ATOM 257 C GLN A 27 -13.430 -1.136 2.924 1.00 22.15 C ATOM 258 O GLN A 27 -12.326 -1.629 3.195 1.00 4.32 O ATOM 259 CB GLN A 27 -12.533 0.915 1.613 1.00 4.13 C ATOM 260 CG GLN A 27 -11.110 0.427 1.459 1.00 63.44 C ATOM 261 CD GLN A 27 -10.131 1.570 1.230 1.00 1.22 C ATOM 262 OE1 GLN A 27 -9.850 1.944 0.092 1.00 71.20 O ATOM 263 NE2 GLN A 27 -9.645 2.152 2.295 1.00 54.21 N ATOM 0 H GLN A 27 -14.881 1.460 2.144 1.00 65.23 H new ATOM 0 HA GLN A 27 -13.570 -0.799 0.826 1.00 34.53 H new ATOM 0 HB2 GLN A 27 -12.767 1.557 0.764 1.00 4.13 H new ATOM 0 HB3 GLN A 27 -12.585 1.537 2.507 1.00 4.13 H new ATOM 0 HG2 GLN A 27 -10.818 -0.125 2.352 1.00 63.44 H new ATOM 0 HG3 GLN A 27 -11.055 -0.269 0.622 1.00 63.44 H new ATOM 0 HE21 GLN A 27 -9.901 1.814 3.223 1.00 54.21 H new ATOM 0 HE22 GLN A 27 -9.010 2.944 2.198 1.00 54.21 H new ATOM 272 N ASP A 28 -14.517 -1.424 3.594 1.00 35.14 N ATOM 273 CA ASP A 28 -14.544 -2.322 4.725 1.00 10.23 C ATOM 274 C ASP A 28 -15.784 -3.211 4.604 1.00 51.34 C ATOM 275 O ASP A 28 -16.896 -2.698 4.401 1.00 1.44 O ATOM 276 CB ASP A 28 -14.587 -1.534 6.034 1.00 71.53 C ATOM 277 CG ASP A 28 -14.601 -2.428 7.251 1.00 1.21 C ATOM 278 OD1 ASP A 28 -15.686 -2.808 7.707 1.00 54.13 O ATOM 279 OD2 ASP A 28 -13.512 -2.751 7.772 1.00 2.20 O ATOM 0 H ASP A 28 -15.430 -1.032 3.364 1.00 35.14 H new ATOM 0 HA ASP A 28 -13.642 -2.934 4.731 1.00 10.23 H new ATOM 0 HB2 ASP A 28 -13.722 -0.872 6.084 1.00 71.53 H new ATOM 0 HB3 ASP A 28 -15.474 -0.900 6.043 1.00 71.53 H new ATOM 284 N PRO A 29 -15.620 -4.543 4.700 1.00 4.14 N ATOM 285 CA PRO A 29 -16.724 -5.493 4.532 1.00 50.52 C ATOM 286 C PRO A 29 -17.848 -5.340 5.551 1.00 73.15 C ATOM 287 O PRO A 29 -19.004 -5.593 5.233 1.00 1.35 O ATOM 288 CB PRO A 29 -16.077 -6.860 4.684 1.00 72.23 C ATOM 289 CG PRO A 29 -14.781 -6.612 5.363 1.00 64.24 C ATOM 290 CD PRO A 29 -14.346 -5.236 4.953 1.00 33.13 C ATOM 0 HA PRO A 29 -17.206 -5.328 3.568 1.00 50.52 H new ATOM 0 HB2 PRO A 29 -16.706 -7.529 5.271 1.00 72.23 H new ATOM 0 HB3 PRO A 29 -15.927 -7.333 3.714 1.00 72.23 H new ATOM 0 HG2 PRO A 29 -14.890 -6.679 6.445 1.00 64.24 H new ATOM 0 HG3 PRO A 29 -14.041 -7.357 5.071 1.00 64.24 H new ATOM 0 HD2 PRO A 29 -13.769 -4.745 5.737 1.00 33.13 H new ATOM 0 HD3 PRO A 29 -13.717 -5.261 4.063 1.00 33.13 H new ATOM 298 N ASP A 30 -17.521 -4.912 6.761 1.00 30.52 N ATOM 299 CA ASP A 30 -18.531 -4.773 7.817 1.00 21.43 C ATOM 300 C ASP A 30 -19.485 -3.650 7.465 1.00 20.31 C ATOM 301 O ASP A 30 -20.699 -3.749 7.676 1.00 65.53 O ATOM 302 CB ASP A 30 -17.869 -4.494 9.162 1.00 1.12 C ATOM 303 CG ASP A 30 -18.861 -4.315 10.286 1.00 23.15 C ATOM 304 OD1 ASP A 30 -19.290 -5.329 10.869 1.00 72.21 O ATOM 305 OD2 ASP A 30 -19.201 -3.167 10.626 1.00 22.03 O ATOM 0 H ASP A 30 -16.575 -4.655 7.042 1.00 30.52 H new ATOM 0 HA ASP A 30 -19.086 -5.708 7.896 1.00 21.43 H new ATOM 0 HB2 ASP A 30 -17.197 -5.316 9.407 1.00 1.12 H new ATOM 0 HB3 ASP A 30 -17.257 -3.596 9.079 1.00 1.12 H new ATOM 310 N VAL A 31 -18.930 -2.603 6.888 1.00 72.21 N ATOM 311 CA VAL A 31 -19.715 -1.465 6.439 1.00 13.11 C ATOM 312 C VAL A 31 -20.656 -1.906 5.314 1.00 74.11 C ATOM 313 O VAL A 31 -21.820 -1.487 5.260 1.00 13.51 O ATOM 314 CB VAL A 31 -18.806 -0.309 5.947 1.00 41.45 C ATOM 315 CG1 VAL A 31 -19.635 0.883 5.491 1.00 74.14 C ATOM 316 CG2 VAL A 31 -17.834 0.106 7.040 1.00 60.54 C ATOM 0 H VAL A 31 -17.928 -2.515 6.717 1.00 72.21 H new ATOM 0 HA VAL A 31 -20.297 -1.095 7.283 1.00 13.11 H new ATOM 0 HB VAL A 31 -18.235 -0.670 5.092 1.00 41.45 H new ATOM 0 HG11 VAL A 31 -18.972 1.679 5.151 1.00 74.14 H new ATOM 0 HG12 VAL A 31 -20.288 0.580 4.672 1.00 74.14 H new ATOM 0 HG13 VAL A 31 -20.240 1.245 6.322 1.00 74.14 H new ATOM 0 HG21 VAL A 31 -17.204 0.918 6.677 1.00 60.54 H new ATOM 0 HG22 VAL A 31 -18.391 0.442 7.914 1.00 60.54 H new ATOM 0 HG23 VAL A 31 -17.209 -0.744 7.313 1.00 60.54 H new ATOM 326 N ILE A 32 -20.149 -2.781 4.441 1.00 24.55 N ATOM 327 CA ILE A 32 -20.926 -3.356 3.356 1.00 43.40 C ATOM 328 C ILE A 32 -22.069 -4.167 3.916 1.00 43.31 C ATOM 329 O ILE A 32 -23.234 -3.979 3.572 1.00 10.24 O ATOM 330 CB ILE A 32 -19.995 -4.279 2.500 1.00 40.42 C ATOM 331 CG1 ILE A 32 -19.160 -3.483 1.493 1.00 22.05 C ATOM 332 CG2 ILE A 32 -20.713 -5.474 1.859 1.00 54.52 C ATOM 333 CD1 ILE A 32 -19.997 -2.764 0.442 1.00 4.42 C ATOM 0 H ILE A 32 -19.183 -3.107 4.473 1.00 24.55 H new ATOM 0 HA ILE A 32 -21.332 -2.559 2.733 1.00 43.40 H new ATOM 0 HB ILE A 32 -19.299 -4.724 3.211 1.00 40.42 H new ATOM 0 HG12 ILE A 32 -18.559 -2.750 2.031 1.00 22.05 H new ATOM 0 HG13 ILE A 32 -18.466 -4.159 0.993 1.00 22.05 H new ATOM 0 HG21 ILE A 32 -19.998 -6.062 1.284 1.00 54.52 H new ATOM 0 HG22 ILE A 32 -21.151 -6.097 2.639 1.00 54.52 H new ATOM 0 HG23 ILE A 32 -21.501 -5.113 1.198 1.00 54.52 H new ATOM 0 HD11 ILE A 32 -19.340 -2.221 -0.237 1.00 4.42 H new ATOM 0 HD12 ILE A 32 -20.579 -3.494 -0.122 1.00 4.42 H new ATOM 0 HD13 ILE A 32 -20.672 -2.062 0.932 1.00 4.42 H new ATOM 345 N ASN A 33 -21.704 -5.004 4.807 1.00 64.03 N ATOM 346 CA ASN A 33 -22.538 -5.984 5.419 1.00 41.21 C ATOM 347 C ASN A 33 -23.797 -5.355 6.024 1.00 45.33 C ATOM 348 O ASN A 33 -24.911 -5.864 5.853 1.00 74.13 O ATOM 349 CB ASN A 33 -21.673 -6.629 6.466 1.00 11.30 C ATOM 350 CG ASN A 33 -22.151 -7.921 6.962 1.00 33.35 C ATOM 351 OD1 ASN A 33 -23.331 -8.175 7.107 1.00 70.13 O ATOM 352 ND2 ASN A 33 -21.219 -8.777 7.172 1.00 54.22 N ATOM 0 H ASN A 33 -20.747 -5.032 5.159 1.00 64.03 H new ATOM 0 HA ASN A 33 -22.907 -6.713 4.698 1.00 41.21 H new ATOM 0 HB2 ASN A 33 -20.672 -6.764 6.055 1.00 11.30 H new ATOM 0 HB3 ASN A 33 -21.582 -5.945 7.310 1.00 11.30 H new ATOM 0 HD21 ASN A 33 -21.454 -9.722 7.476 1.00 54.22 H new ATOM 0 HD22 ASN A 33 -20.243 -8.513 7.035 1.00 54.22 H new ATOM 359 N VAL A 34 -23.617 -4.247 6.692 1.00 24.01 N ATOM 360 CA VAL A 34 -24.723 -3.548 7.310 1.00 52.52 C ATOM 361 C VAL A 34 -25.487 -2.664 6.296 1.00 32.31 C ATOM 362 O VAL A 34 -26.705 -2.501 6.401 1.00 61.31 O ATOM 363 CB VAL A 34 -24.241 -2.683 8.511 1.00 3.33 C ATOM 364 CG1 VAL A 34 -25.403 -1.988 9.210 1.00 14.03 C ATOM 365 CG2 VAL A 34 -23.450 -3.526 9.500 1.00 11.21 C ATOM 0 H VAL A 34 -22.709 -3.802 6.825 1.00 24.01 H new ATOM 0 HA VAL A 34 -25.410 -4.310 7.678 1.00 52.52 H new ATOM 0 HB VAL A 34 -23.587 -1.908 8.111 1.00 3.33 H new ATOM 0 HG11 VAL A 34 -25.025 -1.395 10.042 1.00 14.03 H new ATOM 0 HG12 VAL A 34 -25.916 -1.336 8.503 1.00 14.03 H new ATOM 0 HG13 VAL A 34 -26.101 -2.736 9.586 1.00 14.03 H new ATOM 0 HG21 VAL A 34 -23.123 -2.901 10.331 1.00 11.21 H new ATOM 0 HG22 VAL A 34 -24.080 -4.331 9.878 1.00 11.21 H new ATOM 0 HG23 VAL A 34 -22.579 -3.951 9.001 1.00 11.21 H new ATOM 375 N MET A 35 -24.778 -2.118 5.307 1.00 0.31 N ATOM 376 CA MET A 35 -25.385 -1.163 4.386 1.00 24.34 C ATOM 377 C MET A 35 -26.386 -1.864 3.456 1.00 62.23 C ATOM 378 O MET A 35 -27.456 -1.332 3.172 1.00 3.52 O ATOM 379 CB MET A 35 -24.272 -0.474 3.566 1.00 43.41 C ATOM 380 CG MET A 35 -24.647 0.851 2.886 1.00 30.50 C ATOM 381 SD MET A 35 -25.923 0.768 1.606 1.00 64.52 S ATOM 382 CE MET A 35 -25.099 -0.235 0.385 1.00 62.34 C ATOM 0 H MET A 35 -23.794 -2.319 5.126 1.00 0.31 H new ATOM 0 HA MET A 35 -25.932 -0.412 4.956 1.00 24.34 H new ATOM 0 HB2 MET A 35 -23.424 -0.291 4.226 1.00 43.41 H new ATOM 0 HB3 MET A 35 -23.934 -1.169 2.797 1.00 43.41 H new ATOM 0 HG2 MET A 35 -24.980 1.547 3.656 1.00 30.50 H new ATOM 0 HG3 MET A 35 -23.746 1.274 2.442 1.00 30.50 H new ATOM 0 HE1 MET A 35 -25.442 0.049 -0.610 1.00 62.34 H new ATOM 0 HE2 MET A 35 -24.022 -0.082 0.455 1.00 62.34 H new ATOM 0 HE3 MET A 35 -25.329 -1.286 0.562 1.00 62.34 H new ATOM 392 N LEU A 36 -26.078 -3.074 3.032 1.00 30.40 N ATOM 393 CA LEU A 36 -26.996 -3.786 2.165 1.00 70.15 C ATOM 394 C LEU A 36 -27.671 -4.964 2.834 1.00 24.45 C ATOM 395 O LEU A 36 -28.855 -4.881 3.160 1.00 25.45 O ATOM 396 CB LEU A 36 -26.440 -4.139 0.742 1.00 74.45 C ATOM 397 CG LEU A 36 -25.037 -4.773 0.624 1.00 22.34 C ATOM 398 CD1 LEU A 36 -24.889 -5.448 -0.721 1.00 71.55 C ATOM 399 CD2 LEU A 36 -23.985 -3.689 0.699 1.00 33.41 C ATOM 0 H LEU A 36 -25.221 -3.575 3.266 1.00 30.40 H new ATOM 0 HA LEU A 36 -27.776 -3.049 1.974 1.00 70.15 H new ATOM 0 HB2 LEU A 36 -27.149 -4.819 0.271 1.00 74.45 H new ATOM 0 HB3 LEU A 36 -26.438 -3.222 0.153 1.00 74.45 H new ATOM 0 HG LEU A 36 -24.915 -5.494 1.432 1.00 22.34 H new ATOM 0 HD11 LEU A 36 -23.897 -5.893 -0.798 1.00 71.55 H new ATOM 0 HD12 LEU A 36 -25.645 -6.227 -0.822 1.00 71.55 H new ATOM 0 HD13 LEU A 36 -25.018 -4.711 -1.514 1.00 71.55 H new ATOM 0 HD21 LEU A 36 -22.995 -4.137 0.616 1.00 33.41 H new ATOM 0 HD22 LEU A 36 -24.133 -2.981 -0.117 1.00 33.41 H new ATOM 0 HD23 LEU A 36 -24.068 -3.167 1.652 1.00 33.41 H new ATOM 411 N ASP A 37 -26.920 -6.036 3.078 1.00 3.40 N ATOM 412 CA ASP A 37 -27.486 -7.286 3.632 1.00 51.41 C ATOM 413 C ASP A 37 -26.415 -8.343 3.707 1.00 25.04 C ATOM 414 O ASP A 37 -26.271 -9.032 4.710 1.00 73.01 O ATOM 415 CB ASP A 37 -28.651 -7.807 2.748 1.00 31.50 C ATOM 416 CG ASP A 37 -29.259 -9.114 3.237 1.00 70.31 C ATOM 417 OD1 ASP A 37 -29.979 -9.109 4.251 1.00 25.14 O ATOM 418 OD2 ASP A 37 -29.072 -10.157 2.574 1.00 54.05 O ATOM 0 H ASP A 37 -25.916 -6.074 2.904 1.00 3.40 H new ATOM 0 HA ASP A 37 -27.869 -7.071 4.630 1.00 51.41 H new ATOM 0 HB2 ASP A 37 -29.431 -7.047 2.708 1.00 31.50 H new ATOM 0 HB3 ASP A 37 -28.288 -7.945 1.730 1.00 31.50 H new ATOM 423 N ARG A 38 -25.655 -8.454 2.644 1.00 22.30 N ATOM 424 CA ARG A 38 -24.606 -9.450 2.558 1.00 14.23 C ATOM 425 C ARG A 38 -23.283 -8.768 2.346 1.00 11.43 C ATOM 426 O ARG A 38 -23.222 -7.548 2.212 1.00 62.04 O ATOM 427 CB ARG A 38 -24.828 -10.356 1.351 1.00 71.13 C ATOM 428 CG ARG A 38 -26.161 -11.056 1.276 1.00 73.33 C ATOM 429 CD ARG A 38 -26.221 -11.917 0.029 1.00 10.51 C ATOM 430 NE ARG A 38 -25.989 -11.128 -1.199 1.00 4.11 N ATOM 431 CZ ARG A 38 -25.482 -11.621 -2.335 1.00 55.44 C ATOM 432 NH1 ARG A 38 -25.095 -12.884 -2.411 1.00 60.23 N ATOM 433 NH2 ARG A 38 -25.350 -10.844 -3.386 1.00 62.43 N ATOM 0 H ARG A 38 -25.742 -7.862 1.818 1.00 22.30 H new ATOM 0 HA ARG A 38 -24.617 -10.029 3.482 1.00 14.23 H new ATOM 0 HB2 ARG A 38 -24.704 -9.759 0.448 1.00 71.13 H new ATOM 0 HB3 ARG A 38 -24.044 -11.113 1.343 1.00 71.13 H new ATOM 0 HG2 ARG A 38 -26.308 -11.673 2.162 1.00 73.33 H new ATOM 0 HG3 ARG A 38 -26.967 -10.322 1.261 1.00 73.33 H new ATOM 0 HD2 ARG A 38 -25.474 -12.708 0.098 1.00 10.51 H new ATOM 0 HD3 ARG A 38 -27.195 -12.402 -0.030 1.00 10.51 H new ATOM 0 HE ARG A 38 -26.233 -10.138 -1.179 1.00 4.11 H new ATOM 0 HH11 ARG A 38 -25.182 -13.494 -1.598 1.00 60.23 H new ATOM 0 HH12 ARG A 38 -24.710 -13.248 -3.283 1.00 60.23 H new ATOM 0 HH21 ARG A 38 -25.634 -9.866 -3.336 1.00 62.43 H new ATOM 0 HH22 ARG A 38 -24.964 -11.219 -4.252 1.00 62.43 H new ATOM 447 N THR A 39 -22.235 -9.545 2.327 1.00 23.44 N ATOM 448 CA THR A 39 -20.946 -9.076 1.940 1.00 4.33 C ATOM 449 C THR A 39 -20.491 -9.957 0.780 1.00 14.01 C ATOM 450 O THR A 39 -20.118 -11.120 0.992 1.00 72.21 O ATOM 451 CB THR A 39 -19.932 -9.200 3.085 1.00 54.42 C ATOM 452 OG1 THR A 39 -20.538 -8.714 4.274 1.00 30.13 O ATOM 453 CG2 THR A 39 -18.699 -8.343 2.800 1.00 1.41 C ATOM 0 H THR A 39 -22.259 -10.532 2.584 1.00 23.44 H new ATOM 0 HA THR A 39 -21.004 -8.023 1.665 1.00 4.33 H new ATOM 0 HB THR A 39 -19.634 -10.244 3.186 1.00 54.42 H new ATOM 0 HG1 THR A 39 -19.861 -8.637 4.978 1.00 30.13 H new ATOM 0 HG21 THR A 39 -17.989 -8.442 3.621 1.00 1.41 H new ATOM 0 HG22 THR A 39 -18.231 -8.676 1.874 1.00 1.41 H new ATOM 0 HG23 THR A 39 -18.996 -7.299 2.701 1.00 1.41 H new ATOM 461 N PRO A 40 -20.613 -9.465 -0.455 1.00 50.14 N ATOM 462 CA PRO A 40 -20.197 -10.205 -1.650 1.00 65.04 C ATOM 463 C PRO A 40 -18.708 -10.569 -1.603 1.00 31.34 C ATOM 464 O PRO A 40 -17.913 -9.867 -0.969 1.00 32.22 O ATOM 465 CB PRO A 40 -20.511 -9.253 -2.805 1.00 1.01 C ATOM 466 CG PRO A 40 -21.507 -8.298 -2.252 1.00 32.34 C ATOM 467 CD PRO A 40 -21.176 -8.151 -0.799 1.00 62.05 C ATOM 0 HA PRO A 40 -20.714 -11.160 -1.747 1.00 65.04 H new ATOM 0 HB2 PRO A 40 -19.614 -8.736 -3.146 1.00 1.01 H new ATOM 0 HB3 PRO A 40 -20.914 -9.792 -3.663 1.00 1.01 H new ATOM 0 HG2 PRO A 40 -21.452 -7.337 -2.764 1.00 32.34 H new ATOM 0 HG3 PRO A 40 -22.522 -8.672 -2.385 1.00 32.34 H new ATOM 0 HD2 PRO A 40 -20.460 -7.347 -0.627 1.00 62.05 H new ATOM 0 HD3 PRO A 40 -22.060 -7.922 -0.204 1.00 62.05 H new ATOM 475 N GLU A 41 -18.356 -11.667 -2.260 1.00 71.52 N ATOM 476 CA GLU A 41 -17.008 -12.229 -2.227 1.00 21.04 C ATOM 477 C GLU A 41 -15.974 -11.205 -2.677 1.00 45.44 C ATOM 478 O GLU A 41 -16.044 -10.666 -3.781 1.00 42.41 O ATOM 479 CB GLU A 41 -16.938 -13.485 -3.086 1.00 42.41 C ATOM 480 CG GLU A 41 -15.596 -14.189 -3.042 1.00 25.23 C ATOM 481 CD GLU A 41 -15.591 -15.457 -3.839 1.00 61.52 C ATOM 482 OE1 GLU A 41 -16.078 -16.482 -3.327 1.00 21.24 O ATOM 483 OE2 GLU A 41 -15.080 -15.461 -4.977 1.00 20.24 O ATOM 0 H GLU A 41 -19.005 -12.200 -2.838 1.00 71.52 H new ATOM 0 HA GLU A 41 -16.777 -12.500 -1.197 1.00 21.04 H new ATOM 0 HB2 GLU A 41 -17.712 -14.180 -2.759 1.00 42.41 H new ATOM 0 HB3 GLU A 41 -17.164 -13.219 -4.119 1.00 42.41 H new ATOM 0 HG2 GLU A 41 -14.825 -13.520 -3.424 1.00 25.23 H new ATOM 0 HG3 GLU A 41 -15.340 -14.413 -2.006 1.00 25.23 H new ATOM 490 N ILE A 42 -15.030 -10.957 -1.821 1.00 20.32 N ATOM 491 CA ILE A 42 -14.060 -9.921 -2.039 1.00 41.15 C ATOM 492 C ILE A 42 -12.783 -10.505 -2.609 1.00 71.34 C ATOM 493 O ILE A 42 -12.341 -11.595 -2.212 1.00 14.44 O ATOM 494 CB ILE A 42 -13.693 -9.233 -0.699 1.00 22.01 C ATOM 495 CG1 ILE A 42 -14.951 -8.877 0.091 1.00 55.11 C ATOM 496 CG2 ILE A 42 -12.880 -7.976 -0.965 1.00 13.02 C ATOM 497 CD1 ILE A 42 -14.688 -8.256 1.442 1.00 62.31 C ATOM 0 H ILE A 42 -14.908 -11.468 -0.947 1.00 20.32 H new ATOM 0 HA ILE A 42 -14.497 -9.203 -2.732 1.00 41.15 H new ATOM 0 HB ILE A 42 -13.098 -9.930 -0.108 1.00 22.01 H new ATOM 0 HG12 ILE A 42 -15.553 -8.187 -0.501 1.00 55.11 H new ATOM 0 HG13 ILE A 42 -15.545 -9.780 0.230 1.00 55.11 H new ATOM 0 HG21 ILE A 42 -12.627 -7.499 -0.018 1.00 13.02 H new ATOM 0 HG22 ILE A 42 -11.965 -8.240 -1.495 1.00 13.02 H new ATOM 0 HG23 ILE A 42 -13.465 -7.286 -1.573 1.00 13.02 H new ATOM 0 HD11 ILE A 42 -15.636 -8.036 1.932 1.00 62.31 H new ATOM 0 HD12 ILE A 42 -14.115 -8.950 2.056 1.00 62.31 H new ATOM 0 HD13 ILE A 42 -14.123 -7.333 1.314 1.00 62.31 H new ATOM 509 N VAL A 43 -12.220 -9.793 -3.524 1.00 74.11 N ATOM 510 CA VAL A 43 -10.944 -10.100 -4.073 1.00 40.24 C ATOM 511 C VAL A 43 -10.101 -8.832 -4.029 1.00 52.34 C ATOM 512 O VAL A 43 -10.634 -7.717 -4.154 1.00 4.22 O ATOM 513 CB VAL A 43 -11.032 -10.642 -5.538 1.00 24.11 C ATOM 514 CG1 VAL A 43 -11.616 -9.614 -6.492 1.00 43.34 C ATOM 515 CG2 VAL A 43 -9.672 -11.111 -6.018 1.00 75.10 C ATOM 0 H VAL A 43 -12.647 -8.957 -3.922 1.00 74.11 H new ATOM 0 HA VAL A 43 -10.491 -10.896 -3.482 1.00 40.24 H new ATOM 0 HB VAL A 43 -11.711 -11.495 -5.528 1.00 24.11 H new ATOM 0 HG11 VAL A 43 -11.658 -10.033 -7.497 1.00 43.34 H new ATOM 0 HG12 VAL A 43 -12.622 -9.347 -6.168 1.00 43.34 H new ATOM 0 HG13 VAL A 43 -10.988 -8.723 -6.496 1.00 43.34 H new ATOM 0 HG21 VAL A 43 -9.755 -11.484 -7.039 1.00 75.10 H new ATOM 0 HG22 VAL A 43 -8.970 -10.278 -5.992 1.00 75.10 H new ATOM 0 HG23 VAL A 43 -9.312 -11.909 -5.368 1.00 75.10 H new ATOM 525 N SER A 44 -8.841 -8.984 -3.812 1.00 2.54 N ATOM 526 CA SER A 44 -7.952 -7.875 -3.783 1.00 3.33 C ATOM 527 C SER A 44 -7.590 -7.493 -5.215 1.00 5.03 C ATOM 528 O SER A 44 -7.113 -8.337 -5.998 1.00 23.13 O ATOM 529 CB SER A 44 -6.729 -8.272 -2.995 1.00 2.24 C ATOM 530 OG SER A 44 -7.109 -8.685 -1.679 1.00 61.25 O ATOM 0 H SER A 44 -8.395 -9.887 -3.649 1.00 2.54 H new ATOM 0 HA SER A 44 -8.413 -7.010 -3.307 1.00 3.33 H new ATOM 0 HB2 SER A 44 -6.206 -9.082 -3.503 1.00 2.24 H new ATOM 0 HB3 SER A 44 -6.036 -7.433 -2.936 1.00 2.24 H new ATOM 0 HG SER A 44 -6.310 -8.943 -1.174 1.00 61.25 H new ATOM 536 N ALA A 45 -7.833 -6.257 -5.571 1.00 23.10 N ATOM 537 CA ALA A 45 -7.580 -5.802 -6.912 1.00 44.00 C ATOM 538 C ALA A 45 -7.065 -4.386 -6.936 1.00 70.33 C ATOM 539 O ALA A 45 -7.248 -3.622 -5.985 1.00 13.21 O ATOM 540 CB ALA A 45 -8.832 -5.904 -7.739 1.00 2.14 C ATOM 0 H ALA A 45 -8.208 -5.544 -4.945 1.00 23.10 H new ATOM 0 HA ALA A 45 -6.809 -6.445 -7.336 1.00 44.00 H new ATOM 0 HB1 ALA A 45 -8.628 -5.557 -8.752 1.00 2.14 H new ATOM 0 HB2 ALA A 45 -9.163 -6.942 -7.771 1.00 2.14 H new ATOM 0 HB3 ALA A 45 -9.613 -5.287 -7.294 1.00 2.14 H new ATOM 546 N THR A 46 -6.429 -4.052 -8.011 1.00 2.02 N ATOM 547 CA THR A 46 -5.881 -2.753 -8.220 1.00 75.42 C ATOM 548 C THR A 46 -6.547 -2.091 -9.418 1.00 15.11 C ATOM 549 O THR A 46 -6.717 -2.713 -10.459 1.00 42.13 O ATOM 550 CB THR A 46 -4.361 -2.846 -8.457 1.00 15.11 C ATOM 551 OG1 THR A 46 -3.750 -3.451 -7.322 1.00 71.22 O ATOM 552 CG2 THR A 46 -3.747 -1.470 -8.680 1.00 3.15 C ATOM 0 H THR A 46 -6.272 -4.693 -8.789 1.00 2.02 H new ATOM 0 HA THR A 46 -6.065 -2.151 -7.330 1.00 75.42 H new ATOM 0 HB THR A 46 -4.190 -3.445 -9.351 1.00 15.11 H new ATOM 0 HG1 THR A 46 -3.308 -4.283 -7.593 1.00 71.22 H new ATOM 0 HG21 THR A 46 -2.674 -1.572 -8.844 1.00 3.15 H new ATOM 0 HG22 THR A 46 -4.205 -1.004 -9.553 1.00 3.15 H new ATOM 0 HG23 THR A 46 -3.922 -0.847 -7.803 1.00 3.15 H new ATOM 560 N LEU A 47 -6.939 -0.863 -9.247 1.00 44.34 N ATOM 561 CA LEU A 47 -7.517 -0.073 -10.297 1.00 74.04 C ATOM 562 C LEU A 47 -6.477 0.909 -10.835 1.00 32.32 C ATOM 563 O LEU A 47 -6.185 1.917 -10.197 1.00 50.51 O ATOM 564 CB LEU A 47 -8.756 0.675 -9.779 1.00 24.04 C ATOM 565 CG LEU A 47 -9.427 1.636 -10.756 1.00 73.14 C ATOM 566 CD1 LEU A 47 -9.776 0.935 -12.058 1.00 42.31 C ATOM 567 CD2 LEU A 47 -10.670 2.246 -10.131 1.00 20.42 C ATOM 0 H LEU A 47 -6.865 -0.371 -8.356 1.00 44.34 H new ATOM 0 HA LEU A 47 -7.831 -0.729 -11.109 1.00 74.04 H new ATOM 0 HB2 LEU A 47 -9.494 -0.063 -9.465 1.00 24.04 H new ATOM 0 HB3 LEU A 47 -8.469 1.237 -8.890 1.00 24.04 H new ATOM 0 HG LEU A 47 -8.722 2.436 -10.982 1.00 73.14 H new ATOM 0 HD11 LEU A 47 -10.253 1.643 -12.736 1.00 42.31 H new ATOM 0 HD12 LEU A 47 -8.867 0.548 -12.518 1.00 42.31 H new ATOM 0 HD13 LEU A 47 -10.459 0.110 -11.855 1.00 42.31 H new ATOM 0 HD21 LEU A 47 -11.137 2.929 -10.841 1.00 20.42 H new ATOM 0 HD22 LEU A 47 -11.373 1.454 -9.873 1.00 20.42 H new ATOM 0 HD23 LEU A 47 -10.393 2.793 -9.230 1.00 20.42 H new ATOM 579 N PRO A 48 -5.862 0.601 -11.982 1.00 54.35 N ATOM 580 CA PRO A 48 -4.873 1.459 -12.588 1.00 1.23 C ATOM 581 C PRO A 48 -5.511 2.522 -13.474 1.00 32.41 C ATOM 582 O PRO A 48 -6.544 2.277 -14.118 1.00 55.40 O ATOM 583 CB PRO A 48 -4.021 0.500 -13.434 1.00 62.52 C ATOM 584 CG PRO A 48 -4.729 -0.832 -13.409 1.00 42.54 C ATOM 585 CD PRO A 48 -6.073 -0.608 -12.777 1.00 45.24 C ATOM 0 HA PRO A 48 -4.297 2.005 -11.842 1.00 1.23 H new ATOM 0 HB2 PRO A 48 -3.921 0.868 -14.455 1.00 62.52 H new ATOM 0 HB3 PRO A 48 -3.014 0.412 -13.026 1.00 62.52 H new ATOM 0 HG2 PRO A 48 -4.840 -1.228 -14.418 1.00 42.54 H new ATOM 0 HG3 PRO A 48 -4.154 -1.563 -12.841 1.00 42.54 H new ATOM 0 HD2 PRO A 48 -6.853 -0.469 -13.525 1.00 45.24 H new ATOM 0 HD3 PRO A 48 -6.374 -1.452 -12.157 1.00 45.24 H new ATOM 593 N GLY A 49 -4.912 3.692 -13.495 1.00 34.31 N ATOM 594 CA GLY A 49 -5.417 4.768 -14.302 1.00 64.22 C ATOM 595 C GLY A 49 -6.355 5.644 -13.518 1.00 1.24 C ATOM 596 O GLY A 49 -7.045 6.497 -14.083 1.00 42.45 O ATOM 0 H GLY A 49 -4.074 3.918 -12.960 1.00 34.31 H new ATOM 0 HA2 GLY A 49 -4.586 5.365 -14.677 1.00 64.22 H new ATOM 0 HA3 GLY A 49 -5.935 4.362 -15.171 1.00 64.22 H new ATOM 600 N PHE A 50 -6.382 5.439 -12.218 1.00 64.04 N ATOM 601 CA PHE A 50 -7.243 6.175 -11.312 1.00 64.10 C ATOM 602 C PHE A 50 -6.501 6.378 -10.022 1.00 61.11 C ATOM 603 O PHE A 50 -5.614 5.618 -9.713 1.00 24.51 O ATOM 604 CB PHE A 50 -8.572 5.420 -11.054 1.00 53.44 C ATOM 605 CG PHE A 50 -9.494 5.318 -12.257 1.00 24.12 C ATOM 606 CD1 PHE A 50 -9.358 4.296 -13.185 1.00 31.33 C ATOM 607 CD2 PHE A 50 -10.485 6.257 -12.453 1.00 40.41 C ATOM 608 CE1 PHE A 50 -10.196 4.219 -14.280 1.00 43.03 C ATOM 609 CE2 PHE A 50 -11.327 6.189 -13.544 1.00 62.42 C ATOM 610 CZ PHE A 50 -11.181 5.170 -14.460 1.00 21.25 C ATOM 0 H PHE A 50 -5.797 4.745 -11.752 1.00 64.04 H new ATOM 0 HA PHE A 50 -7.500 7.135 -11.760 1.00 64.10 H new ATOM 0 HB2 PHE A 50 -8.339 4.413 -10.707 1.00 53.44 H new ATOM 0 HB3 PHE A 50 -9.106 5.920 -10.246 1.00 53.44 H new ATOM 0 HD1 PHE A 50 -8.587 3.551 -13.050 1.00 31.33 H new ATOM 0 HD2 PHE A 50 -10.604 7.060 -11.740 1.00 40.41 H new ATOM 0 HE1 PHE A 50 -10.081 3.417 -14.994 1.00 43.03 H new ATOM 0 HE2 PHE A 50 -12.098 6.933 -13.680 1.00 62.42 H new ATOM 0 HZ PHE A 50 -11.836 5.115 -15.317 1.00 21.25 H new ATOM 620 N GLN A 51 -6.867 7.361 -9.261 1.00 53.52 N ATOM 621 CA GLN A 51 -6.153 7.647 -8.040 1.00 21.42 C ATOM 622 C GLN A 51 -7.142 7.976 -6.954 1.00 65.52 C ATOM 623 O GLN A 51 -8.212 8.537 -7.215 1.00 1.45 O ATOM 624 CB GLN A 51 -5.195 8.828 -8.250 1.00 63.12 C ATOM 625 CG GLN A 51 -4.265 9.147 -7.070 1.00 21.02 C ATOM 626 CD GLN A 51 -3.225 8.049 -6.796 1.00 12.11 C ATOM 627 OE1 GLN A 51 -3.505 7.171 -5.864 1.00 30.31 O flip ATOM 628 NE2 GLN A 51 -2.143 8.051 -7.378 1.00 45.42 N flip ATOM 0 H GLN A 51 -7.653 7.982 -9.456 1.00 53.52 H new ATOM 0 HA GLN A 51 -5.569 6.773 -7.751 1.00 21.42 H new ATOM 0 HB2 GLN A 51 -4.582 8.623 -9.128 1.00 63.12 H new ATOM 0 HB3 GLN A 51 -5.786 9.716 -8.474 1.00 63.12 H new ATOM 0 HG2 GLN A 51 -3.747 10.085 -7.269 1.00 21.02 H new ATOM 0 HG3 GLN A 51 -4.867 9.298 -6.174 1.00 21.02 H new ATOM 0 HE21 GLN A 51 -1.953 8.747 -8.099 1.00 45.42 H new ATOM 0 HE22 GLN A 51 -1.435 7.357 -7.140 1.00 45.42 H new ATOM 637 N ARG A 52 -6.792 7.591 -5.753 1.00 4.34 N ATOM 638 CA ARG A 52 -7.623 7.778 -4.605 1.00 21.44 C ATOM 639 C ARG A 52 -7.350 9.101 -3.917 1.00 32.14 C ATOM 640 O ARG A 52 -6.208 9.428 -3.580 1.00 63.33 O ATOM 641 CB ARG A 52 -7.442 6.606 -3.618 1.00 11.50 C ATOM 642 CG ARG A 52 -6.008 6.410 -3.115 1.00 14.22 C ATOM 643 CD ARG A 52 -5.905 5.240 -2.156 1.00 71.04 C ATOM 644 NE ARG A 52 -4.534 5.042 -1.664 1.00 24.42 N ATOM 645 CZ ARG A 52 -4.141 3.994 -0.919 1.00 53.33 C ATOM 646 NH1 ARG A 52 -5.005 3.045 -0.594 1.00 54.12 N ATOM 647 NH2 ARG A 52 -2.885 3.903 -0.506 1.00 64.40 N ATOM 0 H ARG A 52 -5.905 7.131 -5.549 1.00 4.34 H new ATOM 0 HA ARG A 52 -8.658 7.799 -4.947 1.00 21.44 H new ATOM 0 HB2 ARG A 52 -8.095 6.767 -2.760 1.00 11.50 H new ATOM 0 HB3 ARG A 52 -7.772 5.687 -4.102 1.00 11.50 H new ATOM 0 HG2 ARG A 52 -5.344 6.245 -3.964 1.00 14.22 H new ATOM 0 HG3 ARG A 52 -5.669 7.319 -2.618 1.00 14.22 H new ATOM 0 HD2 ARG A 52 -6.572 5.406 -1.310 1.00 71.04 H new ATOM 0 HD3 ARG A 52 -6.244 4.333 -2.655 1.00 71.04 H new ATOM 0 HE ARG A 52 -3.835 5.745 -1.903 1.00 24.42 H new ATOM 0 HH11 ARG A 52 -5.973 3.107 -0.909 1.00 54.12 H new ATOM 0 HH12 ARG A 52 -4.702 2.252 -0.029 1.00 54.12 H new ATOM 0 HH21 ARG A 52 -2.213 4.629 -0.753 1.00 64.40 H new ATOM 0 HH22 ARG A 52 -2.590 3.107 0.059 1.00 64.40 H new ATOM 661 N PHE A 53 -8.392 9.848 -3.727 1.00 11.43 N ATOM 662 CA PHE A 53 -8.340 11.078 -2.997 1.00 64.52 C ATOM 663 C PHE A 53 -9.071 10.857 -1.707 1.00 13.25 C ATOM 664 O PHE A 53 -10.086 10.207 -1.698 1.00 31.24 O ATOM 665 CB PHE A 53 -8.939 12.237 -3.811 1.00 14.03 C ATOM 666 CG PHE A 53 -8.059 12.694 -4.961 1.00 30.30 C ATOM 667 CD1 PHE A 53 -7.738 11.849 -6.012 1.00 31.00 C ATOM 668 CD2 PHE A 53 -7.536 13.971 -4.965 1.00 31.11 C ATOM 669 CE1 PHE A 53 -6.924 12.274 -7.035 1.00 13.22 C ATOM 670 CE2 PHE A 53 -6.720 14.402 -5.984 1.00 64.03 C ATOM 671 CZ PHE A 53 -6.412 13.554 -7.023 1.00 31.54 C ATOM 0 H PHE A 53 -9.320 9.617 -4.081 1.00 11.43 H new ATOM 0 HA PHE A 53 -7.308 11.364 -2.795 1.00 64.52 H new ATOM 0 HB2 PHE A 53 -9.907 11.929 -4.206 1.00 14.03 H new ATOM 0 HB3 PHE A 53 -9.120 13.081 -3.146 1.00 14.03 H new ATOM 0 HD1 PHE A 53 -8.133 10.844 -6.027 1.00 31.00 H new ATOM 0 HD2 PHE A 53 -7.772 14.644 -4.154 1.00 31.11 H new ATOM 0 HE1 PHE A 53 -6.685 11.605 -7.848 1.00 13.22 H new ATOM 0 HE2 PHE A 53 -6.321 15.405 -5.969 1.00 64.03 H new ATOM 0 HZ PHE A 53 -5.772 13.890 -7.826 1.00 31.54 H new ATOM 681 N ARG A 54 -8.529 11.310 -0.615 1.00 40.11 N ATOM 682 CA ARG A 54 -9.131 11.078 0.704 1.00 72.21 C ATOM 683 C ARG A 54 -9.767 12.314 1.249 1.00 63.43 C ATOM 684 O ARG A 54 -9.548 13.419 0.730 1.00 4.20 O ATOM 685 CB ARG A 54 -8.126 10.516 1.719 1.00 11.51 C ATOM 686 CG ARG A 54 -8.064 8.980 1.874 1.00 71.13 C ATOM 687 CD ARG A 54 -7.717 8.204 0.617 1.00 21.41 C ATOM 688 NE ARG A 54 -8.839 8.152 -0.353 1.00 44.01 N ATOM 689 CZ ARG A 54 -9.525 7.040 -0.733 1.00 50.33 C ATOM 690 NH1 ARG A 54 -9.261 5.853 -0.194 1.00 65.15 N ATOM 691 NH2 ARG A 54 -10.487 7.139 -1.650 1.00 1.45 N ATOM 0 H ARG A 54 -7.663 11.849 -0.592 1.00 40.11 H new ATOM 0 HA ARG A 54 -9.905 10.327 0.549 1.00 72.21 H new ATOM 0 HB2 ARG A 54 -7.132 10.868 1.441 1.00 11.51 H new ATOM 0 HB3 ARG A 54 -8.355 10.945 2.694 1.00 11.51 H new ATOM 0 HG2 ARG A 54 -7.328 8.740 2.641 1.00 71.13 H new ATOM 0 HG3 ARG A 54 -9.030 8.631 2.239 1.00 71.13 H new ATOM 0 HD2 ARG A 54 -6.851 8.662 0.140 1.00 21.41 H new ATOM 0 HD3 ARG A 54 -7.431 7.188 0.890 1.00 21.41 H new ATOM 0 HE ARG A 54 -9.124 9.036 -0.776 1.00 44.01 H new ATOM 0 HH11 ARG A 54 -8.534 5.766 0.516 1.00 65.15 H new ATOM 0 HH12 ARG A 54 -9.785 5.030 -0.491 1.00 65.15 H new ATOM 0 HH21 ARG A 54 -10.706 8.045 -2.064 1.00 1.45 H new ATOM 0 HH22 ARG A 54 -11.004 6.308 -1.938 1.00 1.45 H new ATOM 705 N LEU A 55 -10.574 12.142 2.287 1.00 44.43 N ATOM 706 CA LEU A 55 -11.193 13.259 2.936 1.00 14.34 C ATOM 707 C LEU A 55 -10.127 13.917 3.802 1.00 61.21 C ATOM 708 O LEU A 55 -9.926 13.560 4.967 1.00 41.41 O ATOM 709 CB LEU A 55 -12.442 12.811 3.756 1.00 70.32 C ATOM 710 CG LEU A 55 -13.421 13.906 4.286 1.00 33.13 C ATOM 711 CD1 LEU A 55 -14.641 13.251 4.895 1.00 62.13 C ATOM 712 CD2 LEU A 55 -12.778 14.828 5.317 1.00 14.13 C ATOM 0 H LEU A 55 -10.807 11.234 2.688 1.00 44.43 H new ATOM 0 HA LEU A 55 -11.569 13.979 2.209 1.00 14.34 H new ATOM 0 HB2 LEU A 55 -13.018 12.126 3.134 1.00 70.32 H new ATOM 0 HB3 LEU A 55 -12.087 12.241 4.615 1.00 70.32 H new ATOM 0 HG LEU A 55 -13.701 14.520 3.430 1.00 33.13 H new ATOM 0 HD11 LEU A 55 -15.321 14.019 5.263 1.00 62.13 H new ATOM 0 HD12 LEU A 55 -15.147 12.651 4.139 1.00 62.13 H new ATOM 0 HD13 LEU A 55 -14.335 12.610 5.722 1.00 62.13 H new ATOM 0 HD21 LEU A 55 -13.507 15.568 5.648 1.00 14.13 H new ATOM 0 HD22 LEU A 55 -12.443 14.240 6.172 1.00 14.13 H new ATOM 0 HD23 LEU A 55 -11.924 15.336 4.869 1.00 14.13 H new ATOM 724 N LYS A 56 -9.380 14.773 3.175 1.00 23.24 N ATOM 725 CA LYS A 56 -8.317 15.503 3.809 1.00 60.31 C ATOM 726 C LYS A 56 -8.582 16.998 3.587 1.00 11.01 C ATOM 727 O LYS A 56 -7.915 17.877 4.133 1.00 3.23 O ATOM 728 CB LYS A 56 -6.970 14.972 3.217 1.00 72.33 C ATOM 729 CG LYS A 56 -5.665 15.461 3.853 1.00 45.13 C ATOM 730 CD LYS A 56 -5.188 16.784 3.305 1.00 22.51 C ATOM 731 CE LYS A 56 -3.912 17.218 4.001 1.00 33.22 C ATOM 732 NZ LYS A 56 -3.334 18.415 3.379 1.00 71.03 N ATOM 0 H LYS A 56 -9.492 14.991 2.185 1.00 23.24 H new ATOM 0 HA LYS A 56 -8.260 15.361 4.888 1.00 60.31 H new ATOM 0 HB2 LYS A 56 -6.984 13.884 3.277 1.00 72.33 H new ATOM 0 HB3 LYS A 56 -6.944 15.232 2.159 1.00 72.33 H new ATOM 0 HG2 LYS A 56 -5.807 15.552 4.930 1.00 45.13 H new ATOM 0 HG3 LYS A 56 -4.890 14.711 3.696 1.00 45.13 H new ATOM 0 HD2 LYS A 56 -5.013 16.698 2.233 1.00 22.51 H new ATOM 0 HD3 LYS A 56 -5.960 17.541 3.443 1.00 22.51 H new ATOM 0 HE2 LYS A 56 -4.121 17.419 5.052 1.00 33.22 H new ATOM 0 HE3 LYS A 56 -3.186 16.405 3.970 1.00 33.22 H new ATOM 0 HZ1 LYS A 56 -2.674 18.867 4.043 1.00 71.03 H new ATOM 0 HZ2 LYS A 56 -2.824 18.145 2.514 1.00 71.03 H new ATOM 0 HZ3 LYS A 56 -4.094 19.083 3.139 1.00 71.03 H new ATOM 746 N GLY A 57 -9.613 17.249 2.810 1.00 50.23 N ATOM 747 CA GLY A 57 -10.090 18.575 2.543 1.00 24.11 C ATOM 748 C GLY A 57 -11.544 18.633 2.923 1.00 32.14 C ATOM 749 O GLY A 57 -11.921 18.085 3.958 1.00 24.14 O ATOM 0 H GLY A 57 -10.149 16.519 2.341 1.00 50.23 H new ATOM 0 HA2 GLY A 57 -9.518 19.307 3.113 1.00 24.11 H new ATOM 0 HA3 GLY A 57 -9.962 18.821 1.489 1.00 24.11 H new ATOM 753 N ARG A 58 -12.368 19.248 2.111 1.00 45.32 N ATOM 754 CA ARG A 58 -13.801 19.270 2.402 1.00 64.34 C ATOM 755 C ARG A 58 -14.576 18.240 1.585 1.00 74.25 C ATOM 756 O ARG A 58 -15.803 18.160 1.673 1.00 44.31 O ATOM 757 CB ARG A 58 -14.430 20.702 2.315 1.00 35.44 C ATOM 758 CG ARG A 58 -14.218 21.502 1.007 1.00 4.02 C ATOM 759 CD ARG A 58 -14.779 20.820 -0.235 1.00 33.25 C ATOM 760 NE ARG A 58 -16.216 20.546 -0.145 1.00 35.41 N ATOM 761 CZ ARG A 58 -16.914 19.863 -1.053 1.00 1.15 C ATOM 762 NH1 ARG A 58 -16.327 19.438 -2.161 1.00 53.04 N ATOM 763 NH2 ARG A 58 -18.200 19.609 -0.847 1.00 32.13 N ATOM 0 H ARG A 58 -12.091 19.734 1.258 1.00 45.32 H new ATOM 0 HA ARG A 58 -13.894 18.973 3.447 1.00 64.34 H new ATOM 0 HB2 ARG A 58 -15.503 20.608 2.480 1.00 35.44 H new ATOM 0 HB3 ARG A 58 -14.031 21.294 3.139 1.00 35.44 H new ATOM 0 HG2 ARG A 58 -14.684 22.482 1.113 1.00 4.02 H new ATOM 0 HG3 ARG A 58 -13.150 21.671 0.865 1.00 4.02 H new ATOM 0 HD2 ARG A 58 -14.590 21.450 -1.104 1.00 33.25 H new ATOM 0 HD3 ARG A 58 -14.247 19.883 -0.399 1.00 33.25 H new ATOM 0 HE ARG A 58 -16.717 20.903 0.669 1.00 35.41 H new ATOM 0 HH11 ARG A 58 -15.339 19.633 -2.322 1.00 53.04 H new ATOM 0 HH12 ARG A 58 -16.863 18.916 -2.854 1.00 53.04 H new ATOM 0 HH21 ARG A 58 -18.654 19.936 0.006 1.00 32.13 H new ATOM 0 HH22 ARG A 58 -18.734 19.087 -1.541 1.00 32.13 H new ATOM 777 N LEU A 59 -13.872 17.424 0.835 1.00 40.13 N ATOM 778 CA LEU A 59 -14.529 16.462 -0.014 1.00 64.15 C ATOM 779 C LEU A 59 -14.271 15.048 0.496 1.00 72.20 C ATOM 780 O LEU A 59 -13.349 14.822 1.276 1.00 52.21 O ATOM 781 CB LEU A 59 -14.082 16.615 -1.488 1.00 34.31 C ATOM 782 CG LEU A 59 -14.816 15.728 -2.500 1.00 63.53 C ATOM 783 CD1 LEU A 59 -16.290 16.040 -2.501 1.00 31.51 C ATOM 784 CD2 LEU A 59 -14.234 15.873 -3.888 1.00 0.12 C ATOM 0 H LEU A 59 -12.853 17.408 0.796 1.00 40.13 H new ATOM 0 HA LEU A 59 -15.602 16.651 0.020 1.00 64.15 H new ATOM 0 HB2 LEU A 59 -14.214 17.656 -1.782 1.00 34.31 H new ATOM 0 HB3 LEU A 59 -13.015 16.399 -1.549 1.00 34.31 H new ATOM 0 HG LEU A 59 -14.681 14.690 -2.196 1.00 63.53 H new ATOM 0 HD11 LEU A 59 -16.797 15.402 -3.225 1.00 31.51 H new ATOM 0 HD12 LEU A 59 -16.701 15.859 -1.508 1.00 31.51 H new ATOM 0 HD13 LEU A 59 -16.440 17.085 -2.771 1.00 31.51 H new ATOM 0 HD21 LEU A 59 -14.778 15.230 -4.580 1.00 0.12 H new ATOM 0 HD22 LEU A 59 -14.320 16.910 -4.212 1.00 0.12 H new ATOM 0 HD23 LEU A 59 -13.183 15.583 -3.874 1.00 0.12 H new ATOM 796 N TYR A 60 -15.085 14.122 0.026 1.00 11.33 N ATOM 797 CA TYR A 60 -15.100 12.736 0.476 1.00 74.34 C ATOM 798 C TYR A 60 -13.901 11.988 -0.107 1.00 10.15 C ATOM 799 O TYR A 60 -13.216 12.509 -0.996 1.00 71.55 O ATOM 800 CB TYR A 60 -16.380 12.051 -0.049 1.00 71.44 C ATOM 801 CG TYR A 60 -17.669 12.795 0.199 1.00 63.25 C ATOM 802 CD1 TYR A 60 -18.303 12.759 1.428 1.00 65.43 C ATOM 803 CD2 TYR A 60 -18.251 13.533 -0.819 1.00 1.31 C ATOM 804 CE1 TYR A 60 -19.488 13.442 1.635 1.00 32.31 C ATOM 805 CE2 TYR A 60 -19.425 14.213 -0.623 1.00 43.00 C ATOM 806 CZ TYR A 60 -20.043 14.167 0.601 1.00 41.22 C ATOM 807 OH TYR A 60 -21.223 14.853 0.791 1.00 52.22 O ATOM 0 H TYR A 60 -15.775 14.315 -0.700 1.00 11.33 H new ATOM 0 HA TYR A 60 -15.063 12.717 1.565 1.00 74.34 H new ATOM 0 HB2 TYR A 60 -16.273 11.895 -1.122 1.00 71.44 H new ATOM 0 HB3 TYR A 60 -16.457 11.065 0.410 1.00 71.44 H new ATOM 0 HD1 TYR A 60 -17.867 12.190 2.236 1.00 65.43 H new ATOM 0 HD2 TYR A 60 -17.771 13.573 -1.785 1.00 1.31 H new ATOM 0 HE1 TYR A 60 -19.975 13.408 2.598 1.00 32.31 H new ATOM 0 HE2 TYR A 60 -19.862 14.783 -1.429 1.00 43.00 H new ATOM 0 HH TYR A 60 -21.906 14.504 0.181 1.00 52.22 H new ATOM 817 N PRO A 61 -13.614 10.754 0.372 1.00 61.45 N ATOM 818 CA PRO A 61 -12.583 9.938 -0.215 1.00 72.55 C ATOM 819 C PRO A 61 -13.041 9.375 -1.565 1.00 31.12 C ATOM 820 O PRO A 61 -13.601 8.289 -1.642 1.00 35.05 O ATOM 821 CB PRO A 61 -12.346 8.804 0.810 1.00 43.22 C ATOM 822 CG PRO A 61 -13.140 9.194 2.017 1.00 32.10 C ATOM 823 CD PRO A 61 -14.243 10.080 1.520 1.00 64.23 C ATOM 0 HA PRO A 61 -11.672 10.502 -0.415 1.00 72.55 H new ATOM 0 HB2 PRO A 61 -12.675 7.842 0.416 1.00 43.22 H new ATOM 0 HB3 PRO A 61 -11.287 8.705 1.050 1.00 43.22 H new ATOM 0 HG2 PRO A 61 -13.543 8.315 2.519 1.00 32.10 H new ATOM 0 HG3 PRO A 61 -12.516 9.717 2.742 1.00 32.10 H new ATOM 0 HD2 PRO A 61 -15.122 9.507 1.223 1.00 64.23 H new ATOM 0 HD3 PRO A 61 -14.567 10.790 2.280 1.00 64.23 H new ATOM 831 N CYS A 62 -12.836 10.142 -2.600 1.00 30.53 N ATOM 832 CA CYS A 62 -13.290 9.809 -3.920 1.00 54.04 C ATOM 833 C CYS A 62 -12.169 9.178 -4.780 1.00 60.22 C ATOM 834 O CYS A 62 -11.033 8.954 -4.300 1.00 0.41 O ATOM 835 CB CYS A 62 -13.820 11.085 -4.572 1.00 33.35 C ATOM 836 SG CYS A 62 -12.580 12.394 -4.729 1.00 13.31 S ATOM 0 H CYS A 62 -12.340 11.032 -2.548 1.00 30.53 H new ATOM 0 HA CYS A 62 -14.078 9.060 -3.849 1.00 54.04 H new ATOM 0 HB2 CYS A 62 -14.206 10.843 -5.562 1.00 33.35 H new ATOM 0 HB3 CYS A 62 -14.659 11.460 -3.986 1.00 33.35 H new ATOM 0 HG CYS A 62 -13.117 13.435 -5.293 1.00 13.31 H new ATOM 842 N ILE A 63 -12.508 8.873 -6.029 1.00 12.43 N ATOM 843 CA ILE A 63 -11.595 8.303 -7.022 1.00 61.41 C ATOM 844 C ILE A 63 -11.766 9.100 -8.290 1.00 43.02 C ATOM 845 O ILE A 63 -12.874 9.509 -8.594 1.00 0.23 O ATOM 846 CB ILE A 63 -11.967 6.817 -7.357 1.00 64.14 C ATOM 847 CG1 ILE A 63 -11.889 5.931 -6.134 1.00 11.14 C ATOM 848 CG2 ILE A 63 -11.114 6.237 -8.484 1.00 14.52 C ATOM 849 CD1 ILE A 63 -10.527 5.857 -5.490 1.00 62.14 C ATOM 0 H ILE A 63 -13.450 9.018 -6.391 1.00 12.43 H new ATOM 0 HA ILE A 63 -10.579 8.334 -6.629 1.00 61.41 H new ATOM 0 HB ILE A 63 -13.000 6.839 -7.704 1.00 64.14 H new ATOM 0 HG12 ILE A 63 -12.605 6.292 -5.396 1.00 11.14 H new ATOM 0 HG13 ILE A 63 -12.199 4.924 -6.413 1.00 11.14 H new ATOM 0 HG21 ILE A 63 -11.414 5.207 -8.674 1.00 14.52 H new ATOM 0 HG22 ILE A 63 -11.255 6.829 -9.388 1.00 14.52 H new ATOM 0 HG23 ILE A 63 -10.063 6.261 -8.195 1.00 14.52 H new ATOM 0 HD11 ILE A 63 -10.570 5.199 -4.622 1.00 62.14 H new ATOM 0 HD12 ILE A 63 -9.806 5.465 -6.207 1.00 62.14 H new ATOM 0 HD13 ILE A 63 -10.219 6.854 -5.175 1.00 62.14 H new ATOM 861 N VAL A 64 -10.706 9.350 -9.003 1.00 24.10 N ATOM 862 CA VAL A 64 -10.792 10.039 -10.286 1.00 62.24 C ATOM 863 C VAL A 64 -9.734 9.452 -11.223 1.00 21.34 C ATOM 864 O VAL A 64 -8.739 8.883 -10.743 1.00 44.13 O ATOM 865 CB VAL A 64 -10.536 11.585 -10.156 1.00 0.21 C ATOM 866 CG1 VAL A 64 -11.552 12.260 -9.256 1.00 35.43 C ATOM 867 CG2 VAL A 64 -9.124 11.879 -9.667 1.00 5.11 C ATOM 0 H VAL A 64 -9.759 9.090 -8.727 1.00 24.10 H new ATOM 0 HA VAL A 64 -11.801 9.898 -10.673 1.00 62.24 H new ATOM 0 HB VAL A 64 -10.649 12.000 -11.158 1.00 0.21 H new ATOM 0 HG11 VAL A 64 -11.334 13.326 -9.197 1.00 35.43 H new ATOM 0 HG12 VAL A 64 -12.552 12.116 -9.664 1.00 35.43 H new ATOM 0 HG13 VAL A 64 -11.501 11.824 -8.258 1.00 35.43 H new ATOM 0 HG21 VAL A 64 -8.983 12.957 -9.589 1.00 5.11 H new ATOM 0 HG22 VAL A 64 -8.975 11.422 -8.689 1.00 5.11 H new ATOM 0 HG23 VAL A 64 -8.402 11.469 -10.373 1.00 5.11 H new ATOM 877 N PRO A 65 -9.943 9.535 -12.553 1.00 3.24 N ATOM 878 CA PRO A 65 -8.952 9.073 -13.538 1.00 32.14 C ATOM 879 C PRO A 65 -7.622 9.836 -13.423 1.00 42.13 C ATOM 880 O PRO A 65 -7.593 11.074 -13.384 1.00 24.03 O ATOM 881 CB PRO A 65 -9.620 9.344 -14.898 1.00 33.22 C ATOM 882 CG PRO A 65 -10.729 10.299 -14.609 1.00 4.22 C ATOM 883 CD PRO A 65 -11.165 10.037 -13.201 1.00 74.34 C ATOM 0 HA PRO A 65 -8.694 8.024 -13.390 1.00 32.14 H new ATOM 0 HB2 PRO A 65 -8.910 9.769 -15.607 1.00 33.22 H new ATOM 0 HB3 PRO A 65 -9.999 8.423 -15.340 1.00 33.22 H new ATOM 0 HG2 PRO A 65 -10.393 11.329 -14.725 1.00 4.22 H new ATOM 0 HG3 PRO A 65 -11.556 10.154 -15.304 1.00 4.22 H new ATOM 0 HD2 PRO A 65 -11.532 10.943 -12.719 1.00 74.34 H new ATOM 0 HD3 PRO A 65 -11.971 9.305 -13.160 1.00 74.34 H new ATOM 891 N SER A 66 -6.543 9.103 -13.333 1.00 60.43 N ATOM 892 CA SER A 66 -5.240 9.686 -13.208 1.00 72.13 C ATOM 893 C SER A 66 -4.322 9.147 -14.295 1.00 71.24 C ATOM 894 O SER A 66 -4.440 7.985 -14.690 1.00 33.53 O ATOM 895 CB SER A 66 -4.652 9.382 -11.822 1.00 3.11 C ATOM 896 OG SER A 66 -3.429 10.076 -11.609 1.00 34.04 O ATOM 0 H SER A 66 -6.547 8.083 -13.345 1.00 60.43 H new ATOM 0 HA SER A 66 -5.327 10.767 -13.321 1.00 72.13 H new ATOM 0 HB2 SER A 66 -5.370 9.664 -11.052 1.00 3.11 H new ATOM 0 HB3 SER A 66 -4.484 8.309 -11.724 1.00 3.11 H new ATOM 0 HG SER A 66 -3.082 9.862 -10.718 1.00 34.04 H new ATOM 902 N GLU A 67 -3.430 9.986 -14.776 1.00 12.52 N ATOM 903 CA GLU A 67 -2.423 9.557 -15.724 1.00 61.24 C ATOM 904 C GLU A 67 -1.392 8.730 -14.988 1.00 40.30 C ATOM 905 O GLU A 67 -0.849 7.767 -15.512 1.00 3.11 O ATOM 906 CB GLU A 67 -1.744 10.750 -16.384 1.00 44.12 C ATOM 907 CG GLU A 67 -2.672 11.642 -17.183 1.00 23.04 C ATOM 908 CD GLU A 67 -1.944 12.824 -17.765 1.00 21.04 C ATOM 909 OE1 GLU A 67 -1.383 12.701 -18.869 1.00 4.30 O ATOM 910 OE2 GLU A 67 -1.906 13.895 -17.114 1.00 2.04 O ATOM 0 H GLU A 67 -3.381 10.973 -14.525 1.00 12.52 H new ATOM 0 HA GLU A 67 -2.901 8.968 -16.507 1.00 61.24 H new ATOM 0 HB2 GLU A 67 -1.261 11.349 -15.612 1.00 44.12 H new ATOM 0 HB3 GLU A 67 -0.957 10.384 -17.043 1.00 44.12 H new ATOM 0 HG2 GLU A 67 -3.129 11.065 -17.987 1.00 23.04 H new ATOM 0 HG3 GLU A 67 -3.481 11.992 -16.542 1.00 23.04 H new ATOM 917 N LYS A 68 -1.140 9.117 -13.761 1.00 74.40 N ATOM 918 CA LYS A 68 -0.201 8.433 -12.920 1.00 44.32 C ATOM 919 C LYS A 68 -0.815 8.107 -11.592 1.00 23.23 C ATOM 920 O LYS A 68 -0.633 8.827 -10.603 1.00 24.30 O ATOM 921 CB LYS A 68 1.129 9.197 -12.753 1.00 53.42 C ATOM 922 CG LYS A 68 1.993 9.257 -14.013 1.00 61.34 C ATOM 923 CD LYS A 68 2.396 7.851 -14.480 1.00 64.52 C ATOM 924 CE LYS A 68 3.215 7.114 -13.426 1.00 13.15 C ATOM 925 NZ LYS A 68 3.481 5.715 -13.811 1.00 62.22 N ATOM 0 H LYS A 68 -1.586 9.921 -13.320 1.00 74.40 H new ATOM 0 HA LYS A 68 0.049 7.500 -13.424 1.00 44.32 H new ATOM 0 HB2 LYS A 68 0.910 10.215 -12.430 1.00 53.42 H new ATOM 0 HB3 LYS A 68 1.705 8.727 -11.956 1.00 53.42 H new ATOM 0 HG2 LYS A 68 1.446 9.764 -14.808 1.00 61.34 H new ATOM 0 HG3 LYS A 68 2.888 9.847 -13.815 1.00 61.34 H new ATOM 0 HD2 LYS A 68 1.500 7.275 -14.712 1.00 64.52 H new ATOM 0 HD3 LYS A 68 2.974 7.926 -15.401 1.00 64.52 H new ATOM 0 HE2 LYS A 68 4.161 7.634 -13.273 1.00 13.15 H new ATOM 0 HE3 LYS A 68 2.683 7.133 -12.475 1.00 13.15 H new ATOM 0 HZ1 LYS A 68 4.040 5.251 -13.067 1.00 62.22 H new ATOM 0 HZ2 LYS A 68 2.579 5.211 -13.932 1.00 62.22 H new ATOM 0 HZ3 LYS A 68 4.011 5.696 -14.705 1.00 62.22 H new ATOM 939 N GLY A 69 -1.625 7.091 -11.598 1.00 20.40 N ATOM 940 CA GLY A 69 -2.220 6.631 -10.403 1.00 54.43 C ATOM 941 C GLY A 69 -2.805 5.263 -10.561 1.00 34.21 C ATOM 942 O GLY A 69 -3.207 4.865 -11.668 1.00 22.35 O ATOM 0 H GLY A 69 -1.884 6.567 -12.434 1.00 20.40 H new ATOM 0 HA2 GLY A 69 -1.474 6.617 -9.608 1.00 54.43 H new ATOM 0 HA3 GLY A 69 -3.001 7.326 -10.095 1.00 54.43 H new ATOM 946 N GLU A 70 -2.830 4.546 -9.483 1.00 11.00 N ATOM 947 CA GLU A 70 -3.430 3.256 -9.386 1.00 73.44 C ATOM 948 C GLU A 70 -3.887 3.044 -7.955 1.00 41.21 C ATOM 949 O GLU A 70 -3.187 3.422 -7.008 1.00 1.41 O ATOM 950 CB GLU A 70 -2.515 2.105 -9.900 1.00 3.43 C ATOM 951 CG GLU A 70 -1.120 1.983 -9.260 1.00 64.40 C ATOM 952 CD GLU A 70 -0.195 3.137 -9.607 1.00 71.11 C ATOM 953 OE1 GLU A 70 0.359 3.158 -10.740 1.00 12.02 O ATOM 954 OE2 GLU A 70 0.009 4.024 -8.759 1.00 74.32 O ATOM 0 H GLU A 70 -2.413 4.860 -8.607 1.00 11.00 H new ATOM 0 HA GLU A 70 -4.293 3.224 -10.051 1.00 73.44 H new ATOM 0 HB2 GLU A 70 -3.040 1.162 -9.750 1.00 3.43 H new ATOM 0 HB3 GLU A 70 -2.385 2.230 -10.975 1.00 3.43 H new ATOM 0 HG2 GLU A 70 -1.229 1.927 -8.177 1.00 64.40 H new ATOM 0 HG3 GLU A 70 -0.661 1.049 -9.583 1.00 64.40 H new ATOM 961 N VAL A 71 -5.053 2.484 -7.791 1.00 4.55 N ATOM 962 CA VAL A 71 -5.644 2.320 -6.483 1.00 11.32 C ATOM 963 C VAL A 71 -5.737 0.856 -6.121 1.00 40.13 C ATOM 964 O VAL A 71 -6.367 0.083 -6.816 1.00 14.30 O ATOM 965 CB VAL A 71 -7.074 2.933 -6.434 1.00 50.32 C ATOM 966 CG1 VAL A 71 -7.665 2.849 -5.031 1.00 42.32 C ATOM 967 CG2 VAL A 71 -7.062 4.369 -6.922 1.00 51.44 C ATOM 0 H VAL A 71 -5.624 2.127 -8.557 1.00 4.55 H new ATOM 0 HA VAL A 71 -5.002 2.839 -5.770 1.00 11.32 H new ATOM 0 HB VAL A 71 -7.708 2.348 -7.100 1.00 50.32 H new ATOM 0 HG11 VAL A 71 -8.664 3.285 -5.030 1.00 42.32 H new ATOM 0 HG12 VAL A 71 -7.725 1.805 -4.723 1.00 42.32 H new ATOM 0 HG13 VAL A 71 -7.029 3.396 -4.335 1.00 42.32 H new ATOM 0 HG21 VAL A 71 -8.072 4.776 -6.879 1.00 51.44 H new ATOM 0 HG22 VAL A 71 -6.404 4.963 -6.288 1.00 51.44 H new ATOM 0 HG23 VAL A 71 -6.702 4.401 -7.950 1.00 51.44 H new ATOM 977 N HIS A 72 -5.096 0.478 -5.050 1.00 2.03 N ATOM 978 CA HIS A 72 -5.176 -0.889 -4.573 1.00 2.54 C ATOM 979 C HIS A 72 -6.314 -0.983 -3.573 1.00 13.34 C ATOM 980 O HIS A 72 -6.281 -0.333 -2.515 1.00 53.43 O ATOM 981 CB HIS A 72 -3.843 -1.345 -3.938 1.00 10.14 C ATOM 982 CG HIS A 72 -2.683 -1.431 -4.901 1.00 25.42 C ATOM 983 ND1 HIS A 72 -2.036 -2.610 -5.218 1.00 64.22 N ATOM 984 CD2 HIS A 72 -2.037 -0.464 -5.603 1.00 61.44 C ATOM 985 CE1 HIS A 72 -1.059 -2.361 -6.057 1.00 32.30 C ATOM 986 NE2 HIS A 72 -1.037 -1.075 -6.307 1.00 63.34 N ATOM 0 H HIS A 72 -4.510 1.093 -4.485 1.00 2.03 H new ATOM 0 HA HIS A 72 -5.367 -1.555 -5.415 1.00 2.54 H new ATOM 0 HB2 HIS A 72 -3.582 -0.653 -3.137 1.00 10.14 H new ATOM 0 HB3 HIS A 72 -3.990 -2.323 -3.479 1.00 10.14 H new ATOM 0 HD1 HIS A 72 -2.280 -3.532 -4.856 1.00 64.22 H new ATOM 0 HD2 HIS A 72 -2.270 0.591 -5.605 1.00 61.44 H new ATOM 0 HE1 HIS A 72 -0.384 -3.095 -6.473 1.00 32.30 H new ATOM 995 N GLY A 73 -7.316 -1.763 -3.901 1.00 54.13 N ATOM 996 CA GLY A 73 -8.466 -1.866 -3.052 1.00 20.33 C ATOM 997 C GLY A 73 -9.099 -3.229 -3.107 1.00 42.45 C ATOM 998 O GLY A 73 -8.407 -4.240 -3.291 1.00 11.01 O ATOM 0 H GLY A 73 -7.354 -2.331 -4.747 1.00 54.13 H new ATOM 0 HA2 GLY A 73 -8.177 -1.644 -2.025 1.00 20.33 H new ATOM 0 HA3 GLY A 73 -9.200 -1.115 -3.346 1.00 20.33 H new ATOM 1002 N LYS A 74 -10.402 -3.275 -2.973 1.00 44.50 N ATOM 1003 CA LYS A 74 -11.112 -4.533 -2.923 1.00 30.02 C ATOM 1004 C LYS A 74 -12.244 -4.559 -3.931 1.00 1.24 C ATOM 1005 O LYS A 74 -12.913 -3.545 -4.155 1.00 63.02 O ATOM 1006 CB LYS A 74 -11.710 -4.757 -1.527 1.00 14.42 C ATOM 1007 CG LYS A 74 -10.721 -4.762 -0.369 1.00 5.13 C ATOM 1008 CD LYS A 74 -9.656 -5.831 -0.529 1.00 21.32 C ATOM 1009 CE LYS A 74 -8.747 -5.879 0.689 1.00 13.31 C ATOM 1010 NZ LYS A 74 -8.107 -4.573 0.965 1.00 61.21 N ATOM 0 H LYS A 74 -10.997 -2.450 -2.896 1.00 44.50 H new ATOM 0 HA LYS A 74 -10.395 -5.320 -3.156 1.00 30.02 H new ATOM 0 HB2 LYS A 74 -12.451 -3.979 -1.342 1.00 14.42 H new ATOM 0 HB3 LYS A 74 -12.241 -5.709 -1.529 1.00 14.42 H new ATOM 0 HG2 LYS A 74 -10.244 -3.785 -0.297 1.00 5.13 H new ATOM 0 HG3 LYS A 74 -11.259 -4.924 0.565 1.00 5.13 H new ATOM 0 HD2 LYS A 74 -10.129 -6.802 -0.673 1.00 21.32 H new ATOM 0 HD3 LYS A 74 -9.064 -5.629 -1.422 1.00 21.32 H new ATOM 0 HE2 LYS A 74 -9.326 -6.189 1.559 1.00 13.31 H new ATOM 0 HE3 LYS A 74 -7.976 -6.633 0.534 1.00 13.31 H new ATOM 0 HZ1 LYS A 74 -7.362 -4.696 1.680 1.00 61.21 H new ATOM 0 HZ2 LYS A 74 -7.689 -4.199 0.089 1.00 61.21 H new ATOM 0 HZ3 LYS A 74 -8.821 -3.905 1.320 1.00 61.21 H new ATOM 1024 N VAL A 75 -12.437 -5.696 -4.543 1.00 34.11 N ATOM 1025 CA VAL A 75 -13.547 -5.927 -5.426 1.00 34.22 C ATOM 1026 C VAL A 75 -14.502 -6.917 -4.818 1.00 33.01 C ATOM 1027 O VAL A 75 -14.102 -7.981 -4.373 1.00 1.14 O ATOM 1028 CB VAL A 75 -13.090 -6.434 -6.808 1.00 53.51 C ATOM 1029 CG1 VAL A 75 -14.274 -6.940 -7.610 1.00 34.11 C ATOM 1030 CG2 VAL A 75 -12.389 -5.333 -7.560 1.00 75.45 C ATOM 0 H VAL A 75 -11.818 -6.500 -4.440 1.00 34.11 H new ATOM 0 HA VAL A 75 -14.049 -4.970 -5.567 1.00 34.22 H new ATOM 0 HB VAL A 75 -12.394 -7.260 -6.659 1.00 53.51 H new ATOM 0 HG11 VAL A 75 -13.931 -7.293 -8.582 1.00 34.11 H new ATOM 0 HG12 VAL A 75 -14.753 -7.760 -7.074 1.00 34.11 H new ATOM 0 HG13 VAL A 75 -14.991 -6.131 -7.751 1.00 34.11 H new ATOM 0 HG21 VAL A 75 -12.071 -5.703 -8.535 1.00 75.45 H new ATOM 0 HG22 VAL A 75 -13.071 -4.494 -7.696 1.00 75.45 H new ATOM 0 HG23 VAL A 75 -11.517 -5.004 -6.995 1.00 75.45 H new ATOM 1040 N LEU A 76 -15.752 -6.551 -4.801 1.00 41.35 N ATOM 1041 CA LEU A 76 -16.783 -7.395 -4.291 1.00 4.11 C ATOM 1042 C LEU A 76 -17.601 -7.965 -5.399 1.00 70.14 C ATOM 1043 O LEU A 76 -18.280 -7.247 -6.134 1.00 4.23 O ATOM 1044 CB LEU A 76 -17.651 -6.696 -3.262 1.00 4.11 C ATOM 1045 CG LEU A 76 -16.957 -6.362 -1.959 1.00 12.23 C ATOM 1046 CD1 LEU A 76 -15.992 -5.213 -2.085 1.00 34.02 C ATOM 1047 CD2 LEU A 76 -17.930 -6.202 -0.836 1.00 25.02 C ATOM 0 H LEU A 76 -16.082 -5.649 -5.145 1.00 41.35 H new ATOM 0 HA LEU A 76 -16.293 -8.219 -3.772 1.00 4.11 H new ATOM 0 HB2 LEU A 76 -18.034 -5.774 -3.699 1.00 4.11 H new ATOM 0 HB3 LEU A 76 -18.512 -7.328 -3.046 1.00 4.11 H new ATOM 0 HG LEU A 76 -16.337 -7.221 -1.704 1.00 12.23 H new ATOM 0 HD11 LEU A 76 -15.526 -5.021 -1.118 1.00 34.02 H new ATOM 0 HD12 LEU A 76 -15.222 -5.463 -2.815 1.00 34.02 H new ATOM 0 HD13 LEU A 76 -16.528 -4.322 -2.413 1.00 34.02 H new ATOM 0 HD21 LEU A 76 -17.391 -5.963 0.081 1.00 25.02 H new ATOM 0 HD22 LEU A 76 -18.625 -5.396 -1.069 1.00 25.02 H new ATOM 0 HD23 LEU A 76 -18.484 -7.131 -0.700 1.00 25.02 H new ATOM 1059 N MET A 77 -17.500 -9.242 -5.527 1.00 11.22 N ATOM 1060 CA MET A 77 -18.137 -10.000 -6.552 1.00 41.23 C ATOM 1061 C MET A 77 -19.330 -10.736 -5.996 1.00 73.23 C ATOM 1062 O MET A 77 -19.309 -11.192 -4.863 1.00 52.21 O ATOM 1063 CB MET A 77 -17.149 -11.012 -7.048 1.00 13.51 C ATOM 1064 CG MET A 77 -15.840 -10.410 -7.512 1.00 63.13 C ATOM 1065 SD MET A 77 -14.637 -11.655 -7.956 1.00 52.14 S ATOM 1066 CE MET A 77 -15.623 -12.548 -9.118 1.00 32.23 C ATOM 0 H MET A 77 -16.945 -9.815 -4.891 1.00 11.22 H new ATOM 0 HA MET A 77 -18.469 -9.335 -7.349 1.00 41.23 H new ATOM 0 HB2 MET A 77 -16.947 -11.729 -6.252 1.00 13.51 H new ATOM 0 HB3 MET A 77 -17.595 -11.568 -7.873 1.00 13.51 H new ATOM 0 HG2 MET A 77 -16.024 -9.764 -8.371 1.00 63.13 H new ATOM 0 HG3 MET A 77 -15.432 -9.780 -6.721 1.00 63.13 H new ATOM 0 HE1 MET A 77 -14.974 -13.080 -9.813 1.00 32.23 H new ATOM 0 HE2 MET A 77 -16.251 -13.264 -8.588 1.00 32.23 H new ATOM 0 HE3 MET A 77 -16.254 -11.852 -9.671 1.00 32.23 H new ATOM 1076 N GLY A 78 -20.349 -10.863 -6.791 1.00 51.21 N ATOM 1077 CA GLY A 78 -21.524 -11.575 -6.353 1.00 45.41 C ATOM 1078 C GLY A 78 -22.662 -10.645 -6.046 1.00 5.41 C ATOM 1079 O GLY A 78 -23.685 -11.060 -5.501 1.00 71.21 O ATOM 0 H GLY A 78 -20.397 -10.489 -7.739 1.00 51.21 H new ATOM 0 HA2 GLY A 78 -21.830 -12.280 -7.126 1.00 45.41 H new ATOM 0 HA3 GLY A 78 -21.284 -12.160 -5.465 1.00 45.41 H new ATOM 1083 N VAL A 79 -22.487 -9.387 -6.396 1.00 70.11 N ATOM 1084 CA VAL A 79 -23.501 -8.376 -6.178 1.00 75.14 C ATOM 1085 C VAL A 79 -24.685 -8.663 -7.072 1.00 11.11 C ATOM 1086 O VAL A 79 -24.522 -8.837 -8.279 1.00 55.14 O ATOM 1087 CB VAL A 79 -22.964 -6.961 -6.536 1.00 52.33 C ATOM 1088 CG1 VAL A 79 -24.002 -5.894 -6.301 1.00 41.34 C ATOM 1089 CG2 VAL A 79 -21.733 -6.630 -5.765 1.00 70.41 C ATOM 0 H VAL A 79 -21.638 -9.037 -6.840 1.00 70.11 H new ATOM 0 HA VAL A 79 -23.784 -8.400 -5.126 1.00 75.14 H new ATOM 0 HB VAL A 79 -22.720 -6.985 -7.598 1.00 52.33 H new ATOM 0 HG11 VAL A 79 -23.588 -4.920 -6.563 1.00 41.34 H new ATOM 0 HG12 VAL A 79 -24.877 -6.095 -6.919 1.00 41.34 H new ATOM 0 HG13 VAL A 79 -24.293 -5.894 -5.250 1.00 41.34 H new ATOM 0 HG21 VAL A 79 -21.387 -5.634 -6.042 1.00 70.41 H new ATOM 0 HG22 VAL A 79 -21.955 -6.654 -4.698 1.00 70.41 H new ATOM 0 HG23 VAL A 79 -20.955 -7.360 -5.990 1.00 70.41 H new ATOM 1099 N THR A 80 -25.844 -8.725 -6.507 1.00 22.32 N ATOM 1100 CA THR A 80 -27.022 -8.921 -7.290 1.00 51.34 C ATOM 1101 C THR A 80 -27.454 -7.569 -7.858 1.00 10.40 C ATOM 1102 O THR A 80 -26.922 -6.523 -7.441 1.00 0.30 O ATOM 1103 CB THR A 80 -28.156 -9.558 -6.460 1.00 44.40 C ATOM 1104 OG1 THR A 80 -28.447 -8.744 -5.317 1.00 60.22 O ATOM 1105 CG2 THR A 80 -27.769 -10.954 -6.001 1.00 60.44 C ATOM 0 H THR A 80 -26.003 -8.643 -5.503 1.00 22.32 H new ATOM 0 HA THR A 80 -26.803 -9.613 -8.103 1.00 51.34 H new ATOM 0 HB THR A 80 -29.041 -9.628 -7.092 1.00 44.40 H new ATOM 0 HG1 THR A 80 -27.801 -8.936 -4.606 1.00 60.22 H new ATOM 0 HG21 THR A 80 -28.583 -11.384 -5.418 1.00 60.44 H new ATOM 0 HG22 THR A 80 -27.574 -11.582 -6.870 1.00 60.44 H new ATOM 0 HG23 THR A 80 -26.871 -10.899 -5.385 1.00 60.44 H new ATOM 1113 N SER A 81 -28.368 -7.571 -8.804 1.00 54.44 N ATOM 1114 CA SER A 81 -28.844 -6.328 -9.411 1.00 31.23 C ATOM 1115 C SER A 81 -29.363 -5.363 -8.345 1.00 61.25 C ATOM 1116 O SER A 81 -29.005 -4.195 -8.343 1.00 22.31 O ATOM 1117 CB SER A 81 -29.943 -6.601 -10.452 1.00 25.44 C ATOM 1118 OG SER A 81 -30.359 -5.397 -11.095 1.00 0.51 O ATOM 0 H SER A 81 -28.802 -8.416 -9.176 1.00 54.44 H new ATOM 0 HA SER A 81 -27.996 -5.867 -9.918 1.00 31.23 H new ATOM 0 HB2 SER A 81 -29.574 -7.305 -11.198 1.00 25.44 H new ATOM 0 HB3 SER A 81 -30.798 -7.071 -9.966 1.00 25.44 H new ATOM 0 HG SER A 81 -30.906 -4.869 -10.477 1.00 0.51 H new ATOM 1124 N ASP A 82 -30.159 -5.880 -7.418 1.00 41.14 N ATOM 1125 CA ASP A 82 -30.788 -5.057 -6.374 1.00 54.11 C ATOM 1126 C ASP A 82 -29.760 -4.314 -5.537 1.00 45.34 C ATOM 1127 O ASP A 82 -29.932 -3.140 -5.236 1.00 1.33 O ATOM 1128 CB ASP A 82 -31.703 -5.899 -5.475 1.00 54.55 C ATOM 1129 CG ASP A 82 -32.862 -6.506 -6.229 1.00 20.43 C ATOM 1130 OD1 ASP A 82 -32.723 -7.631 -6.746 1.00 53.32 O ATOM 1131 OD2 ASP A 82 -33.926 -5.861 -6.331 1.00 55.42 O ATOM 0 H ASP A 82 -30.390 -6.872 -7.362 1.00 41.14 H new ATOM 0 HA ASP A 82 -31.398 -4.313 -6.887 1.00 54.11 H new ATOM 0 HB2 ASP A 82 -31.119 -6.695 -5.013 1.00 54.55 H new ATOM 0 HB3 ASP A 82 -32.087 -5.275 -4.668 1.00 54.55 H new ATOM 1136 N GLU A 83 -28.695 -4.992 -5.190 1.00 71.21 N ATOM 1137 CA GLU A 83 -27.608 -4.418 -4.393 1.00 40.12 C ATOM 1138 C GLU A 83 -26.792 -3.443 -5.264 1.00 74.53 C ATOM 1139 O GLU A 83 -26.407 -2.391 -4.811 1.00 12.21 O ATOM 1140 CB GLU A 83 -26.733 -5.561 -3.898 1.00 13.20 C ATOM 1141 CG GLU A 83 -27.499 -6.597 -3.086 1.00 53.22 C ATOM 1142 CD GLU A 83 -26.704 -7.857 -2.853 1.00 45.44 C ATOM 1143 OE1 GLU A 83 -26.248 -8.442 -3.852 1.00 32.35 O ATOM 1144 OE2 GLU A 83 -26.606 -8.337 -1.704 1.00 12.15 O ATOM 0 H GLU A 83 -28.544 -5.967 -5.448 1.00 71.21 H new ATOM 0 HA GLU A 83 -28.002 -3.864 -3.541 1.00 40.12 H new ATOM 0 HB2 GLU A 83 -26.269 -6.051 -4.754 1.00 13.20 H new ATOM 0 HB3 GLU A 83 -25.927 -5.154 -3.287 1.00 13.20 H new ATOM 0 HG2 GLU A 83 -27.778 -6.165 -2.125 1.00 53.22 H new ATOM 0 HG3 GLU A 83 -28.425 -6.847 -3.604 1.00 53.22 H new ATOM 1151 N LEU A 84 -26.548 -3.816 -6.526 1.00 50.03 N ATOM 1152 CA LEU A 84 -25.862 -2.931 -7.489 1.00 62.01 C ATOM 1153 C LEU A 84 -26.609 -1.601 -7.597 1.00 31.42 C ATOM 1154 O LEU A 84 -26.021 -0.525 -7.476 1.00 73.23 O ATOM 1155 CB LEU A 84 -25.831 -3.567 -8.885 1.00 22.44 C ATOM 1156 CG LEU A 84 -25.109 -2.754 -9.966 1.00 55.33 C ATOM 1157 CD1 LEU A 84 -23.611 -2.755 -9.745 1.00 40.13 C ATOM 1158 CD2 LEU A 84 -25.465 -3.232 -11.358 1.00 61.01 C ATOM 0 H LEU A 84 -26.813 -4.723 -6.909 1.00 50.03 H new ATOM 0 HA LEU A 84 -24.845 -2.774 -7.131 1.00 62.01 H new ATOM 0 HB2 LEU A 84 -25.353 -4.543 -8.810 1.00 22.44 H new ATOM 0 HB3 LEU A 84 -26.857 -3.739 -9.209 1.00 22.44 H new ATOM 0 HG LEU A 84 -25.454 -1.723 -9.883 1.00 55.33 H new ATOM 0 HD11 LEU A 84 -23.127 -2.170 -10.528 1.00 40.13 H new ATOM 0 HD12 LEU A 84 -23.386 -2.316 -8.773 1.00 40.13 H new ATOM 0 HD13 LEU A 84 -23.239 -3.779 -9.775 1.00 40.13 H new ATOM 0 HD21 LEU A 84 -24.934 -2.631 -12.096 1.00 61.01 H new ATOM 0 HD22 LEU A 84 -25.179 -4.278 -11.468 1.00 61.01 H new ATOM 0 HD23 LEU A 84 -26.539 -3.131 -11.514 1.00 61.01 H new ATOM 1170 N GLU A 85 -27.911 -1.705 -7.818 1.00 24.20 N ATOM 1171 CA GLU A 85 -28.789 -0.556 -7.945 1.00 40.21 C ATOM 1172 C GLU A 85 -28.849 0.210 -6.629 1.00 2.33 C ATOM 1173 O GLU A 85 -29.041 1.416 -6.614 1.00 14.33 O ATOM 1174 CB GLU A 85 -30.183 -1.008 -8.393 1.00 61.15 C ATOM 1175 CG GLU A 85 -30.175 -1.732 -9.739 1.00 14.42 C ATOM 1176 CD GLU A 85 -31.535 -2.226 -10.161 1.00 13.35 C ATOM 1177 OE1 GLU A 85 -31.908 -3.375 -9.819 1.00 14.21 O ATOM 1178 OE2 GLU A 85 -32.258 -1.477 -10.855 1.00 23.13 O ATOM 0 H GLU A 85 -28.391 -2.600 -7.915 1.00 24.20 H new ATOM 0 HA GLU A 85 -28.392 0.117 -8.705 1.00 40.21 H new ATOM 0 HB2 GLU A 85 -30.606 -1.668 -7.635 1.00 61.15 H new ATOM 0 HB3 GLU A 85 -30.837 -0.138 -8.459 1.00 61.15 H new ATOM 0 HG2 GLU A 85 -29.788 -1.058 -10.503 1.00 14.42 H new ATOM 0 HG3 GLU A 85 -29.490 -2.578 -9.684 1.00 14.42 H new ATOM 1185 N ASN A 86 -28.666 -0.510 -5.541 1.00 22.43 N ATOM 1186 CA ASN A 86 -28.620 0.051 -4.194 1.00 54.34 C ATOM 1187 C ASN A 86 -27.342 0.852 -3.947 1.00 64.23 C ATOM 1188 O ASN A 86 -27.391 1.958 -3.408 1.00 71.43 O ATOM 1189 CB ASN A 86 -28.843 -1.058 -3.149 1.00 33.20 C ATOM 1190 CG ASN A 86 -27.934 -1.001 -1.941 1.00 4.43 C ATOM 1191 OD1 ASN A 86 -26.891 -1.637 -1.905 1.00 31.31 O ATOM 1192 ND2 ASN A 86 -28.291 -0.235 -0.981 1.00 21.01 N ATOM 0 H ASN A 86 -28.542 -1.522 -5.562 1.00 22.43 H new ATOM 0 HA ASN A 86 -29.435 0.768 -4.092 1.00 54.34 H new ATOM 0 HB2 ASN A 86 -29.877 -1.010 -2.808 1.00 33.20 H new ATOM 0 HB3 ASN A 86 -28.713 -2.025 -3.636 1.00 33.20 H new ATOM 0 HD21 ASN A 86 -27.699 -0.142 -0.156 1.00 21.01 H new ATOM 0 HD22 ASN A 86 -29.168 0.283 -1.041 1.00 21.01 H new ATOM 1199 N LEU A 87 -26.215 0.307 -4.358 1.00 61.12 N ATOM 1200 CA LEU A 87 -24.936 1.002 -4.260 1.00 32.35 C ATOM 1201 C LEU A 87 -25.008 2.251 -5.117 1.00 53.12 C ATOM 1202 O LEU A 87 -24.563 3.335 -4.721 1.00 35.52 O ATOM 1203 CB LEU A 87 -23.795 0.098 -4.751 1.00 63.51 C ATOM 1204 CG LEU A 87 -23.577 -1.214 -3.985 1.00 62.04 C ATOM 1205 CD1 LEU A 87 -22.489 -2.038 -4.648 1.00 11.31 C ATOM 1206 CD2 LEU A 87 -23.206 -0.934 -2.537 1.00 2.25 C ATOM 0 H LEU A 87 -26.154 -0.625 -4.768 1.00 61.12 H new ATOM 0 HA LEU A 87 -24.738 1.265 -3.221 1.00 32.35 H new ATOM 0 HB2 LEU A 87 -23.980 -0.145 -5.797 1.00 63.51 H new ATOM 0 HB3 LEU A 87 -22.868 0.671 -4.716 1.00 63.51 H new ATOM 0 HG LEU A 87 -24.509 -1.778 -4.003 1.00 62.04 H new ATOM 0 HD11 LEU A 87 -22.346 -2.965 -4.093 1.00 11.31 H new ATOM 0 HD12 LEU A 87 -22.781 -2.269 -5.672 1.00 11.31 H new ATOM 0 HD13 LEU A 87 -21.557 -1.472 -4.655 1.00 11.31 H new ATOM 0 HD21 LEU A 87 -23.056 -1.877 -2.011 1.00 2.25 H new ATOM 0 HD22 LEU A 87 -22.287 -0.349 -2.503 1.00 2.25 H new ATOM 0 HD23 LEU A 87 -24.009 -0.375 -2.057 1.00 2.25 H new ATOM 1218 N ASP A 88 -25.617 2.084 -6.277 1.00 71.23 N ATOM 1219 CA ASP A 88 -25.836 3.157 -7.228 1.00 1.24 C ATOM 1220 C ASP A 88 -26.806 4.191 -6.667 1.00 61.34 C ATOM 1221 O ASP A 88 -26.735 5.358 -6.989 1.00 31.11 O ATOM 1222 CB ASP A 88 -26.374 2.578 -8.538 1.00 50.10 C ATOM 1223 CG ASP A 88 -26.662 3.626 -9.581 1.00 1.14 C ATOM 1224 OD1 ASP A 88 -25.746 3.961 -10.360 1.00 11.03 O ATOM 1225 OD2 ASP A 88 -27.803 4.111 -9.648 1.00 13.11 O ATOM 0 H ASP A 88 -25.979 1.183 -6.589 1.00 71.23 H new ATOM 0 HA ASP A 88 -24.886 3.657 -7.418 1.00 1.24 H new ATOM 0 HB2 ASP A 88 -25.650 1.868 -8.937 1.00 50.10 H new ATOM 0 HB3 ASP A 88 -27.287 2.020 -8.332 1.00 50.10 H new ATOM 1230 N ALA A 89 -27.695 3.753 -5.822 1.00 22.43 N ATOM 1231 CA ALA A 89 -28.652 4.637 -5.197 1.00 74.33 C ATOM 1232 C ALA A 89 -27.982 5.462 -4.117 1.00 62.32 C ATOM 1233 O ALA A 89 -28.175 6.671 -4.031 1.00 63.51 O ATOM 1234 CB ALA A 89 -29.790 3.834 -4.608 1.00 22.01 C ATOM 0 H ALA A 89 -27.781 2.776 -5.544 1.00 22.43 H new ATOM 0 HA ALA A 89 -29.050 5.313 -5.954 1.00 74.33 H new ATOM 0 HB1 ALA A 89 -30.507 4.508 -4.139 1.00 22.01 H new ATOM 0 HB2 ALA A 89 -30.286 3.271 -5.399 1.00 22.01 H new ATOM 0 HB3 ALA A 89 -29.399 3.143 -3.861 1.00 22.01 H new ATOM 1240 N VAL A 90 -27.183 4.801 -3.305 1.00 74.11 N ATOM 1241 CA VAL A 90 -26.508 5.444 -2.199 1.00 0.52 C ATOM 1242 C VAL A 90 -25.358 6.373 -2.674 1.00 5.51 C ATOM 1243 O VAL A 90 -25.385 7.584 -2.418 1.00 61.34 O ATOM 1244 CB VAL A 90 -25.992 4.370 -1.179 1.00 62.52 C ATOM 1245 CG1 VAL A 90 -25.121 4.986 -0.092 1.00 33.53 C ATOM 1246 CG2 VAL A 90 -27.178 3.660 -0.531 1.00 13.34 C ATOM 0 H VAL A 90 -26.984 3.805 -3.394 1.00 74.11 H new ATOM 0 HA VAL A 90 -27.233 6.082 -1.694 1.00 0.52 H new ATOM 0 HB VAL A 90 -25.383 3.658 -1.736 1.00 62.52 H new ATOM 0 HG11 VAL A 90 -24.786 4.206 0.592 1.00 33.53 H new ATOM 0 HG12 VAL A 90 -24.255 5.465 -0.548 1.00 33.53 H new ATOM 0 HG13 VAL A 90 -25.698 5.728 0.459 1.00 33.53 H new ATOM 0 HG21 VAL A 90 -26.814 2.915 0.177 1.00 13.34 H new ATOM 0 HG22 VAL A 90 -27.795 4.389 -0.005 1.00 13.34 H new ATOM 0 HG23 VAL A 90 -27.773 3.169 -1.301 1.00 13.34 H new ATOM 1256 N GLU A 91 -24.393 5.819 -3.391 1.00 42.14 N ATOM 1257 CA GLU A 91 -23.234 6.593 -3.858 1.00 14.13 C ATOM 1258 C GLU A 91 -23.540 7.429 -5.090 1.00 30.04 C ATOM 1259 O GLU A 91 -22.903 8.445 -5.338 1.00 62.44 O ATOM 1260 CB GLU A 91 -22.036 5.682 -4.091 1.00 41.11 C ATOM 1261 CG GLU A 91 -21.586 4.963 -2.833 1.00 1.30 C ATOM 1262 CD GLU A 91 -21.089 5.907 -1.749 1.00 73.25 C ATOM 1263 OE1 GLU A 91 -21.902 6.614 -1.121 1.00 73.51 O ATOM 1264 OE2 GLU A 91 -19.866 5.970 -1.520 1.00 11.25 O ATOM 0 H GLU A 91 -24.382 4.837 -3.667 1.00 42.14 H new ATOM 0 HA GLU A 91 -22.985 7.298 -3.065 1.00 14.13 H new ATOM 0 HB2 GLU A 91 -22.289 4.945 -4.853 1.00 41.11 H new ATOM 0 HB3 GLU A 91 -21.207 6.273 -4.482 1.00 41.11 H new ATOM 0 HG2 GLU A 91 -22.416 4.375 -2.441 1.00 1.30 H new ATOM 0 HG3 GLU A 91 -20.791 4.262 -3.088 1.00 1.30 H new ATOM 1271 N GLY A 92 -24.532 7.004 -5.837 1.00 12.33 N ATOM 1272 CA GLY A 92 -24.903 7.645 -7.097 1.00 5.01 C ATOM 1273 C GLY A 92 -25.391 9.073 -6.953 1.00 43.13 C ATOM 1274 O GLY A 92 -25.473 9.811 -7.943 1.00 0.22 O ATOM 0 H GLY A 92 -25.113 6.201 -5.595 1.00 12.33 H new ATOM 0 HA2 GLY A 92 -24.041 7.634 -7.764 1.00 5.01 H new ATOM 0 HA3 GLY A 92 -25.684 7.054 -7.575 1.00 5.01 H new ATOM 1278 N ASN A 93 -25.738 9.463 -5.749 1.00 73.41 N ATOM 1279 CA ASN A 93 -26.236 10.801 -5.504 1.00 45.21 C ATOM 1280 C ASN A 93 -25.138 11.868 -5.721 1.00 24.44 C ATOM 1281 O ASN A 93 -25.433 12.994 -6.120 1.00 63.51 O ATOM 1282 CB ASN A 93 -26.902 10.900 -4.115 1.00 72.30 C ATOM 1283 CG ASN A 93 -27.466 12.278 -3.819 1.00 72.14 C ATOM 1284 OD1 ASN A 93 -26.724 13.080 -3.098 1.00 54.04 O flip ATOM 1285 ND2 ASN A 93 -28.597 12.592 -4.197 1.00 72.24 N flip ATOM 0 H ASN A 93 -25.685 8.872 -4.919 1.00 73.41 H new ATOM 0 HA ASN A 93 -27.012 11.012 -6.240 1.00 45.21 H new ATOM 0 HB2 ASN A 93 -27.704 10.165 -4.051 1.00 72.30 H new ATOM 0 HB3 ASN A 93 -26.171 10.642 -3.349 1.00 72.30 H new ATOM 0 HD21 ASN A 93 -29.146 11.941 -4.758 1.00 72.24 H new ATOM 0 HD22 ASN A 93 -28.983 13.503 -3.949 1.00 72.24 H new ATOM 1292 N GLU A 94 -23.879 11.512 -5.475 1.00 21.43 N ATOM 1293 CA GLU A 94 -22.763 12.445 -5.730 1.00 45.24 C ATOM 1294 C GLU A 94 -21.671 11.812 -6.617 1.00 34.11 C ATOM 1295 O GLU A 94 -20.673 12.458 -6.949 1.00 72.30 O ATOM 1296 CB GLU A 94 -22.165 12.982 -4.411 1.00 72.41 C ATOM 1297 CG GLU A 94 -23.147 13.809 -3.586 1.00 51.14 C ATOM 1298 CD GLU A 94 -22.560 14.347 -2.299 1.00 42.12 C ATOM 1299 OE1 GLU A 94 -22.602 13.638 -1.275 1.00 42.14 O ATOM 1300 OE2 GLU A 94 -22.078 15.496 -2.278 1.00 1.40 O ATOM 0 H GLU A 94 -23.600 10.603 -5.106 1.00 21.43 H new ATOM 0 HA GLU A 94 -23.176 13.291 -6.280 1.00 45.24 H new ATOM 0 HB2 GLU A 94 -21.817 12.141 -3.811 1.00 72.41 H new ATOM 0 HB3 GLU A 94 -21.292 13.593 -4.640 1.00 72.41 H new ATOM 0 HG2 GLU A 94 -23.502 14.644 -4.190 1.00 51.14 H new ATOM 0 HG3 GLU A 94 -24.016 13.195 -3.350 1.00 51.14 H new ATOM 1307 N TYR A 95 -21.881 10.566 -7.004 1.00 13.31 N ATOM 1308 CA TYR A 95 -20.932 9.813 -7.835 1.00 54.11 C ATOM 1309 C TYR A 95 -21.659 9.128 -8.976 1.00 0.42 C ATOM 1310 O TYR A 95 -22.886 9.080 -8.994 1.00 54.45 O ATOM 1311 CB TYR A 95 -20.196 8.744 -7.011 1.00 71.44 C ATOM 1312 CG TYR A 95 -19.290 9.278 -5.935 1.00 0.50 C ATOM 1313 CD1 TYR A 95 -19.780 9.633 -4.687 1.00 41.12 C ATOM 1314 CD2 TYR A 95 -17.936 9.413 -6.165 1.00 74.23 C ATOM 1315 CE1 TYR A 95 -18.942 10.112 -3.708 1.00 24.04 C ATOM 1316 CE2 TYR A 95 -17.096 9.889 -5.196 1.00 45.31 C ATOM 1317 CZ TYR A 95 -17.599 10.235 -3.968 1.00 14.34 C ATOM 1318 OH TYR A 95 -16.756 10.709 -2.994 1.00 70.04 O ATOM 0 H TYR A 95 -22.717 10.037 -6.754 1.00 13.31 H new ATOM 0 HA TYR A 95 -20.206 10.525 -8.227 1.00 54.11 H new ATOM 0 HB2 TYR A 95 -20.936 8.090 -6.550 1.00 71.44 H new ATOM 0 HB3 TYR A 95 -19.605 8.128 -7.689 1.00 71.44 H new ATOM 0 HD1 TYR A 95 -20.835 9.532 -4.481 1.00 41.12 H new ATOM 0 HD2 TYR A 95 -17.532 9.138 -7.128 1.00 74.23 H new ATOM 0 HE1 TYR A 95 -19.337 10.389 -2.742 1.00 24.04 H new ATOM 0 HE2 TYR A 95 -16.040 9.992 -5.397 1.00 45.31 H new ATOM 0 HH TYR A 95 -15.990 10.105 -2.902 1.00 70.04 H new ATOM 1328 N GLU A 96 -20.916 8.619 -9.932 1.00 33.04 N ATOM 1329 CA GLU A 96 -21.509 7.874 -11.014 1.00 4.53 C ATOM 1330 C GLU A 96 -20.873 6.518 -11.097 1.00 54.45 C ATOM 1331 O GLU A 96 -19.695 6.346 -10.746 1.00 5.21 O ATOM 1332 CB GLU A 96 -21.432 8.612 -12.361 1.00 41.11 C ATOM 1333 CG GLU A 96 -20.030 8.902 -12.876 1.00 12.11 C ATOM 1334 CD GLU A 96 -20.061 9.616 -14.206 1.00 31.51 C ATOM 1335 OE1 GLU A 96 -20.110 10.865 -14.229 1.00 74.03 O ATOM 1336 OE2 GLU A 96 -20.047 8.942 -15.253 1.00 21.35 O ATOM 0 H GLU A 96 -19.901 8.708 -9.981 1.00 33.04 H new ATOM 0 HA GLU A 96 -22.571 7.763 -10.797 1.00 4.53 H new ATOM 0 HB2 GLU A 96 -21.959 8.020 -13.109 1.00 41.11 H new ATOM 0 HB3 GLU A 96 -21.967 9.557 -12.268 1.00 41.11 H new ATOM 0 HG2 GLU A 96 -19.494 9.511 -12.148 1.00 12.11 H new ATOM 0 HG3 GLU A 96 -19.479 7.967 -12.977 1.00 12.11 H new ATOM 1343 N ARG A 97 -21.640 5.555 -11.525 1.00 21.40 N ATOM 1344 CA ARG A 97 -21.167 4.214 -11.617 1.00 24.43 C ATOM 1345 C ARG A 97 -20.528 4.021 -12.970 1.00 41.43 C ATOM 1346 O ARG A 97 -21.205 4.064 -13.998 1.00 30.45 O ATOM 1347 CB ARG A 97 -22.344 3.255 -11.483 1.00 54.22 C ATOM 1348 CG ARG A 97 -21.972 1.790 -11.355 1.00 33.12 C ATOM 1349 CD ARG A 97 -23.215 0.916 -11.409 1.00 25.22 C ATOM 1350 NE ARG A 97 -23.791 0.852 -12.767 1.00 42.23 N ATOM 1351 CZ ARG A 97 -25.017 1.286 -13.134 1.00 32.31 C ATOM 1352 NH1 ARG A 97 -25.740 2.059 -12.334 1.00 2.32 N ATOM 1353 NH2 ARG A 97 -25.476 1.002 -14.339 1.00 25.14 N ATOM 0 H ARG A 97 -22.609 5.683 -11.818 1.00 21.40 H new ATOM 0 HA ARG A 97 -20.443 4.018 -10.826 1.00 24.43 H new ATOM 0 HB2 ARG A 97 -22.929 3.543 -10.609 1.00 54.22 H new ATOM 0 HB3 ARG A 97 -22.990 3.375 -12.352 1.00 54.22 H new ATOM 0 HG2 ARG A 97 -21.289 1.511 -12.158 1.00 33.12 H new ATOM 0 HG3 ARG A 97 -21.444 1.624 -10.416 1.00 33.12 H new ATOM 0 HD2 ARG A 97 -22.965 -0.091 -11.074 1.00 25.22 H new ATOM 0 HD3 ARG A 97 -23.962 1.305 -10.717 1.00 25.22 H new ATOM 0 HE ARG A 97 -23.209 0.442 -13.497 1.00 42.23 H new ATOM 0 HH11 ARG A 97 -25.372 2.336 -11.424 1.00 2.32 H new ATOM 0 HH12 ARG A 97 -26.663 2.376 -12.629 1.00 2.32 H new ATOM 0 HH21 ARG A 97 -24.906 0.458 -14.987 1.00 25.14 H new ATOM 0 HH22 ARG A 97 -26.401 1.327 -14.622 1.00 25.14 H new ATOM 1367 N VAL A 98 -19.252 3.813 -12.976 1.00 44.34 N ATOM 1368 CA VAL A 98 -18.541 3.572 -14.198 1.00 63.55 C ATOM 1369 C VAL A 98 -17.956 2.217 -14.234 1.00 54.51 C ATOM 1370 O VAL A 98 -17.807 1.565 -13.195 1.00 51.33 O ATOM 1371 CB VAL A 98 -17.480 4.622 -14.540 1.00 34.04 C ATOM 1372 CG1 VAL A 98 -18.161 5.908 -14.911 1.00 11.41 C ATOM 1373 CG2 VAL A 98 -16.526 4.836 -13.367 1.00 73.22 C ATOM 0 H VAL A 98 -18.670 3.804 -12.138 1.00 44.34 H new ATOM 0 HA VAL A 98 -19.302 3.654 -14.974 1.00 63.55 H new ATOM 0 HB VAL A 98 -16.888 4.269 -15.385 1.00 34.04 H new ATOM 0 HG11 VAL A 98 -17.411 6.660 -15.156 1.00 11.41 H new ATOM 0 HG12 VAL A 98 -18.804 5.743 -15.775 1.00 11.41 H new ATOM 0 HG13 VAL A 98 -18.763 6.256 -14.072 1.00 11.41 H new ATOM 0 HG21 VAL A 98 -15.782 5.586 -13.635 1.00 73.22 H new ATOM 0 HG22 VAL A 98 -17.089 5.177 -12.498 1.00 73.22 H new ATOM 0 HG23 VAL A 98 -16.025 3.897 -13.129 1.00 73.22 H new ATOM 1383 N THR A 99 -17.634 1.784 -15.399 1.00 41.14 N ATOM 1384 CA THR A 99 -17.119 0.469 -15.563 1.00 32.10 C ATOM 1385 C THR A 99 -15.627 0.577 -15.876 1.00 34.01 C ATOM 1386 O THR A 99 -15.214 1.293 -16.794 1.00 34.23 O ATOM 1387 CB THR A 99 -17.933 -0.347 -16.641 1.00 21.14 C ATOM 1388 OG1 THR A 99 -17.581 -1.740 -16.622 1.00 43.14 O ATOM 1389 CG2 THR A 99 -17.759 0.204 -18.053 1.00 50.12 C ATOM 0 H THR A 99 -17.718 2.324 -16.260 1.00 41.14 H new ATOM 0 HA THR A 99 -17.236 -0.102 -14.642 1.00 32.10 H new ATOM 0 HB THR A 99 -18.982 -0.238 -16.366 1.00 21.14 H new ATOM 0 HG1 THR A 99 -17.403 -2.020 -15.700 1.00 43.14 H new ATOM 0 HG21 THR A 99 -18.341 -0.396 -18.752 1.00 50.12 H new ATOM 0 HG22 THR A 99 -18.105 1.237 -18.086 1.00 50.12 H new ATOM 0 HG23 THR A 99 -16.706 0.165 -18.331 1.00 50.12 H new ATOM 1397 N VAL A 100 -14.829 -0.083 -15.092 1.00 42.13 N ATOM 1398 CA VAL A 100 -13.394 0.036 -15.183 1.00 45.25 C ATOM 1399 C VAL A 100 -12.731 -1.327 -15.240 1.00 62.33 C ATOM 1400 O VAL A 100 -13.389 -2.366 -15.054 1.00 74.12 O ATOM 1401 CB VAL A 100 -12.821 0.830 -13.974 1.00 25.35 C ATOM 1402 CG1 VAL A 100 -13.337 2.266 -13.965 1.00 53.40 C ATOM 1403 CG2 VAL A 100 -13.173 0.133 -12.663 1.00 61.10 C ATOM 0 H VAL A 100 -15.150 -0.724 -14.366 1.00 42.13 H new ATOM 0 HA VAL A 100 -13.177 0.576 -16.104 1.00 45.25 H new ATOM 0 HB VAL A 100 -11.736 0.860 -14.076 1.00 25.35 H new ATOM 0 HG11 VAL A 100 -12.920 2.797 -13.109 1.00 53.40 H new ATOM 0 HG12 VAL A 100 -13.035 2.767 -14.885 1.00 53.40 H new ATOM 0 HG13 VAL A 100 -14.425 2.261 -13.894 1.00 53.40 H new ATOM 0 HG21 VAL A 100 -12.765 0.702 -11.828 1.00 61.10 H new ATOM 0 HG22 VAL A 100 -14.257 0.070 -12.564 1.00 61.10 H new ATOM 0 HG23 VAL A 100 -12.750 -0.871 -12.660 1.00 61.10 H new ATOM 1413 N GLY A 101 -11.459 -1.326 -15.508 1.00 42.43 N ATOM 1414 CA GLY A 101 -10.711 -2.535 -15.543 1.00 64.24 C ATOM 1415 C GLY A 101 -9.726 -2.595 -14.405 1.00 61.14 C ATOM 1416 O GLY A 101 -8.819 -1.763 -14.310 1.00 35.13 O ATOM 0 H GLY A 101 -10.917 -0.485 -15.707 1.00 42.43 H new ATOM 0 HA2 GLY A 101 -11.388 -3.387 -15.487 1.00 64.24 H new ATOM 0 HA3 GLY A 101 -10.180 -2.611 -16.492 1.00 64.24 H new ATOM 1420 N ILE A 102 -9.879 -3.573 -13.563 1.00 22.42 N ATOM 1421 CA ILE A 102 -9.023 -3.735 -12.410 1.00 60.32 C ATOM 1422 C ILE A 102 -8.154 -4.952 -12.580 1.00 64.20 C ATOM 1423 O ILE A 102 -8.407 -5.766 -13.451 1.00 51.11 O ATOM 1424 CB ILE A 102 -9.833 -3.777 -11.057 1.00 34.12 C ATOM 1425 CG1 ILE A 102 -10.953 -4.841 -11.030 1.00 35.11 C ATOM 1426 CG2 ILE A 102 -10.413 -2.429 -10.734 1.00 14.22 C ATOM 1427 CD1 ILE A 102 -10.518 -6.266 -10.844 1.00 64.54 C ATOM 0 H ILE A 102 -10.602 -4.287 -13.651 1.00 22.42 H new ATOM 0 HA ILE A 102 -8.381 -2.856 -12.345 1.00 60.32 H new ATOM 0 HB ILE A 102 -9.106 -4.063 -10.297 1.00 34.12 H new ATOM 0 HG12 ILE A 102 -11.645 -4.588 -10.227 1.00 35.11 H new ATOM 0 HG13 ILE A 102 -11.511 -4.773 -11.964 1.00 35.11 H new ATOM 0 HG21 ILE A 102 -10.966 -2.486 -9.797 1.00 14.22 H new ATOM 0 HG22 ILE A 102 -9.608 -1.700 -10.637 1.00 14.22 H new ATOM 0 HG23 ILE A 102 -11.086 -2.121 -11.534 1.00 14.22 H new ATOM 0 HD11 ILE A 102 -11.393 -6.916 -10.842 1.00 64.54 H new ATOM 0 HD12 ILE A 102 -9.854 -6.553 -11.659 1.00 64.54 H new ATOM 0 HD13 ILE A 102 -9.991 -6.365 -9.895 1.00 64.54 H new ATOM 1439 N VAL A 103 -7.141 -5.065 -11.788 1.00 43.51 N ATOM 1440 CA VAL A 103 -6.231 -6.170 -11.880 1.00 72.10 C ATOM 1441 C VAL A 103 -6.177 -6.891 -10.554 1.00 43.02 C ATOM 1442 O VAL A 103 -5.926 -6.285 -9.518 1.00 5.54 O ATOM 1443 CB VAL A 103 -4.818 -5.711 -12.314 1.00 43.13 C ATOM 1444 CG1 VAL A 103 -3.842 -6.874 -12.360 1.00 65.54 C ATOM 1445 CG2 VAL A 103 -4.876 -5.015 -13.670 1.00 54.33 C ATOM 0 H VAL A 103 -6.915 -4.394 -11.054 1.00 43.51 H new ATOM 0 HA VAL A 103 -6.595 -6.853 -12.647 1.00 72.10 H new ATOM 0 HB VAL A 103 -4.458 -5.003 -11.568 1.00 43.13 H new ATOM 0 HG11 VAL A 103 -2.861 -6.514 -12.669 1.00 65.54 H new ATOM 0 HG12 VAL A 103 -3.768 -7.326 -11.371 1.00 65.54 H new ATOM 0 HG13 VAL A 103 -4.196 -7.618 -13.074 1.00 65.54 H new ATOM 0 HG21 VAL A 103 -3.874 -4.699 -13.960 1.00 54.33 H new ATOM 0 HG22 VAL A 103 -5.269 -5.705 -14.417 1.00 54.33 H new ATOM 0 HG23 VAL A 103 -5.527 -4.143 -13.604 1.00 54.33 H new ATOM 1455 N ARG A 104 -6.441 -8.164 -10.605 1.00 71.22 N ATOM 1456 CA ARG A 104 -6.494 -9.016 -9.451 1.00 53.31 C ATOM 1457 C ARG A 104 -5.090 -9.275 -8.905 1.00 74.12 C ATOM 1458 O ARG A 104 -4.233 -9.817 -9.606 1.00 64.45 O ATOM 1459 CB ARG A 104 -7.181 -10.319 -9.852 1.00 35.11 C ATOM 1460 CG ARG A 104 -7.318 -11.340 -8.760 1.00 14.13 C ATOM 1461 CD ARG A 104 -8.081 -12.547 -9.267 1.00 60.00 C ATOM 1462 NE ARG A 104 -8.186 -13.606 -8.263 1.00 13.12 N ATOM 1463 CZ ARG A 104 -8.846 -14.763 -8.441 1.00 54.35 C ATOM 1464 NH1 ARG A 104 -9.540 -14.982 -9.561 1.00 54.34 N ATOM 1465 NH2 ARG A 104 -8.811 -15.694 -7.504 1.00 54.41 N ATOM 0 H ARG A 104 -6.632 -8.654 -11.479 1.00 71.22 H new ATOM 0 HA ARG A 104 -7.061 -8.534 -8.655 1.00 53.31 H new ATOM 0 HB2 ARG A 104 -8.175 -10.083 -10.232 1.00 35.11 H new ATOM 0 HB3 ARG A 104 -6.623 -10.765 -10.675 1.00 35.11 H new ATOM 0 HG2 ARG A 104 -6.331 -11.644 -8.411 1.00 14.13 H new ATOM 0 HG3 ARG A 104 -7.838 -10.904 -7.907 1.00 14.13 H new ATOM 0 HD2 ARG A 104 -9.081 -12.239 -9.571 1.00 60.00 H new ATOM 0 HD3 ARG A 104 -7.585 -12.940 -10.154 1.00 60.00 H new ATOM 0 HE ARG A 104 -7.726 -13.456 -7.365 1.00 13.12 H new ATOM 0 HH11 ARG A 104 -9.572 -14.268 -10.289 1.00 54.34 H new ATOM 0 HH12 ARG A 104 -10.038 -15.863 -9.688 1.00 54.34 H new ATOM 0 HH21 ARG A 104 -8.283 -15.534 -6.646 1.00 54.41 H new ATOM 0 HH22 ARG A 104 -9.312 -16.572 -7.639 1.00 54.41 H new ATOM 1479 N GLU A 105 -4.884 -8.908 -7.646 1.00 54.20 N ATOM 1480 CA GLU A 105 -3.578 -9.024 -6.963 1.00 1.04 C ATOM 1481 C GLU A 105 -3.101 -10.474 -6.885 1.00 43.41 C ATOM 1482 O GLU A 105 -1.904 -10.741 -6.757 1.00 43.34 O ATOM 1483 CB GLU A 105 -3.681 -8.439 -5.543 1.00 70.50 C ATOM 1484 CG GLU A 105 -4.046 -6.956 -5.473 1.00 65.34 C ATOM 1485 CD GLU A 105 -2.937 -6.034 -5.917 1.00 51.33 C ATOM 1486 OE1 GLU A 105 -2.636 -5.969 -7.124 1.00 50.53 O ATOM 1487 OE2 GLU A 105 -2.338 -5.350 -5.043 1.00 42.30 O ATOM 0 H GLU A 105 -5.618 -8.517 -7.055 1.00 54.20 H new ATOM 0 HA GLU A 105 -2.848 -8.464 -7.548 1.00 1.04 H new ATOM 0 HB2 GLU A 105 -4.427 -9.007 -4.987 1.00 70.50 H new ATOM 0 HB3 GLU A 105 -2.727 -8.586 -5.037 1.00 70.50 H new ATOM 0 HG2 GLU A 105 -4.924 -6.778 -6.094 1.00 65.34 H new ATOM 0 HG3 GLU A 105 -4.324 -6.708 -4.449 1.00 65.34 H new ATOM 1494 N ASP A 106 -4.041 -11.403 -6.958 1.00 40.22 N ATOM 1495 CA ASP A 106 -3.720 -12.827 -6.876 1.00 55.32 C ATOM 1496 C ASP A 106 -2.870 -13.292 -8.038 1.00 22.11 C ATOM 1497 O ASP A 106 -1.760 -13.781 -7.849 1.00 75.55 O ATOM 1498 CB ASP A 106 -4.976 -13.714 -6.829 1.00 65.11 C ATOM 1499 CG ASP A 106 -5.841 -13.507 -5.619 1.00 52.13 C ATOM 1500 OD1 ASP A 106 -5.461 -13.951 -4.521 1.00 54.32 O ATOM 1501 OD2 ASP A 106 -6.942 -12.935 -5.760 1.00 63.03 O ATOM 0 H ASP A 106 -5.034 -11.201 -7.074 1.00 40.22 H new ATOM 0 HA ASP A 106 -3.164 -12.933 -5.945 1.00 55.32 H new ATOM 0 HB2 ASP A 106 -5.572 -13.526 -7.722 1.00 65.11 H new ATOM 0 HB3 ASP A 106 -4.669 -14.759 -6.865 1.00 65.11 H new ATOM 1506 N ASN A 107 -3.362 -13.106 -9.235 1.00 0.34 N ATOM 1507 CA ASN A 107 -2.725 -13.717 -10.410 1.00 43.23 C ATOM 1508 C ASN A 107 -2.410 -12.712 -11.508 1.00 63.22 C ATOM 1509 O ASN A 107 -2.002 -13.097 -12.608 1.00 31.33 O ATOM 1510 CB ASN A 107 -3.606 -14.867 -10.948 1.00 14.40 C ATOM 1511 CG ASN A 107 -4.971 -14.410 -11.448 1.00 0.04 C ATOM 1512 OD1 ASN A 107 -5.506 -13.388 -11.007 1.00 22.24 O ATOM 1513 ND2 ASN A 107 -5.550 -15.169 -12.340 1.00 71.42 N ATOM 0 H ASN A 107 -4.190 -12.547 -9.438 1.00 0.34 H new ATOM 0 HA ASN A 107 -1.765 -14.117 -10.084 1.00 43.23 H new ATOM 0 HB2 ASN A 107 -3.079 -15.366 -11.761 1.00 14.40 H new ATOM 0 HB3 ASN A 107 -3.747 -15.605 -10.158 1.00 14.40 H new ATOM 0 HD21 ASN A 107 -6.474 -14.924 -12.695 1.00 71.42 H new ATOM 0 HD22 ASN A 107 -5.078 -16.006 -12.681 1.00 71.42 H new ATOM 1520 N SER A 108 -2.602 -11.436 -11.207 1.00 74.43 N ATOM 1521 CA SER A 108 -2.273 -10.321 -12.104 1.00 22.14 C ATOM 1522 C SER A 108 -3.235 -10.230 -13.307 1.00 41.15 C ATOM 1523 O SER A 108 -2.996 -9.474 -14.248 1.00 51.20 O ATOM 1524 CB SER A 108 -0.778 -10.382 -12.549 1.00 74.33 C ATOM 1525 OG SER A 108 -0.411 -9.264 -13.352 1.00 33.11 O ATOM 0 H SER A 108 -2.998 -11.133 -10.317 1.00 74.43 H new ATOM 0 HA SER A 108 -2.410 -9.399 -11.538 1.00 22.14 H new ATOM 0 HB2 SER A 108 -0.139 -10.419 -11.667 1.00 74.33 H new ATOM 0 HB3 SER A 108 -0.604 -11.302 -13.108 1.00 74.33 H new ATOM 0 HG SER A 108 -1.199 -8.933 -13.832 1.00 33.11 H new ATOM 1531 N GLU A 109 -4.330 -10.959 -13.254 1.00 63.25 N ATOM 1532 CA GLU A 109 -5.308 -10.908 -14.318 1.00 35.03 C ATOM 1533 C GLU A 109 -6.221 -9.733 -14.159 1.00 3.34 C ATOM 1534 O GLU A 109 -6.532 -9.318 -13.045 1.00 12.33 O ATOM 1535 CB GLU A 109 -6.103 -12.188 -14.404 1.00 32.01 C ATOM 1536 CG GLU A 109 -5.299 -13.365 -14.897 1.00 75.11 C ATOM 1537 CD GLU A 109 -4.838 -13.166 -16.313 1.00 31.44 C ATOM 1538 OE1 GLU A 109 -5.663 -13.319 -17.243 1.00 13.04 O ATOM 1539 OE2 GLU A 109 -3.665 -12.817 -16.530 1.00 2.45 O ATOM 0 H GLU A 109 -4.564 -11.591 -12.488 1.00 63.25 H new ATOM 0 HA GLU A 109 -4.760 -10.791 -15.253 1.00 35.03 H new ATOM 0 HB2 GLU A 109 -6.508 -12.422 -13.419 1.00 32.01 H new ATOM 0 HB3 GLU A 109 -6.953 -12.034 -15.069 1.00 32.01 H new ATOM 0 HG2 GLU A 109 -4.435 -13.512 -14.250 1.00 75.11 H new ATOM 0 HG3 GLU A 109 -5.902 -14.271 -14.834 1.00 75.11 H new ATOM 1546 N LYS A 110 -6.641 -9.205 -15.259 1.00 62.32 N ATOM 1547 CA LYS A 110 -7.503 -8.057 -15.268 1.00 44.05 C ATOM 1548 C LYS A 110 -8.956 -8.496 -15.297 1.00 74.10 C ATOM 1549 O LYS A 110 -9.298 -9.541 -15.864 1.00 61.11 O ATOM 1550 CB LYS A 110 -7.203 -7.150 -16.470 1.00 22.42 C ATOM 1551 CG LYS A 110 -7.355 -7.844 -17.801 1.00 34.43 C ATOM 1552 CD LYS A 110 -7.066 -6.919 -18.963 1.00 51.00 C ATOM 1553 CE LYS A 110 -7.146 -7.664 -20.290 1.00 1.45 C ATOM 1554 NZ LYS A 110 -8.475 -8.272 -20.528 1.00 60.33 N ATOM 0 H LYS A 110 -6.398 -9.555 -16.186 1.00 62.32 H new ATOM 0 HA LYS A 110 -7.318 -7.487 -14.357 1.00 44.05 H new ATOM 0 HB2 LYS A 110 -7.870 -6.288 -16.440 1.00 22.42 H new ATOM 0 HB3 LYS A 110 -6.186 -6.769 -16.382 1.00 22.42 H new ATOM 0 HG2 LYS A 110 -6.680 -8.699 -17.842 1.00 34.43 H new ATOM 0 HG3 LYS A 110 -8.369 -8.234 -17.892 1.00 34.43 H new ATOM 0 HD2 LYS A 110 -7.779 -6.095 -18.962 1.00 51.00 H new ATOM 0 HD3 LYS A 110 -6.074 -6.483 -18.847 1.00 51.00 H new ATOM 0 HE2 LYS A 110 -6.916 -6.975 -21.103 1.00 1.45 H new ATOM 0 HE3 LYS A 110 -6.386 -8.445 -20.309 1.00 1.45 H new ATOM 0 HZ1 LYS A 110 -8.529 -8.617 -21.508 1.00 60.33 H new ATOM 0 HZ2 LYS A 110 -8.615 -9.067 -19.873 1.00 60.33 H new ATOM 0 HZ3 LYS A 110 -9.216 -7.559 -20.371 1.00 60.33 H new ATOM 1568 N MET A 111 -9.777 -7.723 -14.682 1.00 11.35 N ATOM 1569 CA MET A 111 -11.207 -7.958 -14.626 1.00 12.13 C ATOM 1570 C MET A 111 -11.927 -6.686 -14.861 1.00 71.12 C ATOM 1571 O MET A 111 -11.364 -5.602 -14.699 1.00 74.15 O ATOM 1572 CB MET A 111 -11.634 -8.529 -13.280 1.00 30.13 C ATOM 1573 CG MET A 111 -11.135 -9.915 -13.018 1.00 52.20 C ATOM 1574 SD MET A 111 -11.443 -10.480 -11.324 1.00 54.32 S ATOM 1575 CE MET A 111 -13.231 -10.379 -11.250 1.00 63.11 C ATOM 0 H MET A 111 -9.483 -6.882 -14.185 1.00 11.35 H new ATOM 0 HA MET A 111 -11.454 -8.686 -15.399 1.00 12.13 H new ATOM 0 HB2 MET A 111 -11.277 -7.870 -12.488 1.00 30.13 H new ATOM 0 HB3 MET A 111 -12.723 -8.530 -13.227 1.00 30.13 H new ATOM 0 HG2 MET A 111 -11.612 -10.603 -13.716 1.00 52.20 H new ATOM 0 HG3 MET A 111 -10.064 -9.952 -13.217 1.00 52.20 H new ATOM 0 HE1 MET A 111 -13.620 -11.221 -10.677 1.00 63.11 H new ATOM 0 HE2 MET A 111 -13.523 -9.446 -10.768 1.00 63.11 H new ATOM 0 HE3 MET A 111 -13.639 -10.408 -12.260 1.00 63.11 H new ATOM 1585 N ALA A 112 -13.143 -6.802 -15.222 1.00 24.23 N ATOM 1586 CA ALA A 112 -13.956 -5.646 -15.493 1.00 11.30 C ATOM 1587 C ALA A 112 -14.983 -5.487 -14.409 1.00 1.31 C ATOM 1588 O ALA A 112 -15.860 -6.340 -14.248 1.00 60.03 O ATOM 1589 CB ALA A 112 -14.631 -5.769 -16.835 1.00 32.50 C ATOM 0 H ALA A 112 -13.621 -7.695 -15.344 1.00 24.23 H new ATOM 0 HA ALA A 112 -13.315 -4.765 -15.515 1.00 11.30 H new ATOM 0 HB1 ALA A 112 -15.240 -4.884 -17.018 1.00 32.50 H new ATOM 0 HB2 ALA A 112 -13.875 -5.858 -17.616 1.00 32.50 H new ATOM 0 HB3 ALA A 112 -15.266 -6.655 -16.843 1.00 32.50 H new ATOM 1595 N VAL A 113 -14.901 -4.396 -13.694 1.00 32.51 N ATOM 1596 CA VAL A 113 -15.784 -4.157 -12.579 1.00 55.24 C ATOM 1597 C VAL A 113 -16.370 -2.764 -12.666 1.00 60.52 C ATOM 1598 O VAL A 113 -15.989 -1.969 -13.526 1.00 30.32 O ATOM 1599 CB VAL A 113 -15.050 -4.299 -11.207 1.00 73.24 C ATOM 1600 CG1 VAL A 113 -14.410 -5.667 -11.050 1.00 1.33 C ATOM 1601 CG2 VAL A 113 -14.019 -3.199 -11.019 1.00 64.12 C ATOM 0 H VAL A 113 -14.225 -3.651 -13.865 1.00 32.51 H new ATOM 0 HA VAL A 113 -16.571 -4.909 -12.633 1.00 55.24 H new ATOM 0 HB VAL A 113 -15.805 -4.196 -10.427 1.00 73.24 H new ATOM 0 HG11 VAL A 113 -13.910 -5.726 -10.083 1.00 1.33 H new ATOM 0 HG12 VAL A 113 -15.179 -6.437 -11.108 1.00 1.33 H new ATOM 0 HG13 VAL A 113 -13.681 -5.821 -11.846 1.00 1.33 H new ATOM 0 HG21 VAL A 113 -13.525 -3.324 -10.056 1.00 64.12 H new ATOM 0 HG22 VAL A 113 -13.278 -3.254 -11.817 1.00 64.12 H new ATOM 0 HG23 VAL A 113 -14.513 -2.228 -11.050 1.00 64.12 H new ATOM 1611 N LYS A 114 -17.287 -2.476 -11.794 1.00 24.24 N ATOM 1612 CA LYS A 114 -17.872 -1.162 -11.704 1.00 54.54 C ATOM 1613 C LYS A 114 -17.328 -0.458 -10.467 1.00 62.21 C ATOM 1614 O LYS A 114 -16.972 -1.112 -9.493 1.00 0.34 O ATOM 1615 CB LYS A 114 -19.426 -1.216 -11.674 1.00 31.21 C ATOM 1616 CG LYS A 114 -20.129 -1.619 -12.996 1.00 34.30 C ATOM 1617 CD LYS A 114 -19.775 -3.027 -13.470 1.00 41.41 C ATOM 1618 CE LYS A 114 -20.518 -3.409 -14.757 1.00 74.44 C ATOM 1619 NZ LYS A 114 -20.241 -2.477 -15.875 1.00 73.20 N ATOM 0 H LYS A 114 -17.656 -3.145 -11.119 1.00 24.24 H new ATOM 0 HA LYS A 114 -17.598 -0.600 -12.596 1.00 54.54 H new ATOM 0 HB2 LYS A 114 -19.728 -1.920 -10.898 1.00 31.21 H new ATOM 0 HB3 LYS A 114 -19.796 -0.235 -11.376 1.00 31.21 H new ATOM 0 HG2 LYS A 114 -21.208 -1.551 -12.860 1.00 34.30 H new ATOM 0 HG3 LYS A 114 -19.860 -0.904 -13.774 1.00 34.30 H new ATOM 0 HD2 LYS A 114 -18.700 -3.092 -13.640 1.00 41.41 H new ATOM 0 HD3 LYS A 114 -20.018 -3.744 -12.686 1.00 41.41 H new ATOM 0 HE2 LYS A 114 -20.231 -4.419 -15.051 1.00 74.44 H new ATOM 0 HE3 LYS A 114 -21.590 -3.427 -14.561 1.00 74.44 H new ATOM 0 HZ1 LYS A 114 -20.713 -2.818 -16.737 1.00 73.20 H new ATOM 0 HZ2 LYS A 114 -20.600 -1.531 -15.635 1.00 73.20 H new ATOM 0 HZ3 LYS A 114 -19.215 -2.427 -16.039 1.00 73.20 H new ATOM 1633 N THR A 115 -17.226 0.843 -10.516 1.00 12.42 N ATOM 1634 CA THR A 115 -16.742 1.604 -9.389 1.00 53.23 C ATOM 1635 C THR A 115 -17.334 3.016 -9.450 1.00 70.14 C ATOM 1636 O THR A 115 -18.003 3.375 -10.438 1.00 22.02 O ATOM 1637 CB THR A 115 -15.184 1.660 -9.326 1.00 51.01 C ATOM 1638 OG1 THR A 115 -14.765 2.186 -8.052 1.00 35.24 O ATOM 1639 CG2 THR A 115 -14.630 2.556 -10.428 1.00 55.13 C ATOM 0 H THR A 115 -17.473 1.405 -11.331 1.00 12.42 H new ATOM 0 HA THR A 115 -17.065 1.101 -8.477 1.00 53.23 H new ATOM 0 HB THR A 115 -14.804 0.647 -9.460 1.00 51.01 H new ATOM 0 HG1 THR A 115 -14.936 1.522 -7.352 1.00 35.24 H new ATOM 0 HG21 THR A 115 -13.542 2.580 -10.365 1.00 55.13 H new ATOM 0 HG22 THR A 115 -14.928 2.164 -11.400 1.00 55.13 H new ATOM 0 HG23 THR A 115 -15.023 3.566 -10.308 1.00 55.13 H new ATOM 1647 N TYR A 116 -17.107 3.793 -8.417 1.00 71.33 N ATOM 1648 CA TYR A 116 -17.673 5.114 -8.312 1.00 32.35 C ATOM 1649 C TYR A 116 -16.580 6.156 -8.215 1.00 62.31 C ATOM 1650 O TYR A 116 -15.865 6.244 -7.212 1.00 1.24 O ATOM 1651 CB TYR A 116 -18.625 5.195 -7.109 1.00 2.12 C ATOM 1652 CG TYR A 116 -19.792 4.239 -7.214 1.00 22.15 C ATOM 1653 CD1 TYR A 116 -19.670 2.917 -6.802 1.00 42.32 C ATOM 1654 CD2 TYR A 116 -21.007 4.651 -7.742 1.00 4.22 C ATOM 1655 CE1 TYR A 116 -20.720 2.036 -6.918 1.00 41.24 C ATOM 1656 CE2 TYR A 116 -22.064 3.776 -7.855 1.00 40.30 C ATOM 1657 CZ TYR A 116 -21.914 2.470 -7.446 1.00 52.33 C ATOM 1658 OH TYR A 116 -22.959 1.593 -7.569 1.00 73.32 O ATOM 0 H TYR A 116 -16.523 3.525 -7.625 1.00 71.33 H new ATOM 0 HA TYR A 116 -18.250 5.318 -9.214 1.00 32.35 H new ATOM 0 HB2 TYR A 116 -18.068 4.981 -6.197 1.00 2.12 H new ATOM 0 HB3 TYR A 116 -19.003 6.213 -7.020 1.00 2.12 H new ATOM 0 HD1 TYR A 116 -18.735 2.576 -6.384 1.00 42.32 H new ATOM 0 HD2 TYR A 116 -21.125 5.673 -8.069 1.00 4.22 H new ATOM 0 HE1 TYR A 116 -20.608 1.011 -6.597 1.00 41.24 H new ATOM 0 HE2 TYR A 116 -23.006 4.112 -8.262 1.00 40.30 H new ATOM 0 HH TYR A 116 -22.629 0.675 -7.470 1.00 73.32 H new ATOM 1668 N MET A 117 -16.445 6.918 -9.265 1.00 53.31 N ATOM 1669 CA MET A 117 -15.454 7.983 -9.340 1.00 23.51 C ATOM 1670 C MET A 117 -16.162 9.314 -9.221 1.00 74.24 C ATOM 1671 O MET A 117 -17.375 9.409 -9.483 1.00 13.03 O ATOM 1672 CB MET A 117 -14.631 7.959 -10.650 1.00 30.40 C ATOM 1673 CG MET A 117 -15.459 8.252 -11.860 1.00 62.45 C ATOM 1674 SD MET A 117 -14.560 8.329 -13.409 1.00 0.14 S ATOM 1675 CE MET A 117 -15.966 8.595 -14.489 1.00 21.15 C ATOM 0 H MET A 117 -17.018 6.826 -10.104 1.00 53.31 H new ATOM 0 HA MET A 117 -14.750 7.831 -8.522 1.00 23.51 H new ATOM 0 HB2 MET A 117 -13.825 8.690 -10.581 1.00 30.40 H new ATOM 0 HB3 MET A 117 -14.165 6.980 -10.763 1.00 30.40 H new ATOM 0 HG2 MET A 117 -16.230 7.487 -11.945 1.00 62.45 H new ATOM 0 HG3 MET A 117 -15.969 9.203 -11.708 1.00 62.45 H new ATOM 0 HE1 MET A 117 -15.864 7.974 -15.379 1.00 21.15 H new ATOM 0 HE2 MET A 117 -16.884 8.329 -13.964 1.00 21.15 H new ATOM 0 HE3 MET A 117 -16.006 9.644 -14.782 1.00 21.15 H new ATOM 1685 N TRP A 118 -15.432 10.311 -8.812 1.00 1.11 N ATOM 1686 CA TRP A 118 -15.954 11.635 -8.651 1.00 2.53 C ATOM 1687 C TRP A 118 -16.300 12.212 -10.029 1.00 21.44 C ATOM 1688 O TRP A 118 -15.595 11.965 -11.002 1.00 21.41 O ATOM 1689 CB TRP A 118 -14.924 12.489 -7.927 1.00 73.22 C ATOM 1690 CG TRP A 118 -15.398 13.841 -7.591 1.00 63.11 C ATOM 1691 CD1 TRP A 118 -14.948 15.005 -8.092 1.00 3.21 C ATOM 1692 CD2 TRP A 118 -16.433 14.161 -6.683 1.00 4.22 C ATOM 1693 NE1 TRP A 118 -15.639 16.043 -7.548 1.00 50.01 N ATOM 1694 CE2 TRP A 118 -16.558 15.552 -6.673 1.00 64.43 C ATOM 1695 CE3 TRP A 118 -17.264 13.397 -5.873 1.00 63.41 C ATOM 1696 CZ2 TRP A 118 -17.484 16.207 -5.881 1.00 22.43 C ATOM 1697 CZ3 TRP A 118 -18.182 14.030 -5.090 1.00 41.42 C ATOM 1698 CH2 TRP A 118 -18.293 15.428 -5.091 1.00 42.24 C ATOM 0 H TRP A 118 -14.443 10.225 -8.578 1.00 1.11 H new ATOM 0 HA TRP A 118 -16.865 11.620 -8.053 1.00 2.53 H new ATOM 0 HB2 TRP A 118 -14.626 11.981 -7.010 1.00 73.22 H new ATOM 0 HB3 TRP A 118 -14.033 12.572 -8.550 1.00 73.22 H new ATOM 0 HD1 TRP A 118 -14.155 15.102 -8.819 1.00 3.21 H new ATOM 0 HE1 TRP A 118 -15.492 17.030 -7.762 1.00 50.01 H new ATOM 0 HE3 TRP A 118 -17.184 12.320 -5.864 1.00 63.41 H new ATOM 0 HZ2 TRP A 118 -17.567 17.284 -5.884 1.00 22.43 H new ATOM 0 HZ3 TRP A 118 -18.835 13.446 -4.458 1.00 41.42 H new ATOM 0 HH2 TRP A 118 -19.029 15.901 -4.458 1.00 42.24 H new ATOM 1709 N ILE A 119 -17.373 12.975 -10.093 1.00 1.32 N ATOM 1710 CA ILE A 119 -17.931 13.422 -11.372 1.00 34.45 C ATOM 1711 C ILE A 119 -17.083 14.493 -12.068 1.00 61.30 C ATOM 1712 O ILE A 119 -16.866 14.443 -13.283 1.00 12.10 O ATOM 1713 CB ILE A 119 -19.340 14.033 -11.178 1.00 40.02 C ATOM 1714 CG1 ILE A 119 -20.239 13.128 -10.329 1.00 44.10 C ATOM 1715 CG2 ILE A 119 -19.974 14.260 -12.543 1.00 41.33 C ATOM 1716 CD1 ILE A 119 -20.506 11.783 -10.930 1.00 34.14 C ATOM 0 H ILE A 119 -17.885 13.305 -9.274 1.00 1.32 H new ATOM 0 HA ILE A 119 -17.958 12.525 -11.991 1.00 34.45 H new ATOM 0 HB ILE A 119 -19.235 14.980 -10.648 1.00 40.02 H new ATOM 0 HG12 ILE A 119 -19.776 12.990 -9.352 1.00 44.10 H new ATOM 0 HG13 ILE A 119 -21.190 13.634 -10.163 1.00 44.10 H new ATOM 0 HG21 ILE A 119 -20.967 14.690 -12.416 1.00 41.33 H new ATOM 0 HG22 ILE A 119 -19.354 14.943 -13.123 1.00 41.33 H new ATOM 0 HG23 ILE A 119 -20.055 13.309 -13.069 1.00 41.33 H new ATOM 0 HD11 ILE A 119 -21.150 11.208 -10.264 1.00 34.14 H new ATOM 0 HD12 ILE A 119 -20.999 11.907 -11.894 1.00 34.14 H new ATOM 0 HD13 ILE A 119 -19.564 11.253 -11.070 1.00 34.14 H new ATOM 1728 N ASN A 120 -16.595 15.440 -11.319 1.00 24.24 N ATOM 1729 CA ASN A 120 -15.943 16.588 -11.928 1.00 33.33 C ATOM 1730 C ASN A 120 -14.448 16.401 -12.164 1.00 41.42 C ATOM 1731 O ASN A 120 -13.942 16.776 -13.210 1.00 71.14 O ATOM 1732 CB ASN A 120 -16.289 17.880 -11.169 1.00 34.15 C ATOM 1733 CG ASN A 120 -15.594 19.113 -11.709 1.00 4.44 C ATOM 1734 OD1 ASN A 120 -16.061 19.731 -12.658 1.00 11.30 O ATOM 1735 ND2 ASN A 120 -14.534 19.514 -11.072 1.00 73.52 N ATOM 0 H ASN A 120 -16.629 15.451 -10.300 1.00 24.24 H new ATOM 0 HA ASN A 120 -16.351 16.684 -12.934 1.00 33.33 H new ATOM 0 HB2 ASN A 120 -17.367 18.036 -11.209 1.00 34.15 H new ATOM 0 HB3 ASN A 120 -16.023 17.755 -10.119 1.00 34.15 H new ATOM 0 HD21 ASN A 120 -14.061 20.371 -11.358 1.00 73.52 H new ATOM 0 HD22 ASN A 120 -14.176 18.971 -10.286 1.00 73.52 H new ATOM 1742 N LYS A 121 -13.761 15.800 -11.203 1.00 3.40 N ATOM 1743 CA LYS A 121 -12.290 15.520 -11.255 1.00 52.44 C ATOM 1744 C LYS A 121 -11.341 16.719 -11.490 1.00 60.15 C ATOM 1745 O LYS A 121 -10.118 16.542 -11.530 1.00 74.01 O ATOM 1746 CB LYS A 121 -11.848 14.249 -12.057 1.00 65.32 C ATOM 1747 CG LYS A 121 -12.503 13.969 -13.408 1.00 24.00 C ATOM 1748 CD LYS A 121 -13.784 13.169 -13.224 1.00 13.52 C ATOM 1749 CE LYS A 121 -14.436 12.798 -14.545 1.00 52.51 C ATOM 1750 NZ LYS A 121 -14.990 13.964 -15.256 1.00 75.41 N ATOM 0 H LYS A 121 -14.197 15.478 -10.339 1.00 3.40 H new ATOM 0 HA LYS A 121 -12.146 15.269 -10.204 1.00 52.44 H new ATOM 0 HB2 LYS A 121 -10.772 14.318 -12.219 1.00 65.32 H new ATOM 0 HB3 LYS A 121 -12.019 13.381 -11.421 1.00 65.32 H new ATOM 0 HG2 LYS A 121 -12.724 14.909 -13.913 1.00 24.00 H new ATOM 0 HG3 LYS A 121 -11.812 13.419 -14.047 1.00 24.00 H new ATOM 0 HD2 LYS A 121 -13.563 12.260 -12.664 1.00 13.52 H new ATOM 0 HD3 LYS A 121 -14.487 13.749 -12.626 1.00 13.52 H new ATOM 0 HE2 LYS A 121 -13.701 12.305 -15.182 1.00 52.51 H new ATOM 0 HE3 LYS A 121 -15.233 12.078 -14.362 1.00 52.51 H new ATOM 0 HZ1 LYS A 121 -15.377 13.660 -16.172 1.00 75.41 H new ATOM 0 HZ2 LYS A 121 -15.747 14.391 -14.685 1.00 75.41 H new ATOM 0 HZ3 LYS A 121 -14.238 14.665 -15.413 1.00 75.41 H new ATOM 1764 N ALA A 122 -11.873 17.908 -11.598 1.00 35.13 N ATOM 1765 CA ALA A 122 -11.049 19.102 -11.755 1.00 64.55 C ATOM 1766 C ALA A 122 -11.084 19.901 -10.461 1.00 52.01 C ATOM 1767 O ALA A 122 -10.599 21.032 -10.387 1.00 15.13 O ATOM 1768 CB ALA A 122 -11.559 19.946 -12.919 1.00 14.55 C ATOM 0 H ALA A 122 -12.877 18.087 -11.581 1.00 35.13 H new ATOM 0 HA ALA A 122 -10.021 18.812 -11.973 1.00 64.55 H new ATOM 0 HB1 ALA A 122 -10.936 20.834 -13.025 1.00 14.55 H new ATOM 0 HB2 ALA A 122 -11.518 19.361 -13.838 1.00 14.55 H new ATOM 0 HB3 ALA A 122 -12.589 20.247 -12.727 1.00 14.55 H new ATOM 1774 N ASP A 123 -11.644 19.279 -9.450 1.00 41.00 N ATOM 1775 CA ASP A 123 -11.873 19.870 -8.132 1.00 63.13 C ATOM 1776 C ASP A 123 -10.569 20.123 -7.406 1.00 4.22 C ATOM 1777 O ASP A 123 -9.773 19.203 -7.206 1.00 72.04 O ATOM 1778 CB ASP A 123 -12.747 18.922 -7.298 1.00 34.02 C ATOM 1779 CG ASP A 123 -14.038 18.603 -7.978 1.00 14.02 C ATOM 1780 OD1 ASP A 123 -14.011 17.886 -8.996 1.00 1.10 O ATOM 1781 OD2 ASP A 123 -15.105 19.043 -7.507 1.00 50.22 O ATOM 0 H ASP A 123 -11.967 18.314 -9.514 1.00 41.00 H new ATOM 0 HA ASP A 123 -12.376 20.827 -8.268 1.00 63.13 H new ATOM 0 HB2 ASP A 123 -12.200 17.998 -7.108 1.00 34.02 H new ATOM 0 HB3 ASP A 123 -12.951 19.377 -6.329 1.00 34.02 H new ATOM 1786 N PRO A 124 -10.322 21.368 -6.999 1.00 74.52 N ATOM 1787 CA PRO A 124 -9.114 21.725 -6.265 1.00 62.45 C ATOM 1788 C PRO A 124 -9.248 21.451 -4.759 1.00 3.11 C ATOM 1789 O PRO A 124 -8.278 21.549 -4.008 1.00 20.34 O ATOM 1790 CB PRO A 124 -8.997 23.226 -6.519 1.00 73.22 C ATOM 1791 CG PRO A 124 -10.404 23.700 -6.663 1.00 64.23 C ATOM 1792 CD PRO A 124 -11.191 22.548 -7.240 1.00 54.22 C ATOM 0 HA PRO A 124 -8.247 21.147 -6.585 1.00 62.45 H new ATOM 0 HB2 PRO A 124 -8.493 23.729 -5.693 1.00 73.22 H new ATOM 0 HB3 PRO A 124 -8.417 23.431 -7.419 1.00 73.22 H new ATOM 0 HG2 PRO A 124 -10.811 24.003 -5.698 1.00 64.23 H new ATOM 0 HG3 PRO A 124 -10.455 24.570 -7.318 1.00 64.23 H new ATOM 0 HD2 PRO A 124 -12.158 22.439 -6.749 1.00 54.22 H new ATOM 0 HD3 PRO A 124 -11.387 22.690 -8.303 1.00 54.22 H new ATOM 1800 N ASP A 125 -10.445 21.092 -4.348 1.00 32.42 N ATOM 1801 CA ASP A 125 -10.775 20.871 -2.942 1.00 31.15 C ATOM 1802 C ASP A 125 -10.594 19.422 -2.502 1.00 53.32 C ATOM 1803 O ASP A 125 -10.784 19.095 -1.327 1.00 63.30 O ATOM 1804 CB ASP A 125 -12.194 21.351 -2.655 1.00 14.01 C ATOM 1805 CG ASP A 125 -13.219 20.720 -3.556 1.00 31.13 C ATOM 1806 OD1 ASP A 125 -13.366 21.193 -4.703 1.00 24.01 O ATOM 1807 OD2 ASP A 125 -13.887 19.763 -3.146 1.00 3.32 O ATOM 0 H ASP A 125 -11.230 20.942 -4.981 1.00 32.42 H new ATOM 0 HA ASP A 125 -10.067 21.456 -2.355 1.00 31.15 H new ATOM 0 HB2 ASP A 125 -12.444 21.129 -1.617 1.00 14.01 H new ATOM 0 HB3 ASP A 125 -12.236 22.434 -2.769 1.00 14.01 H new ATOM 1812 N MET A 126 -10.234 18.559 -3.417 1.00 3.02 N ATOM 1813 CA MET A 126 -9.944 17.189 -3.051 1.00 72.31 C ATOM 1814 C MET A 126 -8.445 17.005 -3.015 1.00 61.31 C ATOM 1815 O MET A 126 -7.720 17.595 -3.830 1.00 64.44 O ATOM 1816 CB MET A 126 -10.586 16.210 -4.023 1.00 53.34 C ATOM 1817 CG MET A 126 -10.147 16.408 -5.449 1.00 52.13 C ATOM 1818 SD MET A 126 -10.920 15.291 -6.608 1.00 60.02 S ATOM 1819 CE MET A 126 -10.146 15.883 -8.090 1.00 50.33 C ATOM 0 H MET A 126 -10.134 18.772 -4.409 1.00 3.02 H new ATOM 0 HA MET A 126 -10.364 16.983 -2.066 1.00 72.31 H new ATOM 0 HB2 MET A 126 -10.345 15.193 -3.715 1.00 53.34 H new ATOM 0 HB3 MET A 126 -11.670 16.312 -3.967 1.00 53.34 H new ATOM 0 HG2 MET A 126 -10.366 17.433 -5.747 1.00 52.13 H new ATOM 0 HG3 MET A 126 -9.066 16.284 -5.506 1.00 52.13 H new ATOM 0 HE1 MET A 126 -9.824 15.036 -8.696 1.00 50.33 H new ATOM 0 HE2 MET A 126 -10.857 16.485 -8.656 1.00 50.33 H new ATOM 0 HE3 MET A 126 -9.280 16.492 -7.830 1.00 50.33 H new ATOM 1829 N PHE A 127 -7.969 16.224 -2.085 1.00 32.43 N ATOM 1830 CA PHE A 127 -6.551 16.029 -1.937 1.00 61.44 C ATOM 1831 C PHE A 127 -6.241 14.562 -1.838 1.00 73.42 C ATOM 1832 O PHE A 127 -6.895 13.821 -1.084 1.00 20.13 O ATOM 1833 CB PHE A 127 -6.017 16.770 -0.698 1.00 61.44 C ATOM 1834 CG PHE A 127 -6.277 18.252 -0.716 1.00 21.24 C ATOM 1835 CD1 PHE A 127 -5.519 19.093 -1.514 1.00 65.10 C ATOM 1836 CD2 PHE A 127 -7.292 18.803 0.053 1.00 43.33 C ATOM 1837 CE1 PHE A 127 -5.766 20.451 -1.544 1.00 0.11 C ATOM 1838 CE2 PHE A 127 -7.544 20.159 0.026 1.00 25.31 C ATOM 1839 CZ PHE A 127 -6.779 20.984 -0.773 1.00 51.12 C ATOM 0 H PHE A 127 -8.543 15.710 -1.416 1.00 32.43 H new ATOM 0 HA PHE A 127 -6.056 16.441 -2.817 1.00 61.44 H new ATOM 0 HB2 PHE A 127 -6.473 16.342 0.194 1.00 61.44 H new ATOM 0 HB3 PHE A 127 -4.943 16.600 -0.620 1.00 61.44 H new ATOM 0 HD1 PHE A 127 -4.725 18.682 -2.120 1.00 65.10 H new ATOM 0 HD2 PHE A 127 -7.893 18.162 0.681 1.00 43.33 H new ATOM 0 HE1 PHE A 127 -5.167 21.096 -2.170 1.00 0.11 H new ATOM 0 HE2 PHE A 127 -8.338 20.574 0.629 1.00 25.31 H new ATOM 0 HZ PHE A 127 -6.973 22.046 -0.795 1.00 51.12 H new ATOM 1849 N GLY A 128 -5.260 14.128 -2.592 1.00 74.23 N ATOM 1850 CA GLY A 128 -4.849 12.743 -2.564 1.00 12.13 C ATOM 1851 C GLY A 128 -3.926 12.474 -1.414 1.00 3.21 C ATOM 1852 O GLY A 128 -2.830 11.930 -1.594 1.00 23.30 O ATOM 0 H GLY A 128 -4.729 14.715 -3.235 1.00 74.23 H new ATOM 0 HA2 GLY A 128 -5.727 12.102 -2.486 1.00 12.13 H new ATOM 0 HA3 GLY A 128 -4.351 12.490 -3.500 1.00 12.13 H new ATOM 1856 N GLU A 129 -4.359 12.837 -0.228 1.00 64.04 N ATOM 1857 CA GLU A 129 -3.544 12.696 0.928 1.00 15.33 C ATOM 1858 C GLU A 129 -4.240 11.895 1.984 1.00 74.12 C ATOM 1859 O GLU A 129 -5.376 12.160 2.355 1.00 42.41 O ATOM 1860 CB GLU A 129 -3.069 14.046 1.488 1.00 75.13 C ATOM 1861 CG GLU A 129 -2.240 14.871 0.515 1.00 31.12 C ATOM 1862 CD GLU A 129 -1.672 16.120 1.142 1.00 30.04 C ATOM 1863 OE1 GLU A 129 -2.374 17.153 1.203 1.00 24.24 O ATOM 1864 OE2 GLU A 129 -0.511 16.083 1.586 1.00 73.22 O ATOM 0 H GLU A 129 -5.282 13.234 -0.052 1.00 64.04 H new ATOM 0 HA GLU A 129 -2.652 12.154 0.614 1.00 15.33 H new ATOM 0 HB2 GLU A 129 -3.940 14.628 1.789 1.00 75.13 H new ATOM 0 HB3 GLU A 129 -2.480 13.866 2.387 1.00 75.13 H new ATOM 0 HG2 GLU A 129 -1.424 14.259 0.131 1.00 31.12 H new ATOM 0 HG3 GLU A 129 -2.859 15.148 -0.338 1.00 31.12 H new ATOM 1871 N TRP A 130 -3.555 10.908 2.396 1.00 62.14 N ATOM 1872 CA TRP A 130 -3.920 10.012 3.432 1.00 74.41 C ATOM 1873 C TRP A 130 -2.669 9.989 4.282 1.00 70.42 C ATOM 1874 O TRP A 130 -1.619 10.326 3.743 1.00 64.21 O ATOM 1875 CB TRP A 130 -4.192 8.651 2.788 1.00 53.52 C ATOM 1876 CG TRP A 130 -4.961 7.686 3.601 1.00 72.32 C ATOM 1877 CD1 TRP A 130 -6.095 7.939 4.291 1.00 42.45 C ATOM 1878 CD2 TRP A 130 -4.704 6.286 3.745 1.00 71.21 C ATOM 1879 NE1 TRP A 130 -6.551 6.803 4.871 1.00 71.42 N ATOM 1880 CE2 TRP A 130 -5.715 5.769 4.563 1.00 13.13 C ATOM 1881 CE3 TRP A 130 -3.711 5.424 3.273 1.00 10.34 C ATOM 1882 CZ2 TRP A 130 -5.775 4.426 4.926 1.00 15.03 C ATOM 1883 CZ3 TRP A 130 -3.769 4.093 3.630 1.00 33.43 C ATOM 1884 CH2 TRP A 130 -4.796 3.605 4.449 1.00 63.23 C ATOM 0 H TRP A 130 -2.648 10.680 1.989 1.00 62.14 H new ATOM 0 HA TRP A 130 -4.806 10.278 4.008 1.00 74.41 H new ATOM 0 HB2 TRP A 130 -4.728 8.815 1.853 1.00 53.52 H new ATOM 0 HB3 TRP A 130 -3.235 8.196 2.531 1.00 53.52 H new ATOM 0 HD1 TRP A 130 -6.569 8.906 4.369 1.00 42.45 H new ATOM 0 HE1 TRP A 130 -7.389 6.731 5.448 1.00 71.42 H new ATOM 0 HE3 TRP A 130 -2.915 5.792 2.642 1.00 10.34 H new ATOM 0 HZ2 TRP A 130 -6.565 4.050 5.559 1.00 15.03 H new ATOM 0 HZ3 TRP A 130 -3.009 3.414 3.272 1.00 33.43 H new ATOM 0 HH2 TRP A 130 -4.813 2.557 4.708 1.00 63.23 H new ATOM 1895 N ASN A 131 -2.732 9.641 5.545 1.00 11.31 N ATOM 1896 CA ASN A 131 -1.511 9.650 6.398 1.00 23.21 C ATOM 1897 C ASN A 131 -0.351 8.873 5.737 1.00 1.45 C ATOM 1898 O ASN A 131 0.789 9.346 5.697 1.00 52.13 O ATOM 1899 CB ASN A 131 -1.800 9.107 7.812 1.00 44.35 C ATOM 1900 CG ASN A 131 -0.582 9.154 8.731 1.00 1.15 C ATOM 1901 OD1 ASN A 131 -0.335 10.159 9.407 1.00 43.22 O ATOM 1902 ND2 ASN A 131 0.156 8.072 8.795 1.00 4.32 N ATOM 0 H ASN A 131 -3.586 9.350 6.021 1.00 11.31 H new ATOM 0 HA ASN A 131 -1.201 10.690 6.499 1.00 23.21 H new ATOM 0 HB2 ASN A 131 -2.608 9.686 8.259 1.00 44.35 H new ATOM 0 HB3 ASN A 131 -2.150 8.078 7.735 1.00 44.35 H new ATOM 0 HD21 ASN A 131 0.964 8.042 9.417 1.00 4.32 H new ATOM 0 HD22 ASN A 131 -0.078 7.261 8.222 1.00 4.32 H new ATOM 1909 N PHE A 132 -0.657 7.701 5.193 1.00 65.32 N ATOM 1910 CA PHE A 132 0.342 6.889 4.491 1.00 30.44 C ATOM 1911 C PHE A 132 0.691 7.476 3.111 1.00 13.21 C ATOM 1912 O PHE A 132 1.859 7.480 2.699 1.00 13.11 O ATOM 1913 CB PHE A 132 -0.121 5.444 4.369 1.00 75.11 C ATOM 1914 CG PHE A 132 -0.367 4.786 5.690 1.00 23.41 C ATOM 1915 CD1 PHE A 132 0.661 4.150 6.362 1.00 44.23 C ATOM 1916 CD2 PHE A 132 -1.622 4.812 6.262 1.00 61.34 C ATOM 1917 CE1 PHE A 132 0.438 3.550 7.582 1.00 64.21 C ATOM 1918 CE2 PHE A 132 -1.854 4.215 7.481 1.00 53.05 C ATOM 1919 CZ PHE A 132 -0.821 3.582 8.142 1.00 21.41 C ATOM 0 H PHE A 132 -1.589 7.287 5.222 1.00 65.32 H new ATOM 0 HA PHE A 132 1.253 6.906 5.089 1.00 30.44 H new ATOM 0 HB2 PHE A 132 -1.037 5.412 3.779 1.00 75.11 H new ATOM 0 HB3 PHE A 132 0.630 4.874 3.822 1.00 75.11 H new ATOM 0 HD1 PHE A 132 1.649 4.123 5.926 1.00 44.23 H new ATOM 0 HD2 PHE A 132 -2.433 5.307 5.747 1.00 61.34 H new ATOM 0 HE1 PHE A 132 1.248 3.056 8.098 1.00 64.21 H new ATOM 0 HE2 PHE A 132 -2.841 4.242 7.918 1.00 53.05 H new ATOM 0 HZ PHE A 132 -0.999 3.112 9.098 1.00 21.41 H new ATOM 1929 N GLU A 133 -0.327 7.991 2.411 1.00 75.44 N ATOM 1930 CA GLU A 133 -0.141 8.620 1.087 1.00 50.10 C ATOM 1931 C GLU A 133 0.724 9.873 1.199 1.00 44.14 C ATOM 1932 O GLU A 133 1.389 10.256 0.260 1.00 1.23 O ATOM 1933 CB GLU A 133 -1.483 8.979 0.450 1.00 41.44 C ATOM 1934 CG GLU A 133 -2.375 7.802 0.098 1.00 14.11 C ATOM 1935 CD GLU A 133 -1.842 6.966 -1.023 1.00 63.24 C ATOM 1936 OE1 GLU A 133 -2.141 7.280 -2.186 1.00 63.44 O ATOM 1937 OE2 GLU A 133 -1.157 5.957 -0.761 1.00 33.05 O ATOM 0 H GLU A 133 -1.294 7.987 2.737 1.00 75.44 H new ATOM 0 HA GLU A 133 0.363 7.894 0.450 1.00 50.10 H new ATOM 0 HB2 GLU A 133 -2.026 9.633 1.133 1.00 41.44 H new ATOM 0 HB3 GLU A 133 -1.293 9.553 -0.457 1.00 41.44 H new ATOM 0 HG2 GLU A 133 -2.501 7.175 0.981 1.00 14.11 H new ATOM 0 HG3 GLU A 133 -3.363 8.173 -0.174 1.00 14.11 H new ATOM 1944 N GLU A 134 0.680 10.512 2.350 1.00 1.14 N ATOM 1945 CA GLU A 134 1.500 11.675 2.619 1.00 62.11 C ATOM 1946 C GLU A 134 2.975 11.288 2.586 1.00 52.22 C ATOM 1947 O GLU A 134 3.814 12.039 2.092 1.00 53.31 O ATOM 1948 CB GLU A 134 1.134 12.279 3.966 1.00 24.35 C ATOM 1949 CG GLU A 134 1.940 13.503 4.339 1.00 63.52 C ATOM 1950 CD GLU A 134 1.541 14.049 5.670 1.00 32.43 C ATOM 1951 OE1 GLU A 134 2.025 13.541 6.697 1.00 10.12 O ATOM 1952 OE2 GLU A 134 0.729 14.988 5.715 1.00 14.22 O ATOM 0 H GLU A 134 0.075 10.240 3.125 1.00 1.14 H new ATOM 0 HA GLU A 134 1.318 12.424 1.849 1.00 62.11 H new ATOM 0 HB2 GLU A 134 0.077 12.544 3.957 1.00 24.35 H new ATOM 0 HB3 GLU A 134 1.267 11.522 4.739 1.00 24.35 H new ATOM 0 HG2 GLU A 134 3.000 13.249 4.354 1.00 63.52 H new ATOM 0 HG3 GLU A 134 1.807 14.271 3.577 1.00 63.52 H new ATOM 1959 N TRP A 135 3.292 10.108 3.088 1.00 1.52 N ATOM 1960 CA TRP A 135 4.654 9.655 3.040 1.00 30.11 C ATOM 1961 C TRP A 135 4.998 9.235 1.617 1.00 22.11 C ATOM 1962 O TRP A 135 6.112 9.428 1.163 1.00 63.43 O ATOM 1963 CB TRP A 135 4.932 8.540 4.048 1.00 2.11 C ATOM 1964 CG TRP A 135 6.380 8.152 4.086 1.00 24.24 C ATOM 1965 CD1 TRP A 135 6.922 6.945 3.767 1.00 42.53 C ATOM 1966 CD2 TRP A 135 7.480 9.008 4.429 1.00 30.12 C ATOM 1967 NE1 TRP A 135 8.286 6.991 3.919 1.00 4.34 N ATOM 1968 CE2 TRP A 135 8.650 8.247 4.321 1.00 5.52 C ATOM 1969 CE3 TRP A 135 7.580 10.344 4.826 1.00 22.11 C ATOM 1970 CZ2 TRP A 135 9.912 8.773 4.594 1.00 61.30 C ATOM 1971 CZ3 TRP A 135 8.829 10.867 5.093 1.00 31.21 C ATOM 1972 CH2 TRP A 135 9.979 10.083 4.976 1.00 32.14 C ATOM 0 H TRP A 135 2.633 9.463 3.524 1.00 1.52 H new ATOM 0 HA TRP A 135 5.302 10.482 3.330 1.00 30.11 H new ATOM 0 HB2 TRP A 135 4.620 8.865 5.040 1.00 2.11 H new ATOM 0 HB3 TRP A 135 4.331 7.667 3.795 1.00 2.11 H new ATOM 0 HD1 TRP A 135 6.363 6.080 3.443 1.00 42.53 H new ATOM 0 HE1 TRP A 135 8.926 6.213 3.758 1.00 4.34 H new ATOM 0 HE3 TRP A 135 6.696 10.956 4.922 1.00 22.11 H new ATOM 0 HZ2 TRP A 135 10.802 8.168 4.507 1.00 61.30 H new ATOM 0 HZ3 TRP A 135 8.919 11.899 5.397 1.00 31.21 H new ATOM 0 HH2 TRP A 135 10.942 10.522 5.192 1.00 32.14 H new ATOM 1983 N LYS A 136 4.004 8.690 0.916 1.00 65.45 N ATOM 1984 CA LYS A 136 4.131 8.339 -0.508 1.00 1.42 C ATOM 1985 C LYS A 136 4.524 9.606 -1.278 1.00 71.41 C ATOM 1986 O LYS A 136 5.426 9.596 -2.120 1.00 1.11 O ATOM 1987 CB LYS A 136 2.778 7.841 -1.012 1.00 23.24 C ATOM 1988 CG LYS A 136 2.731 7.422 -2.467 1.00 33.34 C ATOM 1989 CD LYS A 136 1.292 7.183 -2.881 1.00 63.02 C ATOM 1990 CE LYS A 136 1.176 6.679 -4.303 1.00 34.33 C ATOM 1991 NZ LYS A 136 1.770 5.340 -4.470 1.00 14.42 N ATOM 0 H LYS A 136 3.089 8.478 1.313 1.00 65.45 H new ATOM 0 HA LYS A 136 4.883 7.563 -0.650 1.00 1.42 H new ATOM 0 HB2 LYS A 136 2.473 6.993 -0.399 1.00 23.24 H new ATOM 0 HB3 LYS A 136 2.041 8.629 -0.856 1.00 23.24 H new ATOM 0 HG2 LYS A 136 3.177 8.195 -3.093 1.00 33.34 H new ATOM 0 HG3 LYS A 136 3.318 6.515 -2.614 1.00 33.34 H new ATOM 0 HD2 LYS A 136 0.838 6.460 -2.204 1.00 63.02 H new ATOM 0 HD3 LYS A 136 0.729 8.111 -2.780 1.00 63.02 H new ATOM 0 HE2 LYS A 136 0.125 6.647 -4.591 1.00 34.33 H new ATOM 0 HE3 LYS A 136 1.669 7.380 -4.976 1.00 34.33 H new ATOM 0 HZ1 LYS A 136 1.507 4.957 -5.401 1.00 14.42 H new ATOM 0 HZ2 LYS A 136 2.806 5.409 -4.404 1.00 14.42 H new ATOM 0 HZ3 LYS A 136 1.417 4.708 -3.723 1.00 14.42 H new ATOM 2005 N ARG A 137 3.833 10.687 -0.946 1.00 63.01 N ATOM 2006 CA ARG A 137 4.083 12.016 -1.461 1.00 65.04 C ATOM 2007 C ARG A 137 5.533 12.439 -1.271 1.00 31.21 C ATOM 2008 O ARG A 137 6.195 12.857 -2.213 1.00 61.13 O ATOM 2009 CB ARG A 137 3.155 13.014 -0.741 1.00 71.21 C ATOM 2010 CG ARG A 137 3.601 14.458 -0.832 1.00 34.04 C ATOM 2011 CD ARG A 137 2.636 15.412 -0.161 1.00 22.21 C ATOM 2012 NE ARG A 137 3.102 16.790 -0.300 1.00 21.13 N ATOM 2013 CZ ARG A 137 2.536 17.874 0.234 1.00 13.14 C ATOM 2014 NH1 ARG A 137 1.427 17.784 0.962 1.00 41.44 N ATOM 2015 NH2 ARG A 137 3.079 19.057 0.015 1.00 34.43 N ATOM 0 H ARG A 137 3.056 10.656 -0.286 1.00 63.01 H new ATOM 0 HA ARG A 137 3.882 12.008 -2.532 1.00 65.04 H new ATOM 0 HB2 ARG A 137 2.153 12.928 -1.161 1.00 71.21 H new ATOM 0 HB3 ARG A 137 3.085 12.733 0.310 1.00 71.21 H new ATOM 0 HG2 ARG A 137 4.584 14.560 -0.373 1.00 34.04 H new ATOM 0 HG3 ARG A 137 3.709 14.735 -1.881 1.00 34.04 H new ATOM 0 HD2 ARG A 137 1.646 15.310 -0.605 1.00 22.21 H new ATOM 0 HD3 ARG A 137 2.540 15.159 0.895 1.00 22.21 H new ATOM 0 HE ARG A 137 3.942 16.938 -0.860 1.00 21.13 H new ATOM 0 HH11 ARG A 137 0.994 16.874 1.121 1.00 41.44 H new ATOM 0 HH12 ARG A 137 1.010 18.625 1.362 1.00 41.44 H new ATOM 0 HH21 ARG A 137 3.921 19.134 -0.556 1.00 34.43 H new ATOM 0 HH22 ARG A 137 2.657 19.894 0.417 1.00 34.43 H new ATOM 2029 N LEU A 138 6.014 12.309 -0.069 1.00 65.45 N ATOM 2030 CA LEU A 138 7.341 12.771 0.277 1.00 63.41 C ATOM 2031 C LEU A 138 8.419 11.814 -0.208 1.00 34.13 C ATOM 2032 O LEU A 138 9.558 12.215 -0.471 1.00 72.24 O ATOM 2033 CB LEU A 138 7.389 13.044 1.760 1.00 60.12 C ATOM 2034 CG LEU A 138 6.346 14.078 2.201 1.00 52.30 C ATOM 2035 CD1 LEU A 138 6.311 14.232 3.681 1.00 24.44 C ATOM 2036 CD2 LEU A 138 6.591 15.424 1.530 1.00 53.04 C ATOM 0 H LEU A 138 5.504 11.881 0.704 1.00 65.45 H new ATOM 0 HA LEU A 138 7.556 13.706 -0.241 1.00 63.41 H new ATOM 0 HB2 LEU A 138 7.225 12.113 2.303 1.00 60.12 H new ATOM 0 HB3 LEU A 138 8.384 13.399 2.029 1.00 60.12 H new ATOM 0 HG LEU A 138 5.372 13.706 1.884 1.00 52.30 H new ATOM 0 HD11 LEU A 138 5.559 14.973 3.952 1.00 24.44 H new ATOM 0 HD12 LEU A 138 6.060 13.276 4.140 1.00 24.44 H new ATOM 0 HD13 LEU A 138 7.288 14.560 4.036 1.00 24.44 H new ATOM 0 HD21 LEU A 138 5.837 16.138 1.861 1.00 53.04 H new ATOM 0 HD22 LEU A 138 7.581 15.791 1.801 1.00 53.04 H new ATOM 0 HD23 LEU A 138 6.530 15.308 0.448 1.00 53.04 H new ATOM 2048 N HIS A 139 8.044 10.567 -0.348 1.00 40.14 N ATOM 2049 CA HIS A 139 8.910 9.557 -0.960 1.00 53.11 C ATOM 2050 C HIS A 139 9.065 9.889 -2.441 1.00 52.22 C ATOM 2051 O HIS A 139 10.153 9.760 -3.017 1.00 25.13 O ATOM 2052 CB HIS A 139 8.307 8.136 -0.782 1.00 55.00 C ATOM 2053 CG HIS A 139 9.104 7.005 -1.415 1.00 34.43 C ATOM 2054 ND1 HIS A 139 10.036 6.259 -0.733 1.00 52.25 N ATOM 2055 CD2 HIS A 139 9.068 6.484 -2.672 1.00 14.31 C ATOM 2056 CE1 HIS A 139 10.538 5.339 -1.532 1.00 32.22 C ATOM 2057 NE2 HIS A 139 9.970 5.455 -2.711 1.00 11.14 N ATOM 0 H HIS A 139 7.137 10.212 -0.047 1.00 40.14 H new ATOM 0 HA HIS A 139 9.885 9.565 -0.473 1.00 53.11 H new ATOM 0 HB2 HIS A 139 8.205 7.934 0.284 1.00 55.00 H new ATOM 0 HB3 HIS A 139 7.302 8.131 -1.205 1.00 55.00 H new ATOM 0 HD2 HIS A 139 8.444 6.820 -3.487 1.00 14.31 H new ATOM 0 HE1 HIS A 139 11.290 4.612 -1.263 1.00 32.22 H new ATOM 0 HE2 HIS A 139 10.169 4.872 -3.524 1.00 11.14 H new ATOM 2066 N LYS A 140 7.970 10.321 -3.048 1.00 52.51 N ATOM 2067 CA LYS A 140 7.975 10.745 -4.432 1.00 21.01 C ATOM 2068 C LYS A 140 8.744 12.044 -4.565 1.00 74.02 C ATOM 2069 O LYS A 140 9.452 12.240 -5.522 1.00 32.52 O ATOM 2070 CB LYS A 140 6.544 10.935 -4.967 1.00 71.34 C ATOM 2071 CG LYS A 140 6.490 11.373 -6.436 1.00 44.13 C ATOM 2072 CD LYS A 140 5.071 11.606 -6.935 1.00 55.44 C ATOM 2073 CE LYS A 140 4.399 12.762 -6.206 1.00 64.40 C ATOM 2074 NZ LYS A 140 3.062 13.049 -6.751 1.00 74.02 N ATOM 0 H LYS A 140 7.059 10.386 -2.594 1.00 52.51 H new ATOM 0 HA LYS A 140 8.457 9.966 -5.022 1.00 21.01 H new ATOM 0 HB2 LYS A 140 5.996 9.999 -4.855 1.00 71.34 H new ATOM 0 HB3 LYS A 140 6.032 11.679 -4.356 1.00 71.34 H new ATOM 0 HG2 LYS A 140 7.067 12.290 -6.558 1.00 44.13 H new ATOM 0 HG3 LYS A 140 6.966 10.612 -7.054 1.00 44.13 H new ATOM 0 HD2 LYS A 140 5.091 11.813 -8.005 1.00 55.44 H new ATOM 0 HD3 LYS A 140 4.483 10.698 -6.797 1.00 55.44 H new ATOM 0 HE2 LYS A 140 4.316 12.524 -5.146 1.00 64.40 H new ATOM 0 HE3 LYS A 140 5.022 13.653 -6.285 1.00 64.40 H new ATOM 0 HZ1 LYS A 140 2.637 13.842 -6.229 1.00 74.02 H new ATOM 0 HZ2 LYS A 140 3.144 13.301 -7.757 1.00 74.02 H new ATOM 0 HZ3 LYS A 140 2.459 12.207 -6.653 1.00 74.02 H new ATOM 2088 N LYS A 141 8.602 12.911 -3.566 1.00 63.34 N ATOM 2089 CA LYS A 141 9.228 14.241 -3.536 1.00 43.33 C ATOM 2090 C LYS A 141 10.746 14.176 -3.781 1.00 72.14 C ATOM 2091 O LYS A 141 11.321 15.094 -4.369 1.00 42.21 O ATOM 2092 CB LYS A 141 8.914 14.950 -2.204 1.00 62.43 C ATOM 2093 CG LYS A 141 9.442 16.378 -2.082 1.00 12.42 C ATOM 2094 CD LYS A 141 8.819 17.314 -3.113 1.00 11.41 C ATOM 2095 CE LYS A 141 9.348 18.730 -2.954 1.00 71.14 C ATOM 2096 NZ LYS A 141 8.733 19.669 -3.918 1.00 33.45 N ATOM 0 H LYS A 141 8.041 12.711 -2.738 1.00 63.34 H new ATOM 0 HA LYS A 141 8.802 14.822 -4.354 1.00 43.33 H new ATOM 0 HB2 LYS A 141 7.833 14.968 -2.067 1.00 62.43 H new ATOM 0 HB3 LYS A 141 9.329 14.356 -1.389 1.00 62.43 H new ATOM 0 HG2 LYS A 141 9.236 16.755 -1.080 1.00 12.42 H new ATOM 0 HG3 LYS A 141 10.525 16.375 -2.205 1.00 12.42 H new ATOM 0 HD2 LYS A 141 9.037 16.951 -4.117 1.00 11.41 H new ATOM 0 HD3 LYS A 141 7.735 17.313 -3.002 1.00 11.41 H new ATOM 0 HE2 LYS A 141 9.155 19.076 -1.939 1.00 71.14 H new ATOM 0 HE3 LYS A 141 10.429 18.729 -3.090 1.00 71.14 H new ATOM 0 HZ1 LYS A 141 9.124 20.622 -3.772 1.00 33.45 H new ATOM 0 HZ2 LYS A 141 8.939 19.355 -4.888 1.00 33.45 H new ATOM 0 HZ3 LYS A 141 7.703 19.691 -3.772 1.00 33.45 H new ATOM 2110 N LYS A 142 11.383 13.089 -3.352 1.00 71.45 N ATOM 2111 CA LYS A 142 12.819 12.925 -3.578 1.00 73.50 C ATOM 2112 C LYS A 142 13.081 12.788 -5.064 1.00 31.40 C ATOM 2113 O LYS A 142 14.027 13.350 -5.610 1.00 71.23 O ATOM 2114 CB LYS A 142 13.361 11.675 -2.876 1.00 21.42 C ATOM 2115 CG LYS A 142 14.883 11.565 -2.931 1.00 34.15 C ATOM 2116 CD LYS A 142 15.529 12.827 -2.375 1.00 43.14 C ATOM 2117 CE LYS A 142 17.034 12.805 -2.486 1.00 31.24 C ATOM 2118 NZ LYS A 142 17.606 14.109 -2.089 1.00 21.22 N ATOM 0 H LYS A 142 10.937 12.319 -2.853 1.00 71.45 H new ATOM 0 HA LYS A 142 13.322 13.802 -3.171 1.00 73.50 H new ATOM 0 HB2 LYS A 142 13.042 11.684 -1.834 1.00 21.42 H new ATOM 0 HB3 LYS A 142 12.923 10.789 -3.336 1.00 21.42 H new ATOM 0 HG2 LYS A 142 15.212 10.698 -2.358 1.00 34.15 H new ATOM 0 HG3 LYS A 142 15.205 11.407 -3.960 1.00 34.15 H new ATOM 0 HD2 LYS A 142 15.142 13.695 -2.909 1.00 43.14 H new ATOM 0 HD3 LYS A 142 15.247 12.944 -1.329 1.00 43.14 H new ATOM 0 HE2 LYS A 142 17.439 12.016 -1.852 1.00 31.24 H new ATOM 0 HE3 LYS A 142 17.325 12.571 -3.510 1.00 31.24 H new ATOM 0 HZ1 LYS A 142 18.621 14.126 -2.315 1.00 21.22 H new ATOM 0 HZ2 LYS A 142 17.123 14.872 -2.606 1.00 21.22 H new ATOM 0 HZ3 LYS A 142 17.477 14.248 -1.066 1.00 21.22 H new ATOM 2132 N PHE A 143 12.216 12.061 -5.699 1.00 0.23 N ATOM 2133 CA PHE A 143 12.317 11.767 -7.092 1.00 13.22 C ATOM 2134 C PHE A 143 11.890 13.005 -7.876 1.00 71.14 C ATOM 2135 O PHE A 143 12.393 13.291 -8.955 1.00 5.54 O ATOM 2136 CB PHE A 143 11.399 10.590 -7.398 1.00 33.13 C ATOM 2137 CG PHE A 143 11.717 9.894 -8.660 1.00 50.43 C ATOM 2138 CD1 PHE A 143 12.727 8.966 -8.671 1.00 13.03 C ATOM 2139 CD2 PHE A 143 11.014 10.148 -9.826 1.00 20.01 C ATOM 2140 CE1 PHE A 143 13.050 8.286 -9.826 1.00 12.03 C ATOM 2141 CE2 PHE A 143 11.328 9.477 -10.991 1.00 75.34 C ATOM 2142 CZ PHE A 143 12.348 8.542 -10.992 1.00 13.14 C ATOM 0 H PHE A 143 11.400 11.645 -5.250 1.00 0.23 H new ATOM 0 HA PHE A 143 13.337 11.505 -7.372 1.00 13.22 H new ATOM 0 HB2 PHE A 143 11.455 9.876 -6.577 1.00 33.13 H new ATOM 0 HB3 PHE A 143 10.370 10.946 -7.441 1.00 33.13 H new ATOM 0 HD1 PHE A 143 13.276 8.765 -7.763 1.00 13.03 H new ATOM 0 HD2 PHE A 143 10.216 10.875 -9.824 1.00 20.01 H new ATOM 0 HE1 PHE A 143 13.847 7.557 -9.821 1.00 12.03 H new ATOM 0 HE2 PHE A 143 10.779 9.681 -11.899 1.00 75.34 H new ATOM 0 HZ PHE A 143 12.596 8.013 -11.900 1.00 13.14 H new ATOM 2152 N ILE A 144 10.964 13.735 -7.291 1.00 43.32 N ATOM 2153 CA ILE A 144 10.447 14.963 -7.847 1.00 14.40 C ATOM 2154 C ILE A 144 11.548 15.998 -8.057 1.00 45.34 C ATOM 2155 O ILE A 144 11.471 16.767 -8.976 1.00 14.25 O ATOM 2156 CB ILE A 144 9.246 15.543 -7.021 1.00 12.53 C ATOM 2157 CG1 ILE A 144 8.087 14.552 -7.006 1.00 40.22 C ATOM 2158 CG2 ILE A 144 8.755 16.868 -7.571 1.00 61.33 C ATOM 2159 CD1 ILE A 144 7.555 14.189 -8.389 1.00 70.20 C ATOM 0 H ILE A 144 10.542 13.484 -6.397 1.00 43.32 H new ATOM 0 HA ILE A 144 10.048 14.712 -8.830 1.00 14.40 H new ATOM 0 HB ILE A 144 9.613 15.711 -6.008 1.00 12.53 H new ATOM 0 HG12 ILE A 144 8.410 13.641 -6.503 1.00 40.22 H new ATOM 0 HG13 ILE A 144 7.273 14.971 -6.415 1.00 40.22 H new ATOM 0 HG21 ILE A 144 7.923 17.228 -6.965 1.00 61.33 H new ATOM 0 HG22 ILE A 144 9.566 17.596 -7.544 1.00 61.33 H new ATOM 0 HG23 ILE A 144 8.422 16.734 -8.600 1.00 61.33 H new ATOM 0 HD11 ILE A 144 6.733 13.480 -8.288 1.00 70.20 H new ATOM 0 HD12 ILE A 144 7.198 15.089 -8.890 1.00 70.20 H new ATOM 0 HD13 ILE A 144 8.353 13.738 -8.979 1.00 70.20 H new ATOM 2171 N GLU A 145 12.580 16.001 -7.208 1.00 64.44 N ATOM 2172 CA GLU A 145 13.692 16.953 -7.373 1.00 32.20 C ATOM 2173 C GLU A 145 14.272 16.916 -8.806 1.00 51.43 C ATOM 2174 O GLU A 145 14.489 17.964 -9.422 1.00 14.04 O ATOM 2175 CB GLU A 145 14.812 16.713 -6.369 1.00 60.13 C ATOM 2176 CG GLU A 145 14.406 16.814 -4.915 1.00 44.11 C ATOM 2177 CD GLU A 145 15.601 16.710 -4.005 1.00 41.32 C ATOM 2178 OE1 GLU A 145 16.103 15.600 -3.780 1.00 51.35 O ATOM 2179 OE2 GLU A 145 16.088 17.755 -3.525 1.00 42.24 O ATOM 0 H GLU A 145 12.673 15.369 -6.413 1.00 64.44 H new ATOM 0 HA GLU A 145 13.268 17.940 -7.188 1.00 32.20 H new ATOM 0 HB2 GLU A 145 15.230 15.722 -6.545 1.00 60.13 H new ATOM 0 HB3 GLU A 145 15.608 17.433 -6.558 1.00 60.13 H new ATOM 0 HG2 GLU A 145 13.896 17.762 -4.743 1.00 44.11 H new ATOM 0 HG3 GLU A 145 13.695 16.022 -4.678 1.00 44.11 H new ATOM 2186 N THR A 146 14.491 15.723 -9.343 1.00 63.51 N ATOM 2187 CA THR A 146 15.007 15.606 -10.698 1.00 5.25 C ATOM 2188 C THR A 146 13.874 15.818 -11.705 1.00 72.30 C ATOM 2189 O THR A 146 14.076 16.352 -12.808 1.00 5.02 O ATOM 2190 CB THR A 146 15.696 14.213 -10.968 1.00 54.23 C ATOM 2191 OG1 THR A 146 16.346 14.232 -12.245 1.00 22.54 O ATOM 2192 CG2 THR A 146 14.672 13.072 -10.978 1.00 33.54 C ATOM 0 H THR A 146 14.322 14.836 -8.869 1.00 63.51 H new ATOM 0 HA THR A 146 15.770 16.376 -10.817 1.00 5.25 H new ATOM 0 HB THR A 146 16.415 14.045 -10.166 1.00 54.23 H new ATOM 0 HG1 THR A 146 16.774 13.365 -12.407 1.00 22.54 H new ATOM 0 HG21 THR A 146 15.182 12.127 -11.167 1.00 33.54 H new ATOM 0 HG22 THR A 146 14.169 13.026 -10.012 1.00 33.54 H new ATOM 0 HG23 THR A 146 13.936 13.250 -11.762 1.00 33.54 H new ATOM 2200 N PHE A 147 12.676 15.454 -11.293 1.00 74.13 N ATOM 2201 CA PHE A 147 11.536 15.459 -12.163 1.00 42.53 C ATOM 2202 C PHE A 147 11.045 16.878 -12.388 1.00 45.22 C ATOM 2203 O PHE A 147 10.518 17.195 -13.427 1.00 32.43 O ATOM 2204 CB PHE A 147 10.436 14.585 -11.579 1.00 24.14 C ATOM 2205 CG PHE A 147 9.514 14.063 -12.615 1.00 71.32 C ATOM 2206 CD1 PHE A 147 9.910 12.987 -13.369 1.00 2.25 C ATOM 2207 CD2 PHE A 147 8.274 14.629 -12.849 1.00 32.20 C ATOM 2208 CE1 PHE A 147 9.113 12.468 -14.336 1.00 74.51 C ATOM 2209 CE2 PHE A 147 7.448 14.111 -13.830 1.00 71.12 C ATOM 2210 CZ PHE A 147 7.871 13.025 -14.579 1.00 33.00 C ATOM 0 H PHE A 147 12.474 15.147 -10.342 1.00 74.13 H new ATOM 0 HA PHE A 147 11.825 15.049 -13.131 1.00 42.53 H new ATOM 0 HB2 PHE A 147 10.887 13.749 -11.044 1.00 24.14 H new ATOM 0 HB3 PHE A 147 9.868 15.161 -10.849 1.00 24.14 H new ATOM 0 HD1 PHE A 147 10.878 12.543 -13.188 1.00 2.25 H new ATOM 0 HD2 PHE A 147 7.950 15.477 -12.264 1.00 32.20 H new ATOM 0 HE1 PHE A 147 9.448 11.621 -14.916 1.00 74.51 H new ATOM 0 HE2 PHE A 147 6.478 14.551 -14.011 1.00 71.12 H new ATOM 0 HZ PHE A 147 7.234 12.615 -15.349 1.00 33.00 H new ATOM 2220 N LYS A 148 11.243 17.710 -11.396 1.00 30.33 N ATOM 2221 CA LYS A 148 10.882 19.119 -11.415 1.00 14.14 C ATOM 2222 C LYS A 148 11.588 19.821 -12.579 1.00 44.44 C ATOM 2223 O LYS A 148 11.017 20.687 -13.229 1.00 72.21 O ATOM 2224 CB LYS A 148 11.287 19.741 -10.059 1.00 54.43 C ATOM 2225 CG LYS A 148 10.973 21.231 -9.796 1.00 33.01 C ATOM 2226 CD LYS A 148 9.472 21.581 -9.773 1.00 52.34 C ATOM 2227 CE LYS A 148 8.882 21.790 -11.162 1.00 75.02 C ATOM 2228 NZ LYS A 148 9.544 22.911 -11.859 1.00 50.02 N ATOM 0 H LYS A 148 11.675 17.421 -10.518 1.00 30.33 H new ATOM 0 HA LYS A 148 9.808 19.238 -11.559 1.00 14.14 H new ATOM 0 HB2 LYS A 148 10.805 19.159 -9.273 1.00 54.43 H new ATOM 0 HB3 LYS A 148 12.362 19.606 -9.943 1.00 54.43 H new ATOM 0 HG2 LYS A 148 11.413 21.517 -8.841 1.00 33.01 H new ATOM 0 HG3 LYS A 148 11.460 21.832 -10.564 1.00 33.01 H new ATOM 0 HD2 LYS A 148 8.927 20.782 -9.271 1.00 52.34 H new ATOM 0 HD3 LYS A 148 9.326 22.486 -9.183 1.00 52.34 H new ATOM 0 HE2 LYS A 148 8.992 20.878 -11.748 1.00 75.02 H new ATOM 0 HE3 LYS A 148 7.813 21.989 -11.080 1.00 75.02 H new ATOM 0 HZ1 LYS A 148 8.980 23.186 -12.689 1.00 50.02 H new ATOM 0 HZ2 LYS A 148 9.626 23.722 -11.213 1.00 50.02 H new ATOM 0 HZ3 LYS A 148 10.493 22.616 -12.167 1.00 50.02 H new ATOM 2242 N LYS A 149 12.819 19.416 -12.845 1.00 51.21 N ATOM 2243 CA LYS A 149 13.584 19.970 -13.952 1.00 11.53 C ATOM 2244 C LYS A 149 13.059 19.422 -15.276 1.00 63.33 C ATOM 2245 O LYS A 149 12.945 20.144 -16.259 1.00 75.10 O ATOM 2246 CB LYS A 149 15.080 19.687 -13.770 1.00 13.43 C ATOM 2247 CG LYS A 149 15.676 20.368 -12.536 1.00 41.33 C ATOM 2248 CD LYS A 149 17.159 20.055 -12.340 1.00 60.53 C ATOM 2249 CE LYS A 149 17.399 18.578 -12.043 1.00 71.24 C ATOM 2250 NZ LYS A 149 18.833 18.280 -11.831 1.00 1.42 N ATOM 0 H LYS A 149 13.312 18.703 -12.308 1.00 51.21 H new ATOM 0 HA LYS A 149 13.460 21.053 -13.966 1.00 11.53 H new ATOM 0 HB2 LYS A 149 15.233 18.611 -13.692 1.00 13.43 H new ATOM 0 HB3 LYS A 149 15.617 20.022 -14.657 1.00 13.43 H new ATOM 0 HG2 LYS A 149 15.546 21.447 -12.625 1.00 41.33 H new ATOM 0 HG3 LYS A 149 15.123 20.052 -11.651 1.00 41.33 H new ATOM 0 HD2 LYS A 149 17.711 20.338 -13.236 1.00 60.53 H new ATOM 0 HD3 LYS A 149 17.551 20.658 -11.521 1.00 60.53 H new ATOM 0 HE2 LYS A 149 16.834 18.290 -11.156 1.00 71.24 H new ATOM 0 HE3 LYS A 149 17.022 17.976 -12.870 1.00 71.24 H new ATOM 0 HZ1 LYS A 149 18.951 17.266 -11.632 1.00 1.42 H new ATOM 0 HZ2 LYS A 149 19.370 18.530 -12.686 1.00 1.42 H new ATOM 0 HZ3 LYS A 149 19.187 18.834 -11.025 1.00 1.42 H new ATOM 2264 N ILE A 150 12.704 18.143 -15.268 1.00 24.41 N ATOM 2265 CA ILE A 150 12.123 17.476 -16.436 1.00 44.55 C ATOM 2266 C ILE A 150 10.779 18.121 -16.775 1.00 33.43 C ATOM 2267 O ILE A 150 10.446 18.339 -17.940 1.00 63.44 O ATOM 2268 CB ILE A 150 11.883 15.965 -16.143 1.00 71.10 C ATOM 2269 CG1 ILE A 150 13.200 15.274 -15.787 1.00 3.33 C ATOM 2270 CG2 ILE A 150 11.207 15.271 -17.329 1.00 14.44 C ATOM 2271 CD1 ILE A 150 13.051 13.813 -15.417 1.00 43.31 C ATOM 0 H ILE A 150 12.809 17.536 -14.455 1.00 24.41 H new ATOM 0 HA ILE A 150 12.818 17.577 -17.270 1.00 44.55 H new ATOM 0 HB ILE A 150 11.211 15.889 -15.288 1.00 71.10 H new ATOM 0 HG12 ILE A 150 13.881 15.356 -16.634 1.00 3.33 H new ATOM 0 HG13 ILE A 150 13.662 15.803 -14.954 1.00 3.33 H new ATOM 0 HG21 ILE A 150 11.053 14.218 -17.095 1.00 14.44 H new ATOM 0 HG22 ILE A 150 10.245 15.743 -17.527 1.00 14.44 H new ATOM 0 HG23 ILE A 150 11.842 15.357 -18.211 1.00 14.44 H new ATOM 0 HD11 ILE A 150 14.030 13.396 -15.178 1.00 43.31 H new ATOM 0 HD12 ILE A 150 12.397 13.722 -14.550 1.00 43.31 H new ATOM 0 HD13 ILE A 150 12.619 13.267 -16.256 1.00 43.31 H new ATOM 2283 N MET A 151 10.033 18.437 -15.732 1.00 72.32 N ATOM 2284 CA MET A 151 8.728 19.018 -15.821 1.00 1.22 C ATOM 2285 C MET A 151 8.762 20.359 -16.544 1.00 60.15 C ATOM 2286 O MET A 151 7.826 20.701 -17.231 1.00 14.34 O ATOM 2287 CB MET A 151 8.146 19.174 -14.419 1.00 25.10 C ATOM 2288 CG MET A 151 6.740 19.690 -14.399 1.00 73.40 C ATOM 2289 SD MET A 151 6.081 19.868 -12.725 1.00 5.42 S ATOM 2290 CE MET A 151 4.427 20.464 -13.086 1.00 31.33 C ATOM 0 H MET A 151 10.340 18.286 -14.771 1.00 72.32 H new ATOM 0 HA MET A 151 8.091 18.354 -16.405 1.00 1.22 H new ATOM 0 HB2 MET A 151 8.175 18.208 -13.915 1.00 25.10 H new ATOM 0 HB3 MET A 151 8.779 19.852 -13.847 1.00 25.10 H new ATOM 0 HG2 MET A 151 6.706 20.656 -14.902 1.00 73.40 H new ATOM 0 HG3 MET A 151 6.101 19.012 -14.966 1.00 73.40 H new ATOM 0 HE1 MET A 151 3.886 20.624 -12.153 1.00 31.33 H new ATOM 0 HE2 MET A 151 4.491 21.404 -13.635 1.00 31.33 H new ATOM 0 HE3 MET A 151 3.898 19.726 -13.690 1.00 31.33 H new ATOM 2300 N GLU A 152 9.862 21.088 -16.409 1.00 14.43 N ATOM 2301 CA GLU A 152 10.020 22.380 -17.087 1.00 73.11 C ATOM 2302 C GLU A 152 10.048 22.171 -18.589 1.00 40.34 C ATOM 2303 O GLU A 152 9.539 22.983 -19.360 1.00 44.43 O ATOM 2304 CB GLU A 152 11.322 23.051 -16.660 1.00 24.35 C ATOM 2305 CG GLU A 152 11.434 23.295 -15.175 1.00 24.41 C ATOM 2306 CD GLU A 152 10.368 24.210 -14.643 1.00 72.12 C ATOM 2307 OE1 GLU A 152 9.260 23.733 -14.333 1.00 53.12 O ATOM 2308 OE2 GLU A 152 10.634 25.416 -14.490 1.00 1.10 O ATOM 0 H GLU A 152 10.661 20.812 -15.838 1.00 14.43 H new ATOM 0 HA GLU A 152 9.179 23.017 -16.813 1.00 73.11 H new ATOM 0 HB2 GLU A 152 12.159 22.430 -16.979 1.00 24.35 H new ATOM 0 HB3 GLU A 152 11.415 24.004 -17.181 1.00 24.35 H new ATOM 0 HG2 GLU A 152 11.379 22.341 -14.651 1.00 24.41 H new ATOM 0 HG3 GLU A 152 12.413 23.722 -14.956 1.00 24.41 H new ATOM 2315 N CYS A 153 10.665 21.085 -18.991 1.00 1.44 N ATOM 2316 CA CYS A 153 10.764 20.715 -20.379 1.00 75.44 C ATOM 2317 C CYS A 153 9.395 20.242 -20.903 1.00 22.43 C ATOM 2318 O CYS A 153 9.032 20.495 -22.053 1.00 21.32 O ATOM 2319 CB CYS A 153 11.832 19.614 -20.529 1.00 53.41 C ATOM 2320 SG CYS A 153 12.112 19.016 -22.209 1.00 22.52 S ATOM 0 H CYS A 153 11.117 20.428 -18.355 1.00 1.44 H new ATOM 0 HA CYS A 153 11.063 21.578 -20.974 1.00 75.44 H new ATOM 0 HB2 CYS A 153 12.775 19.993 -20.136 1.00 53.41 H new ATOM 0 HB3 CYS A 153 11.544 18.768 -19.905 1.00 53.41 H new ATOM 0 HG CYS A 153 13.032 18.098 -22.195 1.00 22.52 H new ATOM 2326 N LYS A 154 8.633 19.589 -20.032 1.00 14.52 N ATOM 2327 CA LYS A 154 7.337 19.019 -20.402 1.00 31.14 C ATOM 2328 C LYS A 154 6.229 20.071 -20.394 1.00 3.33 C ATOM 2329 O LYS A 154 5.424 20.143 -21.321 1.00 3.34 O ATOM 2330 CB LYS A 154 6.954 17.894 -19.421 1.00 13.41 C ATOM 2331 CG LYS A 154 7.955 16.727 -19.232 1.00 2.02 C ATOM 2332 CD LYS A 154 8.149 15.812 -20.462 1.00 20.13 C ATOM 2333 CE LYS A 154 8.935 16.452 -21.601 1.00 22.11 C ATOM 2334 NZ LYS A 154 9.124 15.518 -22.717 1.00 15.14 N ATOM 0 H LYS A 154 8.891 19.439 -19.057 1.00 14.52 H new ATOM 0 HA LYS A 154 7.437 18.626 -21.414 1.00 31.14 H new ATOM 0 HB2 LYS A 154 6.779 18.346 -18.445 1.00 13.41 H new ATOM 0 HB3 LYS A 154 6.005 17.471 -19.751 1.00 13.41 H new ATOM 0 HG2 LYS A 154 8.923 17.143 -18.954 1.00 2.02 H new ATOM 0 HG3 LYS A 154 7.619 16.115 -18.395 1.00 2.02 H new ATOM 0 HD2 LYS A 154 8.662 14.903 -20.147 1.00 20.13 H new ATOM 0 HD3 LYS A 154 7.170 15.512 -20.835 1.00 20.13 H new ATOM 0 HE2 LYS A 154 8.409 17.339 -21.953 1.00 22.11 H new ATOM 0 HE3 LYS A 154 9.907 16.782 -21.233 1.00 22.11 H new ATOM 0 HZ1 LYS A 154 9.662 15.986 -23.474 1.00 15.14 H new ATOM 0 HZ2 LYS A 154 9.647 14.683 -22.386 1.00 15.14 H new ATOM 0 HZ3 LYS A 154 8.197 15.223 -23.083 1.00 15.14 H new ATOM 2348 N LYS A 155 6.208 20.879 -19.367 1.00 20.23 N ATOM 2349 CA LYS A 155 5.177 21.861 -19.163 1.00 75.14 C ATOM 2350 C LYS A 155 5.766 23.037 -18.415 1.00 64.43 C ATOM 2351 O LYS A 155 5.981 22.973 -17.198 1.00 40.14 O ATOM 2352 CB LYS A 155 4.008 21.233 -18.359 1.00 52.12 C ATOM 2353 CG LYS A 155 2.840 22.169 -18.025 1.00 2.33 C ATOM 2354 CD LYS A 155 2.166 22.719 -19.268 1.00 55.20 C ATOM 2355 CE LYS A 155 0.939 23.562 -18.914 1.00 41.55 C ATOM 2356 NZ LYS A 155 -0.125 22.765 -18.238 1.00 63.10 N ATOM 0 H LYS A 155 6.920 20.873 -18.636 1.00 20.23 H new ATOM 0 HA LYS A 155 4.788 22.203 -20.122 1.00 75.14 H new ATOM 0 HB2 LYS A 155 3.618 20.386 -18.924 1.00 52.12 H new ATOM 0 HB3 LYS A 155 4.408 20.836 -17.426 1.00 52.12 H new ATOM 0 HG2 LYS A 155 2.106 21.630 -17.425 1.00 2.33 H new ATOM 0 HG3 LYS A 155 3.204 22.997 -17.416 1.00 2.33 H new ATOM 0 HD2 LYS A 155 2.876 23.326 -19.830 1.00 55.20 H new ATOM 0 HD3 LYS A 155 1.868 21.895 -19.916 1.00 55.20 H new ATOM 0 HE2 LYS A 155 1.241 24.383 -18.264 1.00 41.55 H new ATOM 0 HE3 LYS A 155 0.533 24.007 -19.823 1.00 41.55 H new ATOM 0 HZ1 LYS A 155 -1.017 23.299 -18.247 1.00 63.10 H new ATOM 0 HZ2 LYS A 155 -0.256 21.864 -18.740 1.00 63.10 H new ATOM 0 HZ3 LYS A 155 0.155 22.576 -17.255 1.00 63.10 H new ATOM 2370 N LYS A 156 6.065 24.076 -19.142 1.00 75.45 N ATOM 2371 CA LYS A 156 6.650 25.266 -18.565 1.00 44.25 C ATOM 2372 C LYS A 156 5.611 25.968 -17.685 1.00 4.34 C ATOM 2373 O LYS A 156 4.404 25.881 -17.967 1.00 40.40 O ATOM 2374 CB LYS A 156 7.134 26.205 -19.678 1.00 73.43 C ATOM 2375 CG LYS A 156 8.113 25.552 -20.650 1.00 63.32 C ATOM 2376 CD LYS A 156 8.579 26.508 -21.741 1.00 44.03 C ATOM 2377 CE LYS A 156 9.383 27.669 -21.172 1.00 61.11 C ATOM 2378 NZ LYS A 156 9.862 28.584 -22.225 1.00 72.22 N ATOM 0 H LYS A 156 5.913 24.128 -20.149 1.00 75.45 H new ATOM 0 HA LYS A 156 7.507 24.990 -17.951 1.00 44.25 H new ATOM 0 HB2 LYS A 156 6.271 26.569 -20.235 1.00 73.43 H new ATOM 0 HB3 LYS A 156 7.611 27.075 -19.226 1.00 73.43 H new ATOM 0 HG2 LYS A 156 8.979 25.187 -20.098 1.00 63.32 H new ATOM 0 HG3 LYS A 156 7.639 24.685 -21.110 1.00 63.32 H new ATOM 0 HD2 LYS A 156 9.187 25.965 -22.464 1.00 44.03 H new ATOM 0 HD3 LYS A 156 7.714 26.895 -22.279 1.00 44.03 H new ATOM 0 HE2 LYS A 156 8.767 28.223 -20.464 1.00 61.11 H new ATOM 0 HE3 LYS A 156 10.236 27.280 -20.616 1.00 61.11 H new ATOM 0 HZ1 LYS A 156 10.404 29.359 -21.792 1.00 72.22 H new ATOM 0 HZ2 LYS A 156 10.472 28.063 -22.887 1.00 72.22 H new ATOM 0 HZ3 LYS A 156 9.048 28.977 -22.740 1.00 72.22 H new ATOM 2392 N PRO A 157 6.043 26.621 -16.586 1.00 72.24 N ATOM 2393 CA PRO A 157 5.139 27.355 -15.701 1.00 40.41 C ATOM 2394 C PRO A 157 4.418 28.492 -16.430 1.00 63.21 C ATOM 2395 O PRO A 157 4.988 29.576 -16.676 1.00 14.34 O ATOM 2396 CB PRO A 157 6.055 27.905 -14.598 1.00 64.25 C ATOM 2397 CG PRO A 157 7.276 27.060 -14.666 1.00 51.21 C ATOM 2398 CD PRO A 157 7.435 26.680 -16.106 1.00 23.34 C ATOM 0 HA PRO A 157 4.345 26.716 -15.314 1.00 40.41 H new ATOM 0 HB2 PRO A 157 6.291 28.956 -14.766 1.00 64.25 H new ATOM 0 HB3 PRO A 157 5.581 27.838 -13.619 1.00 64.25 H new ATOM 0 HG2 PRO A 157 8.149 27.606 -14.308 1.00 51.21 H new ATOM 0 HG3 PRO A 157 7.174 26.175 -14.038 1.00 51.21 H new ATOM 0 HD2 PRO A 157 8.021 27.416 -16.656 1.00 23.34 H new ATOM 0 HD3 PRO A 157 7.942 25.721 -16.217 1.00 23.34 H new ATOM 2406 N GLN A 158 3.205 28.211 -16.832 1.00 41.21 N ATOM 2407 CA GLN A 158 2.358 29.133 -17.539 1.00 73.11 C ATOM 2408 C GLN A 158 0.946 28.974 -17.029 1.00 42.03 C ATOM 2409 O GLN A 158 0.485 27.850 -16.817 1.00 2.11 O ATOM 2410 CB GLN A 158 2.398 28.855 -19.059 1.00 42.21 C ATOM 2411 CG GLN A 158 3.744 29.131 -19.727 1.00 75.15 C ATOM 2412 CD GLN A 158 3.767 28.734 -21.195 1.00 33.22 C ATOM 2413 OE1 GLN A 158 2.748 28.747 -21.874 1.00 52.33 O ATOM 2414 NE2 GLN A 158 4.932 28.420 -21.701 1.00 50.10 N ATOM 0 H GLN A 158 2.767 27.304 -16.670 1.00 41.21 H new ATOM 0 HA GLN A 158 2.710 30.151 -17.370 1.00 73.11 H new ATOM 0 HB2 GLN A 158 2.131 27.812 -19.230 1.00 42.21 H new ATOM 0 HB3 GLN A 158 1.636 29.464 -19.545 1.00 42.21 H new ATOM 0 HG2 GLN A 158 3.977 30.192 -19.639 1.00 75.15 H new ATOM 0 HG3 GLN A 158 4.526 28.588 -19.196 1.00 75.15 H new ATOM 0 HE21 GLN A 158 5.762 28.419 -21.108 1.00 50.10 H new ATOM 0 HE22 GLN A 158 5.010 28.177 -22.688 1.00 50.10 H new TER 2423 GLN A 158