USER MOD reduce.3.24.130724 H: found=0, std=0, add=1414, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1414 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 30 GLN : amide:sc= -0.784! C(o=1.6!,f=-4.4!) USER MOD Set 1.2: A 75 TYR OH : rot 23:sc= 0.811 USER MOD Set 1.3: A 159 THR OG1 : rot 160:sc= 1.61 USER MOD Set 2.1: A 27 GLN : amide:sc= -0.748 K(o=-5.6,f=-6.2) USER MOD Set 2.2: A 163 ASN :FLIP amide:sc= -4.81! C(o=-6.2!,f=-5.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 138:sc= 0.0165 (180deg=-0.0843) USER MOD Single : A 3 HIS : no HD1:sc= -1.2 X(o=-1.2,f=-1.5) USER MOD Single : A 4 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.58) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.066 X(o=-0.066,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= -0.203 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 163:sc= -0.0894 (180deg=-0.553) USER MOD Single : A 13 LYS NZ :NH3+ 171:sc= 1.21 (180deg=1.13) USER MOD Single : A 21 THR OG1 : rot 30:sc= 0.15 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.0876 F(o=-0.78,f=-0.088) USER MOD Single : A 35 MET CE :methyl 155:sc= -1.76 (180deg=-2.59!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 MET CE :methyl -106:sc= -0.616 (180deg=-3.53!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 87:sc= 0.0619 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 157:sc= 0 (180deg=-0.919) USER MOD Single : A 57 HIS : no HD1:sc= -0.593 X(o=-0.59,f=-0.49) USER MOD Single : A 59 ASN : amide:sc= -0.553 K(o=-0.55,f=-9.8!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 HIS : no HD1:sc= 0.635 K(o=0.64,f=-2!) USER MOD Single : A 80 LYS NZ :NH3+ -170:sc= 1.06 (180deg=0.549) USER MOD Single : A 85 ASN : amide:sc= 1.81 K(o=1.8,f=-5.3!) USER MOD Single : A 88 CYS SG : rot -31:sc= 0.227 USER MOD Single : A 95 HIS :FLIP no HD1:sc= -0.663 F(o=-1.9,f=-0.66) USER MOD Single : A 96 ASN : amide:sc= -0.251 K(o=-0.25,f=-2.2!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 MET CE :methyl -130:sc= -0.813 (180deg=-2.47!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.195 X(o=-0.2,f=-0.059) USER MOD Single : A 108 SER OG : rot 75:sc= 0.528 USER MOD Single : A 109 HIS : no HE2:sc= -7.57! C(o=-7.6!,f=-13!) USER MOD Single : A 110 GLN :FLIP amide:sc= -0.873 F(o=-2.1,f=-0.87) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.0292 X(o=-0.029,f=-0.49) USER MOD Single : A 115 THR OG1 : rot -168:sc= -0.409 USER MOD Single : A 116 SER OG : rot 79:sc= 0.948 USER MOD Single : A 117 HIS : no HD1:sc= -0.338 X(o=-0.34,f=0.031) USER MOD Single : A 120 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 122 CYS SG : rot -22:sc= -1.23! USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 69:sc= 1.22 USER MOD Single : A 127 ASN : amide:sc= -0.0012 X(o=-0.0012,f=-0.39) USER MOD Single : A 132 ASN : amide:sc= -1.05! C(o=-1!,f=-7.7!) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.663 K(o=-0.66,f=-2.6) USER MOD Single : A 136 ASN : amide:sc= -0.849 K(o=-0.85,f=-4.7!) USER MOD Single : A 137 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.019) USER MOD Single : A 138 CYS SG : rot 180:sc= 0 USER MOD Single : A 146 MET CE :methyl -157:sc= -0.155 (180deg=-0.66) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 THR OG1 : rot -17:sc= 0.377 USER MOD Single : A 156 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0236) USER MOD Single : A 157 GLN : amide:sc= -0.0537 X(o=-0.054,f=-0.038) USER MOD Single : A 160 THR OG1 : rot 81:sc= 0.784 USER MOD Single : A 161 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 ASN : amide:sc= -1.01! X(o=-1!,f=-0.93) USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.840 1.736 45.467 1.00 21.15 N ATOM 2 CA MET A 1 -9.577 0.386 44.889 1.00 11.12 C ATOM 3 C MET A 1 -10.359 0.170 43.580 1.00 11.41 C ATOM 4 O MET A 1 -10.973 1.096 43.053 1.00 71.24 O ATOM 5 CB MET A 1 -9.933 -0.707 45.912 1.00 10.00 C ATOM 6 CG MET A 1 -11.380 -0.676 46.390 1.00 55.51 C ATOM 7 SD MET A 1 -11.743 -1.989 47.574 1.00 73.51 S ATOM 8 CE MET A 1 -13.440 -1.604 48.002 1.00 1.12 C ATOM 0 H1 MET A 1 -9.957 1.656 46.497 1.00 21.15 H new ATOM 0 H2 MET A 1 -9.039 2.365 45.257 1.00 21.15 H new ATOM 0 H3 MET A 1 -10.708 2.129 45.050 1.00 21.15 H new ATOM 0 HA MET A 1 -8.514 0.323 44.654 1.00 11.12 H new ATOM 0 HB2 MET A 1 -9.731 -1.682 45.469 1.00 10.00 H new ATOM 0 HB3 MET A 1 -9.276 -0.607 46.776 1.00 10.00 H new ATOM 0 HG2 MET A 1 -11.587 0.291 46.849 1.00 55.51 H new ATOM 0 HG3 MET A 1 -12.045 -0.771 45.532 1.00 55.51 H new ATOM 0 HE1 MET A 1 -13.806 -2.330 48.728 1.00 1.12 H new ATOM 0 HE2 MET A 1 -13.489 -0.604 48.433 1.00 1.12 H new ATOM 0 HE3 MET A 1 -14.059 -1.643 47.106 1.00 1.12 H new ATOM 20 N GLY A 2 -10.311 -1.053 43.044 1.00 30.44 N ATOM 21 CA GLY A 2 -11.055 -1.379 41.825 1.00 52.23 C ATOM 22 C GLY A 2 -10.164 -1.560 40.597 1.00 54.12 C ATOM 23 O GLY A 2 -10.384 -2.470 39.796 1.00 53.30 O ATOM 0 H GLY A 2 -9.770 -1.827 43.431 1.00 30.44 H new ATOM 0 HA2 GLY A 2 -11.623 -2.294 41.990 1.00 52.23 H new ATOM 0 HA3 GLY A 2 -11.777 -0.587 41.627 1.00 52.23 H new ATOM 27 N HIS A 3 -9.175 -0.668 40.441 1.00 42.03 N ATOM 28 CA HIS A 3 -8.200 -0.702 39.322 1.00 0.12 C ATOM 29 C HIS A 3 -8.873 -0.850 37.940 1.00 22.50 C ATOM 30 O HIS A 3 -8.229 -1.246 36.967 1.00 44.21 O ATOM 31 CB HIS A 3 -7.152 -1.820 39.529 1.00 13.45 C ATOM 32 CG HIS A 3 -7.684 -3.219 39.390 1.00 22.33 C ATOM 33 ND1 HIS A 3 -8.018 -4.009 40.470 1.00 54.24 N ATOM 34 CD2 HIS A 3 -7.949 -3.968 38.291 1.00 61.21 C ATOM 35 CE1 HIS A 3 -8.464 -5.173 40.044 1.00 54.02 C ATOM 36 NE2 HIS A 3 -8.434 -5.174 38.729 1.00 52.22 N ATOM 0 H HIS A 3 -9.021 0.106 41.088 1.00 42.03 H new ATOM 0 HA HIS A 3 -7.696 0.265 39.331 1.00 0.12 H new ATOM 0 HB2 HIS A 3 -6.346 -1.680 38.809 1.00 13.45 H new ATOM 0 HB3 HIS A 3 -6.716 -1.710 40.522 1.00 13.45 H new ATOM 0 HD2 HIS A 3 -7.805 -3.670 37.263 1.00 61.21 H new ATOM 0 HE1 HIS A 3 -8.798 -5.988 40.669 1.00 54.02 H new ATOM 0 HE2 HIS A 3 -8.725 -5.947 38.131 1.00 52.22 H new ATOM 45 N HIS A 4 -10.155 -0.500 37.851 1.00 33.13 N ATOM 46 CA HIS A 4 -10.923 -0.682 36.611 1.00 12.52 C ATOM 47 C HIS A 4 -10.582 0.389 35.556 1.00 3.33 C ATOM 48 O HIS A 4 -10.706 1.590 35.806 1.00 41.40 O ATOM 49 CB HIS A 4 -12.432 -0.692 36.915 1.00 72.14 C ATOM 50 CG HIS A 4 -12.930 0.509 37.663 1.00 1.33 C ATOM 51 ND1 HIS A 4 -13.328 1.672 37.039 1.00 60.31 N ATOM 52 CD2 HIS A 4 -13.113 0.721 38.990 1.00 42.51 C ATOM 53 CE1 HIS A 4 -13.729 2.541 37.942 1.00 50.05 C ATOM 54 NE2 HIS A 4 -13.610 1.991 39.131 1.00 62.34 N ATOM 0 H HIS A 4 -10.687 -0.089 38.618 1.00 33.13 H new ATOM 0 HA HIS A 4 -10.642 -1.646 36.187 1.00 12.52 H new ATOM 0 HB2 HIS A 4 -12.977 -0.769 35.974 1.00 72.14 H new ATOM 0 HB3 HIS A 4 -12.666 -1.586 37.493 1.00 72.14 H new ATOM 0 HD2 HIS A 4 -12.906 0.021 39.786 1.00 42.51 H new ATOM 0 HE1 HIS A 4 -14.094 3.537 37.741 1.00 50.05 H new ATOM 0 HE2 HIS A 4 -13.849 2.438 40.016 1.00 62.34 H new ATOM 63 N HIS A 5 -10.155 -0.061 34.373 1.00 11.25 N ATOM 64 CA HIS A 5 -9.768 0.839 33.274 1.00 32.24 C ATOM 65 C HIS A 5 -10.394 0.406 31.939 1.00 42.34 C ATOM 66 O HIS A 5 -10.810 -0.743 31.778 1.00 30.44 O ATOM 67 CB HIS A 5 -8.239 0.881 33.130 1.00 31.21 C ATOM 68 CG HIS A 5 -7.536 1.495 34.303 1.00 13.23 C ATOM 69 ND1 HIS A 5 -7.602 2.841 34.594 1.00 63.14 N ATOM 70 CD2 HIS A 5 -6.743 0.948 35.256 1.00 64.31 C ATOM 71 CE1 HIS A 5 -6.880 3.093 35.667 1.00 4.11 C ATOM 72 NE2 HIS A 5 -6.348 1.966 36.091 1.00 2.33 N ATOM 0 H HIS A 5 -10.067 -1.052 34.147 1.00 11.25 H new ATOM 0 HA HIS A 5 -10.141 1.833 33.522 1.00 32.24 H new ATOM 0 HB2 HIS A 5 -7.869 -0.134 32.988 1.00 31.21 H new ATOM 0 HB3 HIS A 5 -7.984 1.442 32.231 1.00 31.21 H new ATOM 0 HD2 HIS A 5 -6.472 -0.094 35.343 1.00 64.31 H new ATOM 0 HE1 HIS A 5 -6.747 4.063 36.123 1.00 4.11 H new ATOM 0 HE2 HIS A 5 -5.742 1.865 36.905 1.00 2.33 H new ATOM 81 N HIS A 6 -10.452 1.333 30.982 1.00 72.44 N ATOM 82 CA HIS A 6 -10.993 1.047 29.645 1.00 33.31 C ATOM 83 C HIS A 6 -10.102 1.634 28.538 1.00 12.43 C ATOM 84 O HIS A 6 -9.307 2.547 28.777 1.00 32.40 O ATOM 85 CB HIS A 6 -12.418 1.604 29.503 1.00 63.40 C ATOM 86 CG HIS A 6 -13.411 0.998 30.451 1.00 10.42 C ATOM 87 ND1 HIS A 6 -13.835 -0.313 30.365 1.00 53.03 N ATOM 88 CD2 HIS A 6 -14.076 1.531 31.506 1.00 53.51 C ATOM 89 CE1 HIS A 6 -14.714 -0.555 31.316 1.00 42.14 C ATOM 90 NE2 HIS A 6 -14.877 0.545 32.021 1.00 14.24 N ATOM 0 H HIS A 6 -10.131 2.293 31.105 1.00 72.44 H new ATOM 0 HA HIS A 6 -11.016 -0.037 29.533 1.00 33.31 H new ATOM 0 HB2 HIS A 6 -12.392 2.682 29.661 1.00 63.40 H new ATOM 0 HB3 HIS A 6 -12.760 1.440 28.481 1.00 63.40 H new ATOM 0 HD2 HIS A 6 -13.990 2.543 31.872 1.00 53.51 H new ATOM 0 HE1 HIS A 6 -15.216 -1.496 31.488 1.00 42.14 H new ATOM 0 HE2 HIS A 6 -15.500 0.647 32.822 1.00 14.24 H new ATOM 99 N HIS A 7 -10.243 1.101 27.324 1.00 22.33 N ATOM 100 CA HIS A 7 -9.507 1.601 26.156 1.00 3.14 C ATOM 101 C HIS A 7 -10.451 2.338 25.191 1.00 53.23 C ATOM 102 O HIS A 7 -11.291 1.719 24.538 1.00 63.12 O ATOM 103 CB HIS A 7 -8.817 0.434 25.437 1.00 5.52 C ATOM 104 CG HIS A 7 -7.811 -0.275 26.292 1.00 24.14 C ATOM 105 ND1 HIS A 7 -8.109 -1.389 27.048 1.00 75.02 N ATOM 106 CD2 HIS A 7 -6.500 -0.017 26.519 1.00 54.41 C ATOM 107 CE1 HIS A 7 -7.035 -1.777 27.703 1.00 75.31 C ATOM 108 NE2 HIS A 7 -6.044 -0.965 27.402 1.00 62.10 N ATOM 0 H HIS A 7 -10.864 0.318 27.120 1.00 22.33 H new ATOM 0 HA HIS A 7 -8.751 2.308 26.498 1.00 3.14 H new ATOM 0 HB2 HIS A 7 -9.573 -0.280 25.109 1.00 5.52 H new ATOM 0 HB3 HIS A 7 -8.323 0.809 24.541 1.00 5.52 H new ATOM 0 HD2 HIS A 7 -5.921 0.785 26.086 1.00 54.41 H new ATOM 0 HE1 HIS A 7 -6.977 -2.621 28.375 1.00 75.31 H new ATOM 0 HE2 HIS A 7 -5.093 -1.029 27.765 1.00 62.10 H new ATOM 117 N HIS A 8 -10.303 3.661 25.113 1.00 71.03 N ATOM 118 CA HIS A 8 -11.186 4.502 24.294 1.00 73.12 C ATOM 119 C HIS A 8 -10.463 5.780 23.828 1.00 33.40 C ATOM 120 O HIS A 8 -10.333 6.740 24.591 1.00 51.22 O ATOM 121 CB HIS A 8 -12.446 4.864 25.098 1.00 10.31 C ATOM 122 CG HIS A 8 -13.440 5.708 24.353 1.00 35.34 C ATOM 123 ND1 HIS A 8 -14.564 5.186 23.750 1.00 1.44 N ATOM 124 CD2 HIS A 8 -13.487 7.044 24.127 1.00 54.11 C ATOM 125 CE1 HIS A 8 -15.253 6.157 23.186 1.00 41.51 C ATOM 126 NE2 HIS A 8 -14.622 7.290 23.398 1.00 40.32 N ATOM 0 H HIS A 8 -9.577 4.178 25.609 1.00 71.03 H new ATOM 0 HA HIS A 8 -11.473 3.940 23.406 1.00 73.12 H new ATOM 0 HB2 HIS A 8 -12.936 3.943 25.415 1.00 10.31 H new ATOM 0 HB3 HIS A 8 -12.145 5.393 26.002 1.00 10.31 H new ATOM 0 HD2 HIS A 8 -12.766 7.777 24.459 1.00 54.11 H new ATOM 0 HE1 HIS A 8 -16.179 6.041 22.642 1.00 41.51 H new ATOM 0 HE2 HIS A 8 -14.928 8.207 23.072 1.00 40.32 H new ATOM 135 N SER A 9 -9.988 5.773 22.581 1.00 4.04 N ATOM 136 CA SER A 9 -9.319 6.944 21.983 1.00 5.21 C ATOM 137 C SER A 9 -9.054 6.741 20.481 1.00 24.12 C ATOM 138 O SER A 9 -9.125 5.622 19.969 1.00 2.25 O ATOM 139 CB SER A 9 -7.991 7.246 22.693 1.00 22.44 C ATOM 140 OG SER A 9 -7.350 8.375 22.119 1.00 22.03 O ATOM 0 H SER A 9 -10.052 4.968 21.958 1.00 4.04 H new ATOM 0 HA SER A 9 -9.995 7.789 22.109 1.00 5.21 H new ATOM 0 HB2 SER A 9 -8.174 7.427 23.752 1.00 22.44 H new ATOM 0 HB3 SER A 9 -7.334 6.379 22.627 1.00 22.44 H new ATOM 0 HG SER A 9 -6.508 8.547 22.590 1.00 22.03 H new ATOM 146 N HIS A 10 -8.759 7.838 19.779 1.00 62.24 N ATOM 147 CA HIS A 10 -8.440 7.799 18.342 1.00 53.31 C ATOM 148 C HIS A 10 -7.349 8.820 17.984 1.00 50.41 C ATOM 149 O HIS A 10 -7.521 10.023 18.191 1.00 62.53 O ATOM 150 CB HIS A 10 -9.693 8.088 17.497 1.00 70.55 C ATOM 151 CG HIS A 10 -10.726 7.006 17.539 1.00 61.04 C ATOM 152 ND1 HIS A 10 -10.754 5.964 16.641 1.00 11.43 N ATOM 153 CD2 HIS A 10 -11.775 6.810 18.371 1.00 22.51 C ATOM 154 CE1 HIS A 10 -11.772 5.176 16.914 1.00 11.42 C ATOM 155 NE2 HIS A 10 -12.409 5.664 17.960 1.00 61.31 N ATOM 0 H HIS A 10 -8.733 8.774 20.183 1.00 62.24 H new ATOM 0 HA HIS A 10 -8.074 6.796 18.121 1.00 53.31 H new ATOM 0 HB2 HIS A 10 -10.144 9.018 17.843 1.00 70.55 H new ATOM 0 HB3 HIS A 10 -9.391 8.246 16.462 1.00 70.55 H new ATOM 0 HD2 HIS A 10 -12.060 7.438 19.202 1.00 22.51 H new ATOM 0 HE1 HIS A 10 -12.040 4.281 16.373 1.00 11.42 H new ATOM 0 HE2 HIS A 10 -13.238 5.257 18.393 1.00 61.31 H new ATOM 164 N MET A 11 -6.232 8.342 17.440 1.00 12.14 N ATOM 165 CA MET A 11 -5.159 9.232 16.982 1.00 73.42 C ATOM 166 C MET A 11 -5.544 9.932 15.667 1.00 53.41 C ATOM 167 O MET A 11 -6.244 9.363 14.825 1.00 4.14 O ATOM 168 CB MET A 11 -3.847 8.455 16.792 1.00 41.53 C ATOM 169 CG MET A 11 -3.905 7.392 15.698 1.00 11.22 C ATOM 170 SD MET A 11 -2.307 6.602 15.403 1.00 4.44 S ATOM 171 CE MET A 11 -1.960 5.912 17.021 1.00 71.44 C ATOM 0 H MET A 11 -6.043 7.349 17.304 1.00 12.14 H new ATOM 0 HA MET A 11 -5.012 9.991 17.751 1.00 73.42 H new ATOM 0 HB2 MET A 11 -3.050 9.161 16.556 1.00 41.53 H new ATOM 0 HB3 MET A 11 -3.581 7.977 17.735 1.00 41.53 H new ATOM 0 HG2 MET A 11 -4.635 6.632 15.975 1.00 11.22 H new ATOM 0 HG3 MET A 11 -4.256 7.849 14.772 1.00 11.22 H new ATOM 0 HE1 MET A 11 -1.181 5.154 16.934 1.00 71.44 H new ATOM 0 HE2 MET A 11 -1.623 6.704 17.690 1.00 71.44 H new ATOM 0 HE3 MET A 11 -2.865 5.458 17.424 1.00 71.44 H new ATOM 181 N ASP A 12 -5.087 11.169 15.497 1.00 63.11 N ATOM 182 CA ASP A 12 -5.359 11.928 14.275 1.00 13.20 C ATOM 183 C ASP A 12 -4.492 11.421 13.098 1.00 11.11 C ATOM 184 O ASP A 12 -4.797 10.387 12.503 1.00 12.02 O ATOM 185 CB ASP A 12 -5.144 13.426 14.540 1.00 62.33 C ATOM 186 CG ASP A 12 -5.414 14.283 13.317 1.00 21.33 C ATOM 187 OD1 ASP A 12 -6.593 14.447 12.945 1.00 32.23 O ATOM 188 OD2 ASP A 12 -4.446 14.794 12.726 1.00 23.24 O ATOM 0 H ASP A 12 -4.527 11.669 16.188 1.00 63.11 H new ATOM 0 HA ASP A 12 -6.399 11.777 13.986 1.00 13.20 H new ATOM 0 HB2 ASP A 12 -5.797 13.744 15.353 1.00 62.33 H new ATOM 0 HB3 ASP A 12 -4.119 13.588 14.873 1.00 62.33 H new ATOM 193 N LYS A 13 -3.412 12.134 12.770 1.00 64.15 N ATOM 194 CA LYS A 13 -2.497 11.700 11.703 1.00 34.23 C ATOM 195 C LYS A 13 -1.142 11.264 12.277 1.00 51.04 C ATOM 196 O LYS A 13 -0.573 10.258 11.861 1.00 74.53 O ATOM 197 CB LYS A 13 -2.291 12.825 10.672 1.00 51.13 C ATOM 198 CG LYS A 13 -1.635 14.083 11.240 1.00 4.35 C ATOM 199 CD LYS A 13 -1.410 15.150 10.169 1.00 33.14 C ATOM 200 CE LYS A 13 -2.718 15.605 9.530 1.00 63.33 C ATOM 201 NZ LYS A 13 -3.641 16.217 10.520 1.00 72.31 N ATOM 0 H LYS A 13 -3.148 13.009 13.222 1.00 64.15 H new ATOM 0 HA LYS A 13 -2.953 10.843 11.207 1.00 34.23 H new ATOM 0 HB2 LYS A 13 -1.677 12.446 9.855 1.00 51.13 H new ATOM 0 HB3 LYS A 13 -3.258 13.094 10.246 1.00 51.13 H new ATOM 0 HG2 LYS A 13 -2.262 14.492 12.032 1.00 4.35 H new ATOM 0 HG3 LYS A 13 -0.680 13.819 11.694 1.00 4.35 H new ATOM 0 HD2 LYS A 13 -0.906 16.008 10.613 1.00 33.14 H new ATOM 0 HD3 LYS A 13 -0.748 14.755 9.398 1.00 33.14 H new ATOM 0 HE2 LYS A 13 -2.504 16.326 8.741 1.00 63.33 H new ATOM 0 HE3 LYS A 13 -3.206 14.752 9.059 1.00 63.33 H new ATOM 0 HZ1 LYS A 13 -4.447 16.647 10.023 1.00 72.31 H new ATOM 0 HZ2 LYS A 13 -3.987 15.484 11.171 1.00 72.31 H new ATOM 0 HZ3 LYS A 13 -3.136 16.949 11.059 1.00 72.31 H new ATOM 215 N ARG A 14 -0.636 12.029 13.244 1.00 34.53 N ATOM 216 CA ARG A 14 0.674 11.760 13.837 1.00 33.14 C ATOM 217 C ARG A 14 0.588 10.691 14.933 1.00 42.50 C ATOM 218 O ARG A 14 -0.147 10.842 15.910 1.00 2.41 O ATOM 219 CB ARG A 14 1.273 13.049 14.411 1.00 4.13 C ATOM 220 CG ARG A 14 2.659 12.869 15.024 1.00 60.13 C ATOM 221 CD ARG A 14 3.223 14.182 15.553 1.00 42.14 C ATOM 222 NE ARG A 14 4.520 13.994 16.196 1.00 3.21 N ATOM 223 CZ ARG A 14 5.222 14.948 16.739 1.00 50.53 C ATOM 224 NH1 ARG A 14 4.795 16.171 16.731 1.00 23.21 N ATOM 225 NH2 ARG A 14 6.360 14.677 17.290 1.00 44.21 N ATOM 0 H ARG A 14 -1.114 12.841 13.634 1.00 34.53 H new ATOM 0 HA ARG A 14 1.322 11.381 13.047 1.00 33.14 H new ATOM 0 HB2 ARG A 14 1.331 13.795 13.618 1.00 4.13 H new ATOM 0 HB3 ARG A 14 0.599 13.444 15.171 1.00 4.13 H new ATOM 0 HG2 ARG A 14 2.605 12.144 15.836 1.00 60.13 H new ATOM 0 HG3 ARG A 14 3.336 12.459 14.275 1.00 60.13 H new ATOM 0 HD2 ARG A 14 3.324 14.892 14.732 1.00 42.14 H new ATOM 0 HD3 ARG A 14 2.523 14.617 16.266 1.00 42.14 H new ATOM 0 HE ARG A 14 4.904 13.049 16.222 1.00 3.21 H new ATOM 0 HH11 ARG A 14 3.900 16.396 16.296 1.00 23.21 H new ATOM 0 HH12 ARG A 14 5.354 16.909 17.159 1.00 23.21 H new ATOM 0 HH21 ARG A 14 6.707 13.718 17.299 1.00 44.21 H new ATOM 0 HH22 ARG A 14 6.911 15.422 17.716 1.00 44.21 H new ATOM 239 N LEU A 15 1.348 9.620 14.756 1.00 25.32 N ATOM 240 CA LEU A 15 1.415 8.532 15.734 1.00 44.32 C ATOM 241 C LEU A 15 2.577 8.731 16.722 1.00 34.32 C ATOM 242 O LEU A 15 3.578 9.380 16.407 1.00 12.30 O ATOM 243 CB LEU A 15 1.522 7.170 15.015 1.00 14.33 C ATOM 244 CG LEU A 15 2.463 7.107 13.790 1.00 63.53 C ATOM 245 CD1 LEU A 15 3.924 7.322 14.179 1.00 23.54 C ATOM 246 CD2 LEU A 15 2.298 5.778 13.061 1.00 21.44 C ATOM 0 H LEU A 15 1.936 9.476 13.935 1.00 25.32 H new ATOM 0 HA LEU A 15 0.493 8.544 16.315 1.00 44.32 H new ATOM 0 HB2 LEU A 15 1.856 6.427 15.740 1.00 14.33 H new ATOM 0 HB3 LEU A 15 0.523 6.875 14.693 1.00 14.33 H new ATOM 0 HG LEU A 15 2.181 7.919 13.120 1.00 63.53 H new ATOM 0 HD11 LEU A 15 4.549 7.270 13.288 1.00 23.54 H new ATOM 0 HD12 LEU A 15 4.036 8.301 14.644 1.00 23.54 H new ATOM 0 HD13 LEU A 15 4.231 6.549 14.883 1.00 23.54 H new ATOM 0 HD21 LEU A 15 2.967 5.749 12.201 1.00 21.44 H new ATOM 0 HD22 LEU A 15 2.541 4.959 13.738 1.00 21.44 H new ATOM 0 HD23 LEU A 15 1.267 5.674 12.722 1.00 21.44 H new ATOM 258 N PHE A 16 2.426 8.183 17.925 1.00 40.44 N ATOM 259 CA PHE A 16 3.464 8.271 18.959 1.00 0.21 C ATOM 260 C PHE A 16 3.838 6.878 19.486 1.00 63.33 C ATOM 261 O PHE A 16 2.973 6.123 19.940 1.00 40.21 O ATOM 262 CB PHE A 16 2.993 9.162 20.119 1.00 54.53 C ATOM 263 CG PHE A 16 2.797 10.609 19.736 1.00 0.24 C ATOM 264 CD1 PHE A 16 3.869 11.490 19.732 1.00 33.12 C ATOM 265 CD2 PHE A 16 1.541 11.089 19.384 1.00 23.44 C ATOM 266 CE1 PHE A 16 3.694 12.817 19.385 1.00 60.34 C ATOM 267 CE2 PHE A 16 1.363 12.415 19.036 1.00 35.15 C ATOM 268 CZ PHE A 16 2.441 13.280 19.036 1.00 50.22 C ATOM 0 H PHE A 16 1.592 7.670 18.213 1.00 40.44 H new ATOM 0 HA PHE A 16 4.350 8.716 18.506 1.00 0.21 H new ATOM 0 HB2 PHE A 16 2.054 8.769 20.509 1.00 54.53 H new ATOM 0 HB3 PHE A 16 3.722 9.105 20.927 1.00 54.53 H new ATOM 0 HD1 PHE A 16 4.852 11.135 20.003 1.00 33.12 H new ATOM 0 HD2 PHE A 16 0.694 10.418 19.382 1.00 23.44 H new ATOM 0 HE1 PHE A 16 4.538 13.491 19.387 1.00 60.34 H new ATOM 0 HE2 PHE A 16 0.382 12.775 18.764 1.00 35.15 H new ATOM 0 HZ PHE A 16 2.303 14.316 18.764 1.00 50.22 H new ATOM 278 N LEU A 17 5.125 6.544 19.407 1.00 54.12 N ATOM 279 CA LEU A 17 5.632 5.251 19.888 1.00 65.31 C ATOM 280 C LEU A 17 7.168 5.247 19.946 1.00 5.40 C ATOM 281 O LEU A 17 7.817 6.250 19.639 1.00 43.23 O ATOM 282 CB LEU A 17 5.139 4.090 18.995 1.00 40.22 C ATOM 283 CG LEU A 17 5.768 3.989 17.586 1.00 20.11 C ATOM 284 CD1 LEU A 17 5.295 2.720 16.877 1.00 64.23 C ATOM 285 CD2 LEU A 17 5.444 5.222 16.742 1.00 64.45 C ATOM 0 H LEU A 17 5.843 7.152 19.013 1.00 54.12 H new ATOM 0 HA LEU A 17 5.242 5.105 20.895 1.00 65.31 H new ATOM 0 HB2 LEU A 17 5.325 3.153 19.520 1.00 40.22 H new ATOM 0 HB3 LEU A 17 4.059 4.182 18.881 1.00 40.22 H new ATOM 0 HG LEU A 17 6.850 3.940 17.708 1.00 20.11 H new ATOM 0 HD11 LEU A 17 5.748 2.666 15.887 1.00 64.23 H new ATOM 0 HD12 LEU A 17 5.590 1.847 17.459 1.00 64.23 H new ATOM 0 HD13 LEU A 17 4.210 2.741 16.779 1.00 64.23 H new ATOM 0 HD21 LEU A 17 5.901 5.119 15.758 1.00 64.45 H new ATOM 0 HD22 LEU A 17 4.363 5.314 16.633 1.00 64.45 H new ATOM 0 HD23 LEU A 17 5.836 6.112 17.233 1.00 64.45 H new ATOM 297 N ASP A 18 7.740 4.114 20.347 1.00 51.30 N ATOM 298 CA ASP A 18 9.197 3.964 20.440 1.00 34.43 C ATOM 299 C ASP A 18 9.847 3.761 19.056 1.00 41.30 C ATOM 300 O ASP A 18 9.322 3.019 18.220 1.00 60.54 O ATOM 301 CB ASP A 18 9.534 2.779 21.346 1.00 31.20 C ATOM 302 CG ASP A 18 8.945 2.933 22.735 1.00 63.23 C ATOM 303 OD1 ASP A 18 7.755 2.600 22.921 1.00 50.14 O ATOM 304 OD2 ASP A 18 9.665 3.397 23.645 1.00 43.33 O ATOM 0 H ASP A 18 7.217 3.280 20.615 1.00 51.30 H new ATOM 0 HA ASP A 18 9.599 4.885 20.862 1.00 34.43 H new ATOM 0 HB2 ASP A 18 9.159 1.861 20.894 1.00 31.20 H new ATOM 0 HB3 ASP A 18 10.617 2.678 21.422 1.00 31.20 H new ATOM 309 N PRO A 19 11.014 4.400 18.805 1.00 44.51 N ATOM 310 CA PRO A 19 11.745 4.257 17.529 1.00 44.41 C ATOM 311 C PRO A 19 12.075 2.792 17.207 1.00 42.40 C ATOM 312 O PRO A 19 11.799 2.301 16.109 1.00 12.35 O ATOM 313 CB PRO A 19 13.039 5.066 17.754 1.00 32.25 C ATOM 314 CG PRO A 19 13.133 5.265 19.233 1.00 1.13 C ATOM 315 CD PRO A 19 11.714 5.305 19.734 1.00 35.23 C ATOM 0 HA PRO A 19 11.154 4.609 16.683 1.00 44.41 H new ATOM 0 HB2 PRO A 19 13.908 4.529 17.374 1.00 32.25 H new ATOM 0 HB3 PRO A 19 13.001 6.022 17.231 1.00 32.25 H new ATOM 0 HG2 PRO A 19 13.690 4.454 19.702 1.00 1.13 H new ATOM 0 HG3 PRO A 19 13.657 6.191 19.470 1.00 1.13 H new ATOM 0 HD2 PRO A 19 11.640 4.962 20.766 1.00 35.23 H new ATOM 0 HD3 PRO A 19 11.302 6.314 19.703 1.00 35.23 H new ATOM 323 N ASP A 20 12.651 2.099 18.186 1.00 11.15 N ATOM 324 CA ASP A 20 12.990 0.680 18.055 1.00 42.01 C ATOM 325 C ASP A 20 11.756 -0.164 17.696 1.00 52.01 C ATOM 326 O ASP A 20 11.827 -1.079 16.870 1.00 13.14 O ATOM 327 CB ASP A 20 13.594 0.184 19.371 1.00 75.33 C ATOM 328 CG ASP A 20 12.690 0.481 20.558 1.00 71.33 C ATOM 329 OD1 ASP A 20 12.831 1.565 21.158 1.00 70.11 O ATOM 330 OD2 ASP A 20 11.826 -0.363 20.885 1.00 25.45 O ATOM 0 H ASP A 20 12.896 2.501 19.091 1.00 11.15 H new ATOM 0 HA ASP A 20 13.713 0.572 17.246 1.00 42.01 H new ATOM 0 HB2 ASP A 20 13.769 -0.890 19.308 1.00 75.33 H new ATOM 0 HB3 ASP A 20 14.564 0.657 19.526 1.00 75.33 H new ATOM 335 N THR A 21 10.629 0.160 18.324 1.00 23.32 N ATOM 336 CA THR A 21 9.377 -0.568 18.107 1.00 60.24 C ATOM 337 C THR A 21 8.781 -0.268 16.723 1.00 32.23 C ATOM 338 O THR A 21 8.291 -1.165 16.048 1.00 40.42 O ATOM 339 CB THR A 21 8.334 -0.228 19.200 1.00 33.34 C ATOM 340 OG1 THR A 21 8.864 -0.521 20.508 1.00 1.12 O ATOM 341 CG2 THR A 21 7.037 -1.008 18.993 1.00 1.43 C ATOM 0 H THR A 21 10.555 0.927 18.992 1.00 23.32 H new ATOM 0 HA THR A 21 9.617 -1.630 18.161 1.00 60.24 H new ATOM 0 HB THR A 21 8.115 0.837 19.125 1.00 33.34 H new ATOM 0 HG1 THR A 21 9.837 -0.403 20.501 1.00 1.12 H new ATOM 0 HG21 THR A 21 6.326 -0.746 19.777 1.00 1.43 H new ATOM 0 HG22 THR A 21 6.613 -0.758 18.020 1.00 1.43 H new ATOM 0 HG23 THR A 21 7.245 -2.077 19.034 1.00 1.43 H new ATOM 349 N ALA A 22 8.829 0.989 16.298 1.00 33.21 N ATOM 350 CA ALA A 22 8.280 1.378 14.991 1.00 63.21 C ATOM 351 C ALA A 22 8.955 0.608 13.839 1.00 31.41 C ATOM 352 O ALA A 22 8.319 0.306 12.829 1.00 23.15 O ATOM 353 CB ALA A 22 8.422 2.884 14.789 1.00 42.42 C ATOM 0 H ALA A 22 9.238 1.757 16.830 1.00 33.21 H new ATOM 0 HA ALA A 22 7.222 1.117 14.980 1.00 63.21 H new ATOM 0 HB1 ALA A 22 8.012 3.161 13.818 1.00 42.42 H new ATOM 0 HB2 ALA A 22 7.879 3.409 15.575 1.00 42.42 H new ATOM 0 HB3 ALA A 22 9.476 3.159 14.830 1.00 42.42 H new ATOM 359 N ILE A 23 10.235 0.277 14.009 1.00 44.43 N ATOM 360 CA ILE A 23 10.975 -0.520 13.018 1.00 22.54 C ATOM 361 C ILE A 23 10.284 -1.865 12.738 1.00 1.25 C ATOM 362 O ILE A 23 9.936 -2.167 11.591 1.00 53.11 O ATOM 363 CB ILE A 23 12.434 -0.773 13.482 1.00 15.45 C ATOM 364 CG1 ILE A 23 13.210 0.555 13.549 1.00 24.12 C ATOM 365 CG2 ILE A 23 13.143 -1.776 12.567 1.00 74.12 C ATOM 366 CD1 ILE A 23 14.660 0.406 13.966 1.00 32.55 C ATOM 0 H ILE A 23 10.786 0.547 14.824 1.00 44.43 H new ATOM 0 HA ILE A 23 10.989 0.059 12.095 1.00 22.54 H new ATOM 0 HB ILE A 23 12.403 -1.207 14.481 1.00 15.45 H new ATOM 0 HG12 ILE A 23 13.172 1.035 12.571 1.00 24.12 H new ATOM 0 HG13 ILE A 23 12.708 1.221 14.251 1.00 24.12 H new ATOM 0 HG21 ILE A 23 14.163 -1.932 12.919 1.00 74.12 H new ATOM 0 HG22 ILE A 23 12.606 -2.724 12.581 1.00 74.12 H new ATOM 0 HG23 ILE A 23 13.166 -1.387 11.549 1.00 74.12 H new ATOM 0 HD11 ILE A 23 15.135 1.387 13.988 1.00 32.55 H new ATOM 0 HD12 ILE A 23 14.709 -0.044 14.958 1.00 32.55 H new ATOM 0 HD13 ILE A 23 15.180 -0.233 13.252 1.00 32.55 H new ATOM 378 N GLU A 24 10.077 -2.665 13.785 1.00 44.43 N ATOM 379 CA GLU A 24 9.396 -3.956 13.635 1.00 35.34 C ATOM 380 C GLU A 24 7.959 -3.757 13.121 1.00 10.10 C ATOM 381 O GLU A 24 7.498 -4.490 12.252 1.00 43.44 O ATOM 382 CB GLU A 24 9.392 -4.738 14.965 1.00 71.12 C ATOM 383 CG GLU A 24 8.683 -4.025 16.119 1.00 61.23 C ATOM 384 CD GLU A 24 7.552 -4.839 16.726 1.00 21.12 C ATOM 385 OE1 GLU A 24 7.827 -5.674 17.612 1.00 31.33 O ATOM 386 OE2 GLU A 24 6.386 -4.641 16.322 1.00 20.32 O ATOM 0 H GLU A 24 10.367 -2.447 14.738 1.00 44.43 H new ATOM 0 HA GLU A 24 9.947 -4.542 12.899 1.00 35.34 H new ATOM 0 HB2 GLU A 24 8.913 -5.704 14.803 1.00 71.12 H new ATOM 0 HB3 GLU A 24 10.423 -4.938 15.257 1.00 71.12 H new ATOM 0 HG2 GLU A 24 9.412 -3.793 16.896 1.00 61.23 H new ATOM 0 HG3 GLU A 24 8.286 -3.075 15.761 1.00 61.23 H new ATOM 393 N ARG A 25 7.272 -2.742 13.645 1.00 3.31 N ATOM 394 CA ARG A 25 5.894 -2.428 13.238 1.00 33.54 C ATOM 395 C ARG A 25 5.781 -2.204 11.723 1.00 71.15 C ATOM 396 O ARG A 25 4.965 -2.835 11.046 1.00 61.33 O ATOM 397 CB ARG A 25 5.411 -1.164 13.967 1.00 74.53 C ATOM 398 CG ARG A 25 5.426 -1.279 15.487 1.00 4.14 C ATOM 399 CD ARG A 25 4.276 -2.126 16.003 1.00 12.20 C ATOM 400 NE ARG A 25 4.504 -2.593 17.371 1.00 4.12 N ATOM 401 CZ ARG A 25 3.556 -2.912 18.207 1.00 32.05 C ATOM 402 NH1 ARG A 25 2.311 -2.803 17.867 1.00 24.13 N ATOM 403 NH2 ARG A 25 3.854 -3.338 19.390 1.00 44.54 N ATOM 0 H ARG A 25 7.647 -2.116 14.358 1.00 3.31 H new ATOM 0 HA ARG A 25 5.272 -3.283 13.505 1.00 33.54 H new ATOM 0 HB2 ARG A 25 6.039 -0.324 13.671 1.00 74.53 H new ATOM 0 HB3 ARG A 25 4.397 -0.934 13.641 1.00 74.53 H new ATOM 0 HG2 ARG A 25 6.371 -1.716 15.809 1.00 4.14 H new ATOM 0 HG3 ARG A 25 5.369 -0.283 15.927 1.00 4.14 H new ATOM 0 HD2 ARG A 25 3.355 -1.545 15.968 1.00 12.20 H new ATOM 0 HD3 ARG A 25 4.136 -2.985 15.346 1.00 12.20 H new ATOM 0 HE ARG A 25 5.469 -2.674 17.692 1.00 4.12 H new ATOM 0 HH11 ARG A 25 2.064 -2.465 16.937 1.00 24.13 H new ATOM 0 HH12 ARG A 25 1.577 -3.056 18.529 1.00 24.13 H new ATOM 0 HH21 ARG A 25 4.831 -3.425 19.670 1.00 44.54 H new ATOM 0 HH22 ARG A 25 3.112 -3.588 20.044 1.00 44.54 H new ATOM 417 N LEU A 26 6.605 -1.299 11.205 1.00 21.31 N ATOM 418 CA LEU A 26 6.577 -0.941 9.786 1.00 43.35 C ATOM 419 C LEU A 26 6.971 -2.140 8.905 1.00 52.51 C ATOM 420 O LEU A 26 6.382 -2.368 7.847 1.00 43.33 O ATOM 421 CB LEU A 26 7.511 0.251 9.542 1.00 52.55 C ATOM 422 CG LEU A 26 7.386 0.922 8.167 1.00 51.41 C ATOM 423 CD1 LEU A 26 5.939 1.315 7.883 1.00 75.35 C ATOM 424 CD2 LEU A 26 8.295 2.145 8.090 1.00 73.32 C ATOM 0 H LEU A 26 7.306 -0.796 11.749 1.00 21.31 H new ATOM 0 HA LEU A 26 5.561 -0.658 9.512 1.00 43.35 H new ATOM 0 HB2 LEU A 26 7.322 1.001 10.310 1.00 52.55 H new ATOM 0 HB3 LEU A 26 8.540 -0.085 9.670 1.00 52.55 H new ATOM 0 HG LEU A 26 7.698 0.205 7.407 1.00 51.41 H new ATOM 0 HD11 LEU A 26 5.876 1.788 6.903 1.00 75.35 H new ATOM 0 HD12 LEU A 26 5.311 0.424 7.897 1.00 75.35 H new ATOM 0 HD13 LEU A 26 5.595 2.013 8.646 1.00 75.35 H new ATOM 0 HD21 LEU A 26 8.196 2.611 7.109 1.00 73.32 H new ATOM 0 HD22 LEU A 26 8.009 2.860 8.862 1.00 73.32 H new ATOM 0 HD23 LEU A 26 9.330 1.839 8.244 1.00 73.32 H new ATOM 436 N GLN A 27 7.955 -2.918 9.363 1.00 21.24 N ATOM 437 CA GLN A 27 8.353 -4.151 8.671 1.00 3.13 C ATOM 438 C GLN A 27 7.205 -5.174 8.652 1.00 30.13 C ATOM 439 O GLN A 27 7.011 -5.886 7.664 1.00 62.43 O ATOM 440 CB GLN A 27 9.595 -4.762 9.338 1.00 33.20 C ATOM 441 CG GLN A 27 10.861 -3.928 9.160 1.00 1.01 C ATOM 442 CD GLN A 27 11.377 -3.929 7.726 1.00 22.33 C ATOM 443 OE1 GLN A 27 11.172 -4.879 6.976 1.00 51.31 O ATOM 444 NE2 GLN A 27 12.063 -2.870 7.335 1.00 42.21 N ATOM 0 H GLN A 27 8.491 -2.719 10.208 1.00 21.24 H new ATOM 0 HA GLN A 27 8.595 -3.893 7.640 1.00 3.13 H new ATOM 0 HB2 GLN A 27 9.400 -4.887 10.403 1.00 33.20 H new ATOM 0 HB3 GLN A 27 9.765 -5.757 8.926 1.00 33.20 H new ATOM 0 HG2 GLN A 27 10.660 -2.902 9.467 1.00 1.01 H new ATOM 0 HG3 GLN A 27 11.638 -4.312 9.821 1.00 1.01 H new ATOM 0 HE21 GLN A 27 12.217 -2.096 7.981 1.00 42.21 H new ATOM 0 HE22 GLN A 27 12.438 -2.827 6.388 1.00 42.21 H new ATOM 453 N ARG A 28 6.439 -5.236 9.742 1.00 41.10 N ATOM 454 CA ARG A 28 5.292 -6.146 9.822 1.00 50.51 C ATOM 455 C ARG A 28 4.154 -5.695 8.891 1.00 54.43 C ATOM 456 O ARG A 28 3.489 -6.522 8.262 1.00 0.40 O ATOM 457 CB ARG A 28 4.802 -6.277 11.275 1.00 70.11 C ATOM 458 CG ARG A 28 5.832 -6.937 12.191 1.00 63.23 C ATOM 459 CD ARG A 28 5.211 -7.534 13.448 1.00 35.42 C ATOM 460 NE ARG A 28 4.968 -6.548 14.498 1.00 45.43 N ATOM 461 CZ ARG A 28 3.970 -6.611 15.333 1.00 54.44 C ATOM 462 NH1 ARG A 28 3.022 -7.482 15.167 1.00 24.12 N ATOM 463 NH2 ARG A 28 3.913 -5.787 16.323 1.00 10.13 N ATOM 0 H ARG A 28 6.589 -4.671 10.578 1.00 41.10 H new ATOM 0 HA ARG A 28 5.620 -7.129 9.485 1.00 50.51 H new ATOM 0 HB2 ARG A 28 4.560 -5.287 11.662 1.00 70.11 H new ATOM 0 HB3 ARG A 28 3.881 -6.860 11.292 1.00 70.11 H new ATOM 0 HG2 ARG A 28 6.351 -7.722 11.640 1.00 63.23 H new ATOM 0 HG3 ARG A 28 6.582 -6.199 12.477 1.00 63.23 H new ATOM 0 HD2 ARG A 28 4.269 -8.015 13.186 1.00 35.42 H new ATOM 0 HD3 ARG A 28 5.869 -8.312 13.835 1.00 35.42 H new ATOM 0 HE ARG A 28 5.617 -5.765 14.582 1.00 45.43 H new ATOM 0 HH11 ARG A 28 3.054 -8.126 14.377 1.00 24.12 H new ATOM 0 HH12 ARG A 28 2.245 -7.522 15.827 1.00 24.12 H new ATOM 0 HH21 ARG A 28 4.647 -5.090 16.449 1.00 10.13 H new ATOM 0 HH22 ARG A 28 3.134 -5.832 16.980 1.00 10.13 H new ATOM 477 N LEU A 29 3.942 -4.380 8.796 1.00 1.42 N ATOM 478 CA LEU A 29 2.976 -3.821 7.841 1.00 2.12 C ATOM 479 C LEU A 29 3.422 -4.088 6.397 1.00 11.33 C ATOM 480 O LEU A 29 2.605 -4.400 5.531 1.00 60.10 O ATOM 481 CB LEU A 29 2.806 -2.313 8.065 1.00 73.05 C ATOM 482 CG LEU A 29 2.181 -1.913 9.410 1.00 31.34 C ATOM 483 CD1 LEU A 29 2.154 -0.395 9.554 1.00 51.12 C ATOM 484 CD2 LEU A 29 0.773 -2.495 9.551 1.00 22.12 C ATOM 0 H LEU A 29 4.423 -3.683 9.365 1.00 1.42 H new ATOM 0 HA LEU A 29 2.017 -4.312 8.007 1.00 2.12 H new ATOM 0 HB2 LEU A 29 3.784 -1.838 7.982 1.00 73.05 H new ATOM 0 HB3 LEU A 29 2.188 -1.911 7.262 1.00 73.05 H new ATOM 0 HG LEU A 29 2.797 -2.324 10.209 1.00 31.34 H new ATOM 0 HD11 LEU A 29 1.708 -0.128 10.512 1.00 51.12 H new ATOM 0 HD12 LEU A 29 3.171 -0.007 9.507 1.00 51.12 H new ATOM 0 HD13 LEU A 29 1.563 0.037 8.746 1.00 51.12 H new ATOM 0 HD21 LEU A 29 0.351 -2.198 10.511 1.00 22.12 H new ATOM 0 HD22 LEU A 29 0.142 -2.120 8.746 1.00 22.12 H new ATOM 0 HD23 LEU A 29 0.822 -3.583 9.497 1.00 22.12 H new ATOM 496 N GLN A 30 4.729 -3.963 6.157 1.00 75.41 N ATOM 497 CA GLN A 30 5.326 -4.269 4.851 1.00 41.42 C ATOM 498 C GLN A 30 4.937 -5.679 4.374 1.00 44.13 C ATOM 499 O GLN A 30 4.358 -5.852 3.300 1.00 43.24 O ATOM 500 CB GLN A 30 6.858 -4.156 4.938 1.00 63.12 C ATOM 501 CG GLN A 30 7.587 -4.596 3.672 1.00 1.25 C ATOM 502 CD GLN A 30 7.323 -3.684 2.489 1.00 43.34 C ATOM 503 OE1 GLN A 30 7.144 -2.483 2.642 1.00 55.33 O ATOM 504 NE2 GLN A 30 7.280 -4.249 1.301 1.00 34.42 N ATOM 0 H GLN A 30 5.402 -3.649 6.856 1.00 75.41 H new ATOM 0 HA GLN A 30 4.944 -3.548 4.128 1.00 41.42 H new ATOM 0 HB2 GLN A 30 7.124 -3.122 5.157 1.00 63.12 H new ATOM 0 HB3 GLN A 30 7.209 -4.759 5.775 1.00 63.12 H new ATOM 0 HG2 GLN A 30 8.659 -4.626 3.868 1.00 1.25 H new ATOM 0 HG3 GLN A 30 7.281 -5.611 3.417 1.00 1.25 H new ATOM 0 HE21 GLN A 30 7.434 -5.253 1.208 1.00 34.42 H new ATOM 0 HE22 GLN A 30 7.093 -3.683 0.473 1.00 34.42 H new ATOM 513 N GLN A 31 5.253 -6.686 5.188 1.00 31.21 N ATOM 514 CA GLN A 31 4.977 -8.079 4.829 1.00 53.10 C ATOM 515 C GLN A 31 3.465 -8.354 4.748 1.00 64.41 C ATOM 516 O GLN A 31 3.012 -9.150 3.923 1.00 33.32 O ATOM 517 CB GLN A 31 5.646 -9.031 5.829 1.00 42.23 C ATOM 518 CG GLN A 31 7.145 -8.785 6.011 1.00 40.30 C ATOM 519 CD GLN A 31 7.931 -8.772 4.703 1.00 43.22 C ATOM 520 OE1 GLN A 31 7.508 -9.560 3.731 1.00 21.25 O flip ATOM 521 NE2 GLN A 31 8.932 -8.072 4.578 1.00 34.41 N flip ATOM 0 H GLN A 31 5.699 -6.565 6.097 1.00 31.21 H new ATOM 0 HA GLN A 31 5.397 -8.257 3.839 1.00 53.10 H new ATOM 0 HB2 GLN A 31 5.152 -8.933 6.796 1.00 42.23 H new ATOM 0 HB3 GLN A 31 5.494 -10.058 5.496 1.00 42.23 H new ATOM 0 HG2 GLN A 31 7.288 -7.831 6.519 1.00 40.30 H new ATOM 0 HG3 GLN A 31 7.554 -9.558 6.662 1.00 40.30 H new ATOM 0 HE21 GLN A 31 9.235 -7.473 5.346 1.00 34.41 H new ATOM 0 HE22 GLN A 31 9.461 -8.089 3.706 1.00 34.41 H new ATOM 530 N ALA A 32 2.685 -7.690 5.606 1.00 52.14 N ATOM 531 CA ALA A 32 1.220 -7.782 5.547 1.00 73.54 C ATOM 532 C ALA A 32 0.696 -7.294 4.189 1.00 71.14 C ATOM 533 O ALA A 32 -0.142 -7.944 3.556 1.00 34.23 O ATOM 534 CB ALA A 32 0.594 -6.976 6.682 1.00 71.42 C ATOM 0 H ALA A 32 3.040 -7.085 6.347 1.00 52.14 H new ATOM 0 HA ALA A 32 0.937 -8.828 5.663 1.00 73.54 H new ATOM 0 HB1 ALA A 32 -0.492 -7.053 6.627 1.00 71.42 H new ATOM 0 HB2 ALA A 32 0.937 -7.368 7.639 1.00 71.42 H new ATOM 0 HB3 ALA A 32 0.889 -5.931 6.592 1.00 71.42 H new ATOM 540 N LEU A 33 1.214 -6.151 3.749 1.00 41.20 N ATOM 541 CA LEU A 33 0.893 -5.598 2.431 1.00 63.25 C ATOM 542 C LEU A 33 1.274 -6.588 1.316 1.00 33.43 C ATOM 543 O LEU A 33 0.517 -6.797 0.364 1.00 44.42 O ATOM 544 CB LEU A 33 1.633 -4.263 2.250 1.00 33.43 C ATOM 545 CG LEU A 33 1.383 -3.523 0.928 1.00 65.41 C ATOM 546 CD1 LEU A 33 -0.096 -3.183 0.762 1.00 12.12 C ATOM 547 CD2 LEU A 33 2.240 -2.260 0.864 1.00 62.33 C ATOM 0 H LEU A 33 1.865 -5.582 4.290 1.00 41.20 H new ATOM 0 HA LEU A 33 -0.181 -5.426 2.366 1.00 63.25 H new ATOM 0 HB2 LEU A 33 1.353 -3.602 3.071 1.00 33.43 H new ATOM 0 HB3 LEU A 33 2.703 -4.449 2.341 1.00 33.43 H new ATOM 0 HG LEU A 33 1.667 -4.180 0.106 1.00 65.41 H new ATOM 0 HD11 LEU A 33 -0.245 -2.659 -0.182 1.00 12.12 H new ATOM 0 HD12 LEU A 33 -0.683 -4.101 0.764 1.00 12.12 H new ATOM 0 HD13 LEU A 33 -0.417 -2.545 1.585 1.00 12.12 H new ATOM 0 HD21 LEU A 33 2.055 -1.742 -0.077 1.00 62.33 H new ATOM 0 HD22 LEU A 33 1.983 -1.604 1.695 1.00 62.33 H new ATOM 0 HD23 LEU A 33 3.294 -2.532 0.928 1.00 62.33 H new ATOM 559 N GLU A 34 2.447 -7.210 1.454 1.00 32.24 N ATOM 560 CA GLU A 34 2.906 -8.229 0.500 1.00 14.31 C ATOM 561 C GLU A 34 1.958 -9.442 0.452 1.00 13.12 C ATOM 562 O GLU A 34 1.754 -10.036 -0.607 1.00 55.12 O ATOM 563 CB GLU A 34 4.333 -8.684 0.843 1.00 62.32 C ATOM 564 CG GLU A 34 5.391 -7.602 0.627 1.00 24.23 C ATOM 565 CD GLU A 34 6.809 -8.064 0.938 1.00 4.21 C ATOM 566 OE1 GLU A 34 7.119 -9.259 0.720 1.00 71.14 O ATOM 567 OE2 GLU A 34 7.629 -7.230 1.378 1.00 24.21 O ATOM 0 H GLU A 34 3.099 -7.027 2.217 1.00 32.24 H new ATOM 0 HA GLU A 34 2.905 -7.770 -0.489 1.00 14.31 H new ATOM 0 HB2 GLU A 34 4.362 -9.006 1.884 1.00 62.32 H new ATOM 0 HB3 GLU A 34 4.584 -9.552 0.234 1.00 62.32 H new ATOM 0 HG2 GLU A 34 5.347 -7.264 -0.408 1.00 24.23 H new ATOM 0 HG3 GLU A 34 5.152 -6.742 1.253 1.00 24.23 H new ATOM 574 N MET A 35 1.374 -9.810 1.595 1.00 70.41 N ATOM 575 CA MET A 35 0.387 -10.900 1.631 1.00 61.31 C ATOM 576 C MET A 35 -0.881 -10.524 0.847 1.00 15.43 C ATOM 577 O MET A 35 -1.478 -11.365 0.165 1.00 55.02 O ATOM 578 CB MET A 35 0.015 -11.271 3.075 1.00 51.34 C ATOM 579 CG MET A 35 1.177 -11.815 3.893 1.00 40.55 C ATOM 580 SD MET A 35 0.644 -12.584 5.438 1.00 31.35 S ATOM 581 CE MET A 35 -0.198 -11.219 6.241 1.00 52.53 C ATOM 0 H MET A 35 1.562 -9.377 2.499 1.00 70.41 H new ATOM 0 HA MET A 35 0.848 -11.767 1.159 1.00 61.31 H new ATOM 0 HB2 MET A 35 -0.386 -10.389 3.574 1.00 51.34 H new ATOM 0 HB3 MET A 35 -0.781 -12.015 3.054 1.00 51.34 H new ATOM 0 HG2 MET A 35 1.724 -12.546 3.298 1.00 40.55 H new ATOM 0 HG3 MET A 35 1.870 -11.004 4.116 1.00 40.55 H new ATOM 0 HE1 MET A 35 -0.934 -11.609 6.944 1.00 52.53 H new ATOM 0 HE2 MET A 35 0.528 -10.608 6.777 1.00 52.53 H new ATOM 0 HE3 MET A 35 -0.701 -10.610 5.490 1.00 52.53 H new ATOM 591 N GLY A 36 -1.290 -9.260 0.954 1.00 10.40 N ATOM 592 CA GLY A 36 -2.427 -8.772 0.179 1.00 3.41 C ATOM 593 C GLY A 36 -2.167 -8.814 -1.323 1.00 62.03 C ATOM 594 O GLY A 36 -2.985 -9.323 -2.094 1.00 42.03 O ATOM 0 H GLY A 36 -0.857 -8.565 1.562 1.00 10.40 H new ATOM 0 HA2 GLY A 36 -3.306 -9.374 0.410 1.00 3.41 H new ATOM 0 HA3 GLY A 36 -2.654 -7.749 0.477 1.00 3.41 H new ATOM 598 N VAL A 37 -1.016 -8.287 -1.738 1.00 15.10 N ATOM 599 CA VAL A 37 -0.602 -8.323 -3.145 1.00 53.15 C ATOM 600 C VAL A 37 -0.456 -9.770 -3.647 1.00 52.43 C ATOM 601 O VAL A 37 -0.872 -10.101 -4.760 1.00 41.33 O ATOM 602 CB VAL A 37 0.734 -7.565 -3.350 1.00 72.31 C ATOM 603 CG1 VAL A 37 1.191 -7.637 -4.806 1.00 31.00 C ATOM 604 CG2 VAL A 37 0.601 -6.111 -2.893 1.00 53.01 C ATOM 0 H VAL A 37 -0.349 -7.827 -1.118 1.00 15.10 H new ATOM 0 HA VAL A 37 -1.383 -7.829 -3.724 1.00 53.15 H new ATOM 0 HB VAL A 37 1.495 -8.050 -2.739 1.00 72.31 H new ATOM 0 HG11 VAL A 37 2.131 -7.096 -4.920 1.00 31.00 H new ATOM 0 HG12 VAL A 37 1.335 -8.679 -5.091 1.00 31.00 H new ATOM 0 HG13 VAL A 37 0.434 -7.187 -5.448 1.00 31.00 H new ATOM 0 HG21 VAL A 37 1.549 -5.594 -3.044 1.00 53.01 H new ATOM 0 HG22 VAL A 37 -0.179 -5.617 -3.473 1.00 53.01 H new ATOM 0 HG23 VAL A 37 0.338 -6.085 -1.836 1.00 53.01 H new ATOM 614 N SER A 38 0.124 -10.634 -2.812 1.00 44.41 N ATOM 615 CA SER A 38 0.292 -12.054 -3.161 1.00 73.34 C ATOM 616 C SER A 38 -1.066 -12.727 -3.389 1.00 42.41 C ATOM 617 O SER A 38 -1.222 -13.540 -4.301 1.00 62.15 O ATOM 618 CB SER A 38 1.062 -12.809 -2.067 1.00 12.33 C ATOM 619 OG SER A 38 1.285 -14.164 -2.438 1.00 12.43 O ATOM 0 H SER A 38 0.485 -10.381 -1.892 1.00 44.41 H new ATOM 0 HA SER A 38 0.868 -12.093 -4.085 1.00 73.34 H new ATOM 0 HB2 SER A 38 2.017 -12.317 -1.885 1.00 12.33 H new ATOM 0 HB3 SER A 38 0.502 -12.772 -1.133 1.00 12.33 H new ATOM 0 HG SER A 38 1.778 -14.621 -1.725 1.00 12.43 H new ATOM 625 N SER A 39 -2.050 -12.378 -2.558 1.00 21.12 N ATOM 626 CA SER A 39 -3.424 -12.870 -2.735 1.00 71.34 C ATOM 627 C SER A 39 -3.934 -12.570 -4.149 1.00 54.43 C ATOM 628 O SER A 39 -4.556 -13.415 -4.792 1.00 62.51 O ATOM 629 CB SER A 39 -4.373 -12.234 -1.708 1.00 15.02 C ATOM 630 OG SER A 39 -5.702 -12.715 -1.865 1.00 23.13 O ATOM 0 H SER A 39 -1.925 -11.759 -1.757 1.00 21.12 H new ATOM 0 HA SER A 39 -3.406 -13.949 -2.582 1.00 71.34 H new ATOM 0 HB2 SER A 39 -4.021 -12.454 -0.700 1.00 15.02 H new ATOM 0 HB3 SER A 39 -4.361 -11.150 -1.821 1.00 15.02 H new ATOM 0 HG SER A 39 -6.283 -12.294 -1.197 1.00 23.13 H new ATOM 636 N LEU A 40 -3.667 -11.356 -4.623 1.00 10.21 N ATOM 637 CA LEU A 40 -4.045 -10.957 -5.980 1.00 2.14 C ATOM 638 C LEU A 40 -3.272 -11.777 -7.024 1.00 63.44 C ATOM 639 O LEU A 40 -3.867 -12.369 -7.923 1.00 63.15 O ATOM 640 CB LEU A 40 -3.785 -9.456 -6.188 1.00 73.35 C ATOM 641 CG LEU A 40 -4.244 -8.894 -7.545 1.00 22.30 C ATOM 642 CD1 LEU A 40 -5.761 -9.000 -7.694 1.00 14.40 C ATOM 643 CD2 LEU A 40 -3.781 -7.450 -7.713 1.00 40.43 C ATOM 0 H LEU A 40 -3.190 -10.630 -4.089 1.00 10.21 H new ATOM 0 HA LEU A 40 -5.110 -11.151 -6.108 1.00 2.14 H new ATOM 0 HB2 LEU A 40 -4.288 -8.903 -5.395 1.00 73.35 H new ATOM 0 HB3 LEU A 40 -2.717 -9.270 -6.078 1.00 73.35 H new ATOM 0 HG LEU A 40 -3.787 -9.492 -8.333 1.00 22.30 H new ATOM 0 HD11 LEU A 40 -6.061 -8.596 -8.661 1.00 14.40 H new ATOM 0 HD12 LEU A 40 -6.061 -10.046 -7.629 1.00 14.40 H new ATOM 0 HD13 LEU A 40 -6.245 -8.433 -6.899 1.00 14.40 H new ATOM 0 HD21 LEU A 40 -4.115 -7.071 -8.679 1.00 40.43 H new ATOM 0 HD22 LEU A 40 -4.203 -6.837 -6.916 1.00 40.43 H new ATOM 0 HD23 LEU A 40 -2.693 -7.409 -7.664 1.00 40.43 H new ATOM 655 N MET A 41 -1.946 -11.824 -6.883 1.00 2.01 N ATOM 656 CA MET A 41 -1.083 -12.572 -7.815 1.00 13.31 C ATOM 657 C MET A 41 -1.551 -14.029 -7.990 1.00 13.40 C ATOM 658 O MET A 41 -1.489 -14.587 -9.087 1.00 43.44 O ATOM 659 CB MET A 41 0.372 -12.556 -7.324 1.00 61.03 C ATOM 660 CG MET A 41 1.005 -11.166 -7.240 1.00 40.31 C ATOM 661 SD MET A 41 1.152 -10.342 -8.844 1.00 24.04 S ATOM 662 CE MET A 41 -0.433 -9.511 -8.982 1.00 63.15 C ATOM 0 H MET A 41 -1.440 -11.354 -6.132 1.00 2.01 H new ATOM 0 HA MET A 41 -1.150 -12.077 -8.784 1.00 13.31 H new ATOM 0 HB2 MET A 41 0.413 -13.019 -6.338 1.00 61.03 H new ATOM 0 HB3 MET A 41 0.973 -13.174 -7.991 1.00 61.03 H new ATOM 0 HG2 MET A 41 0.408 -10.543 -6.574 1.00 40.31 H new ATOM 0 HG3 MET A 41 1.995 -11.253 -6.793 1.00 40.31 H new ATOM 0 HE1 MET A 41 -1.057 -10.035 -9.706 1.00 63.15 H new ATOM 0 HE2 MET A 41 -0.928 -9.508 -8.011 1.00 63.15 H new ATOM 0 HE3 MET A 41 -0.278 -8.484 -9.313 1.00 63.15 H new ATOM 672 N ALA A 42 -2.018 -14.634 -6.901 1.00 71.32 N ATOM 673 CA ALA A 42 -2.517 -16.016 -6.924 1.00 54.34 C ATOM 674 C ALA A 42 -3.852 -16.140 -7.682 1.00 63.44 C ATOM 675 O ALA A 42 -4.161 -17.188 -8.252 1.00 10.15 O ATOM 676 CB ALA A 42 -2.678 -16.528 -5.498 1.00 15.25 C ATOM 0 H ALA A 42 -2.063 -14.190 -5.984 1.00 71.32 H new ATOM 0 HA ALA A 42 -1.784 -16.623 -7.456 1.00 54.34 H new ATOM 0 HB1 ALA A 42 -3.048 -17.553 -5.519 1.00 15.25 H new ATOM 0 HB2 ALA A 42 -1.714 -16.501 -4.991 1.00 15.25 H new ATOM 0 HB3 ALA A 42 -3.388 -15.897 -4.963 1.00 15.25 H new ATOM 682 N LEU A 43 -4.635 -15.067 -7.679 1.00 1.13 N ATOM 683 CA LEU A 43 -5.969 -15.064 -8.297 1.00 53.43 C ATOM 684 C LEU A 43 -5.963 -14.441 -9.708 1.00 42.22 C ATOM 685 O LEU A 43 -6.962 -14.513 -10.435 1.00 73.50 O ATOM 686 CB LEU A 43 -6.943 -14.322 -7.376 1.00 44.41 C ATOM 687 CG LEU A 43 -7.168 -14.999 -6.011 1.00 44.43 C ATOM 688 CD1 LEU A 43 -7.851 -14.053 -5.033 1.00 32.22 C ATOM 689 CD2 LEU A 43 -7.987 -16.279 -6.178 1.00 4.31 C ATOM 0 H LEU A 43 -4.372 -14.178 -7.253 1.00 1.13 H new ATOM 0 HA LEU A 43 -6.291 -16.098 -8.421 1.00 53.43 H new ATOM 0 HB2 LEU A 43 -6.569 -13.312 -7.210 1.00 44.41 H new ATOM 0 HB3 LEU A 43 -7.903 -14.227 -7.883 1.00 44.41 H new ATOM 0 HG LEU A 43 -6.193 -15.259 -5.600 1.00 44.43 H new ATOM 0 HD11 LEU A 43 -7.996 -14.559 -4.079 1.00 32.22 H new ATOM 0 HD12 LEU A 43 -7.228 -13.171 -4.885 1.00 32.22 H new ATOM 0 HD13 LEU A 43 -8.818 -13.751 -5.434 1.00 32.22 H new ATOM 0 HD21 LEU A 43 -8.137 -16.745 -5.204 1.00 4.31 H new ATOM 0 HD22 LEU A 43 -8.955 -16.037 -6.617 1.00 4.31 H new ATOM 0 HD23 LEU A 43 -7.454 -16.969 -6.832 1.00 4.31 H new ATOM 701 N VAL A 44 -4.845 -13.821 -10.086 1.00 12.31 N ATOM 702 CA VAL A 44 -4.676 -13.285 -11.441 1.00 73.00 C ATOM 703 C VAL A 44 -4.370 -14.410 -12.446 1.00 62.32 C ATOM 704 O VAL A 44 -3.574 -15.311 -12.169 1.00 52.24 O ATOM 705 CB VAL A 44 -3.545 -12.221 -11.496 1.00 31.44 C ATOM 706 CG1 VAL A 44 -3.231 -11.818 -12.938 1.00 41.21 C ATOM 707 CG2 VAL A 44 -3.917 -10.991 -10.670 1.00 34.01 C ATOM 0 H VAL A 44 -4.042 -13.676 -9.474 1.00 12.31 H new ATOM 0 HA VAL A 44 -5.617 -12.808 -11.714 1.00 73.00 H new ATOM 0 HB VAL A 44 -2.649 -12.670 -11.067 1.00 31.44 H new ATOM 0 HG11 VAL A 44 -2.436 -11.072 -12.943 1.00 41.21 H new ATOM 0 HG12 VAL A 44 -2.909 -12.695 -13.499 1.00 41.21 H new ATOM 0 HG13 VAL A 44 -4.124 -11.399 -13.401 1.00 41.21 H new ATOM 0 HG21 VAL A 44 -3.111 -10.260 -10.723 1.00 34.01 H new ATOM 0 HG22 VAL A 44 -4.833 -10.551 -11.065 1.00 34.01 H new ATOM 0 HG23 VAL A 44 -4.074 -11.284 -9.632 1.00 34.01 H new ATOM 717 N THR A 45 -5.006 -14.348 -13.615 1.00 72.11 N ATOM 718 CA THR A 45 -4.825 -15.365 -14.656 1.00 32.21 C ATOM 719 C THR A 45 -4.388 -14.718 -15.979 1.00 71.10 C ATOM 720 O THR A 45 -4.896 -13.662 -16.355 1.00 53.12 O ATOM 721 CB THR A 45 -6.134 -16.167 -14.896 1.00 41.15 C ATOM 722 OG1 THR A 45 -6.669 -16.642 -13.646 1.00 52.34 O ATOM 723 CG2 THR A 45 -5.892 -17.354 -15.827 1.00 70.25 C ATOM 0 H THR A 45 -5.654 -13.602 -13.868 1.00 72.11 H new ATOM 0 HA THR A 45 -4.049 -16.047 -14.308 1.00 32.21 H new ATOM 0 HB THR A 45 -6.851 -15.494 -15.366 1.00 41.15 H new ATOM 0 HG1 THR A 45 -7.494 -17.144 -13.813 1.00 52.34 H new ATOM 0 HG21 THR A 45 -6.826 -17.896 -15.976 1.00 70.25 H new ATOM 0 HG22 THR A 45 -5.524 -16.994 -16.788 1.00 70.25 H new ATOM 0 HG23 THR A 45 -5.153 -18.020 -15.382 1.00 70.25 H new ATOM 731 N THR A 46 -3.437 -15.347 -16.674 1.00 15.02 N ATOM 732 CA THR A 46 -2.978 -14.861 -17.991 1.00 1.42 C ATOM 733 C THR A 46 -4.140 -14.728 -18.988 1.00 23.50 C ATOM 734 O THR A 46 -4.094 -13.913 -19.910 1.00 22.02 O ATOM 735 CB THR A 46 -1.902 -15.792 -18.604 1.00 74.21 C ATOM 736 OG1 THR A 46 -1.525 -15.325 -19.913 1.00 60.30 O ATOM 737 CG2 THR A 46 -2.401 -17.232 -18.698 1.00 33.12 C ATOM 0 H THR A 46 -2.966 -16.193 -16.353 1.00 15.02 H new ATOM 0 HA THR A 46 -2.544 -13.877 -17.813 1.00 1.42 H new ATOM 0 HB THR A 46 -1.033 -15.772 -17.946 1.00 74.21 H new ATOM 0 HG1 THR A 46 -0.844 -15.921 -20.289 1.00 60.30 H new ATOM 0 HG21 THR A 46 -1.622 -17.859 -19.132 1.00 33.12 H new ATOM 0 HG22 THR A 46 -2.648 -17.597 -17.701 1.00 33.12 H new ATOM 0 HG23 THR A 46 -3.290 -17.269 -19.328 1.00 33.12 H new ATOM 745 N ASP A 47 -5.168 -15.552 -18.805 1.00 5.33 N ATOM 746 CA ASP A 47 -6.372 -15.501 -19.634 1.00 4.35 C ATOM 747 C ASP A 47 -7.640 -15.448 -18.774 1.00 1.31 C ATOM 748 O ASP A 47 -8.173 -16.486 -18.380 1.00 34.41 O ATOM 749 CB ASP A 47 -6.437 -16.722 -20.561 1.00 3.41 C ATOM 750 CG ASP A 47 -5.460 -16.650 -21.717 1.00 23.24 C ATOM 751 OD1 ASP A 47 -5.810 -16.044 -22.752 1.00 22.43 O ATOM 752 OD2 ASP A 47 -4.357 -17.224 -21.610 1.00 34.04 O ATOM 0 H ASP A 47 -5.192 -16.271 -18.082 1.00 5.33 H new ATOM 0 HA ASP A 47 -6.319 -14.591 -20.232 1.00 4.35 H new ATOM 0 HB2 ASP A 47 -6.236 -17.622 -19.980 1.00 3.41 H new ATOM 0 HB3 ASP A 47 -7.449 -16.817 -20.955 1.00 3.41 H new ATOM 757 N TRP A 48 -8.121 -14.244 -18.474 1.00 74.12 N ATOM 758 CA TRP A 48 -9.411 -14.097 -17.792 1.00 13.35 C ATOM 759 C TRP A 48 -10.571 -14.432 -18.743 1.00 45.13 C ATOM 760 O TRP A 48 -11.718 -14.546 -18.322 1.00 54.33 O ATOM 761 CB TRP A 48 -9.571 -12.688 -17.198 1.00 1.52 C ATOM 762 CG TRP A 48 -8.764 -12.476 -15.945 1.00 34.31 C ATOM 763 CD1 TRP A 48 -8.616 -13.358 -14.911 1.00 24.50 C ATOM 764 CD2 TRP A 48 -8.017 -11.307 -15.583 1.00 52.33 C ATOM 765 NE1 TRP A 48 -7.809 -12.817 -13.939 1.00 64.33 N ATOM 766 CE2 TRP A 48 -7.429 -11.559 -14.328 1.00 62.51 C ATOM 767 CE3 TRP A 48 -7.780 -10.078 -16.201 1.00 64.40 C ATOM 768 CZ2 TRP A 48 -6.626 -10.622 -13.682 1.00 41.44 C ATOM 769 CZ3 TRP A 48 -6.982 -9.149 -15.560 1.00 1.11 C ATOM 770 CH2 TRP A 48 -6.411 -9.426 -14.312 1.00 62.11 C ATOM 0 H TRP A 48 -7.648 -13.366 -18.687 1.00 74.12 H new ATOM 0 HA TRP A 48 -9.436 -14.806 -16.965 1.00 13.35 H new ATOM 0 HB2 TRP A 48 -9.273 -11.951 -17.943 1.00 1.52 H new ATOM 0 HB3 TRP A 48 -10.624 -12.511 -16.978 1.00 1.52 H new ATOM 0 HD1 TRP A 48 -9.068 -14.338 -14.865 1.00 24.50 H new ATOM 0 HE1 TRP A 48 -7.537 -13.277 -13.070 1.00 64.33 H new ATOM 0 HE3 TRP A 48 -8.213 -9.856 -17.165 1.00 64.40 H new ATOM 0 HZ2 TRP A 48 -6.188 -10.832 -12.717 1.00 41.44 H new ATOM 0 HZ3 TRP A 48 -6.796 -8.194 -16.029 1.00 1.11 H new ATOM 0 HH2 TRP A 48 -5.789 -8.682 -13.837 1.00 62.11 H new ATOM 781 N ARG A 49 -10.248 -14.610 -20.030 1.00 3.41 N ATOM 782 CA ARG A 49 -11.226 -15.076 -21.022 1.00 52.34 C ATOM 783 C ARG A 49 -11.810 -16.444 -20.630 1.00 30.14 C ATOM 784 O ARG A 49 -12.853 -16.860 -21.143 1.00 73.40 O ATOM 785 CB ARG A 49 -10.583 -15.165 -22.412 1.00 64.11 C ATOM 786 CG ARG A 49 -9.458 -16.192 -22.508 1.00 20.03 C ATOM 787 CD ARG A 49 -8.931 -16.325 -23.931 1.00 21.50 C ATOM 788 NE ARG A 49 -9.985 -16.704 -24.870 1.00 15.05 N ATOM 789 CZ ARG A 49 -10.010 -17.827 -25.536 1.00 31.42 C ATOM 790 NH1 ARG A 49 -9.058 -18.696 -25.412 1.00 74.43 N ATOM 791 NH2 ARG A 49 -10.993 -18.082 -26.333 1.00 53.11 N ATOM 0 H ARG A 49 -9.317 -14.438 -20.409 1.00 3.41 H new ATOM 0 HA ARG A 49 -12.039 -14.350 -21.050 1.00 52.34 H new ATOM 0 HB2 ARG A 49 -11.353 -15.414 -23.142 1.00 64.11 H new ATOM 0 HB3 ARG A 49 -10.191 -14.185 -22.684 1.00 64.11 H new ATOM 0 HG2 ARG A 49 -8.643 -15.901 -21.845 1.00 20.03 H new ATOM 0 HG3 ARG A 49 -9.820 -17.160 -22.163 1.00 20.03 H new ATOM 0 HD2 ARG A 49 -8.489 -15.379 -24.244 1.00 21.50 H new ATOM 0 HD3 ARG A 49 -8.137 -17.072 -23.956 1.00 21.50 H new ATOM 0 HE ARG A 49 -10.752 -16.048 -25.015 1.00 15.05 H new ATOM 0 HH11 ARG A 49 -8.274 -18.508 -24.787 1.00 74.43 H new ATOM 0 HH12 ARG A 49 -9.092 -19.569 -25.939 1.00 74.43 H new ATOM 0 HH21 ARG A 49 -11.749 -17.407 -26.442 1.00 53.11 H new ATOM 0 HH22 ARG A 49 -11.013 -18.959 -26.854 1.00 53.11 H new ATOM 805 N CYS A 50 -11.115 -17.149 -19.733 1.00 44.41 N ATOM 806 CA CYS A 50 -11.624 -18.399 -19.166 1.00 70.45 C ATOM 807 C CYS A 50 -12.827 -18.110 -18.257 1.00 32.31 C ATOM 808 O CYS A 50 -12.707 -18.056 -17.031 1.00 12.30 O ATOM 809 CB CYS A 50 -10.519 -19.129 -18.391 1.00 65.25 C ATOM 810 SG CYS A 50 -9.061 -19.526 -19.391 1.00 74.24 S ATOM 0 H CYS A 50 -10.197 -16.874 -19.384 1.00 44.41 H new ATOM 0 HA CYS A 50 -11.950 -19.048 -19.979 1.00 70.45 H new ATOM 0 HB2 CYS A 50 -10.212 -18.511 -17.547 1.00 65.25 H new ATOM 0 HB3 CYS A 50 -10.927 -20.052 -17.978 1.00 65.25 H new ATOM 0 HG CYS A 50 -8.238 -18.520 -19.377 1.00 74.24 H new ATOM 816 N TYR A 51 -13.978 -17.906 -18.896 1.00 44.00 N ATOM 817 CA TYR A 51 -15.206 -17.463 -18.227 1.00 24.50 C ATOM 818 C TYR A 51 -15.513 -18.259 -16.946 1.00 62.53 C ATOM 819 O TYR A 51 -15.658 -17.680 -15.870 1.00 64.35 O ATOM 820 CB TYR A 51 -16.379 -17.560 -19.214 1.00 72.43 C ATOM 821 CG TYR A 51 -17.710 -17.099 -18.651 1.00 75.34 C ATOM 822 CD1 TYR A 51 -17.873 -15.807 -18.167 1.00 74.22 C ATOM 823 CD2 TYR A 51 -18.804 -17.955 -18.614 1.00 0.00 C ATOM 824 CE1 TYR A 51 -19.085 -15.384 -17.660 1.00 72.41 C ATOM 825 CE2 TYR A 51 -20.017 -17.538 -18.107 1.00 3.03 C ATOM 826 CZ TYR A 51 -20.152 -16.253 -17.631 1.00 5.31 C ATOM 827 OH TYR A 51 -21.361 -15.831 -17.128 1.00 1.33 O ATOM 0 H TYR A 51 -14.088 -18.044 -19.901 1.00 44.00 H new ATOM 0 HA TYR A 51 -15.058 -16.429 -17.915 1.00 24.50 H new ATOM 0 HB2 TYR A 51 -16.146 -16.965 -20.097 1.00 72.43 H new ATOM 0 HB3 TYR A 51 -16.476 -18.594 -19.544 1.00 72.43 H new ATOM 0 HD1 TYR A 51 -17.038 -15.123 -18.188 1.00 74.22 H new ATOM 0 HD2 TYR A 51 -18.703 -18.963 -18.988 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -19.196 -14.376 -17.288 1.00 72.41 H new ATOM 0 HE2 TYR A 51 -20.857 -18.216 -18.083 1.00 3.03 H new ATOM 0 HH TYR A 51 -22.010 -16.563 -17.180 1.00 1.33 H new ATOM 837 N GLY A 52 -15.604 -19.581 -17.065 1.00 62.42 N ATOM 838 CA GLY A 52 -15.917 -20.421 -15.911 1.00 21.14 C ATOM 839 C GLY A 52 -14.872 -20.335 -14.801 1.00 43.31 C ATOM 840 O GLY A 52 -15.207 -20.132 -13.628 1.00 24.41 O ATOM 0 H GLY A 52 -15.467 -20.090 -17.938 1.00 62.42 H new ATOM 0 HA2 GLY A 52 -16.888 -20.129 -15.510 1.00 21.14 H new ATOM 0 HA3 GLY A 52 -16.006 -21.457 -16.238 1.00 21.14 H new ATOM 844 N TYR A 53 -13.606 -20.484 -15.180 1.00 23.45 N ATOM 845 CA TYR A 53 -12.487 -20.446 -14.232 1.00 13.34 C ATOM 846 C TYR A 53 -12.441 -19.121 -13.445 1.00 53.12 C ATOM 847 O TYR A 53 -12.269 -19.115 -12.222 1.00 72.01 O ATOM 848 CB TYR A 53 -11.171 -20.660 -14.994 1.00 44.21 C ATOM 849 CG TYR A 53 -9.950 -20.805 -14.101 1.00 54.54 C ATOM 850 CD1 TYR A 53 -9.722 -21.979 -13.390 1.00 11.23 C ATOM 851 CD2 TYR A 53 -9.023 -19.774 -13.976 1.00 11.02 C ATOM 852 CE1 TYR A 53 -8.611 -22.119 -12.580 1.00 43.02 C ATOM 853 CE2 TYR A 53 -7.911 -19.910 -13.168 1.00 42.45 C ATOM 854 CZ TYR A 53 -7.709 -21.082 -12.473 1.00 3.14 C ATOM 855 OH TYR A 53 -6.602 -21.218 -11.667 1.00 12.04 O ATOM 0 H TYR A 53 -13.323 -20.634 -16.148 1.00 23.45 H new ATOM 0 HA TYR A 53 -12.630 -21.245 -13.505 1.00 13.34 H new ATOM 0 HB2 TYR A 53 -11.263 -21.553 -15.612 1.00 44.21 H new ATOM 0 HB3 TYR A 53 -11.015 -19.819 -15.670 1.00 44.21 H new ATOM 0 HD1 TYR A 53 -10.425 -22.795 -13.472 1.00 11.23 H new ATOM 0 HD2 TYR A 53 -9.176 -18.853 -14.519 1.00 11.02 H new ATOM 0 HE1 TYR A 53 -8.450 -23.036 -12.033 1.00 43.02 H new ATOM 0 HE2 TYR A 53 -7.202 -19.100 -13.081 1.00 42.45 H new ATOM 0 HH TYR A 53 -6.068 -20.397 -11.704 1.00 12.04 H new ATOM 865 N MET A 54 -12.594 -17.998 -14.150 1.00 32.31 N ATOM 866 CA MET A 54 -12.602 -16.679 -13.507 1.00 11.10 C ATOM 867 C MET A 54 -13.867 -16.484 -12.655 1.00 23.11 C ATOM 868 O MET A 54 -13.798 -16.000 -11.524 1.00 2.35 O ATOM 869 CB MET A 54 -12.497 -15.565 -14.558 1.00 43.01 C ATOM 870 CG MET A 54 -12.421 -14.165 -13.961 1.00 11.31 C ATOM 871 SD MET A 54 -12.281 -12.883 -15.215 1.00 11.34 S ATOM 872 CE MET A 54 -12.115 -11.422 -14.194 1.00 71.42 C ATOM 0 H MET A 54 -12.714 -17.974 -15.163 1.00 32.31 H new ATOM 0 HA MET A 54 -11.735 -16.625 -12.849 1.00 11.10 H new ATOM 0 HB2 MET A 54 -11.612 -15.738 -15.171 1.00 43.01 H new ATOM 0 HB3 MET A 54 -13.360 -15.621 -15.222 1.00 43.01 H new ATOM 0 HG2 MET A 54 -13.311 -13.983 -13.358 1.00 11.31 H new ATOM 0 HG3 MET A 54 -11.564 -14.106 -13.290 1.00 11.31 H new ATOM 0 HE1 MET A 54 -11.624 -10.633 -14.764 1.00 71.42 H new ATOM 0 HE2 MET A 54 -13.102 -11.083 -13.881 1.00 71.42 H new ATOM 0 HE3 MET A 54 -11.517 -11.659 -13.314 1.00 71.42 H new ATOM 882 N GLU A 55 -15.016 -16.875 -13.211 1.00 54.21 N ATOM 883 CA GLU A 55 -16.311 -16.793 -12.515 1.00 32.42 C ATOM 884 C GLU A 55 -16.255 -17.459 -11.125 1.00 72.13 C ATOM 885 O GLU A 55 -16.869 -16.979 -10.169 1.00 21.05 O ATOM 886 CB GLU A 55 -17.396 -17.451 -13.384 1.00 21.41 C ATOM 887 CG GLU A 55 -18.789 -17.493 -12.759 1.00 13.31 C ATOM 888 CD GLU A 55 -19.791 -18.250 -13.625 1.00 75.12 C ATOM 889 OE1 GLU A 55 -19.682 -19.491 -13.719 1.00 34.51 O ATOM 890 OE2 GLU A 55 -20.691 -17.613 -14.214 1.00 51.34 O ATOM 0 H GLU A 55 -15.080 -17.257 -14.155 1.00 54.21 H new ATOM 0 HA GLU A 55 -16.553 -15.742 -12.358 1.00 32.42 H new ATOM 0 HB2 GLU A 55 -17.456 -16.915 -14.331 1.00 21.41 H new ATOM 0 HB3 GLU A 55 -17.087 -18.471 -13.614 1.00 21.41 H new ATOM 0 HG2 GLU A 55 -18.730 -17.965 -11.778 1.00 13.31 H new ATOM 0 HG3 GLU A 55 -19.145 -16.475 -12.602 1.00 13.31 H new ATOM 897 N ARG A 56 -15.502 -18.555 -11.019 1.00 15.11 N ATOM 898 CA ARG A 56 -15.325 -19.259 -9.741 1.00 24.11 C ATOM 899 C ARG A 56 -14.695 -18.363 -8.656 1.00 11.21 C ATOM 900 O ARG A 56 -15.070 -18.440 -7.487 1.00 63.13 O ATOM 901 CB ARG A 56 -14.448 -20.505 -9.935 1.00 43.23 C ATOM 902 CG ARG A 56 -15.142 -21.673 -10.628 1.00 71.52 C ATOM 903 CD ARG A 56 -16.332 -22.199 -9.822 1.00 63.21 C ATOM 904 NE ARG A 56 -16.592 -23.613 -10.088 1.00 45.42 N ATOM 905 CZ ARG A 56 -17.706 -24.230 -9.806 1.00 41.11 C ATOM 906 NH1 ARG A 56 -18.734 -23.583 -9.355 1.00 75.52 N ATOM 907 NH2 ARG A 56 -17.793 -25.506 -9.994 1.00 54.14 N ATOM 0 H ARG A 56 -15.003 -18.977 -11.802 1.00 15.11 H new ATOM 0 HA ARG A 56 -16.320 -19.547 -9.403 1.00 24.11 H new ATOM 0 HB2 ARG A 56 -13.569 -20.226 -10.516 1.00 43.23 H new ATOM 0 HB3 ARG A 56 -14.093 -20.838 -8.960 1.00 43.23 H new ATOM 0 HG2 ARG A 56 -15.484 -21.357 -11.614 1.00 71.52 H new ATOM 0 HG3 ARG A 56 -14.425 -22.479 -10.783 1.00 71.52 H new ATOM 0 HD2 ARG A 56 -16.139 -22.060 -8.758 1.00 63.21 H new ATOM 0 HD3 ARG A 56 -17.220 -21.615 -10.064 1.00 63.21 H new ATOM 0 HE ARG A 56 -15.848 -24.156 -10.526 1.00 45.42 H new ATOM 0 HH11 ARG A 56 -18.680 -22.574 -9.215 1.00 75.52 H new ATOM 0 HH12 ARG A 56 -19.597 -24.083 -9.140 1.00 75.52 H new ATOM 0 HH21 ARG A 56 -16.994 -26.023 -10.360 1.00 54.14 H new ATOM 0 HH22 ARG A 56 -18.661 -25.996 -9.776 1.00 54.14 H new ATOM 921 N HIS A 57 -13.736 -17.517 -9.042 1.00 61.21 N ATOM 922 CA HIS A 57 -13.000 -16.702 -8.063 1.00 3.13 C ATOM 923 C HIS A 57 -13.181 -15.193 -8.284 1.00 23.41 C ATOM 924 O HIS A 57 -12.409 -14.395 -7.753 1.00 33.12 O ATOM 925 CB HIS A 57 -11.507 -17.078 -8.047 1.00 25.12 C ATOM 926 CG HIS A 57 -10.751 -16.820 -9.319 1.00 43.10 C ATOM 927 ND1 HIS A 57 -10.524 -17.789 -10.270 1.00 4.53 N ATOM 928 CD2 HIS A 57 -10.109 -15.709 -9.761 1.00 20.44 C ATOM 929 CE1 HIS A 57 -9.775 -17.294 -11.235 1.00 1.23 C ATOM 930 NE2 HIS A 57 -9.504 -16.031 -10.954 1.00 73.35 N ATOM 0 H HIS A 57 -13.451 -17.377 -10.011 1.00 61.21 H new ATOM 0 HA HIS A 57 -13.430 -16.927 -7.087 1.00 3.13 H new ATOM 0 HB2 HIS A 57 -11.022 -16.527 -7.241 1.00 25.12 H new ATOM 0 HB3 HIS A 57 -11.422 -18.137 -7.805 1.00 25.12 H new ATOM 0 HD2 HIS A 57 -10.079 -14.749 -9.267 1.00 20.44 H new ATOM 0 HE1 HIS A 57 -9.439 -17.831 -12.110 1.00 1.23 H new ATOM 0 HE2 HIS A 57 -8.941 -15.401 -11.526 1.00 73.35 H new ATOM 939 N ILE A 58 -14.192 -14.804 -9.064 1.00 43.12 N ATOM 940 CA ILE A 58 -14.490 -13.379 -9.299 1.00 62.50 C ATOM 941 C ILE A 58 -14.643 -12.597 -7.972 1.00 24.14 C ATOM 942 O ILE A 58 -14.216 -11.448 -7.861 1.00 1.11 O ATOM 943 CB ILE A 58 -15.774 -13.209 -10.162 1.00 20.33 C ATOM 944 CG1 ILE A 58 -16.014 -11.724 -10.507 1.00 54.13 C ATOM 945 CG2 ILE A 58 -16.994 -13.805 -9.454 1.00 45.43 C ATOM 946 CD1 ILE A 58 -14.929 -11.110 -11.371 1.00 42.40 C ATOM 0 H ILE A 58 -14.819 -15.449 -9.545 1.00 43.12 H new ATOM 0 HA ILE A 58 -13.641 -12.965 -9.843 1.00 62.50 H new ATOM 0 HB ILE A 58 -15.625 -13.754 -11.094 1.00 20.33 H new ATOM 0 HG12 ILE A 58 -16.970 -11.631 -11.021 1.00 54.13 H new ATOM 0 HG13 ILE A 58 -16.093 -11.154 -9.581 1.00 54.13 H new ATOM 0 HG21 ILE A 58 -17.878 -13.673 -10.078 1.00 45.43 H new ATOM 0 HG22 ILE A 58 -16.829 -14.868 -9.278 1.00 45.43 H new ATOM 0 HG23 ILE A 58 -17.145 -13.299 -8.500 1.00 45.43 H new ATOM 0 HD11 ILE A 58 -15.170 -10.066 -11.570 1.00 42.40 H new ATOM 0 HD12 ILE A 58 -13.973 -11.169 -10.851 1.00 42.40 H new ATOM 0 HD13 ILE A 58 -14.864 -11.653 -12.314 1.00 42.40 H new ATOM 958 N ASN A 59 -15.234 -13.240 -6.967 1.00 21.30 N ATOM 959 CA ASN A 59 -15.388 -12.639 -5.633 1.00 14.30 C ATOM 960 C ASN A 59 -14.081 -12.723 -4.814 1.00 61.13 C ATOM 961 O ASN A 59 -13.736 -11.795 -4.081 1.00 62.23 O ATOM 962 CB ASN A 59 -16.543 -13.320 -4.879 1.00 3.45 C ATOM 963 CG ASN A 59 -16.515 -14.836 -4.985 1.00 63.14 C ATOM 964 OD1 ASN A 59 -15.467 -15.443 -5.167 1.00 43.34 O ATOM 965 ND2 ASN A 59 -17.670 -15.458 -4.875 1.00 22.32 N ATOM 0 H ASN A 59 -15.617 -14.182 -7.047 1.00 21.30 H new ATOM 0 HA ASN A 59 -15.621 -11.583 -5.766 1.00 14.30 H new ATOM 0 HB2 ASN A 59 -16.500 -13.035 -3.828 1.00 3.45 H new ATOM 0 HB3 ASN A 59 -17.491 -12.952 -5.271 1.00 3.45 H new ATOM 0 HD21 ASN A 59 -17.710 -16.475 -4.941 1.00 22.32 H new ATOM 0 HD22 ASN A 59 -18.525 -14.923 -4.724 1.00 22.32 H new ATOM 972 N GLU A 60 -13.355 -13.834 -4.945 1.00 12.51 N ATOM 973 CA GLU A 60 -12.073 -14.007 -4.249 1.00 72.10 C ATOM 974 C GLU A 60 -11.059 -12.934 -4.675 1.00 24.12 C ATOM 975 O GLU A 60 -10.409 -12.308 -3.835 1.00 24.23 O ATOM 976 CB GLU A 60 -11.498 -15.405 -4.521 1.00 74.23 C ATOM 977 CG GLU A 60 -12.368 -16.546 -4.007 1.00 32.24 C ATOM 978 CD GLU A 60 -11.715 -17.907 -4.198 1.00 45.44 C ATOM 979 OE1 GLU A 60 -10.981 -18.355 -3.292 1.00 65.13 O ATOM 980 OE2 GLU A 60 -11.924 -18.529 -5.258 1.00 0.23 O ATOM 0 H GLU A 60 -13.629 -14.627 -5.524 1.00 12.51 H new ATOM 0 HA GLU A 60 -12.259 -13.899 -3.180 1.00 72.10 H new ATOM 0 HB2 GLU A 60 -11.357 -15.525 -5.595 1.00 74.23 H new ATOM 0 HB3 GLU A 60 -10.513 -15.477 -4.060 1.00 74.23 H new ATOM 0 HG2 GLU A 60 -12.576 -16.392 -2.948 1.00 32.24 H new ATOM 0 HG3 GLU A 60 -13.326 -16.530 -4.526 1.00 32.24 H new ATOM 987 N ILE A 61 -10.924 -12.728 -5.987 1.00 33.22 N ATOM 988 CA ILE A 61 -10.030 -11.691 -6.515 1.00 21.20 C ATOM 989 C ILE A 61 -10.526 -10.293 -6.116 1.00 14.33 C ATOM 990 O ILE A 61 -9.733 -9.376 -5.900 1.00 21.33 O ATOM 991 CB ILE A 61 -9.885 -11.793 -8.060 1.00 54.14 C ATOM 992 CG1 ILE A 61 -8.808 -10.818 -8.572 1.00 14.25 C ATOM 993 CG2 ILE A 61 -11.220 -11.533 -8.758 1.00 24.12 C ATOM 994 CD1 ILE A 61 -8.536 -10.929 -10.060 1.00 21.00 C ATOM 0 H ILE A 61 -11.419 -13.262 -6.701 1.00 33.22 H new ATOM 0 HA ILE A 61 -9.045 -11.853 -6.076 1.00 21.20 H new ATOM 0 HB ILE A 61 -9.572 -12.809 -8.299 1.00 54.14 H new ATOM 0 HG12 ILE A 61 -9.117 -9.798 -8.344 1.00 14.25 H new ATOM 0 HG13 ILE A 61 -7.881 -10.999 -8.029 1.00 14.25 H new ATOM 0 HG21 ILE A 61 -11.088 -11.611 -9.837 1.00 24.12 H new ATOM 0 HG22 ILE A 61 -11.953 -12.270 -8.428 1.00 24.12 H new ATOM 0 HG23 ILE A 61 -11.573 -10.533 -8.507 1.00 24.12 H new ATOM 0 HD11 ILE A 61 -7.767 -10.211 -10.344 1.00 21.00 H new ATOM 0 HD12 ILE A 61 -8.195 -11.938 -10.293 1.00 21.00 H new ATOM 0 HD13 ILE A 61 -9.451 -10.718 -10.614 1.00 21.00 H new ATOM 1006 N ARG A 62 -11.846 -10.154 -5.997 1.00 11.41 N ATOM 1007 CA ARG A 62 -12.456 -8.918 -5.504 1.00 70.43 C ATOM 1008 C ARG A 62 -11.975 -8.612 -4.074 1.00 51.21 C ATOM 1009 O ARG A 62 -11.642 -7.472 -3.746 1.00 21.31 O ATOM 1010 CB ARG A 62 -13.984 -9.043 -5.540 1.00 53.23 C ATOM 1011 CG ARG A 62 -14.720 -7.759 -5.187 1.00 51.01 C ATOM 1012 CD ARG A 62 -16.231 -7.927 -5.296 1.00 0.51 C ATOM 1013 NE ARG A 62 -16.787 -8.723 -4.204 1.00 11.24 N ATOM 1014 CZ ARG A 62 -17.923 -8.454 -3.612 1.00 15.43 C ATOM 1015 NH1 ARG A 62 -18.600 -7.396 -3.930 1.00 14.43 N ATOM 1016 NH2 ARG A 62 -18.374 -9.232 -2.683 1.00 52.32 N ATOM 0 H ARG A 62 -12.516 -10.885 -6.236 1.00 11.41 H new ATOM 0 HA ARG A 62 -12.153 -8.093 -6.149 1.00 70.43 H new ATOM 0 HB2 ARG A 62 -14.289 -9.362 -6.537 1.00 53.23 H new ATOM 0 HB3 ARG A 62 -14.290 -9.827 -4.847 1.00 53.23 H new ATOM 0 HG2 ARG A 62 -14.460 -7.458 -4.172 1.00 51.01 H new ATOM 0 HG3 ARG A 62 -14.394 -6.958 -5.851 1.00 51.01 H new ATOM 0 HD2 ARG A 62 -16.703 -6.944 -5.302 1.00 0.51 H new ATOM 0 HD3 ARG A 62 -16.473 -8.402 -6.247 1.00 0.51 H new ATOM 0 HE ARG A 62 -16.259 -9.535 -3.885 1.00 11.24 H new ATOM 0 HH11 ARG A 62 -18.249 -6.763 -4.648 1.00 14.43 H new ATOM 0 HH12 ARG A 62 -19.484 -7.196 -3.462 1.00 14.43 H new ATOM 0 HH21 ARG A 62 -17.844 -10.059 -2.409 1.00 52.32 H new ATOM 0 HH22 ARG A 62 -19.260 -9.018 -2.224 1.00 52.32 H new ATOM 1030 N THR A 63 -11.937 -9.649 -3.230 1.00 12.23 N ATOM 1031 CA THR A 63 -11.383 -9.524 -1.875 1.00 24.53 C ATOM 1032 C THR A 63 -9.897 -9.157 -1.926 1.00 24.20 C ATOM 1033 O THR A 63 -9.443 -8.280 -1.199 1.00 0.44 O ATOM 1034 CB THR A 63 -11.550 -10.832 -1.050 1.00 41.20 C ATOM 1035 OG1 THR A 63 -12.942 -11.092 -0.805 1.00 32.32 O ATOM 1036 CG2 THR A 63 -10.809 -10.753 0.289 1.00 3.20 C ATOM 0 H THR A 63 -12.282 -10.581 -3.459 1.00 12.23 H new ATOM 0 HA THR A 63 -11.945 -8.730 -1.383 1.00 24.53 H new ATOM 0 HB THR A 63 -11.119 -11.644 -1.636 1.00 41.20 H new ATOM 0 HG1 THR A 63 -13.034 -11.919 -0.287 1.00 32.32 H new ATOM 0 HG21 THR A 63 -10.948 -11.685 0.838 1.00 3.20 H new ATOM 0 HG22 THR A 63 -9.746 -10.594 0.108 1.00 3.20 H new ATOM 0 HG23 THR A 63 -11.205 -9.924 0.875 1.00 3.20 H new ATOM 1044 N ALA A 64 -9.146 -9.829 -2.800 1.00 5.43 N ATOM 1045 CA ALA A 64 -7.712 -9.557 -2.965 1.00 23.12 C ATOM 1046 C ALA A 64 -7.451 -8.070 -3.263 1.00 51.42 C ATOM 1047 O ALA A 64 -6.626 -7.432 -2.609 1.00 11.41 O ATOM 1048 CB ALA A 64 -7.136 -10.432 -4.073 1.00 2.25 C ATOM 0 H ALA A 64 -9.505 -10.567 -3.406 1.00 5.43 H new ATOM 0 HA ALA A 64 -7.214 -9.798 -2.026 1.00 23.12 H new ATOM 0 HB1 ALA A 64 -6.072 -10.222 -4.187 1.00 2.25 H new ATOM 0 HB2 ALA A 64 -7.273 -11.482 -3.816 1.00 2.25 H new ATOM 0 HB3 ALA A 64 -7.650 -10.218 -5.010 1.00 2.25 H new ATOM 1054 N VAL A 65 -8.171 -7.531 -4.249 1.00 5.14 N ATOM 1055 CA VAL A 65 -8.094 -6.102 -4.596 1.00 32.22 C ATOM 1056 C VAL A 65 -8.326 -5.212 -3.361 1.00 72.14 C ATOM 1057 O VAL A 65 -7.576 -4.266 -3.105 1.00 30.03 O ATOM 1058 CB VAL A 65 -9.135 -5.749 -5.696 1.00 22.50 C ATOM 1059 CG1 VAL A 65 -9.178 -4.245 -5.966 1.00 33.10 C ATOM 1060 CG2 VAL A 65 -8.835 -6.517 -6.983 1.00 53.42 C ATOM 0 H VAL A 65 -8.820 -8.064 -4.828 1.00 5.14 H new ATOM 0 HA VAL A 65 -7.090 -5.912 -4.976 1.00 32.22 H new ATOM 0 HB VAL A 65 -10.118 -6.047 -5.331 1.00 22.50 H new ATOM 0 HG11 VAL A 65 -9.916 -4.035 -6.740 1.00 33.10 H new ATOM 0 HG12 VAL A 65 -9.452 -3.719 -5.051 1.00 33.10 H new ATOM 0 HG13 VAL A 65 -8.197 -3.907 -6.299 1.00 33.10 H new ATOM 0 HG21 VAL A 65 -9.573 -6.258 -7.742 1.00 53.42 H new ATOM 0 HG22 VAL A 65 -7.840 -6.253 -7.340 1.00 53.42 H new ATOM 0 HG23 VAL A 65 -8.878 -7.588 -6.786 1.00 53.42 H new ATOM 1070 N ASP A 66 -9.364 -5.536 -2.596 1.00 32.51 N ATOM 1071 CA ASP A 66 -9.680 -4.818 -1.359 1.00 44.24 C ATOM 1072 C ASP A 66 -8.533 -4.929 -0.337 1.00 1.52 C ATOM 1073 O ASP A 66 -8.144 -3.936 0.273 1.00 2.21 O ATOM 1074 CB ASP A 66 -10.985 -5.369 -0.769 1.00 63.02 C ATOM 1075 CG ASP A 66 -11.375 -4.706 0.543 1.00 10.54 C ATOM 1076 OD1 ASP A 66 -12.015 -3.631 0.505 1.00 13.10 O ATOM 1077 OD2 ASP A 66 -11.067 -5.266 1.615 1.00 63.52 O ATOM 0 H ASP A 66 -10.008 -6.298 -2.811 1.00 32.51 H new ATOM 0 HA ASP A 66 -9.806 -3.761 -1.593 1.00 44.24 H new ATOM 0 HB2 ASP A 66 -11.790 -5.232 -1.491 1.00 63.02 H new ATOM 0 HB3 ASP A 66 -10.880 -6.442 -0.609 1.00 63.02 H new ATOM 1082 N LYS A 67 -7.986 -6.136 -0.169 1.00 54.13 N ATOM 1083 CA LYS A 67 -6.903 -6.367 0.796 1.00 22.21 C ATOM 1084 C LYS A 67 -5.650 -5.545 0.457 1.00 22.24 C ATOM 1085 O LYS A 67 -5.008 -4.990 1.348 1.00 24.41 O ATOM 1086 CB LYS A 67 -6.536 -7.857 0.875 1.00 72.24 C ATOM 1087 CG LYS A 67 -7.709 -8.767 1.223 1.00 14.21 C ATOM 1088 CD LYS A 67 -7.253 -10.192 1.538 1.00 44.30 C ATOM 1089 CE LYS A 67 -6.681 -10.304 2.945 1.00 50.20 C ATOM 1090 NZ LYS A 67 -6.201 -11.679 3.243 1.00 40.13 N ATOM 0 H LYS A 67 -8.273 -6.967 -0.686 1.00 54.13 H new ATOM 0 HA LYS A 67 -7.276 -6.041 1.767 1.00 22.21 H new ATOM 0 HB2 LYS A 67 -6.119 -8.169 -0.082 1.00 72.24 H new ATOM 0 HB3 LYS A 67 -5.753 -7.989 1.622 1.00 72.24 H new ATOM 0 HG2 LYS A 67 -8.243 -8.359 2.081 1.00 14.21 H new ATOM 0 HG3 LYS A 67 -8.412 -8.787 0.390 1.00 14.21 H new ATOM 0 HD2 LYS A 67 -8.096 -10.875 1.433 1.00 44.30 H new ATOM 0 HD3 LYS A 67 -6.500 -10.501 0.814 1.00 44.30 H new ATOM 0 HE2 LYS A 67 -5.857 -9.600 3.058 1.00 50.20 H new ATOM 0 HE3 LYS A 67 -7.444 -10.021 3.670 1.00 50.20 H new ATOM 0 HZ1 LYS A 67 -5.820 -11.712 4.210 1.00 40.13 H new ATOM 0 HZ2 LYS A 67 -6.992 -12.349 3.160 1.00 40.13 H new ATOM 0 HZ3 LYS A 67 -5.455 -11.940 2.568 1.00 40.13 H new ATOM 1104 N VAL A 68 -5.306 -5.471 -0.831 1.00 74.42 N ATOM 1105 CA VAL A 68 -4.157 -4.672 -1.278 1.00 31.45 C ATOM 1106 C VAL A 68 -4.265 -3.226 -0.773 1.00 34.42 C ATOM 1107 O VAL A 68 -3.379 -2.731 -0.072 1.00 71.13 O ATOM 1108 CB VAL A 68 -4.033 -4.667 -2.825 1.00 65.14 C ATOM 1109 CG1 VAL A 68 -2.868 -3.784 -3.278 1.00 72.15 C ATOM 1110 CG2 VAL A 68 -3.872 -6.090 -3.359 1.00 50.22 C ATOM 0 H VAL A 68 -5.803 -5.951 -1.581 1.00 74.42 H new ATOM 0 HA VAL A 68 -3.264 -5.135 -0.858 1.00 31.45 H new ATOM 0 HB VAL A 68 -4.952 -4.249 -3.236 1.00 65.14 H new ATOM 0 HG11 VAL A 68 -2.803 -3.798 -4.366 1.00 72.15 H new ATOM 0 HG12 VAL A 68 -3.032 -2.762 -2.937 1.00 72.15 H new ATOM 0 HG13 VAL A 68 -1.938 -4.163 -2.854 1.00 72.15 H new ATOM 0 HG21 VAL A 68 -3.787 -6.063 -4.445 1.00 50.22 H new ATOM 0 HG22 VAL A 68 -2.973 -6.538 -2.935 1.00 50.22 H new ATOM 0 HG23 VAL A 68 -4.741 -6.685 -3.078 1.00 50.22 H new ATOM 1120 N GLU A 69 -5.372 -2.567 -1.105 1.00 12.24 N ATOM 1121 CA GLU A 69 -5.610 -1.187 -0.673 1.00 15.22 C ATOM 1122 C GLU A 69 -5.978 -1.101 0.823 1.00 64.53 C ATOM 1123 O GLU A 69 -5.855 -0.042 1.436 1.00 5.43 O ATOM 1124 CB GLU A 69 -6.695 -0.537 -1.545 1.00 64.41 C ATOM 1125 CG GLU A 69 -6.272 -0.317 -3.000 1.00 40.42 C ATOM 1126 CD GLU A 69 -4.971 0.476 -3.132 1.00 34.13 C ATOM 1127 OE1 GLU A 69 -5.019 1.726 -3.116 1.00 3.25 O ATOM 1128 OE2 GLU A 69 -3.895 -0.146 -3.254 1.00 4.33 O ATOM 0 H GLU A 69 -6.121 -2.964 -1.672 1.00 12.24 H new ATOM 0 HA GLU A 69 -4.678 -0.636 -0.801 1.00 15.22 H new ATOM 0 HB2 GLU A 69 -7.586 -1.164 -1.527 1.00 64.41 H new ATOM 0 HB3 GLU A 69 -6.972 0.423 -1.108 1.00 64.41 H new ATOM 0 HG2 GLU A 69 -6.152 -1.284 -3.488 1.00 40.42 H new ATOM 0 HG3 GLU A 69 -7.067 0.210 -3.528 1.00 40.42 H new ATOM 1135 N LEU A 70 -6.427 -2.215 1.407 1.00 14.35 N ATOM 1136 CA LEU A 70 -6.694 -2.279 2.854 1.00 3.10 C ATOM 1137 C LEU A 70 -5.393 -2.133 3.655 1.00 3.44 C ATOM 1138 O LEU A 70 -5.227 -1.180 4.423 1.00 21.20 O ATOM 1139 CB LEU A 70 -7.387 -3.601 3.224 1.00 22.44 C ATOM 1140 CG LEU A 70 -7.589 -3.846 4.733 1.00 42.11 C ATOM 1141 CD1 LEU A 70 -8.487 -2.775 5.347 1.00 30.14 C ATOM 1142 CD2 LEU A 70 -8.159 -5.240 4.980 1.00 41.33 C ATOM 0 H LEU A 70 -6.614 -3.084 0.906 1.00 14.35 H new ATOM 0 HA LEU A 70 -7.357 -1.452 3.106 1.00 3.10 H new ATOM 0 HB2 LEU A 70 -8.361 -3.629 2.736 1.00 22.44 H new ATOM 0 HB3 LEU A 70 -6.802 -4.425 2.815 1.00 22.44 H new ATOM 0 HG LEU A 70 -6.615 -3.784 5.219 1.00 42.11 H new ATOM 0 HD11 LEU A 70 -8.613 -2.972 6.412 1.00 30.14 H new ATOM 0 HD12 LEU A 70 -8.030 -1.795 5.211 1.00 30.14 H new ATOM 0 HD13 LEU A 70 -9.461 -2.792 4.857 1.00 30.14 H new ATOM 0 HD21 LEU A 70 -8.294 -5.393 6.051 1.00 41.33 H new ATOM 0 HD22 LEU A 70 -9.121 -5.334 4.476 1.00 41.33 H new ATOM 0 HD23 LEU A 70 -7.470 -5.989 4.590 1.00 41.33 H new ATOM 1154 N PHE A 71 -4.465 -3.076 3.463 1.00 62.50 N ATOM 1155 CA PHE A 71 -3.158 -3.019 4.127 1.00 75.11 C ATOM 1156 C PHE A 71 -2.413 -1.735 3.738 1.00 3.43 C ATOM 1157 O PHE A 71 -1.693 -1.148 4.544 1.00 64.04 O ATOM 1158 CB PHE A 71 -2.310 -4.248 3.763 1.00 14.54 C ATOM 1159 CG PHE A 71 -2.936 -5.566 4.157 1.00 75.53 C ATOM 1160 CD1 PHE A 71 -3.163 -5.872 5.492 1.00 2.41 C ATOM 1161 CD2 PHE A 71 -3.290 -6.502 3.193 1.00 61.10 C ATOM 1162 CE1 PHE A 71 -3.731 -7.079 5.853 1.00 11.22 C ATOM 1163 CE2 PHE A 71 -3.856 -7.708 3.551 1.00 44.32 C ATOM 1164 CZ PHE A 71 -4.078 -7.997 4.881 1.00 45.54 C ATOM 0 H PHE A 71 -4.593 -3.885 2.856 1.00 62.50 H new ATOM 0 HA PHE A 71 -3.325 -3.017 5.204 1.00 75.11 H new ATOM 0 HB2 PHE A 71 -2.133 -4.249 2.687 1.00 14.54 H new ATOM 0 HB3 PHE A 71 -1.337 -4.161 4.246 1.00 14.54 H new ATOM 0 HD1 PHE A 71 -2.893 -5.159 6.257 1.00 2.41 H new ATOM 0 HD2 PHE A 71 -3.120 -6.282 2.149 1.00 61.10 H new ATOM 0 HE1 PHE A 71 -3.904 -7.304 6.895 1.00 11.22 H new ATOM 0 HE2 PHE A 71 -4.125 -8.426 2.790 1.00 44.32 H new ATOM 0 HZ PHE A 71 -4.523 -8.940 5.162 1.00 45.54 H new ATOM 1174 N LEU A 72 -2.603 -1.309 2.491 1.00 53.31 N ATOM 1175 CA LEU A 72 -2.047 -0.047 2.000 1.00 53.44 C ATOM 1176 C LEU A 72 -2.614 1.149 2.787 1.00 22.40 C ATOM 1177 O LEU A 72 -1.876 2.054 3.169 1.00 73.04 O ATOM 1178 CB LEU A 72 -2.339 0.085 0.490 1.00 45.25 C ATOM 1179 CG LEU A 72 -1.857 1.370 -0.214 1.00 53.12 C ATOM 1180 CD1 LEU A 72 -2.836 2.522 -0.021 1.00 21.12 C ATOM 1181 CD2 LEU A 72 -0.453 1.754 0.251 1.00 24.04 C ATOM 0 H LEU A 72 -3.143 -1.824 1.795 1.00 53.31 H new ATOM 0 HA LEU A 72 -0.968 -0.047 2.152 1.00 53.44 H new ATOM 0 HB2 LEU A 72 -1.886 -0.767 -0.017 1.00 45.25 H new ATOM 0 HB3 LEU A 72 -3.417 0.006 0.347 1.00 45.25 H new ATOM 0 HG LEU A 72 -1.814 1.160 -1.283 1.00 53.12 H new ATOM 0 HD11 LEU A 72 -2.460 3.408 -0.532 1.00 21.12 H new ATOM 0 HD12 LEU A 72 -3.806 2.248 -0.436 1.00 21.12 H new ATOM 0 HD13 LEU A 72 -2.943 2.734 1.043 1.00 21.12 H new ATOM 0 HD21 LEU A 72 -0.136 2.663 -0.260 1.00 24.04 H new ATOM 0 HD22 LEU A 72 -0.461 1.927 1.327 1.00 24.04 H new ATOM 0 HD23 LEU A 72 0.241 0.946 0.018 1.00 24.04 H new ATOM 1193 N LYS A 73 -3.922 1.147 3.018 1.00 32.41 N ATOM 1194 CA LYS A 73 -4.581 2.224 3.770 1.00 10.05 C ATOM 1195 C LYS A 73 -3.999 2.351 5.187 1.00 41.13 C ATOM 1196 O LYS A 73 -3.708 3.455 5.658 1.00 30.01 O ATOM 1197 CB LYS A 73 -6.099 1.971 3.824 1.00 51.14 C ATOM 1198 CG LYS A 73 -6.897 3.012 4.620 1.00 3.55 C ATOM 1199 CD LYS A 73 -7.373 2.472 5.972 1.00 40.35 C ATOM 1200 CE LYS A 73 -8.319 1.286 5.807 1.00 71.23 C ATOM 1201 NZ LYS A 73 -8.834 0.787 7.109 1.00 63.13 N ATOM 0 H LYS A 73 -4.553 0.413 2.697 1.00 32.41 H new ATOM 0 HA LYS A 73 -4.397 3.167 3.255 1.00 10.05 H new ATOM 0 HB2 LYS A 73 -6.484 1.940 2.805 1.00 51.14 H new ATOM 0 HB3 LYS A 73 -6.274 0.988 4.261 1.00 51.14 H new ATOM 0 HG2 LYS A 73 -6.278 3.895 4.782 1.00 3.55 H new ATOM 0 HG3 LYS A 73 -7.760 3.330 4.035 1.00 3.55 H new ATOM 0 HD2 LYS A 73 -6.511 2.169 6.566 1.00 40.35 H new ATOM 0 HD3 LYS A 73 -7.878 3.266 6.523 1.00 40.35 H new ATOM 0 HE2 LYS A 73 -9.158 1.579 5.176 1.00 71.23 H new ATOM 0 HE3 LYS A 73 -7.799 0.479 5.292 1.00 71.23 H new ATOM 0 HZ1 LYS A 73 -9.472 -0.018 6.945 1.00 63.13 H new ATOM 0 HZ2 LYS A 73 -8.037 0.482 7.704 1.00 63.13 H new ATOM 0 HZ3 LYS A 73 -9.354 1.548 7.591 1.00 63.13 H new ATOM 1215 N GLU A 74 -3.816 1.212 5.852 1.00 70.14 N ATOM 1216 CA GLU A 74 -3.249 1.191 7.204 1.00 11.04 C ATOM 1217 C GLU A 74 -1.750 1.544 7.175 1.00 5.52 C ATOM 1218 O GLU A 74 -1.239 2.237 8.060 1.00 30.14 O ATOM 1219 CB GLU A 74 -3.476 -0.188 7.853 1.00 65.04 C ATOM 1220 CG GLU A 74 -4.901 -0.718 7.672 1.00 13.13 C ATOM 1221 CD GLU A 74 -5.276 -1.820 8.658 1.00 25.34 C ATOM 1222 OE1 GLU A 74 -4.690 -2.922 8.592 1.00 1.44 O ATOM 1223 OE2 GLU A 74 -6.168 -1.583 9.502 1.00 73.34 O ATOM 0 H GLU A 74 -4.051 0.292 5.480 1.00 70.14 H new ATOM 0 HA GLU A 74 -3.757 1.945 7.805 1.00 11.04 H new ATOM 0 HB2 GLU A 74 -2.773 -0.903 7.425 1.00 65.04 H new ATOM 0 HB3 GLU A 74 -3.254 -0.121 8.918 1.00 65.04 H new ATOM 0 HG2 GLU A 74 -5.603 0.109 7.781 1.00 13.13 H new ATOM 0 HG3 GLU A 74 -5.011 -1.098 6.657 1.00 13.13 H new ATOM 1230 N TYR A 75 -1.058 1.077 6.131 1.00 42.44 N ATOM 1231 CA TYR A 75 0.365 1.385 5.923 1.00 41.33 C ATOM 1232 C TYR A 75 0.591 2.892 5.715 1.00 65.03 C ATOM 1233 O TYR A 75 1.453 3.495 6.358 1.00 55.25 O ATOM 1234 CB TYR A 75 0.900 0.596 4.714 1.00 72.10 C ATOM 1235 CG TYR A 75 2.354 0.878 4.368 1.00 50.24 C ATOM 1236 CD1 TYR A 75 3.390 0.262 5.065 1.00 62.21 C ATOM 1237 CD2 TYR A 75 2.688 1.759 3.343 1.00 2.02 C ATOM 1238 CE1 TYR A 75 4.714 0.518 4.749 1.00 13.21 C ATOM 1239 CE2 TYR A 75 4.008 2.019 3.026 1.00 15.44 C ATOM 1240 CZ TYR A 75 5.016 1.397 3.731 1.00 23.25 C ATOM 1241 OH TYR A 75 6.330 1.666 3.424 1.00 74.12 O ATOM 0 H TYR A 75 -1.462 0.479 5.410 1.00 42.44 H new ATOM 0 HA TYR A 75 0.909 1.088 6.819 1.00 41.33 H new ATOM 0 HB2 TYR A 75 0.788 -0.470 4.914 1.00 72.10 H new ATOM 0 HB3 TYR A 75 0.282 0.824 3.845 1.00 72.10 H new ATOM 0 HD1 TYR A 75 3.158 -0.426 5.864 1.00 62.21 H new ATOM 0 HD2 TYR A 75 1.902 2.248 2.786 1.00 2.02 H new ATOM 0 HE1 TYR A 75 5.506 0.031 5.298 1.00 13.21 H new ATOM 0 HE2 TYR A 75 4.249 2.707 2.229 1.00 15.44 H new ATOM 0 HH TYR A 75 6.895 0.926 3.729 1.00 74.12 H new ATOM 1251 N LEU A 76 -0.186 3.497 4.813 1.00 31.15 N ATOM 1252 CA LEU A 76 -0.070 4.933 4.534 1.00 1.10 C ATOM 1253 C LEU A 76 -0.330 5.779 5.789 1.00 51.31 C ATOM 1254 O LEU A 76 0.385 6.745 6.039 1.00 21.41 O ATOM 1255 CB LEU A 76 -1.012 5.363 3.390 1.00 50.32 C ATOM 1256 CG LEU A 76 -0.540 4.987 1.971 1.00 4.04 C ATOM 1257 CD1 LEU A 76 -1.528 5.478 0.910 1.00 44.32 C ATOM 1258 CD2 LEU A 76 0.855 5.549 1.699 1.00 1.34 C ATOM 0 H LEU A 76 -0.900 3.018 4.264 1.00 31.15 H new ATOM 0 HA LEU A 76 0.957 5.111 4.216 1.00 1.10 H new ATOM 0 HB2 LEU A 76 -1.991 4.915 3.560 1.00 50.32 H new ATOM 0 HB3 LEU A 76 -1.144 6.444 3.437 1.00 50.32 H new ATOM 0 HG LEU A 76 -0.495 3.899 1.914 1.00 4.04 H new ATOM 0 HD11 LEU A 76 -1.168 5.198 -0.080 1.00 44.32 H new ATOM 0 HD12 LEU A 76 -2.504 5.024 1.083 1.00 44.32 H new ATOM 0 HD13 LEU A 76 -1.617 6.563 0.970 1.00 44.32 H new ATOM 0 HD21 LEU A 76 1.169 5.272 0.693 1.00 1.34 H new ATOM 0 HD22 LEU A 76 0.833 6.635 1.786 1.00 1.34 H new ATOM 0 HD23 LEU A 76 1.559 5.141 2.424 1.00 1.34 H new ATOM 1270 N HIS A 77 -1.340 5.417 6.582 1.00 72.44 N ATOM 1271 CA HIS A 77 -1.630 6.152 7.822 1.00 31.45 C ATOM 1272 C HIS A 77 -0.441 6.078 8.797 1.00 1.21 C ATOM 1273 O HIS A 77 -0.167 7.027 9.531 1.00 45.21 O ATOM 1274 CB HIS A 77 -2.902 5.614 8.496 1.00 43.13 C ATOM 1275 CG HIS A 77 -3.391 6.480 9.625 1.00 31.42 C ATOM 1276 ND1 HIS A 77 -3.260 6.148 10.958 1.00 10.22 N ATOM 1277 CD2 HIS A 77 -4.009 7.689 9.607 1.00 34.42 C ATOM 1278 CE1 HIS A 77 -3.771 7.108 11.703 1.00 52.14 C ATOM 1279 NE2 HIS A 77 -4.231 8.052 10.910 1.00 73.22 N ATOM 0 H HIS A 77 -1.964 4.632 6.395 1.00 72.44 H new ATOM 0 HA HIS A 77 -1.795 7.196 7.556 1.00 31.45 H new ATOM 0 HB2 HIS A 77 -3.690 5.525 7.749 1.00 43.13 H new ATOM 0 HB3 HIS A 77 -2.707 4.611 8.875 1.00 43.13 H new ATOM 0 HD2 HIS A 77 -4.276 8.259 8.729 1.00 34.42 H new ATOM 0 HE1 HIS A 77 -3.806 7.118 12.782 1.00 52.14 H new ATOM 0 HE2 HIS A 77 -4.680 8.915 11.216 1.00 73.22 H new ATOM 1288 N PHE A 78 0.264 4.947 8.783 1.00 21.33 N ATOM 1289 CA PHE A 78 1.427 4.742 9.652 1.00 10.41 C ATOM 1290 C PHE A 78 2.624 5.592 9.187 1.00 31.11 C ATOM 1291 O PHE A 78 3.192 6.365 9.963 1.00 51.42 O ATOM 1292 CB PHE A 78 1.805 3.252 9.666 1.00 33.31 C ATOM 1293 CG PHE A 78 2.757 2.856 10.776 1.00 32.34 C ATOM 1294 CD1 PHE A 78 4.134 2.940 10.603 1.00 32.43 C ATOM 1295 CD2 PHE A 78 2.267 2.386 11.987 1.00 75.40 C ATOM 1296 CE1 PHE A 78 4.997 2.560 11.616 1.00 24.40 C ATOM 1297 CE2 PHE A 78 3.127 2.010 13.002 1.00 4.43 C ATOM 1298 CZ PHE A 78 4.493 2.096 12.816 1.00 44.00 C ATOM 0 H PHE A 78 0.050 4.155 8.177 1.00 21.33 H new ATOM 0 HA PHE A 78 1.165 5.058 10.662 1.00 10.41 H new ATOM 0 HB2 PHE A 78 0.894 2.660 9.757 1.00 33.31 H new ATOM 0 HB3 PHE A 78 2.257 2.996 8.708 1.00 33.31 H new ATOM 0 HD1 PHE A 78 4.534 3.305 9.669 1.00 32.43 H new ATOM 0 HD2 PHE A 78 1.200 2.313 12.138 1.00 75.40 H new ATOM 0 HE1 PHE A 78 6.065 2.626 11.469 1.00 24.40 H new ATOM 0 HE2 PHE A 78 2.731 1.649 13.940 1.00 4.43 H new ATOM 0 HZ PHE A 78 5.166 1.801 13.607 1.00 44.00 H new ATOM 1308 N VAL A 79 2.999 5.451 7.914 1.00 2.50 N ATOM 1309 CA VAL A 79 4.132 6.201 7.358 1.00 74.11 C ATOM 1310 C VAL A 79 3.878 7.722 7.373 1.00 33.45 C ATOM 1311 O VAL A 79 4.790 8.503 7.642 1.00 75.31 O ATOM 1312 CB VAL A 79 4.482 5.741 5.918 1.00 45.30 C ATOM 1313 CG1 VAL A 79 4.902 4.273 5.912 1.00 23.35 C ATOM 1314 CG2 VAL A 79 3.313 5.973 4.965 1.00 20.10 C ATOM 0 H VAL A 79 2.539 4.828 7.250 1.00 2.50 H new ATOM 0 HA VAL A 79 4.983 5.987 8.004 1.00 74.11 H new ATOM 0 HB VAL A 79 5.321 6.342 5.567 1.00 45.30 H new ATOM 0 HG11 VAL A 79 5.144 3.968 4.894 1.00 23.35 H new ATOM 0 HG12 VAL A 79 5.778 4.143 6.548 1.00 23.35 H new ATOM 0 HG13 VAL A 79 4.085 3.659 6.290 1.00 23.35 H new ATOM 0 HG21 VAL A 79 3.588 5.641 3.964 1.00 20.10 H new ATOM 0 HG22 VAL A 79 2.446 5.409 5.309 1.00 20.10 H new ATOM 0 HG23 VAL A 79 3.069 7.035 4.941 1.00 20.10 H new ATOM 1324 N LYS A 80 2.639 8.137 7.090 1.00 24.10 N ATOM 1325 CA LYS A 80 2.257 9.556 7.186 1.00 51.40 C ATOM 1326 C LYS A 80 2.463 10.081 8.613 1.00 43.01 C ATOM 1327 O LYS A 80 2.973 11.185 8.811 1.00 62.41 O ATOM 1328 CB LYS A 80 0.792 9.760 6.766 1.00 54.12 C ATOM 1329 CG LYS A 80 0.541 9.622 5.264 1.00 43.10 C ATOM 1330 CD LYS A 80 -0.950 9.707 4.940 1.00 60.34 C ATOM 1331 CE LYS A 80 -1.215 9.701 3.438 1.00 51.40 C ATOM 1332 NZ LYS A 80 -0.630 10.891 2.765 1.00 74.23 N ATOM 0 H LYS A 80 1.885 7.517 6.794 1.00 24.10 H new ATOM 0 HA LYS A 80 2.899 10.117 6.507 1.00 51.40 H new ATOM 0 HB2 LYS A 80 0.171 9.036 7.294 1.00 54.12 H new ATOM 0 HB3 LYS A 80 0.469 10.751 7.087 1.00 54.12 H new ATOM 0 HG2 LYS A 80 1.077 10.407 4.730 1.00 43.10 H new ATOM 0 HG3 LYS A 80 0.938 8.670 4.913 1.00 43.10 H new ATOM 0 HD2 LYS A 80 -1.469 8.867 5.402 1.00 60.34 H new ATOM 0 HD3 LYS A 80 -1.364 10.616 5.376 1.00 60.34 H new ATOM 0 HE2 LYS A 80 -0.797 8.795 3.000 1.00 51.40 H new ATOM 0 HE3 LYS A 80 -2.290 9.675 3.259 1.00 51.40 H new ATOM 0 HZ1 LYS A 80 -0.973 10.939 1.784 1.00 74.23 H new ATOM 0 HZ2 LYS A 80 -0.915 11.752 3.273 1.00 74.23 H new ATOM 0 HZ3 LYS A 80 0.407 10.815 2.766 1.00 74.23 H new ATOM 1346 N GLY A 81 2.065 9.279 9.603 1.00 33.34 N ATOM 1347 CA GLY A 81 2.292 9.634 10.997 1.00 44.20 C ATOM 1348 C GLY A 81 3.771 9.811 11.320 1.00 62.55 C ATOM 1349 O GLY A 81 4.153 10.715 12.068 1.00 21.43 O ATOM 0 H GLY A 81 1.588 8.388 9.463 1.00 33.34 H new ATOM 0 HA2 GLY A 81 1.760 10.558 11.225 1.00 44.20 H new ATOM 0 HA3 GLY A 81 1.873 8.859 11.639 1.00 44.20 H new ATOM 1353 N ALA A 82 4.604 8.938 10.761 1.00 31.11 N ATOM 1354 CA ALA A 82 6.058 9.067 10.889 1.00 61.20 C ATOM 1355 C ALA A 82 6.555 10.376 10.253 1.00 1.21 C ATOM 1356 O ALA A 82 7.299 11.138 10.875 1.00 30.24 O ATOM 1357 CB ALA A 82 6.749 7.867 10.254 1.00 61.22 C ATOM 0 H ALA A 82 4.300 8.132 10.214 1.00 31.11 H new ATOM 0 HA ALA A 82 6.307 9.095 11.950 1.00 61.20 H new ATOM 0 HB1 ALA A 82 7.829 7.974 10.355 1.00 61.22 H new ATOM 0 HB2 ALA A 82 6.426 6.954 10.755 1.00 61.22 H new ATOM 0 HB3 ALA A 82 6.487 7.813 9.197 1.00 61.22 H new ATOM 1363 N VAL A 83 6.124 10.638 9.018 1.00 64.30 N ATOM 1364 CA VAL A 83 6.448 11.895 8.329 1.00 3.42 C ATOM 1365 C VAL A 83 5.991 13.110 9.159 1.00 23.34 C ATOM 1366 O VAL A 83 6.675 14.133 9.223 1.00 71.43 O ATOM 1367 CB VAL A 83 5.797 11.950 6.916 1.00 13.31 C ATOM 1368 CG1 VAL A 83 6.098 13.275 6.213 1.00 62.35 C ATOM 1369 CG2 VAL A 83 6.262 10.771 6.059 1.00 34.13 C ATOM 0 H VAL A 83 5.549 9.997 8.471 1.00 64.30 H new ATOM 0 HA VAL A 83 7.531 11.931 8.213 1.00 3.42 H new ATOM 0 HB VAL A 83 4.717 11.879 7.048 1.00 13.31 H new ATOM 0 HG11 VAL A 83 5.629 13.280 5.229 1.00 62.35 H new ATOM 0 HG12 VAL A 83 5.704 14.100 6.807 1.00 62.35 H new ATOM 0 HG13 VAL A 83 7.176 13.391 6.101 1.00 62.35 H new ATOM 0 HG21 VAL A 83 5.795 10.829 5.076 1.00 34.13 H new ATOM 0 HG22 VAL A 83 7.346 10.807 5.948 1.00 34.13 H new ATOM 0 HG23 VAL A 83 5.977 9.836 6.541 1.00 34.13 H new ATOM 1379 N ALA A 84 4.837 12.979 9.808 1.00 0.11 N ATOM 1380 CA ALA A 84 4.321 14.023 10.699 1.00 13.32 C ATOM 1381 C ALA A 84 5.292 14.304 11.862 1.00 43.05 C ATOM 1382 O ALA A 84 5.424 15.443 12.314 1.00 3.13 O ATOM 1383 CB ALA A 84 2.945 13.632 11.226 1.00 2.24 C ATOM 0 H ALA A 84 4.237 12.158 9.735 1.00 0.11 H new ATOM 0 HA ALA A 84 4.228 14.943 10.122 1.00 13.32 H new ATOM 0 HB1 ALA A 84 2.572 14.415 11.886 1.00 2.24 H new ATOM 0 HB2 ALA A 84 2.258 13.505 10.390 1.00 2.24 H new ATOM 0 HB3 ALA A 84 3.020 12.696 11.779 1.00 2.24 H new ATOM 1389 N ASN A 85 5.978 13.263 12.340 1.00 44.22 N ATOM 1390 CA ASN A 85 7.009 13.433 13.374 1.00 2.13 C ATOM 1391 C ASN A 85 8.254 14.125 12.800 1.00 74.31 C ATOM 1392 O ASN A 85 8.872 14.961 13.463 1.00 64.21 O ATOM 1393 CB ASN A 85 7.397 12.083 13.996 1.00 43.32 C ATOM 1394 CG ASN A 85 6.337 11.559 14.949 1.00 22.13 C ATOM 1395 OD1 ASN A 85 6.330 11.891 16.129 1.00 22.52 O ATOM 1396 ND2 ASN A 85 5.431 10.738 14.456 1.00 50.23 N ATOM 0 H ASN A 85 5.842 12.300 12.033 1.00 44.22 H new ATOM 0 HA ASN A 85 6.588 14.065 14.156 1.00 2.13 H new ATOM 0 HB2 ASN A 85 7.561 11.354 13.202 1.00 43.32 H new ATOM 0 HB3 ASN A 85 8.341 12.190 14.530 1.00 43.32 H new ATOM 0 HD21 ASN A 85 4.700 10.362 15.061 1.00 50.23 H new ATOM 0 HD22 ASN A 85 5.461 10.478 13.470 1.00 50.23 H new ATOM 1403 N ALA A 86 8.604 13.787 11.559 1.00 41.51 N ATOM 1404 CA ALA A 86 9.740 14.414 10.869 1.00 42.31 C ATOM 1405 C ALA A 86 9.570 15.937 10.744 1.00 45.30 C ATOM 1406 O ALA A 86 10.545 16.671 10.578 1.00 22.51 O ATOM 1407 CB ALA A 86 9.923 13.795 9.489 1.00 42.21 C ATOM 0 H ALA A 86 8.118 13.081 11.006 1.00 41.51 H new ATOM 0 HA ALA A 86 10.629 14.230 11.472 1.00 42.31 H new ATOM 0 HB1 ALA A 86 10.767 14.268 8.987 1.00 42.21 H new ATOM 0 HB2 ALA A 86 10.113 12.727 9.592 1.00 42.21 H new ATOM 0 HB3 ALA A 86 9.019 13.947 8.899 1.00 42.21 H new ATOM 1413 N ALA A 87 8.325 16.407 10.819 1.00 2.24 N ATOM 1414 CA ALA A 87 8.032 17.845 10.764 1.00 44.34 C ATOM 1415 C ALA A 87 8.563 18.584 12.008 1.00 64.54 C ATOM 1416 O ALA A 87 8.782 19.795 11.980 1.00 14.43 O ATOM 1417 CB ALA A 87 6.530 18.066 10.614 1.00 72.34 C ATOM 0 H ALA A 87 7.500 15.815 10.918 1.00 2.24 H new ATOM 0 HA ALA A 87 8.545 18.258 9.895 1.00 44.34 H new ATOM 0 HB1 ALA A 87 6.322 19.135 10.574 1.00 72.34 H new ATOM 0 HB2 ALA A 87 6.183 17.594 9.695 1.00 72.34 H new ATOM 0 HB3 ALA A 87 6.011 17.627 11.466 1.00 72.34 H new ATOM 1423 N CYS A 88 8.777 17.839 13.094 1.00 23.24 N ATOM 1424 CA CYS A 88 9.275 18.411 14.357 1.00 4.25 C ATOM 1425 C CYS A 88 10.804 18.583 14.348 1.00 63.51 C ATOM 1426 O CYS A 88 11.373 19.230 15.231 1.00 31.42 O ATOM 1427 CB CYS A 88 8.863 17.516 15.532 1.00 21.01 C ATOM 1428 SG CYS A 88 9.379 18.123 17.159 1.00 63.05 S ATOM 0 H CYS A 88 8.614 16.833 13.129 1.00 23.24 H new ATOM 0 HA CYS A 88 8.830 19.400 14.468 1.00 4.25 H new ATOM 0 HB2 CYS A 88 7.778 17.408 15.526 1.00 21.01 H new ATOM 0 HB3 CYS A 88 9.283 16.522 15.379 1.00 21.01 H new ATOM 0 HG CYS A 88 10.495 18.780 17.043 1.00 63.05 H new ATOM 1434 N LEU A 89 11.466 17.999 13.350 1.00 64.13 N ATOM 1435 CA LEU A 89 12.926 18.095 13.219 1.00 65.00 C ATOM 1436 C LEU A 89 13.355 19.504 12.766 1.00 30.33 C ATOM 1437 O LEU A 89 12.832 20.027 11.779 1.00 33.11 O ATOM 1438 CB LEU A 89 13.436 17.041 12.221 1.00 41.25 C ATOM 1439 CG LEU A 89 13.172 15.577 12.617 1.00 20.24 C ATOM 1440 CD1 LEU A 89 13.656 14.624 11.525 1.00 41.24 C ATOM 1441 CD2 LEU A 89 13.839 15.255 13.954 1.00 15.55 C ATOM 0 H LEU A 89 11.016 17.452 12.616 1.00 64.13 H new ATOM 0 HA LEU A 89 13.367 17.907 14.198 1.00 65.00 H new ATOM 0 HB2 LEU A 89 12.972 17.227 11.252 1.00 41.25 H new ATOM 0 HB3 LEU A 89 14.510 17.177 12.091 1.00 41.25 H new ATOM 0 HG LEU A 89 12.096 15.441 12.730 1.00 20.24 H new ATOM 0 HD11 LEU A 89 13.459 13.595 11.827 1.00 41.24 H new ATOM 0 HD12 LEU A 89 13.128 14.837 10.596 1.00 41.24 H new ATOM 0 HD13 LEU A 89 14.727 14.759 11.373 1.00 41.24 H new ATOM 0 HD21 LEU A 89 13.642 14.216 14.218 1.00 15.55 H new ATOM 0 HD22 LEU A 89 14.915 15.410 13.871 1.00 15.55 H new ATOM 0 HD23 LEU A 89 13.437 15.909 14.728 1.00 15.55 H new ATOM 1453 N PRO A 90 14.321 20.133 13.476 1.00 62.44 N ATOM 1454 CA PRO A 90 14.768 21.514 13.180 1.00 72.20 C ATOM 1455 C PRO A 90 15.244 21.703 11.726 1.00 71.10 C ATOM 1456 O PRO A 90 14.951 22.722 11.094 1.00 3.31 O ATOM 1457 CB PRO A 90 15.930 21.742 14.171 1.00 60.31 C ATOM 1458 CG PRO A 90 16.314 20.380 14.653 1.00 21.45 C ATOM 1459 CD PRO A 90 15.055 19.558 14.617 1.00 10.12 C ATOM 0 HA PRO A 90 13.950 22.227 13.289 1.00 72.20 H new ATOM 0 HB2 PRO A 90 16.770 22.238 13.684 1.00 60.31 H new ATOM 0 HB3 PRO A 90 15.620 22.379 14.999 1.00 60.31 H new ATOM 0 HG2 PRO A 90 17.084 19.943 14.016 1.00 21.45 H new ATOM 0 HG3 PRO A 90 16.723 20.424 15.663 1.00 21.45 H new ATOM 0 HD2 PRO A 90 15.268 18.499 14.469 1.00 10.12 H new ATOM 0 HD3 PRO A 90 14.490 19.643 15.545 1.00 10.12 H new ATOM 1467 N GLU A 91 15.973 20.718 11.200 1.00 23.31 N ATOM 1468 CA GLU A 91 16.473 20.769 9.816 1.00 30.42 C ATOM 1469 C GLU A 91 15.336 20.828 8.798 1.00 32.14 C ATOM 1470 O GLU A 91 15.389 21.598 7.836 1.00 52.15 O ATOM 1471 CB GLU A 91 17.333 19.537 9.492 1.00 12.20 C ATOM 1472 CG GLU A 91 18.688 19.503 10.173 1.00 72.32 C ATOM 1473 CD GLU A 91 18.592 19.522 11.689 1.00 63.05 C ATOM 1474 OE1 GLU A 91 17.986 18.591 12.257 1.00 51.40 O ATOM 1475 OE2 GLU A 91 19.112 20.470 12.317 1.00 73.23 O ATOM 0 H GLU A 91 16.233 19.873 11.708 1.00 23.31 H new ATOM 0 HA GLU A 91 17.071 21.678 9.745 1.00 30.42 H new ATOM 0 HB2 GLU A 91 16.779 18.642 9.774 1.00 12.20 H new ATOM 0 HB3 GLU A 91 17.484 19.492 8.413 1.00 12.20 H new ATOM 0 HG2 GLU A 91 19.223 18.607 9.860 1.00 72.32 H new ATOM 0 HG3 GLU A 91 19.277 20.358 9.841 1.00 72.32 H new ATOM 1482 N LEU A 92 14.337 19.960 8.996 1.00 1.13 N ATOM 1483 CA LEU A 92 13.237 19.770 8.039 1.00 73.30 C ATOM 1484 C LEU A 92 13.720 18.988 6.791 1.00 64.22 C ATOM 1485 O LEU A 92 12.915 18.412 6.060 1.00 62.35 O ATOM 1486 CB LEU A 92 12.617 21.139 7.659 1.00 45.05 C ATOM 1487 CG LEU A 92 11.189 21.138 7.070 1.00 40.02 C ATOM 1488 CD1 LEU A 92 11.173 20.686 5.611 1.00 4.41 C ATOM 1489 CD2 LEU A 92 10.255 20.278 7.923 1.00 54.31 C ATOM 0 H LEU A 92 14.267 19.369 9.824 1.00 1.13 H new ATOM 0 HA LEU A 92 12.458 19.171 8.511 1.00 73.30 H new ATOM 0 HB2 LEU A 92 12.612 21.765 8.551 1.00 45.05 H new ATOM 0 HB3 LEU A 92 13.278 21.618 6.937 1.00 45.05 H new ATOM 0 HG LEU A 92 10.826 22.165 7.089 1.00 40.02 H new ATOM 0 HD11 LEU A 92 10.149 20.700 5.237 1.00 4.41 H new ATOM 0 HD12 LEU A 92 11.787 21.361 5.014 1.00 4.41 H new ATOM 0 HD13 LEU A 92 11.571 19.674 5.539 1.00 4.41 H new ATOM 0 HD21 LEU A 92 9.254 20.290 7.492 1.00 54.31 H new ATOM 0 HD22 LEU A 92 10.626 19.254 7.949 1.00 54.31 H new ATOM 0 HD23 LEU A 92 10.218 20.677 8.937 1.00 54.31 H new ATOM 1501 N ILE A 93 15.044 18.920 6.592 1.00 23.53 N ATOM 1502 CA ILE A 93 15.632 18.274 5.408 1.00 4.41 C ATOM 1503 C ILE A 93 15.110 16.839 5.223 1.00 62.24 C ATOM 1504 O ILE A 93 14.643 16.468 4.144 1.00 74.02 O ATOM 1505 CB ILE A 93 17.180 18.240 5.500 1.00 23.01 C ATOM 1506 CG1 ILE A 93 17.746 19.646 5.766 1.00 52.54 C ATOM 1507 CG2 ILE A 93 17.786 17.652 4.224 1.00 71.43 C ATOM 1508 CD1 ILE A 93 17.409 20.661 4.694 1.00 51.44 C ATOM 0 H ILE A 93 15.732 19.306 7.239 1.00 23.53 H new ATOM 0 HA ILE A 93 15.332 18.871 4.547 1.00 4.41 H new ATOM 0 HB ILE A 93 17.452 17.599 6.338 1.00 23.01 H new ATOM 0 HG12 ILE A 93 17.366 20.004 6.723 1.00 52.54 H new ATOM 0 HG13 ILE A 93 18.830 19.578 5.859 1.00 52.54 H new ATOM 0 HG21 ILE A 93 18.872 17.638 4.310 1.00 71.43 H new ATOM 0 HG22 ILE A 93 17.420 16.635 4.082 1.00 71.43 H new ATOM 0 HG23 ILE A 93 17.498 18.264 3.369 1.00 71.43 H new ATOM 0 HD11 ILE A 93 17.844 21.625 4.956 1.00 51.44 H new ATOM 0 HD12 ILE A 93 17.813 20.328 3.738 1.00 51.44 H new ATOM 0 HD13 ILE A 93 16.326 20.761 4.615 1.00 51.44 H new ATOM 1520 N LEU A 94 15.187 16.038 6.287 1.00 32.54 N ATOM 1521 CA LEU A 94 14.676 14.663 6.255 1.00 12.52 C ATOM 1522 C LEU A 94 13.183 14.626 5.887 1.00 54.43 C ATOM 1523 O LEU A 94 12.754 13.805 5.073 1.00 2.45 O ATOM 1524 CB LEU A 94 14.907 13.979 7.612 1.00 63.13 C ATOM 1525 CG LEU A 94 14.373 12.540 7.724 1.00 43.24 C ATOM 1526 CD1 LEU A 94 14.947 11.653 6.618 1.00 41.31 C ATOM 1527 CD2 LEU A 94 14.687 11.956 9.099 1.00 60.41 C ATOM 0 H LEU A 94 15.596 16.315 7.179 1.00 32.54 H new ATOM 0 HA LEU A 94 15.223 14.121 5.484 1.00 12.52 H new ATOM 0 HB2 LEU A 94 15.977 13.968 7.817 1.00 63.13 H new ATOM 0 HB3 LEU A 94 14.439 14.584 8.389 1.00 63.13 H new ATOM 0 HG LEU A 94 13.290 12.572 7.602 1.00 43.24 H new ATOM 0 HD11 LEU A 94 14.553 10.642 6.721 1.00 41.31 H new ATOM 0 HD12 LEU A 94 14.664 12.055 5.645 1.00 41.31 H new ATOM 0 HD13 LEU A 94 16.034 11.629 6.698 1.00 41.31 H new ATOM 0 HD21 LEU A 94 14.301 10.938 9.159 1.00 60.41 H new ATOM 0 HD22 LEU A 94 15.766 11.945 9.252 1.00 60.41 H new ATOM 0 HD23 LEU A 94 14.218 12.567 9.870 1.00 60.41 H new ATOM 1539 N HIS A 95 12.401 15.536 6.474 1.00 24.24 N ATOM 1540 CA HIS A 95 10.957 15.600 6.217 1.00 3.05 C ATOM 1541 C HIS A 95 10.662 15.848 4.727 1.00 62.32 C ATOM 1542 O HIS A 95 9.718 15.286 4.170 1.00 53.41 O ATOM 1543 CB HIS A 95 10.314 16.706 7.064 1.00 22.43 C ATOM 1544 CG HIS A 95 8.823 16.806 6.907 1.00 55.44 C ATOM 1545 ND1 HIS A 95 7.837 15.994 7.346 1.00 64.10 N flip ATOM 1546 CD2 HIS A 95 8.191 17.839 6.245 1.00 31.11 C flip ATOM 1547 CE1 HIS A 95 6.646 16.543 6.949 1.00 34.24 C flip ATOM 1548 NE2 HIS A 95 6.887 17.654 6.287 1.00 5.12 N flip ATOM 0 H HIS A 95 12.742 16.239 7.130 1.00 24.24 H new ATOM 0 HA HIS A 95 10.529 14.637 6.494 1.00 3.05 H new ATOM 0 HB2 HIS A 95 10.548 16.528 8.114 1.00 22.43 H new ATOM 0 HB3 HIS A 95 10.762 17.662 6.795 1.00 22.43 H new ATOM 0 HD2 HIS A 95 8.688 18.670 5.767 1.00 31.11 H new ATOM 0 HE1 HIS A 95 5.668 16.130 7.147 1.00 34.24 H new ATOM 0 HE2 HIS A 95 6.184 18.268 5.876 1.00 5.12 H new ATOM 1557 N ASN A 96 11.474 16.697 4.101 1.00 43.21 N ATOM 1558 CA ASN A 96 11.327 17.020 2.675 1.00 3.02 C ATOM 1559 C ASN A 96 11.552 15.771 1.801 1.00 63.13 C ATOM 1560 O ASN A 96 10.714 15.416 0.971 1.00 33.03 O ATOM 1561 CB ASN A 96 12.327 18.128 2.293 1.00 31.54 C ATOM 1562 CG ASN A 96 12.073 18.723 0.915 1.00 51.44 C ATOM 1563 OD1 ASN A 96 11.537 18.075 0.024 1.00 4.42 O ATOM 1564 ND2 ASN A 96 12.470 19.967 0.724 1.00 41.35 N ATOM 0 H ASN A 96 12.247 17.179 4.559 1.00 43.21 H new ATOM 0 HA ASN A 96 10.311 17.373 2.499 1.00 3.02 H new ATOM 0 HB2 ASN A 96 12.280 18.922 3.038 1.00 31.54 H new ATOM 0 HB3 ASN A 96 13.338 17.721 2.324 1.00 31.54 H new ATOM 0 HD21 ASN A 96 12.333 20.412 -0.183 1.00 41.35 H new ATOM 0 HD22 ASN A 96 12.914 20.483 1.484 1.00 41.35 H new ATOM 1571 N LYS A 97 12.678 15.097 2.016 1.00 63.04 N ATOM 1572 CA LYS A 97 13.027 13.904 1.237 1.00 44.32 C ATOM 1573 C LYS A 97 12.003 12.770 1.429 1.00 43.52 C ATOM 1574 O LYS A 97 11.436 12.263 0.459 1.00 74.44 O ATOM 1575 CB LYS A 97 14.429 13.413 1.627 1.00 22.31 C ATOM 1576 CG LYS A 97 15.524 14.453 1.414 1.00 62.53 C ATOM 1577 CD LYS A 97 16.899 13.924 1.818 1.00 14.13 C ATOM 1578 CE LYS A 97 17.984 14.980 1.648 1.00 74.04 C ATOM 1579 NZ LYS A 97 19.321 14.475 2.061 1.00 34.34 N ATOM 0 H LYS A 97 13.367 15.354 2.723 1.00 63.04 H new ATOM 0 HA LYS A 97 13.015 14.185 0.184 1.00 44.32 H new ATOM 0 HB2 LYS A 97 14.422 13.116 2.676 1.00 22.31 H new ATOM 0 HB3 LYS A 97 14.668 12.523 1.045 1.00 22.31 H new ATOM 0 HG2 LYS A 97 15.543 14.750 0.365 1.00 62.53 H new ATOM 0 HG3 LYS A 97 15.294 15.346 1.994 1.00 62.53 H new ATOM 0 HD2 LYS A 97 16.871 13.596 2.857 1.00 14.13 H new ATOM 0 HD3 LYS A 97 17.144 13.050 1.214 1.00 14.13 H new ATOM 0 HE2 LYS A 97 18.022 15.297 0.606 1.00 74.04 H new ATOM 0 HE3 LYS A 97 17.730 15.860 2.239 1.00 74.04 H new ATOM 0 HZ1 LYS A 97 20.031 15.224 1.930 1.00 34.34 H new ATOM 0 HZ2 LYS A 97 19.293 14.197 3.063 1.00 34.34 H new ATOM 0 HZ3 LYS A 97 19.576 13.651 1.480 1.00 34.34 H new ATOM 1593 N MET A 98 11.757 12.389 2.685 1.00 42.42 N ATOM 1594 CA MET A 98 10.882 11.249 2.990 1.00 44.13 C ATOM 1595 C MET A 98 9.445 11.459 2.473 1.00 41.04 C ATOM 1596 O MET A 98 8.784 10.499 2.071 1.00 30.14 O ATOM 1597 CB MET A 98 10.872 10.956 4.500 1.00 34.44 C ATOM 1598 CG MET A 98 10.193 12.023 5.348 1.00 23.12 C ATOM 1599 SD MET A 98 10.394 11.739 7.118 1.00 43.31 S ATOM 1600 CE MET A 98 9.724 10.086 7.295 1.00 62.24 C ATOM 0 H MET A 98 12.149 12.850 3.506 1.00 42.42 H new ATOM 0 HA MET A 98 11.292 10.386 2.465 1.00 44.13 H new ATOM 0 HB2 MET A 98 10.371 10.003 4.669 1.00 34.44 H new ATOM 0 HB3 MET A 98 11.901 10.840 4.841 1.00 34.44 H new ATOM 0 HG2 MET A 98 10.603 13.000 5.092 1.00 23.12 H new ATOM 0 HG3 MET A 98 9.130 12.051 5.107 1.00 23.12 H new ATOM 0 HE1 MET A 98 8.999 10.072 8.109 1.00 62.24 H new ATOM 0 HE2 MET A 98 9.234 9.791 6.367 1.00 62.24 H new ATOM 0 HE3 MET A 98 10.531 9.388 7.517 1.00 62.24 H new ATOM 1610 N LYS A 99 8.960 12.707 2.470 1.00 50.35 N ATOM 1611 CA LYS A 99 7.612 12.981 1.954 1.00 33.54 C ATOM 1612 C LYS A 99 7.576 12.830 0.425 1.00 2.21 C ATOM 1613 O LYS A 99 6.591 12.354 -0.131 1.00 50.43 O ATOM 1614 CB LYS A 99 7.106 14.380 2.362 1.00 43.00 C ATOM 1615 CG LYS A 99 7.785 15.544 1.642 1.00 23.02 C ATOM 1616 CD LYS A 99 7.017 16.853 1.821 1.00 22.31 C ATOM 1617 CE LYS A 99 5.624 16.779 1.199 1.00 33.50 C ATOM 1618 NZ LYS A 99 4.905 18.077 1.262 1.00 1.31 N ATOM 0 H LYS A 99 9.466 13.525 2.810 1.00 50.35 H new ATOM 0 HA LYS A 99 6.943 12.246 2.402 1.00 33.54 H new ATOM 0 HB2 LYS A 99 6.033 14.432 2.174 1.00 43.00 H new ATOM 0 HB3 LYS A 99 7.248 14.503 3.436 1.00 43.00 H new ATOM 0 HG2 LYS A 99 8.799 15.664 2.023 1.00 23.02 H new ATOM 0 HG3 LYS A 99 7.868 15.315 0.580 1.00 23.02 H new ATOM 0 HD2 LYS A 99 6.930 17.082 2.883 1.00 22.31 H new ATOM 0 HD3 LYS A 99 7.577 17.669 1.364 1.00 22.31 H new ATOM 0 HE2 LYS A 99 5.710 16.465 0.159 1.00 33.50 H new ATOM 0 HE3 LYS A 99 5.039 16.018 1.715 1.00 33.50 H new ATOM 0 HZ1 LYS A 99 3.966 17.975 0.828 1.00 1.31 H new ATOM 0 HZ2 LYS A 99 4.798 18.367 2.255 1.00 1.31 H new ATOM 0 HZ3 LYS A 99 5.448 18.800 0.747 1.00 1.31 H new ATOM 1632 N ARG A 100 8.658 13.233 -0.248 1.00 12.24 N ATOM 1633 CA ARG A 100 8.772 13.062 -1.702 1.00 4.32 C ATOM 1634 C ARG A 100 8.702 11.578 -2.087 1.00 32.55 C ATOM 1635 O ARG A 100 7.947 11.190 -2.985 1.00 73.13 O ATOM 1636 CB ARG A 100 10.082 13.674 -2.213 1.00 30.12 C ATOM 1637 CG ARG A 100 10.116 15.200 -2.171 1.00 44.22 C ATOM 1638 CD ARG A 100 11.468 15.737 -2.636 1.00 43.33 C ATOM 1639 NE ARG A 100 11.872 15.154 -3.920 1.00 25.43 N ATOM 1640 CZ ARG A 100 13.071 14.706 -4.181 1.00 72.24 C ATOM 1641 NH1 ARG A 100 14.021 14.816 -3.311 1.00 13.22 N ATOM 1642 NH2 ARG A 100 13.325 14.159 -5.324 1.00 13.31 N ATOM 0 H ARG A 100 9.466 13.679 0.188 1.00 12.24 H new ATOM 0 HA ARG A 100 7.934 13.580 -2.168 1.00 4.32 H new ATOM 0 HB2 ARG A 100 10.908 13.286 -1.617 1.00 30.12 H new ATOM 0 HB3 ARG A 100 10.248 13.346 -3.239 1.00 30.12 H new ATOM 0 HG2 ARG A 100 9.325 15.601 -2.805 1.00 44.22 H new ATOM 0 HG3 ARG A 100 9.916 15.543 -1.156 1.00 44.22 H new ATOM 0 HD2 ARG A 100 11.416 16.822 -2.729 1.00 43.33 H new ATOM 0 HD3 ARG A 100 12.225 15.518 -1.883 1.00 43.33 H new ATOM 0 HE ARG A 100 11.170 15.094 -4.658 1.00 25.43 H new ATOM 0 HH11 ARG A 100 13.838 15.256 -2.409 1.00 13.22 H new ATOM 0 HH12 ARG A 100 14.953 14.462 -3.526 1.00 13.22 H new ATOM 0 HH21 ARG A 100 12.588 14.076 -6.025 1.00 13.31 H new ATOM 0 HH22 ARG A 100 14.262 13.810 -5.525 1.00 13.31 H new ATOM 1656 N GLU A 101 9.492 10.756 -1.395 1.00 44.13 N ATOM 1657 CA GLU A 101 9.475 9.303 -1.595 1.00 13.11 C ATOM 1658 C GLU A 101 8.061 8.738 -1.378 1.00 50.21 C ATOM 1659 O GLU A 101 7.603 7.867 -2.122 1.00 23.03 O ATOM 1660 CB GLU A 101 10.463 8.620 -0.631 1.00 1.45 C ATOM 1661 CG GLU A 101 11.878 9.194 -0.668 1.00 63.03 C ATOM 1662 CD GLU A 101 12.543 9.071 -2.033 1.00 1.40 C ATOM 1663 OE1 GLU A 101 13.049 7.980 -2.356 1.00 22.11 O ATOM 1664 OE2 GLU A 101 12.563 10.067 -2.789 1.00 2.41 O ATOM 0 H GLU A 101 10.155 11.072 -0.687 1.00 44.13 H new ATOM 0 HA GLU A 101 9.778 9.099 -2.622 1.00 13.11 H new ATOM 0 HB2 GLU A 101 10.077 8.703 0.385 1.00 1.45 H new ATOM 0 HB3 GLU A 101 10.509 7.557 -0.869 1.00 1.45 H new ATOM 0 HG2 GLU A 101 11.844 10.245 -0.382 1.00 63.03 H new ATOM 0 HG3 GLU A 101 12.490 8.681 0.074 1.00 63.03 H new ATOM 1671 N LEU A 102 7.377 9.244 -0.352 1.00 55.52 N ATOM 1672 CA LEU A 102 6.007 8.823 -0.040 1.00 1.12 C ATOM 1673 C LEU A 102 5.009 9.275 -1.120 1.00 41.45 C ATOM 1674 O LEU A 102 4.105 8.525 -1.494 1.00 75.41 O ATOM 1675 CB LEU A 102 5.585 9.378 1.328 1.00 44.24 C ATOM 1676 CG LEU A 102 4.166 8.995 1.785 1.00 0.13 C ATOM 1677 CD1 LEU A 102 4.011 7.476 1.846 1.00 63.44 C ATOM 1678 CD2 LEU A 102 3.844 9.631 3.136 1.00 12.45 C ATOM 0 H LEU A 102 7.750 9.950 0.282 1.00 55.52 H new ATOM 0 HA LEU A 102 5.995 7.733 -0.013 1.00 1.12 H new ATOM 0 HB2 LEU A 102 6.296 9.031 2.077 1.00 44.24 H new ATOM 0 HB3 LEU A 102 5.658 10.465 1.299 1.00 44.24 H new ATOM 0 HG LEU A 102 3.455 9.379 1.053 1.00 0.13 H new ATOM 0 HD11 LEU A 102 3.001 7.226 2.171 1.00 63.44 H new ATOM 0 HD12 LEU A 102 4.189 7.052 0.858 1.00 63.44 H new ATOM 0 HD13 LEU A 102 4.732 7.065 2.553 1.00 63.44 H new ATOM 0 HD21 LEU A 102 2.837 9.348 3.441 1.00 12.45 H new ATOM 0 HD22 LEU A 102 4.560 9.284 3.881 1.00 12.45 H new ATOM 0 HD23 LEU A 102 3.906 10.716 3.051 1.00 12.45 H new ATOM 1690 N GLN A 103 5.188 10.495 -1.629 1.00 0.11 N ATOM 1691 CA GLN A 103 4.290 11.057 -2.647 1.00 54.31 C ATOM 1692 C GLN A 103 4.160 10.127 -3.855 1.00 63.50 C ATOM 1693 O GLN A 103 3.057 9.768 -4.251 1.00 33.31 O ATOM 1694 CB GLN A 103 4.783 12.444 -3.095 1.00 42.35 C ATOM 1695 CG GLN A 103 4.530 13.548 -2.071 1.00 74.21 C ATOM 1696 CD GLN A 103 3.062 13.933 -1.975 1.00 64.54 C ATOM 1697 OE1 GLN A 103 2.603 14.849 -2.651 1.00 63.24 O ATOM 1698 NE2 GLN A 103 2.306 13.233 -1.151 1.00 54.21 N ATOM 0 H GLN A 103 5.948 11.117 -1.354 1.00 0.11 H new ATOM 0 HA GLN A 103 3.303 11.161 -2.195 1.00 54.31 H new ATOM 0 HB2 GLN A 103 5.852 12.390 -3.301 1.00 42.35 H new ATOM 0 HB3 GLN A 103 4.291 12.709 -4.031 1.00 42.35 H new ATOM 0 HG2 GLN A 103 4.880 13.218 -1.093 1.00 74.21 H new ATOM 0 HG3 GLN A 103 5.115 14.428 -2.339 1.00 74.21 H new ATOM 0 HE21 GLN A 103 2.715 12.477 -0.602 1.00 54.21 H new ATOM 0 HE22 GLN A 103 1.313 13.448 -1.063 1.00 54.21 H new ATOM 1707 N ARG A 104 5.294 9.717 -4.418 1.00 53.22 N ATOM 1708 CA ARG A 104 5.303 8.823 -5.584 1.00 61.04 C ATOM 1709 C ARG A 104 4.551 7.507 -5.295 1.00 74.41 C ATOM 1710 O ARG A 104 3.882 6.950 -6.173 1.00 44.24 O ATOM 1711 CB ARG A 104 6.749 8.536 -6.010 1.00 3.34 C ATOM 1712 CG ARG A 104 7.594 9.791 -6.266 1.00 32.22 C ATOM 1713 CD ARG A 104 7.148 10.581 -7.502 1.00 1.12 C ATOM 1714 NE ARG A 104 5.883 11.302 -7.300 1.00 2.40 N ATOM 1715 CZ ARG A 104 5.712 12.579 -7.540 1.00 53.24 C ATOM 1716 NH1 ARG A 104 6.682 13.309 -7.996 1.00 0.25 N ATOM 1717 NH2 ARG A 104 4.561 13.121 -7.329 1.00 11.34 N ATOM 0 H ARG A 104 6.221 9.987 -4.089 1.00 53.22 H new ATOM 0 HA ARG A 104 4.782 9.324 -6.400 1.00 61.04 H new ATOM 0 HB2 ARG A 104 7.232 7.939 -5.236 1.00 3.34 H new ATOM 0 HB3 ARG A 104 6.735 7.931 -6.917 1.00 3.34 H new ATOM 0 HG2 ARG A 104 7.543 10.439 -5.391 1.00 32.22 H new ATOM 0 HG3 ARG A 104 8.637 9.500 -6.387 1.00 32.22 H new ATOM 0 HD2 ARG A 104 7.927 11.295 -7.770 1.00 1.12 H new ATOM 0 HD3 ARG A 104 7.039 9.897 -8.343 1.00 1.12 H new ATOM 0 HE ARG A 104 5.085 10.773 -6.949 1.00 2.40 H new ATOM 0 HH11 ARG A 104 7.595 12.891 -8.173 1.00 0.25 H new ATOM 0 HH12 ARG A 104 6.532 14.301 -8.177 1.00 0.25 H new ATOM 0 HH21 ARG A 104 3.788 12.556 -6.977 1.00 11.34 H new ATOM 0 HH22 ARG A 104 4.423 14.115 -7.514 1.00 11.34 H new ATOM 1731 N VAL A 105 4.649 7.020 -4.058 1.00 0.40 N ATOM 1732 CA VAL A 105 3.883 5.842 -3.632 1.00 14.11 C ATOM 1733 C VAL A 105 2.374 6.152 -3.613 1.00 55.31 C ATOM 1734 O VAL A 105 1.554 5.359 -4.089 1.00 54.03 O ATOM 1735 CB VAL A 105 4.323 5.354 -2.227 1.00 4.54 C ATOM 1736 CG1 VAL A 105 3.513 4.131 -1.791 1.00 2.24 C ATOM 1737 CG2 VAL A 105 5.820 5.047 -2.207 1.00 21.15 C ATOM 0 H VAL A 105 5.247 7.418 -3.334 1.00 0.40 H new ATOM 0 HA VAL A 105 4.083 5.050 -4.354 1.00 14.11 H new ATOM 0 HB VAL A 105 4.128 6.156 -1.515 1.00 4.54 H new ATOM 0 HG11 VAL A 105 3.842 3.810 -0.803 1.00 2.24 H new ATOM 0 HG12 VAL A 105 2.455 4.390 -1.755 1.00 2.24 H new ATOM 0 HG13 VAL A 105 3.664 3.321 -2.505 1.00 2.24 H new ATOM 0 HG21 VAL A 105 6.108 4.706 -1.213 1.00 21.15 H new ATOM 0 HG22 VAL A 105 6.041 4.267 -2.936 1.00 21.15 H new ATOM 0 HG23 VAL A 105 6.380 5.948 -2.458 1.00 21.15 H new ATOM 1747 N GLU A 106 2.020 7.316 -3.067 1.00 22.45 N ATOM 1748 CA GLU A 106 0.624 7.762 -3.016 1.00 34.02 C ATOM 1749 C GLU A 106 0.037 7.928 -4.430 1.00 40.14 C ATOM 1750 O GLU A 106 -1.052 7.430 -4.715 1.00 54.22 O ATOM 1751 CB GLU A 106 0.504 9.085 -2.244 1.00 10.24 C ATOM 1752 CG GLU A 106 0.933 8.998 -0.781 1.00 43.41 C ATOM 1753 CD GLU A 106 0.658 10.287 -0.021 1.00 12.24 C ATOM 1754 OE1 GLU A 106 -0.528 10.658 0.111 1.00 1.34 O ATOM 1755 OE2 GLU A 106 1.614 10.940 0.448 1.00 12.23 O ATOM 0 H GLU A 106 2.683 7.971 -2.652 1.00 22.45 H new ATOM 0 HA GLU A 106 0.054 6.993 -2.495 1.00 34.02 H new ATOM 0 HB2 GLU A 106 1.110 9.841 -2.744 1.00 10.24 H new ATOM 0 HB3 GLU A 106 -0.530 9.426 -2.288 1.00 10.24 H new ATOM 0 HG2 GLU A 106 0.406 8.175 -0.298 1.00 43.41 H new ATOM 0 HG3 GLU A 106 1.997 8.769 -0.730 1.00 43.41 H new ATOM 1762 N ASP A 107 0.771 8.610 -5.314 1.00 11.41 N ATOM 1763 CA ASP A 107 0.333 8.809 -6.704 1.00 63.25 C ATOM 1764 C ASP A 107 0.052 7.467 -7.398 1.00 4.33 C ATOM 1765 O ASP A 107 -0.850 7.358 -8.230 1.00 13.04 O ATOM 1766 CB ASP A 107 1.387 9.595 -7.493 1.00 13.11 C ATOM 1767 CG ASP A 107 1.596 10.999 -6.950 1.00 24.45 C ATOM 1768 OD1 ASP A 107 0.638 11.805 -6.977 1.00 73.11 O ATOM 1769 OD2 ASP A 107 2.716 11.313 -6.509 1.00 1.13 O ATOM 0 H ASP A 107 1.672 9.035 -5.094 1.00 11.41 H new ATOM 0 HA ASP A 107 -0.594 9.382 -6.680 1.00 63.25 H new ATOM 0 HB2 ASP A 107 2.333 9.055 -7.467 1.00 13.11 H new ATOM 0 HB3 ASP A 107 1.083 9.655 -8.538 1.00 13.11 H new ATOM 1774 N SER A 108 0.822 6.444 -7.041 1.00 62.23 N ATOM 1775 CA SER A 108 0.609 5.094 -7.576 1.00 52.30 C ATOM 1776 C SER A 108 -0.719 4.495 -7.080 1.00 64.41 C ATOM 1777 O SER A 108 -1.417 3.814 -7.823 1.00 23.14 O ATOM 1778 CB SER A 108 1.773 4.163 -7.193 1.00 14.14 C ATOM 1779 OG SER A 108 3.000 4.596 -7.768 1.00 44.14 O ATOM 0 H SER A 108 1.599 6.519 -6.385 1.00 62.23 H new ATOM 0 HA SER A 108 0.564 5.180 -8.662 1.00 52.30 H new ATOM 0 HB2 SER A 108 1.871 4.129 -6.108 1.00 14.14 H new ATOM 0 HB3 SER A 108 1.553 3.148 -7.525 1.00 14.14 H new ATOM 0 HG SER A 108 3.334 5.376 -7.277 1.00 44.14 H new ATOM 1785 N HIS A 109 -1.066 4.749 -5.818 1.00 41.34 N ATOM 1786 CA HIS A 109 -2.286 4.180 -5.227 1.00 10.03 C ATOM 1787 C HIS A 109 -3.544 5.031 -5.467 1.00 45.30 C ATOM 1788 O HIS A 109 -4.659 4.505 -5.475 1.00 3.14 O ATOM 1789 CB HIS A 109 -2.078 3.935 -3.734 1.00 15.40 C ATOM 1790 CG HIS A 109 -1.187 2.766 -3.481 1.00 30.13 C ATOM 1791 ND1 HIS A 109 -1.662 1.482 -3.374 1.00 12.42 N ATOM 1792 CD2 HIS A 109 0.158 2.679 -3.365 1.00 11.52 C ATOM 1793 CE1 HIS A 109 -0.656 0.657 -3.208 1.00 61.14 C ATOM 1794 NE2 HIS A 109 0.464 1.352 -3.199 1.00 42.33 N ATOM 0 H HIS A 109 -0.526 5.340 -5.186 1.00 41.34 H new ATOM 0 HA HIS A 109 -2.466 3.233 -5.736 1.00 10.03 H new ATOM 0 HB2 HIS A 109 -1.647 4.826 -3.277 1.00 15.40 H new ATOM 0 HB3 HIS A 109 -3.043 3.766 -3.256 1.00 15.40 H new ATOM 0 HD1 HIS A 109 -2.645 1.212 -3.417 1.00 12.42 H new ATOM 0 HD2 HIS A 109 0.859 3.500 -3.397 1.00 11.52 H new ATOM 0 HE1 HIS A 109 -0.733 -0.415 -3.097 1.00 61.14 H new ATOM 1803 N GLN A 110 -3.381 6.337 -5.657 1.00 63.34 N ATOM 1804 CA GLN A 110 -4.532 7.220 -5.894 1.00 5.53 C ATOM 1805 C GLN A 110 -5.342 6.759 -7.122 1.00 22.15 C ATOM 1806 O GLN A 110 -6.572 6.869 -7.142 1.00 53.12 O ATOM 1807 CB GLN A 110 -4.083 8.680 -6.057 1.00 25.41 C ATOM 1808 CG GLN A 110 -3.325 8.962 -7.349 1.00 74.33 C ATOM 1809 CD GLN A 110 -2.828 10.395 -7.454 1.00 1.40 C ATOM 1810 OE1 GLN A 110 -2.474 10.995 -6.335 1.00 44.22 O flip ATOM 1811 NE2 GLN A 110 -2.742 10.954 -8.540 1.00 50.24 N flip ATOM 0 H GLN A 110 -2.477 6.809 -5.653 1.00 63.34 H new ATOM 0 HA GLN A 110 -5.180 7.160 -5.020 1.00 5.53 H new ATOM 0 HB2 GLN A 110 -4.961 9.325 -6.016 1.00 25.41 H new ATOM 0 HB3 GLN A 110 -3.450 8.950 -5.212 1.00 25.41 H new ATOM 0 HG2 GLN A 110 -2.475 8.284 -7.419 1.00 74.33 H new ATOM 0 HG3 GLN A 110 -3.974 8.747 -8.198 1.00 74.33 H new ATOM 0 HE21 GLN A 110 -3.024 10.464 -9.389 1.00 50.24 H new ATOM 0 HE22 GLN A 110 -2.389 11.909 -8.595 1.00 50.24 H new ATOM 1820 N ILE A 111 -4.653 6.228 -8.136 1.00 1.33 N ATOM 1821 CA ILE A 111 -5.328 5.669 -9.315 1.00 41.31 C ATOM 1822 C ILE A 111 -5.963 4.303 -8.992 1.00 52.43 C ATOM 1823 O ILE A 111 -7.041 3.979 -9.491 1.00 24.02 O ATOM 1824 CB ILE A 111 -4.366 5.518 -10.527 1.00 43.15 C ATOM 1825 CG1 ILE A 111 -3.223 4.537 -10.201 1.00 41.22 C ATOM 1826 CG2 ILE A 111 -3.810 6.882 -10.947 1.00 43.12 C ATOM 1827 CD1 ILE A 111 -2.288 4.267 -11.364 1.00 21.33 C ATOM 0 H ILE A 111 -3.635 6.173 -8.167 1.00 1.33 H new ATOM 0 HA ILE A 111 -6.110 6.377 -9.588 1.00 41.31 H new ATOM 0 HB ILE A 111 -4.933 5.108 -11.363 1.00 43.15 H new ATOM 0 HG12 ILE A 111 -2.644 4.935 -9.368 1.00 41.22 H new ATOM 0 HG13 ILE A 111 -3.653 3.593 -9.868 1.00 41.22 H new ATOM 0 HG21 ILE A 111 -3.139 6.755 -11.797 1.00 43.12 H new ATOM 0 HG22 ILE A 111 -4.633 7.539 -11.229 1.00 43.12 H new ATOM 0 HG23 ILE A 111 -3.262 7.324 -10.115 1.00 43.12 H new ATOM 0 HD11 ILE A 111 -1.512 3.568 -11.052 1.00 21.33 H new ATOM 0 HD12 ILE A 111 -2.852 3.838 -12.192 1.00 21.33 H new ATOM 0 HD13 ILE A 111 -1.827 5.201 -11.684 1.00 21.33 H new ATOM 1839 N LEU A 112 -5.301 3.519 -8.135 1.00 2.35 N ATOM 1840 CA LEU A 112 -5.822 2.207 -7.714 1.00 55.45 C ATOM 1841 C LEU A 112 -7.192 2.344 -7.035 1.00 72.41 C ATOM 1842 O LEU A 112 -8.059 1.482 -7.176 1.00 24.41 O ATOM 1843 CB LEU A 112 -4.835 1.511 -6.767 1.00 3.15 C ATOM 1844 CG LEU A 112 -3.454 1.205 -7.368 1.00 25.44 C ATOM 1845 CD1 LEU A 112 -2.584 0.455 -6.365 1.00 13.43 C ATOM 1846 CD2 LEU A 112 -3.588 0.414 -8.669 1.00 32.53 C ATOM 0 H LEU A 112 -4.404 3.767 -7.718 1.00 2.35 H new ATOM 0 HA LEU A 112 -5.943 1.598 -8.610 1.00 55.45 H new ATOM 0 HB2 LEU A 112 -4.699 2.138 -5.886 1.00 3.15 H new ATOM 0 HB3 LEU A 112 -5.281 0.576 -6.427 1.00 3.15 H new ATOM 0 HG LEU A 112 -2.968 2.153 -7.599 1.00 25.44 H new ATOM 0 HD11 LEU A 112 -1.611 0.248 -6.810 1.00 13.43 H new ATOM 0 HD12 LEU A 112 -2.452 1.064 -5.471 1.00 13.43 H new ATOM 0 HD13 LEU A 112 -3.067 -0.484 -6.096 1.00 13.43 H new ATOM 0 HD21 LEU A 112 -2.597 0.210 -9.075 1.00 32.53 H new ATOM 0 HD22 LEU A 112 -4.100 -0.528 -8.471 1.00 32.53 H new ATOM 0 HD23 LEU A 112 -4.163 0.995 -9.390 1.00 32.53 H new ATOM 1858 N SER A 113 -7.380 3.432 -6.294 1.00 31.42 N ATOM 1859 CA SER A 113 -8.692 3.752 -5.719 1.00 33.42 C ATOM 1860 C SER A 113 -9.741 3.928 -6.828 1.00 61.11 C ATOM 1861 O SER A 113 -10.846 3.388 -6.748 1.00 74.42 O ATOM 1862 CB SER A 113 -8.620 5.030 -4.868 1.00 43.33 C ATOM 1863 OG SER A 113 -9.906 5.410 -4.397 1.00 71.12 O ATOM 0 H SER A 113 -6.647 4.107 -6.076 1.00 31.42 H new ATOM 0 HA SER A 113 -8.987 2.920 -5.079 1.00 33.42 H new ATOM 0 HB2 SER A 113 -7.953 4.868 -4.021 1.00 43.33 H new ATOM 0 HB3 SER A 113 -8.193 5.840 -5.460 1.00 43.33 H new ATOM 0 HG SER A 113 -9.829 6.225 -3.858 1.00 71.12 H new ATOM 1869 N GLN A 114 -9.371 4.665 -7.877 1.00 14.43 N ATOM 1870 CA GLN A 114 -10.277 4.929 -9.002 1.00 41.21 C ATOM 1871 C GLN A 114 -10.604 3.643 -9.779 1.00 1.31 C ATOM 1872 O GLN A 114 -11.748 3.427 -10.183 1.00 75.44 O ATOM 1873 CB GLN A 114 -9.660 5.970 -9.945 1.00 51.13 C ATOM 1874 CG GLN A 114 -9.411 7.326 -9.287 1.00 4.03 C ATOM 1875 CD GLN A 114 -10.687 8.002 -8.804 1.00 42.52 C ATOM 1876 OE1 GLN A 114 -11.759 7.826 -9.375 1.00 3.42 O ATOM 1877 NE2 GLN A 114 -10.582 8.788 -7.751 1.00 22.41 N ATOM 0 H GLN A 114 -8.449 5.091 -7.973 1.00 14.43 H new ATOM 0 HA GLN A 114 -11.209 5.319 -8.593 1.00 41.21 H new ATOM 0 HB2 GLN A 114 -8.716 5.584 -10.329 1.00 51.13 H new ATOM 0 HB3 GLN A 114 -10.320 6.108 -10.801 1.00 51.13 H new ATOM 0 HG2 GLN A 114 -8.735 7.194 -8.442 1.00 4.03 H new ATOM 0 HG3 GLN A 114 -8.908 7.981 -9.998 1.00 4.03 H new ATOM 0 HE21 GLN A 114 -9.677 8.915 -7.297 1.00 22.41 H new ATOM 0 HE22 GLN A 114 -11.406 9.269 -7.390 1.00 22.41 H new ATOM 1886 N THR A 115 -9.599 2.792 -9.988 1.00 31.03 N ATOM 1887 CA THR A 115 -9.807 1.506 -10.677 1.00 13.43 C ATOM 1888 C THR A 115 -10.665 0.556 -9.835 1.00 43.01 C ATOM 1889 O THR A 115 -11.649 -0.002 -10.320 1.00 1.11 O ATOM 1890 CB THR A 115 -8.471 0.798 -11.013 1.00 64.14 C ATOM 1891 OG1 THR A 115 -7.724 0.554 -9.811 1.00 40.31 O ATOM 1892 CG2 THR A 115 -7.634 1.632 -11.976 1.00 71.44 C ATOM 0 H THR A 115 -8.637 2.963 -9.695 1.00 31.03 H new ATOM 0 HA THR A 115 -10.323 1.744 -11.607 1.00 13.43 H new ATOM 0 HB THR A 115 -8.706 -0.152 -11.494 1.00 64.14 H new ATOM 0 HG1 THR A 115 -6.811 0.284 -10.042 1.00 40.31 H new ATOM 0 HG21 THR A 115 -6.702 1.110 -12.194 1.00 71.44 H new ATOM 0 HG22 THR A 115 -8.189 1.785 -12.902 1.00 71.44 H new ATOM 0 HG23 THR A 115 -7.412 2.598 -11.522 1.00 71.44 H new ATOM 1900 N SER A 116 -10.290 0.377 -8.567 1.00 54.34 N ATOM 1901 CA SER A 116 -11.066 -0.459 -7.632 1.00 50.53 C ATOM 1902 C SER A 116 -12.530 -0.003 -7.561 1.00 63.20 C ATOM 1903 O SER A 116 -13.448 -0.823 -7.475 1.00 0.21 O ATOM 1904 CB SER A 116 -10.442 -0.424 -6.227 1.00 63.21 C ATOM 1905 OG SER A 116 -9.112 -0.918 -6.239 1.00 30.00 O ATOM 0 H SER A 116 -9.455 0.797 -8.158 1.00 54.34 H new ATOM 0 HA SER A 116 -11.041 -1.482 -8.008 1.00 50.53 H new ATOM 0 HB2 SER A 116 -10.449 0.599 -5.850 1.00 63.21 H new ATOM 0 HB3 SER A 116 -11.047 -1.020 -5.544 1.00 63.21 H new ATOM 0 HG SER A 116 -8.507 -0.221 -6.569 1.00 30.00 H new ATOM 1911 N HIS A 117 -12.746 1.314 -7.599 1.00 31.25 N ATOM 1912 CA HIS A 117 -14.103 1.868 -7.650 1.00 44.12 C ATOM 1913 C HIS A 117 -14.770 1.591 -9.007 1.00 24.22 C ATOM 1914 O HIS A 117 -15.931 1.204 -9.054 1.00 34.13 O ATOM 1915 CB HIS A 117 -14.088 3.378 -7.365 1.00 24.42 C ATOM 1916 CG HIS A 117 -14.079 3.721 -5.903 1.00 5.44 C ATOM 1917 ND1 HIS A 117 -15.099 4.418 -5.295 1.00 13.25 N ATOM 1918 CD2 HIS A 117 -13.172 3.471 -4.928 1.00 44.11 C ATOM 1919 CE1 HIS A 117 -14.825 4.582 -4.019 1.00 72.23 C ATOM 1920 NE2 HIS A 117 -13.664 4.016 -3.767 1.00 32.14 N ATOM 0 H HIS A 117 -12.004 2.014 -7.596 1.00 31.25 H new ATOM 0 HA HIS A 117 -14.688 1.372 -6.876 1.00 44.12 H new ATOM 0 HB2 HIS A 117 -13.210 3.818 -7.837 1.00 24.42 H new ATOM 0 HB3 HIS A 117 -14.962 3.834 -7.830 1.00 24.42 H new ATOM 0 HD2 HIS A 117 -12.237 2.942 -5.042 1.00 44.11 H new ATOM 0 HE1 HIS A 117 -15.447 5.094 -3.300 1.00 72.23 H new ATOM 0 HE2 HIS A 117 -13.204 3.987 -2.857 1.00 32.14 H new ATOM 1929 N ASP A 118 -14.024 1.771 -10.099 1.00 61.32 N ATOM 1930 CA ASP A 118 -14.550 1.547 -11.456 1.00 74.31 C ATOM 1931 C ASP A 118 -15.071 0.108 -11.620 1.00 70.02 C ATOM 1932 O ASP A 118 -16.177 -0.114 -12.115 1.00 33.53 O ATOM 1933 CB ASP A 118 -13.454 1.843 -12.492 1.00 64.13 C ATOM 1934 CG ASP A 118 -13.937 1.703 -13.927 1.00 41.21 C ATOM 1935 OD1 ASP A 118 -14.550 2.658 -14.447 1.00 33.13 O ATOM 1936 OD2 ASP A 118 -13.700 0.648 -14.547 1.00 75.33 O ATOM 0 H ASP A 118 -13.050 2.072 -10.074 1.00 61.32 H new ATOM 0 HA ASP A 118 -15.389 2.224 -11.618 1.00 74.31 H new ATOM 0 HB2 ASP A 118 -13.080 2.855 -12.338 1.00 64.13 H new ATOM 0 HB3 ASP A 118 -12.616 1.165 -12.329 1.00 64.13 H new ATOM 1941 N LEU A 119 -14.264 -0.861 -11.185 1.00 20.30 N ATOM 1942 CA LEU A 119 -14.663 -2.275 -11.188 1.00 20.21 C ATOM 1943 C LEU A 119 -15.947 -2.484 -10.366 1.00 21.32 C ATOM 1944 O LEU A 119 -16.816 -3.280 -10.724 1.00 21.31 O ATOM 1945 CB LEU A 119 -13.527 -3.140 -10.619 1.00 53.31 C ATOM 1946 CG LEU A 119 -12.168 -2.988 -11.322 1.00 2.44 C ATOM 1947 CD1 LEU A 119 -11.105 -3.827 -10.616 1.00 33.33 C ATOM 1948 CD2 LEU A 119 -12.273 -3.374 -12.796 1.00 22.44 C ATOM 0 H LEU A 119 -13.325 -0.694 -10.824 1.00 20.30 H new ATOM 0 HA LEU A 119 -14.863 -2.574 -12.217 1.00 20.21 H new ATOM 0 HB2 LEU A 119 -13.401 -2.896 -9.564 1.00 53.31 H new ATOM 0 HB3 LEU A 119 -13.829 -4.186 -10.670 1.00 53.31 H new ATOM 0 HG LEU A 119 -11.870 -1.941 -11.269 1.00 2.44 H new ATOM 0 HD11 LEU A 119 -10.149 -3.708 -11.126 1.00 33.33 H new ATOM 0 HD12 LEU A 119 -11.008 -3.496 -9.582 1.00 33.33 H new ATOM 0 HD13 LEU A 119 -11.398 -4.877 -10.635 1.00 33.33 H new ATOM 0 HD21 LEU A 119 -11.300 -3.258 -13.273 1.00 22.44 H new ATOM 0 HD22 LEU A 119 -12.596 -4.412 -12.878 1.00 22.44 H new ATOM 0 HD23 LEU A 119 -12.998 -2.728 -13.291 1.00 22.44 H new ATOM 1960 N ASN A 120 -16.055 -1.748 -9.261 1.00 2.31 N ATOM 1961 CA ASN A 120 -17.247 -1.794 -8.411 1.00 24.43 C ATOM 1962 C ASN A 120 -18.460 -1.178 -9.132 1.00 13.34 C ATOM 1963 O ASN A 120 -19.573 -1.703 -9.059 1.00 25.35 O ATOM 1964 CB ASN A 120 -16.981 -1.051 -7.094 1.00 44.34 C ATOM 1965 CG ASN A 120 -18.144 -1.146 -6.123 1.00 52.13 C ATOM 1966 OD1 ASN A 120 -18.845 -2.150 -6.071 1.00 73.15 O ATOM 1967 ND2 ASN A 120 -18.363 -0.102 -5.350 1.00 71.34 N ATOM 0 H ASN A 120 -15.330 -1.111 -8.931 1.00 2.31 H new ATOM 0 HA ASN A 120 -17.474 -2.838 -8.193 1.00 24.43 H new ATOM 0 HB2 ASN A 120 -16.087 -1.461 -6.625 1.00 44.34 H new ATOM 0 HB3 ASN A 120 -16.776 -0.002 -7.308 1.00 44.34 H new ATOM 0 HD21 ASN A 120 -19.135 -0.114 -4.683 1.00 71.34 H new ATOM 0 HD22 ASN A 120 -17.761 0.718 -5.418 1.00 71.34 H new ATOM 1974 N GLU A 121 -18.237 -0.070 -9.838 1.00 11.53 N ATOM 1975 CA GLU A 121 -19.309 0.619 -10.568 1.00 14.12 C ATOM 1976 C GLU A 121 -19.817 -0.239 -11.738 1.00 25.43 C ATOM 1977 O GLU A 121 -21.021 -0.302 -11.997 1.00 11.23 O ATOM 1978 CB GLU A 121 -18.825 1.987 -11.073 1.00 61.15 C ATOM 1979 CG GLU A 121 -18.312 2.898 -9.962 1.00 11.34 C ATOM 1980 CD GLU A 121 -17.992 4.302 -10.449 1.00 41.11 C ATOM 1981 OE1 GLU A 121 -18.912 5.146 -10.492 1.00 50.32 O ATOM 1982 OE2 GLU A 121 -16.822 4.572 -10.789 1.00 54.23 O ATOM 0 H GLU A 121 -17.322 0.373 -9.922 1.00 11.53 H new ATOM 0 HA GLU A 121 -20.139 0.778 -9.880 1.00 14.12 H new ATOM 0 HB2 GLU A 121 -18.031 1.836 -11.804 1.00 61.15 H new ATOM 0 HB3 GLU A 121 -19.644 2.485 -11.591 1.00 61.15 H new ATOM 0 HG2 GLU A 121 -19.060 2.955 -9.171 1.00 11.34 H new ATOM 0 HG3 GLU A 121 -17.417 2.458 -9.523 1.00 11.34 H new ATOM 1989 N CYS A 122 -18.898 -0.923 -12.422 1.00 50.34 N ATOM 1990 CA CYS A 122 -19.269 -1.861 -13.494 1.00 71.23 C ATOM 1991 C CYS A 122 -19.854 -3.157 -12.911 1.00 53.13 C ATOM 1992 O CYS A 122 -20.197 -4.084 -13.648 1.00 62.20 O ATOM 1993 CB CYS A 122 -18.056 -2.204 -14.369 1.00 75.13 C ATOM 1994 SG CYS A 122 -16.861 -3.305 -13.579 1.00 72.13 S ATOM 0 H CYS A 122 -17.894 -0.849 -12.257 1.00 50.34 H new ATOM 0 HA CYS A 122 -20.025 -1.371 -14.108 1.00 71.23 H new ATOM 0 HB2 CYS A 122 -18.407 -2.668 -15.291 1.00 75.13 H new ATOM 0 HB3 CYS A 122 -17.551 -1.279 -14.649 1.00 75.13 H new ATOM 0 HG CYS A 122 -16.995 -3.236 -12.288 1.00 72.13 H new ATOM 2000 N SER A 123 -19.938 -3.214 -11.579 1.00 70.42 N ATOM 2001 CA SER A 123 -20.548 -4.343 -10.854 1.00 5.31 C ATOM 2002 C SER A 123 -19.727 -5.633 -10.982 1.00 31.53 C ATOM 2003 O SER A 123 -20.219 -6.715 -10.655 1.00 73.21 O ATOM 2004 CB SER A 123 -21.983 -4.597 -11.344 1.00 0.33 C ATOM 2005 OG SER A 123 -22.763 -3.407 -11.316 1.00 53.04 O ATOM 0 H SER A 123 -19.585 -2.478 -10.967 1.00 70.42 H new ATOM 0 HA SER A 123 -20.566 -4.061 -9.801 1.00 5.31 H new ATOM 0 HB2 SER A 123 -21.957 -4.992 -12.360 1.00 0.33 H new ATOM 0 HB3 SER A 123 -22.453 -5.356 -10.719 1.00 0.33 H new ATOM 0 HG SER A 123 -23.669 -3.602 -11.635 1.00 53.04 H new ATOM 2011 N TRP A 124 -18.474 -5.514 -11.431 1.00 1.14 N ATOM 2012 CA TRP A 124 -17.615 -6.684 -11.679 1.00 44.50 C ATOM 2013 C TRP A 124 -18.249 -7.645 -12.704 1.00 2.20 C ATOM 2014 O TRP A 124 -17.991 -8.851 -12.686 1.00 72.32 O ATOM 2015 CB TRP A 124 -17.309 -7.424 -10.361 1.00 61.14 C ATOM 2016 CG TRP A 124 -16.413 -6.657 -9.428 1.00 13.45 C ATOM 2017 CD1 TRP A 124 -16.782 -5.684 -8.541 1.00 32.54 C ATOM 2018 CD2 TRP A 124 -14.995 -6.810 -9.286 1.00 54.32 C ATOM 2019 NE1 TRP A 124 -15.680 -5.221 -7.865 1.00 34.01 N ATOM 2020 CE2 TRP A 124 -14.570 -5.894 -8.304 1.00 61.54 C ATOM 2021 CE3 TRP A 124 -14.042 -7.629 -9.900 1.00 5.24 C ATOM 2022 CZ2 TRP A 124 -13.237 -5.782 -7.917 1.00 1.50 C ATOM 2023 CZ3 TRP A 124 -12.719 -7.515 -9.515 1.00 34.51 C ATOM 2024 CH2 TRP A 124 -12.327 -6.596 -8.534 1.00 15.20 C ATOM 0 H TRP A 124 -18.028 -4.619 -11.632 1.00 1.14 H new ATOM 0 HA TRP A 124 -16.678 -6.321 -12.101 1.00 44.50 H new ATOM 0 HB2 TRP A 124 -18.247 -7.642 -9.851 1.00 61.14 H new ATOM 0 HB3 TRP A 124 -16.842 -8.381 -10.593 1.00 61.14 H new ATOM 0 HD1 TRP A 124 -17.792 -5.331 -8.394 1.00 32.54 H new ATOM 0 HE1 TRP A 124 -15.687 -4.493 -7.151 1.00 34.01 H new ATOM 0 HE3 TRP A 124 -14.334 -8.338 -10.661 1.00 5.24 H new ATOM 0 HZ2 TRP A 124 -12.933 -5.078 -7.157 1.00 1.50 H new ATOM 0 HZ3 TRP A 124 -11.975 -8.146 -9.979 1.00 34.51 H new ATOM 0 HH2 TRP A 124 -11.285 -6.528 -8.259 1.00 15.20 H new ATOM 2035 N SER A 125 -19.055 -7.089 -13.615 1.00 32.52 N ATOM 2036 CA SER A 125 -19.756 -7.879 -14.644 1.00 70.12 C ATOM 2037 C SER A 125 -18.790 -8.778 -15.434 1.00 72.23 C ATOM 2038 O SER A 125 -17.900 -8.290 -16.137 1.00 1.15 O ATOM 2039 CB SER A 125 -20.500 -6.952 -15.620 1.00 21.43 C ATOM 2040 OG SER A 125 -21.448 -6.136 -14.946 1.00 55.24 O ATOM 0 H SER A 125 -19.242 -6.087 -13.664 1.00 32.52 H new ATOM 0 HA SER A 125 -20.471 -8.518 -14.125 1.00 70.12 H new ATOM 0 HB2 SER A 125 -19.781 -6.320 -16.142 1.00 21.43 H new ATOM 0 HB3 SER A 125 -21.007 -7.551 -16.377 1.00 21.43 H new ATOM 0 HG SER A 125 -20.978 -5.486 -14.383 1.00 55.24 H new ATOM 2046 N LEU A 126 -18.991 -10.093 -15.330 1.00 61.10 N ATOM 2047 CA LEU A 126 -18.119 -11.083 -15.983 1.00 42.54 C ATOM 2048 C LEU A 126 -18.021 -10.866 -17.504 1.00 75.42 C ATOM 2049 O LEU A 126 -16.973 -11.101 -18.106 1.00 43.51 O ATOM 2050 CB LEU A 126 -18.616 -12.511 -15.688 1.00 22.01 C ATOM 2051 CG LEU A 126 -18.279 -13.072 -14.290 1.00 61.24 C ATOM 2052 CD1 LEU A 126 -16.769 -13.198 -14.111 1.00 75.22 C ATOM 2053 CD2 LEU A 126 -18.889 -12.209 -13.182 1.00 43.00 C ATOM 0 H LEU A 126 -19.756 -10.504 -14.795 1.00 61.10 H new ATOM 0 HA LEU A 126 -17.120 -10.950 -15.569 1.00 42.54 H new ATOM 0 HB2 LEU A 126 -19.699 -12.530 -15.814 1.00 22.01 H new ATOM 0 HB3 LEU A 126 -18.196 -13.182 -16.437 1.00 22.01 H new ATOM 0 HG LEU A 126 -18.718 -14.067 -14.214 1.00 61.24 H new ATOM 0 HD11 LEU A 126 -16.552 -13.595 -13.119 1.00 75.22 H new ATOM 0 HD12 LEU A 126 -16.368 -13.872 -14.868 1.00 75.22 H new ATOM 0 HD13 LEU A 126 -16.307 -12.217 -14.218 1.00 75.22 H new ATOM 0 HD21 LEU A 126 -18.633 -12.631 -12.210 1.00 43.00 H new ATOM 0 HD22 LEU A 126 -18.495 -11.195 -13.252 1.00 43.00 H new ATOM 0 HD23 LEU A 126 -19.973 -12.186 -13.294 1.00 43.00 H new ATOM 2065 N ASN A 127 -19.110 -10.407 -18.117 1.00 13.33 N ATOM 2066 CA ASN A 127 -19.141 -10.159 -19.564 1.00 74.01 C ATOM 2067 C ASN A 127 -18.144 -9.055 -19.965 1.00 62.23 C ATOM 2068 O ASN A 127 -17.626 -9.046 -21.080 1.00 70.32 O ATOM 2069 CB ASN A 127 -20.564 -9.781 -20.001 1.00 75.52 C ATOM 2070 CG ASN A 127 -20.702 -9.649 -21.508 1.00 53.34 C ATOM 2071 OD1 ASN A 127 -20.958 -10.623 -22.210 1.00 54.12 O ATOM 2072 ND2 ASN A 127 -20.552 -8.446 -22.020 1.00 20.50 N ATOM 0 H ASN A 127 -19.985 -10.198 -17.637 1.00 13.33 H new ATOM 0 HA ASN A 127 -18.843 -11.076 -20.073 1.00 74.01 H new ATOM 0 HB2 ASN A 127 -21.262 -10.537 -19.642 1.00 75.52 H new ATOM 0 HB3 ASN A 127 -20.845 -8.838 -19.531 1.00 75.52 H new ATOM 0 HD21 ASN A 127 -20.648 -8.304 -23.025 1.00 20.50 H new ATOM 0 HD22 ASN A 127 -20.340 -7.656 -21.411 1.00 20.50 H new ATOM 2079 N ILE A 128 -17.878 -8.134 -19.043 1.00 72.21 N ATOM 2080 CA ILE A 128 -16.936 -7.036 -19.284 1.00 53.11 C ATOM 2081 C ILE A 128 -15.498 -7.440 -18.912 1.00 15.23 C ATOM 2082 O ILE A 128 -14.547 -7.133 -19.633 1.00 50.04 O ATOM 2083 CB ILE A 128 -17.336 -5.776 -18.473 1.00 63.34 C ATOM 2084 CG1 ILE A 128 -18.772 -5.347 -18.829 1.00 73.01 C ATOM 2085 CG2 ILE A 128 -16.347 -4.632 -18.720 1.00 65.34 C ATOM 2086 CD1 ILE A 128 -19.264 -4.145 -18.053 1.00 2.31 C ATOM 0 H ILE A 128 -18.302 -8.123 -18.116 1.00 72.21 H new ATOM 0 HA ILE A 128 -16.975 -6.808 -20.349 1.00 53.11 H new ATOM 0 HB ILE A 128 -17.303 -6.023 -17.412 1.00 63.34 H new ATOM 0 HG12 ILE A 128 -18.820 -5.123 -19.895 1.00 73.01 H new ATOM 0 HG13 ILE A 128 -19.446 -6.184 -18.648 1.00 73.01 H new ATOM 0 HG21 ILE A 128 -16.648 -3.759 -18.141 1.00 65.34 H new ATOM 0 HG22 ILE A 128 -15.348 -4.943 -18.415 1.00 65.34 H new ATOM 0 HG23 ILE A 128 -16.341 -4.379 -19.780 1.00 65.34 H new ATOM 0 HD11 ILE A 128 -20.282 -3.905 -18.360 1.00 2.31 H new ATOM 0 HD12 ILE A 128 -19.250 -4.370 -16.987 1.00 2.31 H new ATOM 0 HD13 ILE A 128 -18.615 -3.293 -18.252 1.00 2.31 H new ATOM 2098 N LEU A 129 -15.357 -8.138 -17.783 1.00 24.35 N ATOM 2099 CA LEU A 129 -14.038 -8.525 -17.260 1.00 31.50 C ATOM 2100 C LEU A 129 -13.529 -9.846 -17.863 1.00 44.43 C ATOM 2101 O LEU A 129 -12.472 -9.882 -18.490 1.00 42.01 O ATOM 2102 CB LEU A 129 -14.101 -8.641 -15.731 1.00 65.20 C ATOM 2103 CG LEU A 129 -14.517 -7.358 -14.995 1.00 72.43 C ATOM 2104 CD1 LEU A 129 -14.539 -7.588 -13.487 1.00 60.51 C ATOM 2105 CD2 LEU A 129 -13.589 -6.195 -15.355 1.00 43.43 C ATOM 0 H LEU A 129 -16.141 -8.449 -17.209 1.00 24.35 H new ATOM 0 HA LEU A 129 -13.333 -7.746 -17.549 1.00 31.50 H new ATOM 0 HB2 LEU A 129 -14.803 -9.434 -15.471 1.00 65.20 H new ATOM 0 HB3 LEU A 129 -13.122 -8.950 -15.365 1.00 65.20 H new ATOM 0 HG LEU A 129 -15.525 -7.094 -15.315 1.00 72.43 H new ATOM 0 HD11 LEU A 129 -14.836 -6.668 -12.983 1.00 60.51 H new ATOM 0 HD12 LEU A 129 -15.252 -8.378 -13.250 1.00 60.51 H new ATOM 0 HD13 LEU A 129 -13.545 -7.882 -13.149 1.00 60.51 H new ATOM 0 HD21 LEU A 129 -13.905 -5.299 -14.821 1.00 43.43 H new ATOM 0 HD22 LEU A 129 -12.566 -6.445 -15.072 1.00 43.43 H new ATOM 0 HD23 LEU A 129 -13.634 -6.012 -16.429 1.00 43.43 H new ATOM 2117 N ALA A 130 -14.283 -10.927 -17.668 1.00 32.44 N ATOM 2118 CA ALA A 130 -13.866 -12.255 -18.143 1.00 13.04 C ATOM 2119 C ALA A 130 -13.938 -12.361 -19.673 1.00 52.41 C ATOM 2120 O ALA A 130 -12.973 -12.744 -20.330 1.00 74.42 O ATOM 2121 CB ALA A 130 -14.726 -13.337 -17.494 1.00 71.04 C ATOM 0 H ALA A 130 -15.182 -10.915 -17.187 1.00 32.44 H new ATOM 0 HA ALA A 130 -12.825 -12.401 -17.854 1.00 13.04 H new ATOM 0 HB1 ALA A 130 -14.410 -14.317 -17.852 1.00 71.04 H new ATOM 0 HB2 ALA A 130 -14.611 -13.292 -16.411 1.00 71.04 H new ATOM 0 HB3 ALA A 130 -15.772 -13.176 -17.755 1.00 71.04 H new ATOM 2127 N ILE A 131 -15.073 -11.980 -20.244 1.00 54.45 N ATOM 2128 CA ILE A 131 -15.277 -12.063 -21.697 1.00 43.31 C ATOM 2129 C ILE A 131 -14.659 -10.832 -22.405 1.00 63.12 C ATOM 2130 O ILE A 131 -15.215 -10.283 -23.360 1.00 43.34 O ATOM 2131 CB ILE A 131 -16.795 -12.184 -22.017 1.00 55.40 C ATOM 2132 CG1 ILE A 131 -17.450 -13.214 -21.074 1.00 4.11 C ATOM 2133 CG2 ILE A 131 -17.017 -12.590 -23.473 1.00 74.15 C ATOM 2134 CD1 ILE A 131 -18.943 -13.377 -21.277 1.00 45.51 C ATOM 0 H ILE A 131 -15.871 -11.609 -19.729 1.00 54.45 H new ATOM 0 HA ILE A 131 -14.773 -12.954 -22.072 1.00 43.31 H new ATOM 0 HB ILE A 131 -17.257 -11.209 -21.862 1.00 55.40 H new ATOM 0 HG12 ILE A 131 -16.967 -14.181 -21.217 1.00 4.11 H new ATOM 0 HG13 ILE A 131 -17.265 -12.915 -20.042 1.00 4.11 H new ATOM 0 HG21 ILE A 131 -18.086 -12.667 -23.670 1.00 74.15 H new ATOM 0 HG22 ILE A 131 -16.580 -11.839 -24.131 1.00 74.15 H new ATOM 0 HG23 ILE A 131 -16.543 -13.554 -23.658 1.00 74.15 H new ATOM 0 HD11 ILE A 131 -19.327 -14.118 -20.576 1.00 45.51 H new ATOM 0 HD12 ILE A 131 -19.440 -12.423 -21.104 1.00 45.51 H new ATOM 0 HD13 ILE A 131 -19.138 -13.708 -22.297 1.00 45.51 H new ATOM 2146 N ASN A 132 -13.473 -10.436 -21.938 1.00 44.11 N ATOM 2147 CA ASN A 132 -12.791 -9.230 -22.416 1.00 73.22 C ATOM 2148 C ASN A 132 -12.072 -9.478 -23.760 1.00 61.44 C ATOM 2149 O ASN A 132 -12.520 -9.016 -24.816 1.00 11.42 O ATOM 2150 CB ASN A 132 -11.776 -8.770 -21.358 1.00 25.23 C ATOM 2151 CG ASN A 132 -11.378 -7.314 -21.505 1.00 25.23 C ATOM 2152 OD1 ASN A 132 -10.525 -6.965 -22.309 1.00 23.31 O ATOM 2153 ND2 ASN A 132 -11.977 -6.454 -20.707 1.00 2.33 N ATOM 0 H ASN A 132 -12.958 -10.942 -21.218 1.00 44.11 H new ATOM 0 HA ASN A 132 -13.540 -8.455 -22.580 1.00 73.22 H new ATOM 0 HB2 ASN A 132 -12.199 -8.926 -20.366 1.00 25.23 H new ATOM 0 HB3 ASN A 132 -10.884 -9.392 -21.425 1.00 25.23 H new ATOM 0 HD21 ASN A 132 -11.733 -5.464 -20.749 1.00 2.33 H new ATOM 0 HD22 ASN A 132 -12.685 -6.778 -20.047 1.00 2.33 H new ATOM 2160 N LYS A 133 -10.957 -10.214 -23.709 1.00 54.42 N ATOM 2161 CA LYS A 133 -10.131 -10.479 -24.898 1.00 13.31 C ATOM 2162 C LYS A 133 -9.092 -11.587 -24.623 1.00 14.54 C ATOM 2163 O LYS A 133 -8.771 -11.871 -23.466 1.00 61.10 O ATOM 2164 CB LYS A 133 -9.422 -9.184 -25.337 1.00 62.31 C ATOM 2165 CG LYS A 133 -8.523 -8.576 -24.260 1.00 34.34 C ATOM 2166 CD LYS A 133 -7.974 -7.209 -24.669 1.00 51.13 C ATOM 2167 CE LYS A 133 -9.091 -6.216 -24.975 1.00 33.33 C ATOM 2168 NZ LYS A 133 -8.576 -4.837 -25.163 1.00 33.24 N ATOM 0 H LYS A 133 -10.602 -10.640 -22.853 1.00 54.42 H new ATOM 0 HA LYS A 133 -10.785 -10.825 -25.699 1.00 13.31 H new ATOM 0 HB2 LYS A 133 -8.822 -9.392 -26.223 1.00 62.31 H new ATOM 0 HB3 LYS A 133 -10.174 -8.450 -25.626 1.00 62.31 H new ATOM 0 HG2 LYS A 133 -9.087 -8.476 -23.332 1.00 34.34 H new ATOM 0 HG3 LYS A 133 -7.693 -9.253 -24.057 1.00 34.34 H new ATOM 0 HD2 LYS A 133 -7.347 -6.815 -23.869 1.00 51.13 H new ATOM 0 HD3 LYS A 133 -7.337 -7.321 -25.547 1.00 51.13 H new ATOM 0 HE2 LYS A 133 -9.619 -6.531 -25.875 1.00 33.33 H new ATOM 0 HE3 LYS A 133 -9.816 -6.224 -24.161 1.00 33.33 H new ATOM 0 HZ1 LYS A 133 -9.368 -4.196 -25.369 1.00 33.24 H new ATOM 0 HZ2 LYS A 133 -8.094 -4.525 -24.296 1.00 33.24 H new ATOM 0 HZ3 LYS A 133 -7.904 -4.823 -25.957 1.00 33.24 H new ATOM 2182 N PRO A 134 -8.562 -12.245 -25.682 1.00 51.51 N ATOM 2183 CA PRO A 134 -7.512 -13.273 -25.529 1.00 12.12 C ATOM 2184 C PRO A 134 -6.192 -12.696 -24.983 1.00 12.14 C ATOM 2185 O PRO A 134 -5.636 -11.750 -25.550 1.00 20.41 O ATOM 2186 CB PRO A 134 -7.326 -13.814 -26.957 1.00 73.25 C ATOM 2187 CG PRO A 134 -7.821 -12.724 -27.848 1.00 12.43 C ATOM 2188 CD PRO A 134 -8.946 -12.059 -27.098 1.00 55.12 C ATOM 0 HA PRO A 134 -7.796 -14.039 -24.807 1.00 12.12 H new ATOM 0 HB2 PRO A 134 -6.280 -14.045 -27.159 1.00 73.25 H new ATOM 0 HB3 PRO A 134 -7.890 -14.734 -27.107 1.00 73.25 H new ATOM 0 HG2 PRO A 134 -7.027 -12.012 -28.073 1.00 12.43 H new ATOM 0 HG3 PRO A 134 -8.169 -13.125 -28.800 1.00 12.43 H new ATOM 0 HD2 PRO A 134 -9.034 -11.004 -27.356 1.00 55.12 H new ATOM 0 HD3 PRO A 134 -9.907 -12.523 -27.319 1.00 55.12 H new ATOM 2196 N GLN A 135 -5.691 -13.290 -23.892 1.00 23.34 N ATOM 2197 CA GLN A 135 -4.488 -12.805 -23.192 1.00 13.43 C ATOM 2198 C GLN A 135 -4.576 -11.306 -22.851 1.00 34.11 C ATOM 2199 O GLN A 135 -4.100 -10.445 -23.598 1.00 4.14 O ATOM 2200 CB GLN A 135 -3.205 -13.101 -23.990 1.00 21.11 C ATOM 2201 CG GLN A 135 -2.915 -14.590 -24.168 1.00 53.23 C ATOM 2202 CD GLN A 135 -3.770 -15.247 -25.239 1.00 71.03 C ATOM 2203 OE1 GLN A 135 -4.128 -14.633 -26.239 1.00 12.12 O ATOM 2204 NE2 GLN A 135 -4.118 -16.497 -25.032 1.00 41.21 N ATOM 0 H GLN A 135 -6.106 -14.120 -23.468 1.00 23.34 H new ATOM 0 HA GLN A 135 -4.439 -13.355 -22.252 1.00 13.43 H new ATOM 0 HB2 GLN A 135 -3.285 -12.637 -24.973 1.00 21.11 H new ATOM 0 HB3 GLN A 135 -2.359 -12.634 -23.485 1.00 21.11 H new ATOM 0 HG2 GLN A 135 -1.863 -14.720 -24.423 1.00 53.23 H new ATOM 0 HG3 GLN A 135 -3.079 -15.101 -23.219 1.00 53.23 H new ATOM 0 HE21 GLN A 135 -3.805 -16.981 -24.191 1.00 41.21 H new ATOM 0 HE22 GLN A 135 -4.702 -16.983 -25.713 1.00 41.21 H new ATOM 2213 N ASN A 136 -5.197 -11.008 -21.719 1.00 53.01 N ATOM 2214 CA ASN A 136 -5.350 -9.629 -21.242 1.00 41.24 C ATOM 2215 C ASN A 136 -4.018 -9.067 -20.709 1.00 34.42 C ATOM 2216 O ASN A 136 -3.420 -9.624 -19.786 1.00 11.34 O ATOM 2217 CB ASN A 136 -6.430 -9.587 -20.157 1.00 51.34 C ATOM 2218 CG ASN A 136 -6.210 -10.649 -19.093 1.00 33.04 C ATOM 2219 OD1 ASN A 136 -6.673 -11.780 -19.220 1.00 54.25 O ATOM 2220 ND2 ASN A 136 -5.503 -10.298 -18.041 1.00 54.14 N ATOM 0 H ASN A 136 -5.610 -11.708 -21.103 1.00 53.01 H new ATOM 0 HA ASN A 136 -5.653 -9.000 -22.079 1.00 41.24 H new ATOM 0 HB2 ASN A 136 -6.437 -8.602 -19.690 1.00 51.34 H new ATOM 0 HB3 ASN A 136 -7.409 -9.730 -20.614 1.00 51.34 H new ATOM 0 HD21 ASN A 136 -5.324 -10.974 -17.298 1.00 54.14 H new ATOM 0 HD22 ASN A 136 -5.134 -9.350 -17.968 1.00 54.14 H new ATOM 2227 N LYS A 137 -3.550 -7.964 -21.300 1.00 2.22 N ATOM 2228 CA LYS A 137 -2.253 -7.371 -20.926 1.00 34.11 C ATOM 2229 C LYS A 137 -2.291 -5.829 -20.897 1.00 24.44 C ATOM 2230 O LYS A 137 -1.238 -5.183 -20.867 1.00 22.33 O ATOM 2231 CB LYS A 137 -1.161 -7.827 -21.912 1.00 20.03 C ATOM 2232 CG LYS A 137 -0.784 -9.304 -21.800 1.00 54.32 C ATOM 2233 CD LYS A 137 0.248 -9.712 -22.852 1.00 10.23 C ATOM 2234 CE LYS A 137 1.504 -8.844 -22.799 1.00 2.44 C ATOM 2235 NZ LYS A 137 2.189 -8.916 -21.479 1.00 63.55 N ATOM 0 H LYS A 137 -4.044 -7.462 -22.037 1.00 2.22 H new ATOM 0 HA LYS A 137 -2.028 -7.718 -19.918 1.00 34.11 H new ATOM 0 HB2 LYS A 137 -1.500 -7.628 -22.928 1.00 20.03 H new ATOM 0 HB3 LYS A 137 -0.268 -7.224 -21.750 1.00 20.03 H new ATOM 0 HG2 LYS A 137 -0.386 -9.502 -20.805 1.00 54.32 H new ATOM 0 HG3 LYS A 137 -1.679 -9.916 -21.913 1.00 54.32 H new ATOM 0 HD2 LYS A 137 0.524 -10.756 -22.702 1.00 10.23 H new ATOM 0 HD3 LYS A 137 -0.199 -9.640 -23.843 1.00 10.23 H new ATOM 0 HE2 LYS A 137 2.194 -9.160 -23.581 1.00 2.44 H new ATOM 0 HE3 LYS A 137 1.236 -7.809 -23.010 1.00 2.44 H new ATOM 0 HZ1 LYS A 137 3.070 -8.365 -21.515 1.00 63.55 H new ATOM 0 HZ2 LYS A 137 1.566 -8.526 -20.743 1.00 63.55 H new ATOM 0 HZ3 LYS A 137 2.410 -9.908 -21.256 1.00 63.55 H new ATOM 2249 N CYS A 138 -3.489 -5.240 -20.885 1.00 13.15 N ATOM 2250 CA CYS A 138 -3.618 -3.770 -20.958 1.00 5.51 C ATOM 2251 C CYS A 138 -5.077 -3.294 -20.813 1.00 10.43 C ATOM 2252 O CYS A 138 -5.490 -2.331 -21.459 1.00 54.34 O ATOM 2253 CB CYS A 138 -3.030 -3.252 -22.283 1.00 32.41 C ATOM 2254 SG CYS A 138 -3.728 -4.020 -23.766 1.00 55.42 S ATOM 0 H CYS A 138 -4.375 -5.743 -20.827 1.00 13.15 H new ATOM 0 HA CYS A 138 -3.059 -3.360 -20.117 1.00 5.51 H new ATOM 0 HB2 CYS A 138 -3.187 -2.175 -22.339 1.00 32.41 H new ATOM 0 HB3 CYS A 138 -1.953 -3.417 -22.277 1.00 32.41 H new ATOM 0 HG CYS A 138 -3.167 -3.512 -24.823 1.00 55.42 H new ATOM 2260 N ASP A 139 -5.849 -3.960 -19.960 1.00 72.40 N ATOM 2261 CA ASP A 139 -7.217 -3.526 -19.640 1.00 32.23 C ATOM 2262 C ASP A 139 -7.231 -2.737 -18.310 1.00 60.10 C ATOM 2263 O ASP A 139 -6.220 -2.685 -17.604 1.00 13.04 O ATOM 2264 CB ASP A 139 -8.137 -4.757 -19.557 1.00 63.54 C ATOM 2265 CG ASP A 139 -9.601 -4.392 -19.369 1.00 54.15 C ATOM 2266 OD1 ASP A 139 -10.287 -4.126 -20.381 1.00 74.22 O ATOM 2267 OD2 ASP A 139 -10.061 -4.351 -18.211 1.00 4.35 O ATOM 0 H ASP A 139 -5.555 -4.806 -19.473 1.00 72.40 H new ATOM 0 HA ASP A 139 -7.582 -2.866 -20.426 1.00 32.23 H new ATOM 0 HB2 ASP A 139 -8.029 -5.347 -20.467 1.00 63.54 H new ATOM 0 HB3 ASP A 139 -7.816 -5.388 -18.728 1.00 63.54 H new ATOM 2272 N ASP A 140 -8.365 -2.119 -17.968 1.00 52.14 N ATOM 2273 CA ASP A 140 -8.491 -1.408 -16.688 1.00 3.35 C ATOM 2274 C ASP A 140 -8.225 -2.353 -15.507 1.00 34.34 C ATOM 2275 O ASP A 140 -7.627 -1.963 -14.499 1.00 11.43 O ATOM 2276 CB ASP A 140 -9.882 -0.776 -16.549 1.00 14.21 C ATOM 2277 CG ASP A 140 -10.104 0.370 -17.519 1.00 21.22 C ATOM 2278 OD1 ASP A 140 -9.119 1.038 -17.897 1.00 61.21 O ATOM 2279 OD2 ASP A 140 -11.269 0.631 -17.886 1.00 33.12 O ATOM 0 H ASP A 140 -9.202 -2.095 -18.551 1.00 52.14 H new ATOM 0 HA ASP A 140 -7.743 -0.615 -16.675 1.00 3.35 H new ATOM 0 HB2 ASP A 140 -10.642 -1.540 -16.715 1.00 14.21 H new ATOM 0 HB3 ASP A 140 -10.012 -0.414 -15.529 1.00 14.21 H new ATOM 2284 N LEU A 141 -8.663 -3.601 -15.649 1.00 24.10 N ATOM 2285 CA LEU A 141 -8.408 -4.630 -14.642 1.00 62.01 C ATOM 2286 C LEU A 141 -6.899 -4.945 -14.556 1.00 43.50 C ATOM 2287 O LEU A 141 -6.350 -5.109 -13.463 1.00 0.33 O ATOM 2288 CB LEU A 141 -9.223 -5.894 -14.966 1.00 61.13 C ATOM 2289 CG LEU A 141 -9.218 -6.991 -13.884 1.00 34.45 C ATOM 2290 CD1 LEU A 141 -9.665 -6.433 -12.536 1.00 42.02 C ATOM 2291 CD2 LEU A 141 -10.114 -8.157 -14.301 1.00 74.04 C ATOM 0 H LEU A 141 -9.198 -3.926 -16.454 1.00 24.10 H new ATOM 0 HA LEU A 141 -8.724 -4.258 -13.667 1.00 62.01 H new ATOM 0 HB2 LEU A 141 -10.256 -5.599 -15.153 1.00 61.13 H new ATOM 0 HB3 LEU A 141 -8.841 -6.322 -15.893 1.00 61.13 H new ATOM 0 HG LEU A 141 -8.196 -7.356 -13.778 1.00 34.45 H new ATOM 0 HD11 LEU A 141 -9.652 -7.228 -11.791 1.00 42.02 H new ATOM 0 HD12 LEU A 141 -8.987 -5.637 -12.229 1.00 42.02 H new ATOM 0 HD13 LEU A 141 -10.676 -6.035 -12.624 1.00 42.02 H new ATOM 0 HD21 LEU A 141 -10.099 -8.923 -13.526 1.00 74.04 H new ATOM 0 HD22 LEU A 141 -11.135 -7.800 -14.439 1.00 74.04 H new ATOM 0 HD23 LEU A 141 -9.748 -8.581 -15.236 1.00 74.04 H new ATOM 2303 N ASP A 142 -6.231 -5.001 -15.714 1.00 74.24 N ATOM 2304 CA ASP A 142 -4.771 -5.175 -15.761 1.00 60.14 C ATOM 2305 C ASP A 142 -4.040 -3.999 -15.090 1.00 34.41 C ATOM 2306 O ASP A 142 -3.031 -4.191 -14.410 1.00 33.43 O ATOM 2307 CB ASP A 142 -4.280 -5.307 -17.209 1.00 33.20 C ATOM 2308 CG ASP A 142 -4.675 -6.620 -17.861 1.00 25.50 C ATOM 2309 OD1 ASP A 142 -4.324 -7.686 -17.313 1.00 41.11 O ATOM 2310 OD2 ASP A 142 -5.310 -6.588 -18.934 1.00 1.23 O ATOM 0 H ASP A 142 -6.675 -4.929 -16.630 1.00 74.24 H new ATOM 0 HA ASP A 142 -4.544 -6.090 -15.215 1.00 60.14 H new ATOM 0 HB2 ASP A 142 -4.681 -4.482 -17.798 1.00 33.20 H new ATOM 0 HB3 ASP A 142 -3.194 -5.213 -17.227 1.00 33.20 H new ATOM 2315 N ARG A 143 -4.554 -2.780 -15.293 1.00 14.41 N ATOM 2316 CA ARG A 143 -3.939 -1.571 -14.729 1.00 65.33 C ATOM 2317 C ARG A 143 -3.746 -1.691 -13.208 1.00 64.22 C ATOM 2318 O ARG A 143 -2.691 -1.337 -12.679 1.00 70.54 O ATOM 2319 CB ARG A 143 -4.774 -0.323 -15.062 1.00 63.34 C ATOM 2320 CG ARG A 143 -4.231 0.965 -14.441 1.00 41.32 C ATOM 2321 CD ARG A 143 -5.016 2.194 -14.887 1.00 3.34 C ATOM 2322 NE ARG A 143 -4.803 2.502 -16.299 1.00 72.14 N ATOM 2323 CZ ARG A 143 -5.676 3.111 -17.058 1.00 32.32 C ATOM 2324 NH1 ARG A 143 -6.825 3.477 -16.586 1.00 61.54 N ATOM 2325 NH2 ARG A 143 -5.391 3.366 -18.293 1.00 75.52 N ATOM 0 H ARG A 143 -5.394 -2.604 -15.844 1.00 14.41 H new ATOM 0 HA ARG A 143 -2.955 -1.466 -15.186 1.00 65.33 H new ATOM 0 HB2 ARG A 143 -4.817 -0.204 -16.145 1.00 63.34 H new ATOM 0 HB3 ARG A 143 -5.796 -0.479 -14.718 1.00 63.34 H new ATOM 0 HG2 ARG A 143 -4.268 0.887 -13.354 1.00 41.32 H new ATOM 0 HG3 ARG A 143 -3.183 1.086 -14.716 1.00 41.32 H new ATOM 0 HD2 ARG A 143 -6.079 2.029 -14.709 1.00 3.34 H new ATOM 0 HD3 ARG A 143 -4.721 3.051 -14.281 1.00 3.34 H new ATOM 0 HE ARG A 143 -3.916 2.224 -16.720 1.00 72.14 H new ATOM 0 HH11 ARG A 143 -7.058 3.291 -15.611 1.00 61.54 H new ATOM 0 HH12 ARG A 143 -7.497 3.951 -17.190 1.00 61.54 H new ATOM 0 HH21 ARG A 143 -4.486 3.092 -18.675 1.00 75.52 H new ATOM 0 HH22 ARG A 143 -6.072 3.841 -18.886 1.00 75.52 H new ATOM 2339 N PHE A 144 -4.758 -2.203 -12.510 1.00 24.00 N ATOM 2340 CA PHE A 144 -4.648 -2.412 -11.061 1.00 54.45 C ATOM 2341 C PHE A 144 -3.567 -3.456 -10.738 1.00 23.44 C ATOM 2342 O PHE A 144 -2.767 -3.272 -9.826 1.00 13.33 O ATOM 2343 CB PHE A 144 -5.994 -2.850 -10.461 1.00 12.35 C ATOM 2344 CG PHE A 144 -5.955 -3.000 -8.956 1.00 2.13 C ATOM 2345 CD1 PHE A 144 -6.191 -1.910 -8.129 1.00 22.04 C ATOM 2346 CD2 PHE A 144 -5.666 -4.226 -8.368 1.00 25.51 C ATOM 2347 CE1 PHE A 144 -6.141 -2.038 -6.753 1.00 35.02 C ATOM 2348 CE2 PHE A 144 -5.613 -4.357 -6.993 1.00 4.32 C ATOM 2349 CZ PHE A 144 -5.850 -3.262 -6.185 1.00 54.03 C ATOM 0 H PHE A 144 -5.653 -2.479 -12.914 1.00 24.00 H new ATOM 0 HA PHE A 144 -4.362 -1.460 -10.613 1.00 54.45 H new ATOM 0 HB2 PHE A 144 -6.758 -2.120 -10.727 1.00 12.35 H new ATOM 0 HB3 PHE A 144 -6.291 -3.799 -10.907 1.00 12.35 H new ATOM 0 HD1 PHE A 144 -6.417 -0.949 -8.566 1.00 22.04 H new ATOM 0 HD2 PHE A 144 -5.481 -5.087 -8.993 1.00 25.51 H new ATOM 0 HE1 PHE A 144 -6.329 -1.181 -6.123 1.00 35.02 H new ATOM 0 HE2 PHE A 144 -5.386 -5.316 -6.550 1.00 4.32 H new ATOM 0 HZ PHE A 144 -5.808 -3.363 -5.111 1.00 54.03 H new ATOM 2359 N VAL A 145 -3.546 -4.543 -11.507 1.00 33.34 N ATOM 2360 CA VAL A 145 -2.611 -5.651 -11.272 1.00 11.12 C ATOM 2361 C VAL A 145 -1.141 -5.237 -11.483 1.00 1.21 C ATOM 2362 O VAL A 145 -0.284 -5.497 -10.632 1.00 5.42 O ATOM 2363 CB VAL A 145 -2.944 -6.858 -12.186 1.00 52.44 C ATOM 2364 CG1 VAL A 145 -1.956 -8.005 -11.972 1.00 13.22 C ATOM 2365 CG2 VAL A 145 -4.380 -7.329 -11.946 1.00 54.40 C ATOM 0 H VAL A 145 -4.168 -4.684 -12.303 1.00 33.34 H new ATOM 0 HA VAL A 145 -2.731 -5.939 -10.228 1.00 11.12 H new ATOM 0 HB VAL A 145 -2.854 -6.531 -13.222 1.00 52.44 H new ATOM 0 HG11 VAL A 145 -2.216 -8.836 -12.627 1.00 13.22 H new ATOM 0 HG12 VAL A 145 -0.947 -7.664 -12.202 1.00 13.22 H new ATOM 0 HG13 VAL A 145 -2.000 -8.334 -10.934 1.00 13.22 H new ATOM 0 HG21 VAL A 145 -4.598 -8.177 -12.595 1.00 54.40 H new ATOM 0 HG22 VAL A 145 -4.495 -7.630 -10.905 1.00 54.40 H new ATOM 0 HG23 VAL A 145 -5.071 -6.516 -12.167 1.00 54.40 H new ATOM 2375 N MET A 146 -0.852 -4.590 -12.614 1.00 33.10 N ATOM 2376 CA MET A 146 0.519 -4.167 -12.940 1.00 63.22 C ATOM 2377 C MET A 146 1.084 -3.194 -11.892 1.00 23.44 C ATOM 2378 O MET A 146 2.284 -3.187 -11.624 1.00 71.14 O ATOM 2379 CB MET A 146 0.575 -3.525 -14.334 1.00 11.30 C ATOM 2380 CG MET A 146 -0.341 -2.322 -14.500 1.00 4.42 C ATOM 2381 SD MET A 146 -0.062 -1.440 -16.048 1.00 33.24 S ATOM 2382 CE MET A 146 1.579 -0.775 -15.764 1.00 5.01 C ATOM 0 H MET A 146 -1.545 -4.346 -13.321 1.00 33.10 H new ATOM 0 HA MET A 146 1.139 -5.063 -12.935 1.00 63.22 H new ATOM 0 HB2 MET A 146 1.601 -3.219 -14.540 1.00 11.30 H new ATOM 0 HB3 MET A 146 0.310 -4.275 -15.079 1.00 11.30 H new ATOM 0 HG2 MET A 146 -1.379 -2.653 -14.457 1.00 4.42 H new ATOM 0 HG3 MET A 146 -0.190 -1.638 -13.665 1.00 4.42 H new ATOM 0 HE1 MET A 146 1.734 0.095 -16.402 1.00 5.01 H new ATOM 0 HE2 MET A 146 1.677 -0.481 -14.719 1.00 5.01 H new ATOM 0 HE3 MET A 146 2.325 -1.534 -15.998 1.00 5.01 H new ATOM 2392 N VAL A 147 0.219 -2.370 -11.308 1.00 11.22 N ATOM 2393 CA VAL A 147 0.635 -1.448 -10.247 1.00 12.23 C ATOM 2394 C VAL A 147 0.632 -2.146 -8.875 1.00 41.52 C ATOM 2395 O VAL A 147 1.470 -1.865 -8.020 1.00 0.33 O ATOM 2396 CB VAL A 147 -0.272 -0.194 -10.200 1.00 73.42 C ATOM 2397 CG1 VAL A 147 0.187 0.779 -9.112 1.00 15.24 C ATOM 2398 CG2 VAL A 147 -0.306 0.495 -11.565 1.00 50.21 C ATOM 0 H VAL A 147 -0.771 -2.319 -11.548 1.00 11.22 H new ATOM 0 HA VAL A 147 1.652 -1.130 -10.478 1.00 12.23 H new ATOM 0 HB VAL A 147 -1.283 -0.518 -9.952 1.00 73.42 H new ATOM 0 HG11 VAL A 147 -0.468 1.650 -9.103 1.00 15.24 H new ATOM 0 HG12 VAL A 147 0.147 0.285 -8.141 1.00 15.24 H new ATOM 0 HG13 VAL A 147 1.210 1.097 -9.316 1.00 15.24 H new ATOM 0 HG21 VAL A 147 -0.948 1.374 -11.513 1.00 50.21 H new ATOM 0 HG22 VAL A 147 0.703 0.799 -11.845 1.00 50.21 H new ATOM 0 HG23 VAL A 147 -0.697 -0.196 -12.312 1.00 50.21 H new ATOM 2408 N ALA A 148 -0.297 -3.075 -8.678 1.00 32.22 N ATOM 2409 CA ALA A 148 -0.391 -3.821 -7.420 1.00 45.45 C ATOM 2410 C ALA A 148 0.899 -4.600 -7.112 1.00 13.22 C ATOM 2411 O ALA A 148 1.327 -4.680 -5.962 1.00 74.32 O ATOM 2412 CB ALA A 148 -1.580 -4.770 -7.455 1.00 22.22 C ATOM 0 H ALA A 148 -0.999 -3.333 -9.372 1.00 32.22 H new ATOM 0 HA ALA A 148 -0.533 -3.093 -6.621 1.00 45.45 H new ATOM 0 HB1 ALA A 148 -1.637 -5.317 -6.514 1.00 22.22 H new ATOM 0 HB2 ALA A 148 -2.497 -4.199 -7.599 1.00 22.22 H new ATOM 0 HB3 ALA A 148 -1.459 -5.475 -8.278 1.00 22.22 H new ATOM 2418 N LYS A 149 1.522 -5.163 -8.145 1.00 43.32 N ATOM 2419 CA LYS A 149 2.749 -5.950 -7.965 1.00 43.32 C ATOM 2420 C LYS A 149 3.966 -5.081 -7.593 1.00 54.23 C ATOM 2421 O LYS A 149 4.907 -5.568 -6.964 1.00 44.33 O ATOM 2422 CB LYS A 149 3.054 -6.775 -9.220 1.00 12.32 C ATOM 2423 CG LYS A 149 3.158 -5.955 -10.504 1.00 24.34 C ATOM 2424 CD LYS A 149 3.570 -6.821 -11.692 1.00 31.42 C ATOM 2425 CE LYS A 149 2.640 -8.017 -11.875 1.00 24.14 C ATOM 2426 NZ LYS A 149 3.136 -8.956 -12.914 1.00 53.44 N ATOM 0 H LYS A 149 1.203 -5.092 -9.111 1.00 43.32 H new ATOM 0 HA LYS A 149 2.565 -6.622 -7.127 1.00 43.32 H new ATOM 0 HB2 LYS A 149 3.991 -7.311 -9.069 1.00 12.32 H new ATOM 0 HB3 LYS A 149 2.274 -7.526 -9.345 1.00 12.32 H new ATOM 0 HG2 LYS A 149 2.198 -5.482 -10.713 1.00 24.34 H new ATOM 0 HG3 LYS A 149 3.885 -5.154 -10.367 1.00 24.34 H new ATOM 0 HD2 LYS A 149 3.567 -6.217 -12.599 1.00 31.42 H new ATOM 0 HD3 LYS A 149 4.591 -7.174 -11.547 1.00 31.42 H new ATOM 0 HE2 LYS A 149 2.539 -8.546 -10.927 1.00 24.14 H new ATOM 0 HE3 LYS A 149 1.646 -7.664 -12.150 1.00 24.14 H new ATOM 0 HZ1 LYS A 149 2.475 -9.753 -13.006 1.00 53.44 H new ATOM 0 HZ2 LYS A 149 3.208 -8.459 -13.825 1.00 53.44 H new ATOM 0 HZ3 LYS A 149 4.073 -9.314 -12.640 1.00 53.44 H new ATOM 2440 N THR A 150 3.958 -3.801 -7.974 1.00 60.30 N ATOM 2441 CA THR A 150 5.062 -2.891 -7.608 1.00 21.20 C ATOM 2442 C THR A 150 4.816 -2.229 -6.245 1.00 73.03 C ATOM 2443 O THR A 150 5.729 -1.652 -5.653 1.00 64.40 O ATOM 2444 CB THR A 150 5.321 -1.790 -8.674 1.00 53.40 C ATOM 2445 OG1 THR A 150 6.376 -0.919 -8.238 1.00 23.34 O ATOM 2446 CG2 THR A 150 4.072 -0.965 -8.958 1.00 43.03 C ATOM 0 H THR A 150 3.216 -3.371 -8.526 1.00 60.30 H new ATOM 0 HA THR A 150 5.951 -3.519 -7.553 1.00 21.20 H new ATOM 0 HB THR A 150 5.610 -2.295 -9.596 1.00 53.40 H new ATOM 0 HG1 THR A 150 6.517 -1.033 -7.275 1.00 23.34 H new ATOM 0 HG21 THR A 150 4.299 -0.208 -9.709 1.00 43.03 H new ATOM 0 HG22 THR A 150 3.281 -1.618 -9.328 1.00 43.03 H new ATOM 0 HG23 THR A 150 3.741 -0.479 -8.040 1.00 43.03 H new ATOM 2454 N VAL A 151 3.584 -2.346 -5.743 1.00 31.15 N ATOM 2455 CA VAL A 151 3.202 -1.789 -4.436 1.00 72.13 C ATOM 2456 C VAL A 151 4.187 -2.167 -3.307 1.00 14.24 C ATOM 2457 O VAL A 151 4.628 -1.290 -2.557 1.00 51.51 O ATOM 2458 CB VAL A 151 1.770 -2.229 -4.037 1.00 73.12 C ATOM 2459 CG1 VAL A 151 1.460 -1.846 -2.593 1.00 21.42 C ATOM 2460 CG2 VAL A 151 0.740 -1.630 -4.991 1.00 60.52 C ATOM 0 H VAL A 151 2.824 -2.826 -6.225 1.00 31.15 H new ATOM 0 HA VAL A 151 3.234 -0.706 -4.555 1.00 72.13 H new ATOM 0 HB VAL A 151 1.716 -3.315 -4.112 1.00 73.12 H new ATOM 0 HG11 VAL A 151 0.449 -2.167 -2.340 1.00 21.42 H new ATOM 0 HG12 VAL A 151 2.172 -2.332 -1.927 1.00 21.42 H new ATOM 0 HG13 VAL A 151 1.537 -0.765 -2.479 1.00 21.42 H new ATOM 0 HG21 VAL A 151 -0.259 -1.950 -4.695 1.00 60.52 H new ATOM 0 HG22 VAL A 151 0.799 -0.542 -4.954 1.00 60.52 H new ATOM 0 HG23 VAL A 151 0.944 -1.970 -6.006 1.00 60.52 H new ATOM 2470 N PRO A 152 4.546 -3.467 -3.146 1.00 34.35 N ATOM 2471 CA PRO A 152 5.522 -3.881 -2.123 1.00 1.40 C ATOM 2472 C PRO A 152 6.856 -3.127 -2.235 1.00 11.13 C ATOM 2473 O PRO A 152 7.452 -2.756 -1.225 1.00 31.02 O ATOM 2474 CB PRO A 152 5.729 -5.378 -2.407 1.00 31.22 C ATOM 2475 CG PRO A 152 4.479 -5.808 -3.092 1.00 72.25 C ATOM 2476 CD PRO A 152 4.036 -4.628 -3.913 1.00 61.44 C ATOM 0 HA PRO A 152 5.162 -3.668 -1.116 1.00 1.40 H new ATOM 0 HB2 PRO A 152 6.603 -5.545 -3.036 1.00 31.22 H new ATOM 0 HB3 PRO A 152 5.888 -5.938 -1.485 1.00 31.22 H new ATOM 0 HG2 PRO A 152 4.658 -6.678 -3.723 1.00 72.25 H new ATOM 0 HG3 PRO A 152 3.714 -6.091 -2.369 1.00 72.25 H new ATOM 0 HD2 PRO A 152 4.453 -4.659 -4.920 1.00 61.44 H new ATOM 0 HD3 PRO A 152 2.952 -4.596 -4.018 1.00 61.44 H new ATOM 2484 N ASP A 153 7.307 -2.885 -3.466 1.00 15.01 N ATOM 2485 CA ASP A 153 8.594 -2.223 -3.692 1.00 71.05 C ATOM 2486 C ASP A 153 8.487 -0.720 -3.396 1.00 31.34 C ATOM 2487 O ASP A 153 9.396 -0.124 -2.808 1.00 34.14 O ATOM 2488 CB ASP A 153 9.079 -2.459 -5.127 1.00 74.11 C ATOM 2489 CG ASP A 153 10.578 -2.254 -5.258 1.00 34.51 C ATOM 2490 OD1 ASP A 153 11.017 -1.108 -5.489 1.00 22.11 O ATOM 2491 OD2 ASP A 153 11.327 -3.245 -5.113 1.00 53.34 O ATOM 0 H ASP A 153 6.805 -3.135 -4.318 1.00 15.01 H new ATOM 0 HA ASP A 153 9.326 -2.655 -3.010 1.00 71.05 H new ATOM 0 HB2 ASP A 153 8.823 -3.473 -5.435 1.00 74.11 H new ATOM 0 HB3 ASP A 153 8.559 -1.780 -5.802 1.00 74.11 H new ATOM 2496 N ASP A 154 7.367 -0.113 -3.793 1.00 53.24 N ATOM 2497 CA ASP A 154 7.067 1.274 -3.422 1.00 53.11 C ATOM 2498 C ASP A 154 7.152 1.434 -1.897 1.00 62.42 C ATOM 2499 O ASP A 154 7.736 2.391 -1.378 1.00 54.41 O ATOM 2500 CB ASP A 154 5.663 1.670 -3.905 1.00 5.11 C ATOM 2501 CG ASP A 154 5.463 1.488 -5.403 1.00 63.34 C ATOM 2502 OD1 ASP A 154 6.440 1.637 -6.165 1.00 71.44 O ATOM 2503 OD2 ASP A 154 4.324 1.198 -5.823 1.00 0.30 O ATOM 0 H ASP A 154 6.653 -0.558 -4.370 1.00 53.24 H new ATOM 0 HA ASP A 154 7.798 1.927 -3.898 1.00 53.11 H new ATOM 0 HB2 ASP A 154 4.922 1.073 -3.372 1.00 5.11 H new ATOM 0 HB3 ASP A 154 5.479 2.713 -3.646 1.00 5.11 H new ATOM 2508 N ALA A 155 6.572 0.464 -1.191 1.00 53.14 N ATOM 2509 CA ALA A 155 6.613 0.417 0.270 1.00 51.04 C ATOM 2510 C ALA A 155 8.040 0.184 0.803 1.00 23.32 C ATOM 2511 O ALA A 155 8.428 0.772 1.809 1.00 10.01 O ATOM 2512 CB ALA A 155 5.668 -0.664 0.782 1.00 51.33 C ATOM 0 H ALA A 155 6.061 -0.310 -1.615 1.00 53.14 H new ATOM 0 HA ALA A 155 6.287 1.388 0.642 1.00 51.04 H new ATOM 0 HB1 ALA A 155 5.704 -0.693 1.871 1.00 51.33 H new ATOM 0 HB2 ALA A 155 4.651 -0.441 0.458 1.00 51.33 H new ATOM 0 HB3 ALA A 155 5.972 -1.632 0.383 1.00 51.33 H new ATOM 2518 N LYS A 156 8.821 -0.671 0.125 1.00 24.34 N ATOM 2519 CA LYS A 156 10.231 -0.915 0.501 1.00 2.32 C ATOM 2520 C LYS A 156 10.983 0.408 0.731 1.00 2.52 C ATOM 2521 O LYS A 156 11.775 0.536 1.669 1.00 12.33 O ATOM 2522 CB LYS A 156 10.958 -1.739 -0.588 1.00 40.11 C ATOM 2523 CG LYS A 156 11.202 -3.210 -0.238 1.00 53.32 C ATOM 2524 CD LYS A 156 9.905 -4.006 -0.169 1.00 35.42 C ATOM 2525 CE LYS A 156 10.151 -5.500 0.023 1.00 75.44 C ATOM 2526 NZ LYS A 156 10.869 -5.799 1.289 1.00 15.31 N ATOM 0 H LYS A 156 8.506 -1.206 -0.684 1.00 24.34 H new ATOM 0 HA LYS A 156 10.225 -1.481 1.432 1.00 2.32 H new ATOM 0 HB2 LYS A 156 10.373 -1.693 -1.507 1.00 40.11 H new ATOM 0 HB3 LYS A 156 11.918 -1.268 -0.797 1.00 40.11 H new ATOM 0 HG2 LYS A 156 11.861 -3.655 -0.984 1.00 53.32 H new ATOM 0 HG3 LYS A 156 11.717 -3.273 0.721 1.00 53.32 H new ATOM 0 HD2 LYS A 156 9.295 -3.632 0.653 1.00 35.42 H new ATOM 0 HD3 LYS A 156 9.336 -3.849 -1.085 1.00 35.42 H new ATOM 0 HE2 LYS A 156 9.196 -6.026 0.017 1.00 75.44 H new ATOM 0 HE3 LYS A 156 10.730 -5.881 -0.818 1.00 75.44 H new ATOM 0 HZ1 LYS A 156 10.952 -6.829 1.406 1.00 15.31 H new ATOM 0 HZ2 LYS A 156 11.819 -5.376 1.258 1.00 15.31 H new ATOM 0 HZ3 LYS A 156 10.339 -5.401 2.091 1.00 15.31 H new ATOM 2540 N GLN A 157 10.714 1.388 -0.130 1.00 31.51 N ATOM 2541 CA GLN A 157 11.351 2.707 -0.050 1.00 23.42 C ATOM 2542 C GLN A 157 11.110 3.384 1.310 1.00 75.23 C ATOM 2543 O GLN A 157 12.055 3.719 2.029 1.00 52.45 O ATOM 2544 CB GLN A 157 10.820 3.603 -1.179 1.00 21.33 C ATOM 2545 CG GLN A 157 11.146 3.100 -2.582 1.00 10.21 C ATOM 2546 CD GLN A 157 12.636 3.101 -2.871 1.00 2.45 C ATOM 2547 OE1 GLN A 157 13.186 4.099 -3.322 1.00 51.32 O ATOM 2548 NE2 GLN A 157 13.304 1.990 -2.623 1.00 22.02 N ATOM 0 H GLN A 157 10.052 1.294 -0.900 1.00 31.51 H new ATOM 0 HA GLN A 157 12.426 2.564 -0.159 1.00 23.42 H new ATOM 0 HB2 GLN A 157 9.738 3.692 -1.079 1.00 21.33 H new ATOM 0 HB3 GLN A 157 11.234 4.604 -1.059 1.00 21.33 H new ATOM 0 HG2 GLN A 157 10.757 2.089 -2.701 1.00 10.21 H new ATOM 0 HG3 GLN A 157 10.637 3.725 -3.316 1.00 10.21 H new ATOM 0 HE21 GLN A 157 12.818 1.176 -2.248 1.00 22.02 H new ATOM 0 HE22 GLN A 157 14.306 1.946 -2.807 1.00 22.02 H new ATOM 2557 N LEU A 158 9.842 3.583 1.660 1.00 40.13 N ATOM 2558 CA LEU A 158 9.485 4.241 2.925 1.00 75.40 C ATOM 2559 C LEU A 158 9.847 3.374 4.135 1.00 52.41 C ATOM 2560 O LEU A 158 10.417 3.868 5.109 1.00 43.14 O ATOM 2561 CB LEU A 158 7.988 4.591 2.954 1.00 33.23 C ATOM 2562 CG LEU A 158 7.584 5.847 2.162 1.00 41.34 C ATOM 2563 CD1 LEU A 158 8.273 7.088 2.731 1.00 42.21 C ATOM 2564 CD2 LEU A 158 7.904 5.684 0.677 1.00 54.23 C ATOM 0 H LEU A 158 9.043 3.301 1.092 1.00 40.13 H new ATOM 0 HA LEU A 158 10.064 5.162 2.986 1.00 75.40 H new ATOM 0 HB2 LEU A 158 7.427 3.742 2.565 1.00 33.23 H new ATOM 0 HB3 LEU A 158 7.684 4.725 3.992 1.00 33.23 H new ATOM 0 HG LEU A 158 6.506 5.977 2.262 1.00 41.34 H new ATOM 0 HD11 LEU A 158 7.974 7.965 2.157 1.00 42.21 H new ATOM 0 HD12 LEU A 158 7.982 7.220 3.773 1.00 42.21 H new ATOM 0 HD13 LEU A 158 9.354 6.965 2.669 1.00 42.21 H new ATOM 0 HD21 LEU A 158 7.609 6.585 0.140 1.00 54.23 H new ATOM 0 HD22 LEU A 158 8.974 5.521 0.551 1.00 54.23 H new ATOM 0 HD23 LEU A 158 7.358 4.829 0.279 1.00 54.23 H new ATOM 2576 N THR A 159 9.521 2.087 4.059 1.00 34.21 N ATOM 2577 CA THR A 159 9.815 1.133 5.138 1.00 1.20 C ATOM 2578 C THR A 159 11.287 1.201 5.577 1.00 32.21 C ATOM 2579 O THR A 159 11.587 1.328 6.762 1.00 1.44 O ATOM 2580 CB THR A 159 9.478 -0.319 4.714 1.00 2.01 C ATOM 2581 OG1 THR A 159 8.105 -0.406 4.303 1.00 41.42 O ATOM 2582 CG2 THR A 159 9.729 -1.306 5.849 1.00 0.44 C ATOM 0 H THR A 159 9.049 1.672 3.256 1.00 34.21 H new ATOM 0 HA THR A 159 9.185 1.417 5.981 1.00 1.20 H new ATOM 0 HB THR A 159 10.131 -0.580 3.881 1.00 2.01 H new ATOM 0 HG1 THR A 159 7.980 -1.203 3.746 1.00 41.42 H new ATOM 0 HG21 THR A 159 9.482 -2.314 5.516 1.00 0.44 H new ATOM 0 HG22 THR A 159 10.779 -1.267 6.140 1.00 0.44 H new ATOM 0 HG23 THR A 159 9.106 -1.043 6.704 1.00 0.44 H new ATOM 2590 N THR A 160 12.203 1.132 4.616 1.00 63.35 N ATOM 2591 CA THR A 160 13.642 1.184 4.917 1.00 62.23 C ATOM 2592 C THR A 160 14.064 2.568 5.440 1.00 52.21 C ATOM 2593 O THR A 160 14.764 2.677 6.450 1.00 21.31 O ATOM 2594 CB THR A 160 14.491 0.832 3.670 1.00 41.04 C ATOM 2595 OG1 THR A 160 14.054 -0.418 3.113 1.00 55.01 O ATOM 2596 CG2 THR A 160 15.974 0.738 4.020 1.00 13.53 C ATOM 0 H THR A 160 11.983 1.040 3.624 1.00 63.35 H new ATOM 0 HA THR A 160 13.823 0.443 5.696 1.00 62.23 H new ATOM 0 HB THR A 160 14.356 1.629 2.939 1.00 41.04 H new ATOM 0 HG1 THR A 160 13.261 -0.269 2.557 1.00 55.01 H new ATOM 0 HG21 THR A 160 16.544 0.490 3.125 1.00 13.53 H new ATOM 0 HG22 THR A 160 16.316 1.695 4.414 1.00 13.53 H new ATOM 0 HG23 THR A 160 16.122 -0.038 4.771 1.00 13.53 H new ATOM 2604 N THR A 161 13.624 3.621 4.750 1.00 4.44 N ATOM 2605 CA THR A 161 13.992 5.005 5.104 1.00 41.22 C ATOM 2606 C THR A 161 13.588 5.369 6.544 1.00 13.13 C ATOM 2607 O THR A 161 14.406 5.868 7.326 1.00 10.35 O ATOM 2608 CB THR A 161 13.349 6.025 4.130 1.00 14.14 C ATOM 2609 OG1 THR A 161 13.761 5.742 2.785 1.00 24.23 O ATOM 2610 CG2 THR A 161 13.733 7.461 4.484 1.00 63.54 C ATOM 0 H THR A 161 13.010 3.548 3.939 1.00 4.44 H new ATOM 0 HA THR A 161 15.078 5.056 5.025 1.00 41.22 H new ATOM 0 HB THR A 161 12.267 5.929 4.218 1.00 14.14 H new ATOM 0 HG1 THR A 161 13.177 5.055 2.402 1.00 24.23 H new ATOM 0 HG21 THR A 161 13.264 8.147 3.779 1.00 63.54 H new ATOM 0 HG22 THR A 161 13.394 7.690 5.494 1.00 63.54 H new ATOM 0 HG23 THR A 161 14.816 7.572 4.431 1.00 63.54 H new ATOM 2618 N ILE A 162 12.329 5.121 6.890 1.00 62.35 N ATOM 2619 CA ILE A 162 11.822 5.429 8.232 1.00 24.14 C ATOM 2620 C ILE A 162 12.584 4.643 9.311 1.00 20.13 C ATOM 2621 O ILE A 162 12.931 5.184 10.358 1.00 52.44 O ATOM 2622 CB ILE A 162 10.303 5.131 8.335 1.00 43.42 C ATOM 2623 CG1 ILE A 162 9.522 6.028 7.355 1.00 3.43 C ATOM 2624 CG2 ILE A 162 9.797 5.322 9.768 1.00 52.22 C ATOM 2625 CD1 ILE A 162 8.027 5.791 7.356 1.00 63.51 C ATOM 0 H ILE A 162 11.638 4.708 6.264 1.00 62.35 H new ATOM 0 HA ILE A 162 11.983 6.494 8.402 1.00 24.14 H new ATOM 0 HB ILE A 162 10.138 4.088 8.064 1.00 43.42 H new ATOM 0 HG12 ILE A 162 9.714 7.072 7.604 1.00 3.43 H new ATOM 0 HG13 ILE A 162 9.904 5.865 6.347 1.00 3.43 H new ATOM 0 HG21 ILE A 162 8.729 5.106 9.809 1.00 52.22 H new ATOM 0 HG22 ILE A 162 10.330 4.645 10.435 1.00 52.22 H new ATOM 0 HG23 ILE A 162 9.971 6.351 10.081 1.00 52.22 H new ATOM 0 HD11 ILE A 162 7.552 6.462 6.640 1.00 63.51 H new ATOM 0 HD12 ILE A 162 7.822 4.758 7.077 1.00 63.51 H new ATOM 0 HD13 ILE A 162 7.629 5.983 8.352 1.00 63.51 H new ATOM 2637 N ASN A 163 12.863 3.373 9.033 1.00 74.11 N ATOM 2638 CA ASN A 163 13.588 2.510 9.973 1.00 23.15 C ATOM 2639 C ASN A 163 15.017 3.016 10.260 1.00 24.22 C ATOM 2640 O ASN A 163 15.439 3.073 11.417 1.00 34.55 O ATOM 2641 CB ASN A 163 13.616 1.072 9.443 1.00 13.31 C ATOM 2642 CG ASN A 163 12.255 0.404 9.547 1.00 12.24 C ATOM 2643 OD1 ASN A 163 12.236 -0.905 9.669 1.00 4.45 O flip ATOM 2644 ND2 ASN A 163 11.224 1.060 9.517 1.00 62.44 N flip ATOM 0 H ASN A 163 12.599 2.913 8.162 1.00 74.11 H new ATOM 0 HA ASN A 163 13.053 2.536 10.923 1.00 23.15 H new ATOM 0 HB2 ASN A 163 13.941 1.075 8.402 1.00 13.31 H new ATOM 0 HB3 ASN A 163 14.349 0.492 10.004 1.00 13.31 H new ATOM 0 HD21 ASN A 163 11.268 2.075 9.422 1.00 62.44 H new ATOM 0 HD22 ASN A 163 10.320 0.593 9.587 1.00 62.44 H new ATOM 2651 N THR A 164 15.762 3.390 9.218 1.00 33.44 N ATOM 2652 CA THR A 164 17.136 3.900 9.410 1.00 25.52 C ATOM 2653 C THR A 164 17.158 5.301 10.044 1.00 51.52 C ATOM 2654 O THR A 164 18.159 5.699 10.641 1.00 2.42 O ATOM 2655 CB THR A 164 17.958 3.936 8.096 1.00 52.33 C ATOM 2656 OG1 THR A 164 19.252 4.516 8.338 1.00 35.42 O ATOM 2657 CG2 THR A 164 17.248 4.729 7.006 1.00 73.50 C ATOM 0 H THR A 164 15.452 3.354 8.247 1.00 33.44 H new ATOM 0 HA THR A 164 17.601 3.189 10.092 1.00 25.52 H new ATOM 0 HB THR A 164 18.068 2.907 7.753 1.00 52.33 H new ATOM 0 HG1 THR A 164 19.764 4.533 7.503 1.00 35.42 H new ATOM 0 HG21 THR A 164 17.857 4.730 6.102 1.00 73.50 H new ATOM 0 HG22 THR A 164 16.282 4.270 6.793 1.00 73.50 H new ATOM 0 HG23 THR A 164 17.096 5.755 7.342 1.00 73.50 H new ATOM 2665 N ASN A 165 16.063 6.048 9.904 1.00 33.10 N ATOM 2666 CA ASN A 165 15.952 7.384 10.515 1.00 43.20 C ATOM 2667 C ASN A 165 15.006 7.382 11.729 1.00 12.23 C ATOM 2668 O ASN A 165 14.668 8.439 12.259 1.00 75.11 O ATOM 2669 CB ASN A 165 15.477 8.412 9.478 1.00 13.32 C ATOM 2670 CG ASN A 165 16.516 8.663 8.398 1.00 12.51 C ATOM 2671 OD1 ASN A 165 17.371 9.532 8.531 1.00 24.31 O ATOM 2672 ND2 ASN A 165 16.450 7.906 7.322 1.00 2.05 N ATOM 0 H ASN A 165 15.240 5.757 9.376 1.00 33.10 H new ATOM 0 HA ASN A 165 16.945 7.663 10.867 1.00 43.20 H new ATOM 0 HB2 ASN A 165 14.554 8.060 9.017 1.00 13.32 H new ATOM 0 HB3 ASN A 165 15.244 9.351 9.980 1.00 13.32 H new ATOM 0 HD21 ASN A 165 17.123 8.034 6.567 1.00 2.05 H new ATOM 0 HD22 ASN A 165 15.726 7.192 7.244 1.00 2.05 H new ATOM 2679 N ALA A 166 14.598 6.191 12.175 1.00 43.11 N ATOM 2680 CA ALA A 166 13.690 6.047 13.326 1.00 53.03 C ATOM 2681 C ALA A 166 14.221 6.778 14.566 1.00 74.22 C ATOM 2682 O ALA A 166 13.471 7.444 15.280 1.00 53.35 O ATOM 2683 CB ALA A 166 13.482 4.570 13.643 1.00 41.12 C ATOM 0 H ALA A 166 14.882 5.305 11.756 1.00 43.11 H new ATOM 0 HA ALA A 166 12.737 6.502 13.055 1.00 53.03 H new ATOM 0 HB1 ALA A 166 12.810 4.472 14.495 1.00 41.12 H new ATOM 0 HB2 ALA A 166 13.047 4.070 12.778 1.00 41.12 H new ATOM 0 HB3 ALA A 166 14.441 4.111 13.883 1.00 41.12 H new ATOM 2689 N GLU A 167 15.519 6.643 14.804 1.00 60.40 N ATOM 2690 CA GLU A 167 16.188 7.285 15.941 1.00 33.33 C ATOM 2691 C GLU A 167 16.129 8.826 15.874 1.00 31.43 C ATOM 2692 O GLU A 167 16.284 9.506 16.892 1.00 52.14 O ATOM 2693 CB GLU A 167 17.640 6.785 16.021 1.00 24.02 C ATOM 2694 CG GLU A 167 18.400 6.810 14.692 1.00 60.15 C ATOM 2695 CD GLU A 167 18.996 8.169 14.350 1.00 32.24 C ATOM 2696 OE1 GLU A 167 19.872 8.644 15.107 1.00 33.15 O ATOM 2697 OE2 GLU A 167 18.612 8.752 13.314 1.00 4.35 O ATOM 0 H GLU A 167 16.142 6.087 14.218 1.00 60.40 H new ATOM 0 HA GLU A 167 15.654 7.006 16.850 1.00 33.33 H new ATOM 0 HB2 GLU A 167 18.181 7.395 16.744 1.00 24.02 H new ATOM 0 HB3 GLU A 167 17.638 5.764 16.403 1.00 24.02 H new ATOM 0 HG2 GLU A 167 19.201 6.071 14.728 1.00 60.15 H new ATOM 0 HG3 GLU A 167 17.724 6.508 13.892 1.00 60.15 H new ATOM 2704 N ALA A 168 15.915 9.366 14.676 1.00 21.30 N ATOM 2705 CA ALA A 168 15.738 10.810 14.494 1.00 50.13 C ATOM 2706 C ALA A 168 14.253 11.198 14.566 1.00 43.11 C ATOM 2707 O ALA A 168 13.890 12.190 15.200 1.00 35.23 O ATOM 2708 CB ALA A 168 16.337 11.254 13.163 1.00 70.22 C ATOM 0 H ALA A 168 15.859 8.826 13.813 1.00 21.30 H new ATOM 0 HA ALA A 168 16.261 11.319 15.303 1.00 50.13 H new ATOM 0 HB1 ALA A 168 16.198 12.328 13.042 1.00 70.22 H new ATOM 0 HB2 ALA A 168 17.402 11.022 13.148 1.00 70.22 H new ATOM 0 HB3 ALA A 168 15.840 10.729 12.347 1.00 70.22 H new ATOM 2714 N LEU A 169 13.404 10.402 13.913 1.00 33.33 N ATOM 2715 CA LEU A 169 11.955 10.649 13.875 1.00 63.15 C ATOM 2716 C LEU A 169 11.312 10.506 15.263 1.00 11.23 C ATOM 2717 O LEU A 169 10.672 11.430 15.767 1.00 73.30 O ATOM 2718 CB LEU A 169 11.287 9.667 12.900 1.00 24.43 C ATOM 2719 CG LEU A 169 11.821 9.705 11.458 1.00 42.41 C ATOM 2720 CD1 LEU A 169 11.151 8.635 10.603 1.00 75.22 C ATOM 2721 CD2 LEU A 169 11.623 11.085 10.843 1.00 71.42 C ATOM 0 H LEU A 169 13.696 9.572 13.397 1.00 33.33 H new ATOM 0 HA LEU A 169 11.804 11.675 13.539 1.00 63.15 H new ATOM 0 HB2 LEU A 169 11.409 8.656 13.288 1.00 24.43 H new ATOM 0 HB3 LEU A 169 10.217 9.873 12.879 1.00 24.43 H new ATOM 0 HG LEU A 169 12.890 9.496 11.489 1.00 42.41 H new ATOM 0 HD11 LEU A 169 11.545 8.681 9.588 1.00 75.22 H new ATOM 0 HD12 LEU A 169 11.354 7.651 11.026 1.00 75.22 H new ATOM 0 HD13 LEU A 169 10.075 8.806 10.583 1.00 75.22 H new ATOM 0 HD21 LEU A 169 12.008 11.088 9.823 1.00 71.42 H new ATOM 0 HD22 LEU A 169 10.561 11.329 10.830 1.00 71.42 H new ATOM 0 HD23 LEU A 169 12.158 11.827 11.435 1.00 71.42 H new ATOM 2733 N PHE A 170 11.480 9.337 15.872 1.00 35.43 N ATOM 2734 CA PHE A 170 10.890 9.050 17.180 1.00 14.01 C ATOM 2735 C PHE A 170 11.965 9.093 18.270 1.00 3.24 C ATOM 2736 O PHE A 170 12.734 8.148 18.434 1.00 31.52 O ATOM 2737 CB PHE A 170 10.211 7.673 17.160 1.00 2.32 C ATOM 2738 CG PHE A 170 9.338 7.454 15.948 1.00 75.43 C ATOM 2739 CD1 PHE A 170 8.093 8.058 15.853 1.00 31.12 C ATOM 2740 CD2 PHE A 170 9.774 6.656 14.898 1.00 61.33 C ATOM 2741 CE1 PHE A 170 7.300 7.868 14.739 1.00 52.54 C ATOM 2742 CE2 PHE A 170 8.982 6.466 13.782 1.00 52.41 C ATOM 2743 CZ PHE A 170 7.746 7.072 13.701 1.00 0.21 C ATOM 0 H PHE A 170 12.023 8.567 15.480 1.00 35.43 H new ATOM 0 HA PHE A 170 10.141 9.810 17.401 1.00 14.01 H new ATOM 0 HB2 PHE A 170 10.977 6.898 17.192 1.00 2.32 H new ATOM 0 HB3 PHE A 170 9.606 7.561 18.060 1.00 2.32 H new ATOM 0 HD1 PHE A 170 7.740 8.684 16.659 1.00 31.12 H new ATOM 0 HD2 PHE A 170 10.742 6.179 14.955 1.00 61.33 H new ATOM 0 HE1 PHE A 170 6.331 8.341 14.679 1.00 52.54 H new ATOM 0 HE2 PHE A 170 9.331 5.842 12.972 1.00 52.41 H new ATOM 0 HZ PHE A 170 7.128 6.925 12.828 1.00 0.21 H new ATOM 2753 N ARG A 171 12.034 10.195 19.002 1.00 75.30 N ATOM 2754 CA ARG A 171 13.080 10.372 20.011 1.00 4.23 C ATOM 2755 C ARG A 171 12.707 9.686 21.338 1.00 1.24 C ATOM 2756 O ARG A 171 11.660 9.978 21.921 1.00 32.11 O ATOM 2757 CB ARG A 171 13.336 11.866 20.245 1.00 44.04 C ATOM 2758 CG ARG A 171 14.682 12.161 20.899 1.00 62.15 C ATOM 2759 CD ARG A 171 15.835 11.759 19.983 1.00 62.41 C ATOM 2760 NE ARG A 171 17.139 12.047 20.568 1.00 4.21 N ATOM 2761 CZ ARG A 171 18.271 11.863 19.945 1.00 11.25 C ATOM 2762 NH1 ARG A 171 18.287 11.435 18.719 1.00 61.24 N ATOM 2763 NH2 ARG A 171 19.387 12.112 20.548 1.00 14.34 N ATOM 0 H ARG A 171 11.385 10.978 18.921 1.00 75.30 H new ATOM 0 HA ARG A 171 13.990 9.903 19.636 1.00 4.23 H new ATOM 0 HB2 ARG A 171 13.283 12.389 19.290 1.00 44.04 H new ATOM 0 HB3 ARG A 171 12.541 12.268 20.873 1.00 44.04 H new ATOM 0 HG2 ARG A 171 14.752 13.223 21.133 1.00 62.15 H new ATOM 0 HG3 ARG A 171 14.758 11.621 21.843 1.00 62.15 H new ATOM 0 HD2 ARG A 171 15.766 10.694 19.764 1.00 62.41 H new ATOM 0 HD3 ARG A 171 15.742 12.287 19.034 1.00 62.41 H new ATOM 0 HE ARG A 171 17.168 12.414 21.519 1.00 4.21 H new ATOM 0 HH11 ARG A 171 17.410 11.240 18.235 1.00 61.24 H new ATOM 0 HH12 ARG A 171 19.176 11.294 18.240 1.00 61.24 H new ATOM 0 HH21 ARG A 171 19.382 12.452 21.510 1.00 14.34 H new ATOM 0 HH22 ARG A 171 20.272 11.969 20.062 1.00 14.34 H new ATOM 2777 N PRO A 172 13.564 8.769 21.844 1.00 11.12 N ATOM 2778 CA PRO A 172 13.322 8.089 23.127 1.00 11.01 C ATOM 2779 C PRO A 172 13.551 9.016 24.333 1.00 62.34 C ATOM 2780 O PRO A 172 12.956 8.829 25.396 1.00 21.21 O ATOM 2781 CB PRO A 172 14.333 6.934 23.113 1.00 71.31 C ATOM 2782 CG PRO A 172 15.444 7.402 22.230 1.00 21.10 C ATOM 2783 CD PRO A 172 14.822 8.322 21.205 1.00 62.42 C ATOM 0 HA PRO A 172 12.289 7.757 23.230 1.00 11.01 H new ATOM 0 HB2 PRO A 172 14.694 6.713 24.118 1.00 71.31 H new ATOM 0 HB3 PRO A 172 13.882 6.019 22.728 1.00 71.31 H new ATOM 0 HG2 PRO A 172 16.205 7.925 22.809 1.00 21.10 H new ATOM 0 HG3 PRO A 172 15.936 6.558 21.746 1.00 21.10 H new ATOM 0 HD2 PRO A 172 15.475 9.164 20.976 1.00 62.42 H new ATOM 0 HD3 PRO A 172 14.630 7.803 20.266 1.00 62.42 H new ATOM 2791 N GLY A 173 14.423 10.012 24.163 1.00 75.41 N ATOM 2792 CA GLY A 173 14.638 11.017 25.200 1.00 24.25 C ATOM 2793 C GLY A 173 13.546 12.085 25.221 1.00 42.52 C ATOM 2794 O GLY A 173 12.870 12.302 24.214 1.00 53.25 O ATOM 0 H GLY A 173 14.987 10.142 23.323 1.00 75.41 H new ATOM 0 HA2 GLY A 173 14.680 10.527 26.173 1.00 24.25 H new ATOM 0 HA3 GLY A 173 15.605 11.495 25.042 1.00 24.25 H new ATOM 2798 N PRO A 174 13.360 12.793 26.353 1.00 15.40 N ATOM 2799 CA PRO A 174 12.291 13.804 26.500 1.00 3.25 C ATOM 2800 C PRO A 174 12.593 15.134 25.774 1.00 33.33 C ATOM 2801 O PRO A 174 12.119 16.197 26.184 1.00 31.11 O ATOM 2802 CB PRO A 174 12.240 14.015 28.019 1.00 74.12 C ATOM 2803 CG PRO A 174 13.637 13.760 28.474 1.00 3.20 C ATOM 2804 CD PRO A 174 14.169 12.663 27.586 1.00 13.42 C ATOM 0 HA PRO A 174 11.354 13.471 26.055 1.00 3.25 H new ATOM 0 HB2 PRO A 174 11.918 15.026 28.270 1.00 74.12 H new ATOM 0 HB3 PRO A 174 11.536 13.330 28.492 1.00 74.12 H new ATOM 0 HG2 PRO A 174 14.246 14.660 28.389 1.00 3.20 H new ATOM 0 HG3 PRO A 174 13.658 13.459 29.521 1.00 3.20 H new ATOM 0 HD2 PRO A 174 15.232 12.791 27.384 1.00 13.42 H new ATOM 0 HD3 PRO A 174 14.047 11.681 28.044 1.00 13.42 H new ATOM 2812 N GLY A 175 13.359 15.067 24.686 1.00 70.42 N ATOM 2813 CA GLY A 175 13.706 16.266 23.928 1.00 13.42 C ATOM 2814 C GLY A 175 12.569 16.761 23.034 1.00 51.14 C ATOM 2815 O GLY A 175 12.640 16.656 21.805 1.00 51.42 O ATOM 0 H GLY A 175 13.748 14.201 24.312 1.00 70.42 H new ATOM 0 HA2 GLY A 175 13.986 17.059 24.622 1.00 13.42 H new ATOM 0 HA3 GLY A 175 14.581 16.058 23.312 1.00 13.42 H new ATOM 2819 N SER A 176 11.518 17.293 23.655 1.00 22.30 N ATOM 2820 CA SER A 176 10.357 17.838 22.925 1.00 1.53 C ATOM 2821 C SER A 176 10.575 19.312 22.546 1.00 5.04 C ATOM 2822 O SER A 176 10.885 19.594 21.368 1.00 37.23 O ATOM 2823 CB SER A 176 9.083 17.708 23.772 1.00 41.45 C ATOM 2824 OG SER A 176 7.980 18.356 23.153 1.00 44.05 O ATOM 2825 OXT SER A 176 10.448 20.186 23.436 1.00 37.23 O ATOM 0 H SER A 176 11.439 17.362 24.670 1.00 22.30 H new ATOM 0 HA SER A 176 10.244 17.259 22.008 1.00 1.53 H new ATOM 0 HB2 SER A 176 8.850 16.654 23.922 1.00 41.45 H new ATOM 0 HB3 SER A 176 9.254 18.140 24.758 1.00 41.45 H new ATOM 0 HG SER A 176 7.184 18.255 23.715 1.00 44.05 H new TER 2831 SER A 176