USER MOD reduce.3.24.130724 H: found=0, std=0, add=1590, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1589 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 CYS SG : rot 21:sc= 0.867 USER MOD Set 1.2: B 98 ASN : amide:sc= 0.812 X(o=1.7,f=2) USER MOD Set 2.1: A 19 GLN : amide:sc= -0.264 K(o=-1.8,f=-3.8) USER MOD Set 2.2: A 101 TYR OH : rot 5:sc= -1.55! USER MOD Set 3.1: A 38 LYS NZ :NH3+ 142:sc= -0.93! (180deg=-1.89!) USER MOD Set 3.2: A 72 SER OG : rot -84:sc= 0.914 USER MOD Single : A 1 MET CE :methyl -140:sc= -2.49 (180deg=-5.25!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.0721 X(o=0.072,f=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 ASN : amide:sc= -0.413 X(o=-0.41,f=0) USER MOD Single : A 18 MET CE :methyl -116:sc= -3.62 (180deg=-6.54!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 5:sc= -0.384! USER MOD Single : A 37 THR OG1 : rot -127:sc= -1.25 USER MOD Single : A 41 HIS : no HD1:sc= -9.94! C(o=-9.9!,f=-18!) USER MOD Single : A 45 LYS NZ :NH3+ 133:sc= -2.19 (180deg=-5.51!) USER MOD Single : A 48 MET CE :methyl 143:sc= -5.24! (180deg=-11.1!) USER MOD Single : A 50 LYS NZ :NH3+ -152:sc= -0.101 (180deg=-0.651) USER MOD Single : A 53 ASN : amide:sc= -0.17 K(o=-0.17,f=-2.2!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 55 LYS NZ :NH3+ -153:sc= -0.0756 (180deg=-0.309) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 150:sc= -2.47 USER MOD Single : A 60 GLN : amide:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.0324 K(o=-0.032,f=-1.4) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -2.24 K(o=-2.2,f=-5.4!) USER MOD Single : A 76 SER OG : rot -93:sc= 0.623 USER MOD Single : A 77 THR OG1 : rot 105:sc= 0.0163 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0948 K(o=-0.095,f=-1) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 CYS SG : rot 101:sc= 0.174 USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 97 THR OG1 : rot -42:sc= 0.869 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 36 HIS : no HD1:sc= -9.59! C(o=-9.6!,f=-19!) USER MOD Single : B 37 SER OG : rot 160:sc= -1.59! USER MOD Single : B 46 LYS NZ :NH3+ 161:sc= -0.156 (180deg=-0.411) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot -58:sc= 0.632 USER MOD Single : B 55 ASN : amide:sc= -1.56 K(o=-1.6,f=-4!) USER MOD Single : B 68 HIS : no HE2:sc= -3.26 K(o=-3.3,f=-7.1!) USER MOD Single : B 72 SER OG : rot -102:sc= 0.153 USER MOD Single : B 73 ASN : amide:sc= -0.297 X(o=-0.3,f=0) USER MOD Single : B 76 SER OG : rot 73:sc= 1.14 USER MOD Single : B 78 CYS SG : rot 53:sc= -0.173 USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 87 TYR OH : rot 180:sc= 0 USER MOD Single : B 88 THR OG1 : rot 126:sc= 1.05 USER MOD Single : B 93 GLN : amide:sc= -0.229 K(o=-0.23,f=-1.3!) USER MOD Single : B 96 LYS NZ :NH3+ 178:sc= -1.72 (180deg=-1.84) USER MOD Single : B 100 GLN : amide:sc= -4.52! K(o=-4.5!,f=-1.2) USER MOD Single : B 103 SER OG : rot 170:sc= -0.0941 USER MOD Single : B 104 MET CE :methyl 170:sc= -4.19 (180deg=-4.33) USER MOD Single : B 106 GLN : amide:sc= -0.348 X(o=-0.35,f=-0.094) USER MOD Single : B 108 CYS SG : rot 170:sc= -5.07! USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 110 LYS NZ :NH3+ 172:sc= -1.25! (180deg=-1.31!) USER MOD Single : B 113 ASN : amide:sc= -0.143 K(o=-0.14,f=-2.4!) USER MOD Single : B 116 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-0.23) USER MOD Single : B 118 ASN : amide:sc= -1.07 K(o=-1.1,f=-3.3!) USER MOD Single : B 121 SER OG : rot 29:sc= 0.0603 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.584 30.720 -11.890 1.00 0.00 N ATOM 2 CA MET A 1 -2.689 29.563 -10.963 1.00 0.00 C ATOM 3 C MET A 1 -1.936 29.828 -9.662 1.00 0.00 C ATOM 4 O MET A 1 -0.707 29.878 -9.645 1.00 0.00 O ATOM 5 CB MET A 1 -2.119 28.326 -11.659 1.00 0.00 C ATOM 6 CG MET A 1 -2.689 27.017 -11.139 1.00 0.00 C ATOM 7 SD MET A 1 -1.730 25.584 -11.664 1.00 0.00 S ATOM 8 CE MET A 1 -2.882 24.259 -11.314 1.00 0.00 C ATOM 0 H1 MET A 1 -3.105 30.512 -12.766 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.989 31.565 -11.438 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.584 30.894 -12.116 1.00 0.00 H new ATOM 0 HA MET A 1 -3.737 29.403 -10.710 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.316 28.399 -12.729 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.036 28.316 -11.534 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.723 27.047 -10.050 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.716 26.909 -11.487 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.343 23.409 -10.897 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.626 24.604 -10.596 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.380 23.957 -12.235 1.00 0.00 H new ATOM 20 N ASP A 2 -2.684 29.996 -8.576 1.00 0.00 N ATOM 21 CA ASP A 2 -2.086 30.256 -7.272 1.00 0.00 C ATOM 22 C ASP A 2 -2.102 29.000 -6.406 1.00 0.00 C ATOM 23 O ASP A 2 -2.295 29.072 -5.192 1.00 0.00 O ATOM 24 CB ASP A 2 -2.833 31.387 -6.562 1.00 0.00 C ATOM 25 CG ASP A 2 -2.831 32.674 -7.364 1.00 0.00 C ATOM 26 OD1 ASP A 2 -1.830 33.416 -7.293 1.00 0.00 O ATOM 27 OD2 ASP A 2 -3.831 32.938 -8.063 1.00 0.00 O ATOM 0 H ASP A 2 -3.703 29.957 -8.573 1.00 0.00 H new ATOM 0 HA ASP A 2 -1.050 30.555 -7.428 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -3.862 31.079 -6.377 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -2.375 31.567 -5.590 1.00 0.00 H new ATOM 32 N LEU A 3 -1.896 27.849 -7.039 1.00 0.00 N ATOM 33 CA LEU A 3 -1.886 26.577 -6.327 1.00 0.00 C ATOM 34 C LEU A 3 -0.785 26.552 -5.271 1.00 0.00 C ATOM 35 O LEU A 3 0.327 26.090 -5.530 1.00 0.00 O ATOM 36 CB LEU A 3 -1.693 25.420 -7.309 1.00 0.00 C ATOM 37 CG LEU A 3 -1.615 24.033 -6.670 1.00 0.00 C ATOM 38 CD1 LEU A 3 -2.932 23.684 -5.993 1.00 0.00 C ATOM 39 CD2 LEU A 3 -1.256 22.986 -7.713 1.00 0.00 C ATOM 0 H LEU A 3 -1.734 27.772 -8.043 1.00 0.00 H new ATOM 0 HA LEU A 3 -2.847 26.463 -5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -2.517 25.428 -8.023 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -0.778 25.594 -7.876 1.00 0.00 H new ATOM 0 HG LEU A 3 -0.832 24.045 -5.912 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -2.859 22.694 -5.544 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.149 24.419 -5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -3.733 23.689 -6.732 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -1.205 22.005 -7.241 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -2.017 22.974 -8.493 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -0.289 23.228 -8.153 1.00 0.00 H new ATOM 51 N SER A 4 -1.101 27.053 -4.082 1.00 0.00 N ATOM 52 CA SER A 4 -0.139 27.088 -2.988 1.00 0.00 C ATOM 53 C SER A 4 -0.786 27.617 -1.711 1.00 0.00 C ATOM 54 O SER A 4 -0.159 28.343 -0.940 1.00 0.00 O ATOM 55 CB SER A 4 1.062 27.959 -3.364 1.00 0.00 C ATOM 56 OG SER A 4 2.236 27.522 -2.702 1.00 0.00 O ATOM 0 H SER A 4 -2.016 27.440 -3.852 1.00 0.00 H new ATOM 0 HA SER A 4 0.203 26.069 -2.806 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.215 27.926 -4.443 1.00 0.00 H new ATOM 0 HB3 SER A 4 0.858 28.997 -3.102 1.00 0.00 H new ATOM 0 HG SER A 4 2.989 28.094 -2.960 1.00 0.00 H new ATOM 62 N ALA A 5 -2.044 27.248 -1.495 1.00 0.00 N ATOM 63 CA ALA A 5 -2.776 27.686 -0.313 1.00 0.00 C ATOM 64 C ALA A 5 -4.146 27.021 -0.238 1.00 0.00 C ATOM 65 O ALA A 5 -4.592 26.615 0.835 1.00 0.00 O ATOM 66 CB ALA A 5 -2.921 29.199 -0.313 1.00 0.00 C ATOM 0 H ALA A 5 -2.578 26.647 -2.123 1.00 0.00 H new ATOM 0 HA ALA A 5 -2.208 27.387 0.568 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -3.470 29.512 0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -1.933 29.659 -0.310 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -3.465 29.512 -1.204 1.00 0.00 H new ATOM 72 N LEU A 6 -4.809 26.912 -1.385 1.00 0.00 N ATOM 73 CA LEU A 6 -6.129 26.296 -1.450 1.00 0.00 C ATOM 74 C LEU A 6 -6.046 24.801 -1.154 1.00 0.00 C ATOM 75 O LEU A 6 -6.154 23.972 -2.057 1.00 0.00 O ATOM 76 CB LEU A 6 -6.755 26.523 -2.827 1.00 0.00 C ATOM 77 CG LEU A 6 -5.924 26.016 -4.008 1.00 0.00 C ATOM 78 CD1 LEU A 6 -6.822 25.396 -5.068 1.00 0.00 C ATOM 79 CD2 LEU A 6 -5.097 27.146 -4.602 1.00 0.00 C ATOM 0 H LEU A 6 -4.453 27.242 -2.282 1.00 0.00 H new ATOM 0 HA LEU A 6 -6.759 26.763 -0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.729 26.034 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -6.931 27.591 -2.958 1.00 0.00 H new ATOM 0 HG LEU A 6 -5.243 25.246 -3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -6.212 25.042 -5.899 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -7.369 24.558 -4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.528 26.144 -5.429 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.513 26.767 -5.440 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -5.760 27.938 -4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -4.425 27.544 -3.842 1.00 0.00 H new ATOM 91 N ARG A 7 -5.854 24.464 0.118 1.00 0.00 N ATOM 92 CA ARG A 7 -5.758 23.070 0.532 1.00 0.00 C ATOM 93 C ARG A 7 -4.595 22.373 -0.167 1.00 0.00 C ATOM 94 O ARG A 7 -4.794 21.609 -1.111 1.00 0.00 O ATOM 95 CB ARG A 7 -7.066 22.335 0.231 1.00 0.00 C ATOM 96 CG ARG A 7 -7.326 21.156 1.155 1.00 0.00 C ATOM 97 CD ARG A 7 -8.813 20.975 1.420 1.00 0.00 C ATOM 98 NE ARG A 7 -9.329 21.978 2.348 1.00 0.00 N ATOM 99 CZ ARG A 7 -9.170 21.919 3.668 1.00 0.00 C ATOM 100 NH1 ARG A 7 -8.510 20.907 4.219 1.00 0.00 N ATOM 101 NH2 ARG A 7 -9.671 22.873 4.440 1.00 0.00 N ATOM 0 H ARG A 7 -5.762 25.137 0.879 1.00 0.00 H new ATOM 0 HA ARG A 7 -5.577 23.048 1.607 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -7.895 23.038 0.310 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -7.046 21.981 -0.800 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -6.921 20.247 0.710 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -6.803 21.309 2.099 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -9.359 21.037 0.479 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -8.990 19.979 1.827 1.00 0.00 H new ATOM 0 HE ARG A 7 -9.842 22.771 1.961 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -8.122 20.170 3.630 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -8.391 20.867 5.231 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -10.179 23.653 4.022 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -9.549 22.827 5.452 1.00 0.00 H new ATOM 115 N VAL A 8 -3.382 22.643 0.303 1.00 0.00 N ATOM 116 CA VAL A 8 -2.186 22.043 -0.277 1.00 0.00 C ATOM 117 C VAL A 8 -1.398 21.265 0.771 1.00 0.00 C ATOM 118 O VAL A 8 -0.918 20.162 0.511 1.00 0.00 O ATOM 119 CB VAL A 8 -1.270 23.109 -0.905 1.00 0.00 C ATOM 120 CG1 VAL A 8 -0.133 22.451 -1.673 1.00 0.00 C ATOM 121 CG2 VAL A 8 -2.069 24.033 -1.810 1.00 0.00 C ATOM 0 H VAL A 8 -3.201 23.274 1.084 1.00 0.00 H new ATOM 0 HA VAL A 8 -2.522 21.359 -1.057 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.838 23.708 -0.103 1.00 0.00 H new ATOM 0 HG11 VAL A 8 0.504 23.220 -2.110 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.456 21.835 -0.994 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.543 21.826 -2.466 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.405 24.780 -2.245 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.532 23.451 -2.607 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.844 24.532 -1.228 1.00 0.00 H new ATOM 131 N GLU A 9 -1.268 21.848 1.959 1.00 0.00 N ATOM 132 CA GLU A 9 -0.538 21.209 3.048 1.00 0.00 C ATOM 133 C GLU A 9 -1.236 19.928 3.493 1.00 0.00 C ATOM 134 O GLU A 9 -0.589 18.977 3.932 1.00 0.00 O ATOM 135 CB GLU A 9 -0.403 22.169 4.232 1.00 0.00 C ATOM 136 CG GLU A 9 -1.735 22.684 4.751 1.00 0.00 C ATOM 137 CD GLU A 9 -2.072 24.065 4.224 1.00 0.00 C ATOM 138 OE1 GLU A 9 -2.709 24.152 3.154 1.00 0.00 O ATOM 139 OE2 GLU A 9 -1.699 25.059 4.882 1.00 0.00 O ATOM 0 H GLU A 9 -1.658 22.761 2.192 1.00 0.00 H new ATOM 0 HA GLU A 9 0.456 20.951 2.684 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.122 21.662 5.042 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.214 23.017 3.933 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.525 21.988 4.467 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.710 22.711 5.840 1.00 0.00 H new ATOM 146 N GLU A 10 -2.560 19.910 3.377 1.00 0.00 N ATOM 147 CA GLU A 10 -3.345 18.745 3.768 1.00 0.00 C ATOM 148 C GLU A 10 -3.018 17.547 2.883 1.00 0.00 C ATOM 149 O GLU A 10 -2.776 16.446 3.376 1.00 0.00 O ATOM 150 CB GLU A 10 -4.840 19.062 3.687 1.00 0.00 C ATOM 151 CG GLU A 10 -5.409 19.647 4.970 1.00 0.00 C ATOM 152 CD GLU A 10 -5.616 18.599 6.046 1.00 0.00 C ATOM 153 OE1 GLU A 10 -4.934 17.553 5.996 1.00 0.00 O ATOM 154 OE2 GLU A 10 -6.461 18.823 6.939 1.00 0.00 O ATOM 0 H GLU A 10 -3.111 20.688 3.016 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.089 18.493 4.797 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.010 19.764 2.871 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.383 18.150 3.441 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.735 20.418 5.344 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.360 20.133 4.753 1.00 0.00 H new ATOM 161 N VAL A 11 -3.012 17.770 1.573 1.00 0.00 N ATOM 162 CA VAL A 11 -2.715 16.709 0.618 1.00 0.00 C ATOM 163 C VAL A 11 -1.323 16.134 0.855 1.00 0.00 C ATOM 164 O VAL A 11 -1.086 14.946 0.633 1.00 0.00 O ATOM 165 CB VAL A 11 -2.809 17.215 -0.833 1.00 0.00 C ATOM 166 CG1 VAL A 11 -2.692 16.056 -1.811 1.00 0.00 C ATOM 167 CG2 VAL A 11 -4.107 17.977 -1.050 1.00 0.00 C ATOM 0 H VAL A 11 -3.209 18.676 1.148 1.00 0.00 H new ATOM 0 HA VAL A 11 -3.460 15.928 0.770 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.980 17.898 -1.015 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -2.761 16.433 -2.832 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.732 15.558 -1.672 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -3.499 15.346 -1.631 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -4.155 18.327 -2.081 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -4.953 17.319 -0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.144 18.832 -0.375 1.00 0.00 H new ATOM 177 N GLN A 12 -0.407 16.983 1.308 1.00 0.00 N ATOM 178 CA GLN A 12 0.963 16.557 1.577 1.00 0.00 C ATOM 179 C GLN A 12 0.992 15.455 2.629 1.00 0.00 C ATOM 180 O GLN A 12 1.653 14.431 2.451 1.00 0.00 O ATOM 181 CB GLN A 12 1.806 17.747 2.042 1.00 0.00 C ATOM 182 CG GLN A 12 3.247 17.695 1.563 1.00 0.00 C ATOM 183 CD GLN A 12 4.202 17.216 2.638 1.00 0.00 C ATOM 184 OE1 GLN A 12 4.600 17.980 3.518 1.00 0.00 O ATOM 185 NE2 GLN A 12 4.577 15.944 2.573 1.00 0.00 N ATOM 0 H GLN A 12 -0.587 17.969 1.497 1.00 0.00 H new ATOM 0 HA GLN A 12 1.384 16.162 0.652 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.346 18.669 1.685 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.795 17.786 3.131 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.315 17.033 0.700 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.551 18.687 1.228 1.00 0.00 H new ATOM 0 HE21 GLN A 12 4.223 15.345 1.827 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.219 15.565 3.269 1.00 0.00 H new ATOM 194 N ASN A 13 0.272 15.669 3.725 1.00 0.00 N ATOM 195 CA ASN A 13 0.215 14.693 4.806 1.00 0.00 C ATOM 196 C ASN A 13 -0.356 13.368 4.311 1.00 0.00 C ATOM 197 O ASN A 13 0.011 12.300 4.800 1.00 0.00 O ATOM 198 CB ASN A 13 -0.633 15.228 5.961 1.00 0.00 C ATOM 199 CG ASN A 13 0.198 15.946 7.005 1.00 0.00 C ATOM 200 OD1 ASN A 13 0.170 17.174 7.101 1.00 0.00 O ATOM 201 ND2 ASN A 13 0.945 15.183 7.794 1.00 0.00 N ATOM 0 H ASN A 13 -0.281 16.511 3.888 1.00 0.00 H new ATOM 0 HA ASN A 13 1.231 14.521 5.161 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.387 15.911 5.569 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.165 14.401 6.431 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.526 15.610 8.515 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.937 14.170 7.679 1.00 0.00 H new ATOM 208 N VAL A 14 -1.256 13.446 3.336 1.00 0.00 N ATOM 209 CA VAL A 14 -1.878 12.255 2.771 1.00 0.00 C ATOM 210 C VAL A 14 -0.882 11.458 1.937 1.00 0.00 C ATOM 211 O VAL A 14 -0.626 10.286 2.209 1.00 0.00 O ATOM 212 CB VAL A 14 -3.093 12.618 1.896 1.00 0.00 C ATOM 213 CG1 VAL A 14 -3.819 11.363 1.437 1.00 0.00 C ATOM 214 CG2 VAL A 14 -4.037 13.541 2.651 1.00 0.00 C ATOM 0 H VAL A 14 -1.571 14.323 2.921 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.214 11.645 3.609 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.734 13.144 1.012 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.674 11.642 0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -3.139 10.742 0.854 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.166 10.805 2.307 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.889 13.787 2.018 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.388 13.042 3.554 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.511 14.456 2.923 1.00 0.00 H new ATOM 224 N ILE A 15 -0.321 12.103 0.918 1.00 0.00 N ATOM 225 CA ILE A 15 0.649 11.454 0.045 1.00 0.00 C ATOM 226 C ILE A 15 1.851 10.952 0.839 1.00 0.00 C ATOM 227 O ILE A 15 2.462 9.942 0.487 1.00 0.00 O ATOM 228 CB ILE A 15 1.137 12.408 -1.063 1.00 0.00 C ATOM 229 CG1 ILE A 15 -0.054 13.020 -1.803 1.00 0.00 C ATOM 230 CG2 ILE A 15 2.048 11.673 -2.035 1.00 0.00 C ATOM 231 CD1 ILE A 15 0.126 14.486 -2.131 1.00 0.00 C ATOM 0 H ILE A 15 -0.522 13.074 0.678 1.00 0.00 H new ATOM 0 HA ILE A 15 0.143 10.606 -0.417 1.00 0.00 H new ATOM 0 HB ILE A 15 1.707 13.214 -0.600 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.220 12.467 -2.728 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.950 12.900 -1.194 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.383 12.361 -2.811 1.00 0.00 H new ATOM 0 HG22 ILE A 15 2.912 11.282 -1.499 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.502 10.848 -2.493 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.757 14.853 -2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.262 15.051 -1.209 1.00 0.00 H new ATOM 0 HD13 ILE A 15 1.003 14.612 -2.766 1.00 0.00 H new ATOM 243 N ASN A 16 2.182 11.661 1.913 1.00 0.00 N ATOM 244 CA ASN A 16 3.308 11.285 2.759 1.00 0.00 C ATOM 245 C ASN A 16 2.986 10.029 3.563 1.00 0.00 C ATOM 246 O ASN A 16 3.774 9.085 3.600 1.00 0.00 O ATOM 247 CB ASN A 16 3.669 12.432 3.705 1.00 0.00 C ATOM 248 CG ASN A 16 5.014 12.229 4.374 1.00 0.00 C ATOM 249 OD1 ASN A 16 5.125 12.277 5.599 1.00 0.00 O ATOM 250 ND2 ASN A 16 6.046 12.000 3.570 1.00 0.00 N ATOM 0 H ASN A 16 1.687 12.499 2.218 1.00 0.00 H new ATOM 0 HA ASN A 16 4.161 11.075 2.114 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.681 13.369 3.148 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.897 12.526 4.469 1.00 0.00 H new ATOM 0 HD21 ASN A 16 6.976 11.855 3.963 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.908 11.969 2.560 1.00 0.00 H new ATOM 257 N ALA A 17 1.819 10.025 4.200 1.00 0.00 N ATOM 258 CA ALA A 17 1.391 8.884 5.000 1.00 0.00 C ATOM 259 C ALA A 17 1.291 7.627 4.141 1.00 0.00 C ATOM 260 O ALA A 17 1.559 6.520 4.609 1.00 0.00 O ATOM 261 CB ALA A 17 0.058 9.180 5.671 1.00 0.00 C ATOM 0 H ALA A 17 1.154 10.798 4.177 1.00 0.00 H new ATOM 0 HA ALA A 17 2.138 8.707 5.773 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.249 8.319 6.265 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.162 10.050 6.319 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.695 9.383 4.910 1.00 0.00 H new ATOM 267 N MET A 18 0.905 7.809 2.883 1.00 0.00 N ATOM 268 CA MET A 18 0.769 6.692 1.956 1.00 0.00 C ATOM 269 C MET A 18 2.115 6.010 1.729 1.00 0.00 C ATOM 270 O MET A 18 2.201 4.782 1.693 1.00 0.00 O ATOM 271 CB MET A 18 0.197 7.176 0.622 1.00 0.00 C ATOM 272 CG MET A 18 -0.823 6.227 0.016 1.00 0.00 C ATOM 273 SD MET A 18 -1.851 7.019 -1.236 1.00 0.00 S ATOM 274 CE MET A 18 -2.742 8.210 -0.238 1.00 0.00 C ATOM 0 H MET A 18 0.681 8.720 2.482 1.00 0.00 H new ATOM 0 HA MET A 18 0.083 5.967 2.395 1.00 0.00 H new ATOM 0 HB2 MET A 18 -0.268 8.151 0.768 1.00 0.00 H new ATOM 0 HB3 MET A 18 1.015 7.316 -0.085 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.304 5.378 -0.429 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.460 5.832 0.807 1.00 0.00 H new ATOM 0 HE1 MET A 18 -3.806 7.972 -0.251 1.00 0.00 H new ATOM 0 HE2 MET A 18 -2.374 8.173 0.787 1.00 0.00 H new ATOM 0 HE3 MET A 18 -2.589 9.211 -0.642 1.00 0.00 H new ATOM 284 N GLN A 19 3.163 6.814 1.579 1.00 0.00 N ATOM 285 CA GLN A 19 4.505 6.287 1.358 1.00 0.00 C ATOM 286 C GLN A 19 4.937 5.403 2.522 1.00 0.00 C ATOM 287 O GLN A 19 5.552 4.355 2.324 1.00 0.00 O ATOM 288 CB GLN A 19 5.503 7.431 1.171 1.00 0.00 C ATOM 289 CG GLN A 19 6.694 7.063 0.302 1.00 0.00 C ATOM 290 CD GLN A 19 7.880 7.983 0.518 1.00 0.00 C ATOM 291 OE1 GLN A 19 7.780 8.989 1.219 1.00 0.00 O ATOM 292 NE2 GLN A 19 9.013 7.641 -0.086 1.00 0.00 N ATOM 0 H GLN A 19 3.109 7.832 1.606 1.00 0.00 H new ATOM 0 HA GLN A 19 4.487 5.682 0.451 1.00 0.00 H new ATOM 0 HB2 GLN A 19 4.988 8.282 0.726 1.00 0.00 H new ATOM 0 HB3 GLN A 19 5.863 7.752 2.149 1.00 0.00 H new ATOM 0 HG2 GLN A 19 6.992 6.036 0.516 1.00 0.00 H new ATOM 0 HG3 GLN A 19 6.398 7.097 -0.747 1.00 0.00 H new ATOM 0 HE21 GLN A 19 9.051 6.798 -0.658 1.00 0.00 H new ATOM 0 HE22 GLN A 19 9.844 8.222 0.023 1.00 0.00 H new ATOM 301 N LYS A 20 4.607 5.829 3.737 1.00 0.00 N ATOM 302 CA LYS A 20 4.958 5.072 4.933 1.00 0.00 C ATOM 303 C LYS A 20 4.337 3.680 4.890 1.00 0.00 C ATOM 304 O LYS A 20 4.912 2.715 5.394 1.00 0.00 O ATOM 305 CB LYS A 20 4.491 5.813 6.189 1.00 0.00 C ATOM 306 CG LYS A 20 5.462 6.884 6.657 1.00 0.00 C ATOM 307 CD LYS A 20 5.067 7.436 8.019 1.00 0.00 C ATOM 308 CE LYS A 20 6.277 7.943 8.786 1.00 0.00 C ATOM 309 NZ LYS A 20 6.846 6.898 9.681 1.00 0.00 N ATOM 0 H LYS A 20 4.097 6.694 3.919 1.00 0.00 H new ATOM 0 HA LYS A 20 6.043 4.969 4.965 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.523 6.273 5.991 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.343 5.092 6.993 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.468 6.467 6.710 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.491 7.695 5.929 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.350 8.247 7.890 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.568 6.658 8.597 1.00 0.00 H new ATOM 0 HE2 LYS A 20 7.041 8.273 8.082 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.993 8.813 9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.669 7.284 10.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.126 6.601 10.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 7.141 6.078 9.113 1.00 0.00 H new ATOM 323 N ILE A 21 3.161 3.585 4.278 1.00 0.00 N ATOM 324 CA ILE A 21 2.459 2.314 4.159 1.00 0.00 C ATOM 325 C ILE A 21 3.215 1.361 3.240 1.00 0.00 C ATOM 326 O ILE A 21 3.184 0.144 3.426 1.00 0.00 O ATOM 327 CB ILE A 21 1.030 2.516 3.620 1.00 0.00 C ATOM 328 CG1 ILE A 21 0.283 3.540 4.475 1.00 0.00 C ATOM 329 CG2 ILE A 21 0.275 1.195 3.589 1.00 0.00 C ATOM 330 CD1 ILE A 21 -0.950 4.100 3.805 1.00 0.00 C ATOM 0 H ILE A 21 2.674 4.376 3.856 1.00 0.00 H new ATOM 0 HA ILE A 21 2.402 1.880 5.157 1.00 0.00 H new ATOM 0 HB ILE A 21 1.096 2.894 2.600 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.005 3.074 5.417 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.959 4.360 4.719 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.732 1.360 3.205 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.799 0.492 2.942 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.216 0.786 4.598 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.430 4.820 4.469 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.666 4.596 2.877 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.645 3.289 3.586 1.00 0.00 H new ATOM 342 N LEU A 22 3.896 1.924 2.248 1.00 0.00 N ATOM 343 CA LEU A 22 4.666 1.130 1.299 1.00 0.00 C ATOM 344 C LEU A 22 6.160 1.292 1.553 1.00 0.00 C ATOM 345 O LEU A 22 6.969 1.210 0.628 1.00 0.00 O ATOM 346 CB LEU A 22 4.333 1.544 -0.138 1.00 0.00 C ATOM 347 CG LEU A 22 3.080 0.897 -0.735 1.00 0.00 C ATOM 348 CD1 LEU A 22 3.105 -0.611 -0.535 1.00 0.00 C ATOM 349 CD2 LEU A 22 1.824 1.498 -0.122 1.00 0.00 C ATOM 0 H LEU A 22 3.930 2.930 2.080 1.00 0.00 H new ATOM 0 HA LEU A 22 4.399 0.082 1.436 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.211 2.627 -0.167 1.00 0.00 H new ATOM 0 HB3 LEU A 22 5.184 1.302 -0.774 1.00 0.00 H new ATOM 0 HG LEU A 22 3.069 1.098 -1.806 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.206 -1.050 -0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.984 -1.029 -1.026 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.143 -0.836 0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.944 1.026 -0.559 1.00 0.00 H new ATOM 0 HD22 LEU A 22 1.829 1.331 0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 22 1.798 2.569 -0.323 1.00 0.00 H new ATOM 361 N GLU A 23 6.519 1.529 2.810 1.00 0.00 N ATOM 362 CA GLU A 23 7.916 1.709 3.186 1.00 0.00 C ATOM 363 C GLU A 23 8.566 0.373 3.536 1.00 0.00 C ATOM 364 O GLU A 23 8.020 -0.691 3.245 1.00 0.00 O ATOM 365 CB GLU A 23 8.027 2.675 4.367 1.00 0.00 C ATOM 366 CG GLU A 23 9.131 3.707 4.205 1.00 0.00 C ATOM 367 CD GLU A 23 8.831 5.002 4.936 1.00 0.00 C ATOM 368 OE1 GLU A 23 8.713 4.967 6.179 1.00 0.00 O ATOM 369 OE2 GLU A 23 8.715 6.049 4.266 1.00 0.00 O ATOM 0 H GLU A 23 5.861 1.601 3.586 1.00 0.00 H new ATOM 0 HA GLU A 23 8.445 2.131 2.331 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.075 3.190 4.495 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.206 2.104 5.278 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.068 3.293 4.577 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.274 3.917 3.145 1.00 0.00 H new ATOM 376 N CYS A 24 9.739 0.441 4.157 1.00 0.00 N ATOM 377 CA CYS A 24 10.475 -0.756 4.544 1.00 0.00 C ATOM 378 C CYS A 24 10.539 -0.890 6.065 1.00 0.00 C ATOM 379 O CYS A 24 10.721 0.100 6.773 1.00 0.00 O ATOM 380 CB CYS A 24 11.882 -0.696 3.962 1.00 0.00 C ATOM 381 SG CYS A 24 12.786 -2.255 4.023 1.00 0.00 S ATOM 0 H CYS A 24 10.201 1.316 4.404 1.00 0.00 H new ATOM 0 HA CYS A 24 9.955 -1.630 4.151 1.00 0.00 H new ATOM 0 HB2 CYS A 24 11.818 -0.368 2.924 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.452 0.061 4.501 1.00 0.00 H new ATOM 386 N PRO A 25 10.366 -2.116 6.593 1.00 0.00 N ATOM 387 CA PRO A 25 10.381 -2.369 8.030 1.00 0.00 C ATOM 388 C PRO A 25 11.750 -2.772 8.578 1.00 0.00 C ATOM 389 O PRO A 25 11.841 -3.295 9.689 1.00 0.00 O ATOM 390 CB PRO A 25 9.407 -3.536 8.145 1.00 0.00 C ATOM 391 CG PRO A 25 9.613 -4.323 6.890 1.00 0.00 C ATOM 392 CD PRO A 25 10.110 -3.355 5.838 1.00 0.00 C ATOM 0 HA PRO A 25 10.125 -1.478 8.603 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.613 -4.139 9.029 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.378 -3.187 8.230 1.00 0.00 H new ATOM 0 HG2 PRO A 25 10.336 -5.123 7.051 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.682 -4.793 6.573 1.00 0.00 H new ATOM 0 HD2 PRO A 25 11.014 -3.722 5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 25 9.368 -3.200 5.055 1.00 0.00 H new ATOM 400 N ILE A 26 12.817 -2.538 7.814 1.00 0.00 N ATOM 401 CA ILE A 26 14.155 -2.901 8.279 1.00 0.00 C ATOM 402 C ILE A 26 15.220 -1.886 7.861 1.00 0.00 C ATOM 403 O ILE A 26 16.127 -1.584 8.635 1.00 0.00 O ATOM 404 CB ILE A 26 14.567 -4.308 7.791 1.00 0.00 C ATOM 405 CG1 ILE A 26 14.713 -4.336 6.269 1.00 0.00 C ATOM 406 CG2 ILE A 26 13.550 -5.342 8.248 1.00 0.00 C ATOM 407 CD1 ILE A 26 16.149 -4.252 5.800 1.00 0.00 C ATOM 0 H ILE A 26 12.784 -2.108 6.890 1.00 0.00 H new ATOM 0 HA ILE A 26 14.097 -2.903 9.367 1.00 0.00 H new ATOM 0 HB ILE A 26 15.535 -4.553 8.228 1.00 0.00 H new ATOM 0 HG12 ILE A 26 14.267 -5.254 5.886 1.00 0.00 H new ATOM 0 HG13 ILE A 26 14.150 -3.506 5.842 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.852 -6.329 7.898 1.00 0.00 H new ATOM 0 HG22 ILE A 26 13.497 -5.344 9.337 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.571 -5.095 7.838 1.00 0.00 H new ATOM 0 HD11 ILE A 26 16.178 -4.277 4.711 1.00 0.00 H new ATOM 0 HD12 ILE A 26 16.593 -3.322 6.154 1.00 0.00 H new ATOM 0 HD13 ILE A 26 16.712 -5.097 6.197 1.00 0.00 H new ATOM 419 N CYS A 27 15.119 -1.364 6.642 1.00 0.00 N ATOM 420 CA CYS A 27 16.094 -0.391 6.153 1.00 0.00 C ATOM 421 C CYS A 27 15.414 0.865 5.608 1.00 0.00 C ATOM 422 O CYS A 27 16.067 1.720 5.011 1.00 0.00 O ATOM 423 CB CYS A 27 16.974 -1.017 5.070 1.00 0.00 C ATOM 424 SG CYS A 27 16.056 -1.693 3.667 1.00 0.00 S ATOM 0 H CYS A 27 14.379 -1.595 5.979 1.00 0.00 H new ATOM 0 HA CYS A 27 16.716 -0.097 6.999 1.00 0.00 H new ATOM 0 HB2 CYS A 27 17.671 -0.264 4.704 1.00 0.00 H new ATOM 0 HB3 CYS A 27 17.570 -1.813 5.517 1.00 0.00 H new ATOM 429 N LEU A 28 14.106 0.976 5.821 1.00 0.00 N ATOM 430 CA LEU A 28 13.350 2.134 5.352 1.00 0.00 C ATOM 431 C LEU A 28 13.609 2.406 3.871 1.00 0.00 C ATOM 432 O LEU A 28 13.531 3.548 3.420 1.00 0.00 O ATOM 433 CB LEU A 28 13.710 3.370 6.177 1.00 0.00 C ATOM 434 CG LEU A 28 13.001 3.476 7.528 1.00 0.00 C ATOM 435 CD1 LEU A 28 11.506 3.671 7.332 1.00 0.00 C ATOM 436 CD2 LEU A 28 13.273 2.237 8.369 1.00 0.00 C ATOM 0 H LEU A 28 13.548 0.279 6.315 1.00 0.00 H new ATOM 0 HA LEU A 28 12.290 1.912 5.477 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.787 3.373 6.348 1.00 0.00 H new ATOM 0 HB3 LEU A 28 13.478 4.259 5.591 1.00 0.00 H new ATOM 0 HG LEU A 28 13.393 4.345 8.057 1.00 0.00 H new ATOM 0 HD11 LEU A 28 11.018 3.744 8.304 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.329 4.586 6.767 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.097 2.822 6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.761 2.328 9.327 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.907 1.354 7.845 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.345 2.140 8.538 1.00 0.00 H new ATOM 448 N GLU A 29 13.916 1.352 3.117 1.00 0.00 N ATOM 449 CA GLU A 29 14.182 1.493 1.689 1.00 0.00 C ATOM 450 C GLU A 29 12.930 1.191 0.872 1.00 0.00 C ATOM 451 O GLU A 29 12.403 0.080 0.921 1.00 0.00 O ATOM 452 CB GLU A 29 15.320 0.563 1.264 1.00 0.00 C ATOM 453 CG GLU A 29 16.652 0.893 1.918 1.00 0.00 C ATOM 454 CD GLU A 29 17.165 2.267 1.534 1.00 0.00 C ATOM 455 OE1 GLU A 29 17.732 2.402 0.430 1.00 0.00 O ATOM 456 OE2 GLU A 29 16.999 3.209 2.339 1.00 0.00 O ATOM 0 H GLU A 29 13.986 0.397 3.469 1.00 0.00 H new ATOM 0 HA GLU A 29 14.478 2.525 1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 29 15.049 -0.464 1.509 1.00 0.00 H new ATOM 0 HB3 GLU A 29 15.434 0.613 0.181 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.544 0.839 3.001 1.00 0.00 H new ATOM 0 HG3 GLU A 29 17.388 0.142 1.633 1.00 0.00 H new ATOM 463 N LEU A 30 12.459 2.187 0.121 1.00 0.00 N ATOM 464 CA LEU A 30 11.264 2.033 -0.712 1.00 0.00 C ATOM 465 C LEU A 30 11.221 0.657 -1.371 1.00 0.00 C ATOM 466 O LEU A 30 11.866 0.423 -2.394 1.00 0.00 O ATOM 467 CB LEU A 30 11.217 3.127 -1.781 1.00 0.00 C ATOM 468 CG LEU A 30 9.823 3.436 -2.332 1.00 0.00 C ATOM 469 CD1 LEU A 30 8.848 3.718 -1.198 1.00 0.00 C ATOM 470 CD2 LEU A 30 9.879 4.612 -3.294 1.00 0.00 C ATOM 0 H LEU A 30 12.887 3.111 0.072 1.00 0.00 H new ATOM 0 HA LEU A 30 10.392 2.127 -0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.636 4.042 -1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.861 2.832 -2.609 1.00 0.00 H new ATOM 0 HG LEU A 30 9.468 2.562 -2.878 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.863 3.935 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.784 2.846 -0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.197 4.575 -0.622 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.879 4.818 -3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.256 5.491 -2.772 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.542 4.371 -4.125 1.00 0.00 H new ATOM 482 N ILE A 31 10.464 -0.251 -0.766 1.00 0.00 N ATOM 483 CA ILE A 31 10.335 -1.614 -1.272 1.00 0.00 C ATOM 484 C ILE A 31 9.952 -1.637 -2.750 1.00 0.00 C ATOM 485 O ILE A 31 8.850 -1.236 -3.126 1.00 0.00 O ATOM 486 CB ILE A 31 9.294 -2.412 -0.459 1.00 0.00 C ATOM 487 CG1 ILE A 31 7.894 -1.809 -0.624 1.00 0.00 C ATOM 488 CG2 ILE A 31 9.692 -2.448 1.012 1.00 0.00 C ATOM 489 CD1 ILE A 31 6.925 -2.721 -1.346 1.00 0.00 C ATOM 0 H ILE A 31 9.927 -0.067 0.081 1.00 0.00 H new ATOM 0 HA ILE A 31 11.313 -2.083 -1.162 1.00 0.00 H new ATOM 0 HB ILE A 31 9.268 -3.433 -0.840 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.491 -1.571 0.360 1.00 0.00 H new ATOM 0 HG13 ILE A 31 7.974 -0.870 -1.172 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.950 -3.014 1.576 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.667 -2.925 1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.744 -1.431 1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.955 -2.230 -1.427 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.306 -2.939 -2.344 1.00 0.00 H new ATOM 0 HD13 ILE A 31 6.816 -3.651 -0.788 1.00 0.00 H new ATOM 501 N LYS A 32 10.871 -2.115 -3.583 1.00 0.00 N ATOM 502 CA LYS A 32 10.632 -2.199 -5.018 1.00 0.00 C ATOM 503 C LYS A 32 9.996 -3.538 -5.377 1.00 0.00 C ATOM 504 O LYS A 32 9.054 -3.601 -6.168 1.00 0.00 O ATOM 505 CB LYS A 32 11.941 -2.018 -5.789 1.00 0.00 C ATOM 506 CG LYS A 32 12.623 -0.686 -5.524 1.00 0.00 C ATOM 507 CD LYS A 32 12.171 0.376 -6.514 1.00 0.00 C ATOM 508 CE LYS A 32 12.555 0.011 -7.938 1.00 0.00 C ATOM 509 NZ LYS A 32 12.920 1.211 -8.740 1.00 0.00 N ATOM 0 H LYS A 32 11.788 -2.450 -3.288 1.00 0.00 H new ATOM 0 HA LYS A 32 9.946 -1.400 -5.298 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.624 -2.825 -5.524 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.740 -2.108 -6.856 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.400 -0.357 -4.509 1.00 0.00 H new ATOM 0 HG3 LYS A 32 13.704 -0.810 -5.589 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.090 0.499 -6.448 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.618 1.334 -6.250 1.00 0.00 H new ATOM 0 HE2 LYS A 32 13.395 -0.683 -7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 32 11.724 -0.506 -8.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 13.175 0.919 -9.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 12.110 1.862 -8.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.730 1.691 -8.298 1.00 0.00 H new ATOM 523 N GLU A 33 10.516 -4.607 -4.783 1.00 0.00 N ATOM 524 CA GLU A 33 10.001 -5.948 -5.028 1.00 0.00 C ATOM 525 C GLU A 33 9.107 -6.397 -3.875 1.00 0.00 C ATOM 526 O GLU A 33 9.585 -6.975 -2.899 1.00 0.00 O ATOM 527 CB GLU A 33 11.154 -6.936 -5.210 1.00 0.00 C ATOM 528 CG GLU A 33 11.786 -6.886 -6.592 1.00 0.00 C ATOM 529 CD GLU A 33 12.836 -7.961 -6.791 1.00 0.00 C ATOM 530 OE1 GLU A 33 13.956 -7.802 -6.261 1.00 0.00 O ATOM 531 OE2 GLU A 33 12.538 -8.961 -7.478 1.00 0.00 O ATOM 0 H GLU A 33 11.296 -4.570 -4.127 1.00 0.00 H new ATOM 0 HA GLU A 33 9.408 -5.925 -5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.920 -6.730 -4.462 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.789 -7.946 -5.023 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.008 -6.998 -7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 33 12.240 -5.907 -6.745 1.00 0.00 H new ATOM 538 N PRO A 34 7.791 -6.131 -3.966 1.00 0.00 N ATOM 539 CA PRO A 34 6.836 -6.508 -2.919 1.00 0.00 C ATOM 540 C PRO A 34 6.754 -8.016 -2.718 1.00 0.00 C ATOM 541 O PRO A 34 6.290 -8.747 -3.594 1.00 0.00 O ATOM 542 CB PRO A 34 5.498 -5.961 -3.428 1.00 0.00 C ATOM 543 CG PRO A 34 5.684 -5.785 -4.895 1.00 0.00 C ATOM 544 CD PRO A 34 7.133 -5.442 -5.089 1.00 0.00 C ATOM 0 HA PRO A 34 7.129 -6.109 -1.948 1.00 0.00 H new ATOM 0 HB2 PRO A 34 4.683 -6.652 -3.214 1.00 0.00 H new ATOM 0 HB3 PRO A 34 5.249 -5.016 -2.946 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.423 -6.696 -5.434 1.00 0.00 H new ATOM 0 HG3 PRO A 34 5.041 -4.993 -5.278 1.00 0.00 H new ATOM 0 HD2 PRO A 34 7.505 -5.793 -6.051 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.301 -4.365 -5.056 1.00 0.00 H new ATOM 552 N VAL A 35 7.204 -8.473 -1.555 1.00 0.00 N ATOM 553 CA VAL A 35 7.179 -9.894 -1.228 1.00 0.00 C ATOM 554 C VAL A 35 6.491 -10.125 0.114 1.00 0.00 C ATOM 555 O VAL A 35 6.389 -9.212 0.932 1.00 0.00 O ATOM 556 CB VAL A 35 8.602 -10.486 -1.180 1.00 0.00 C ATOM 557 CG1 VAL A 35 9.433 -9.805 -0.101 1.00 0.00 C ATOM 558 CG2 VAL A 35 8.550 -11.990 -0.952 1.00 0.00 C ATOM 0 H VAL A 35 7.591 -7.879 -0.822 1.00 0.00 H new ATOM 0 HA VAL A 35 6.618 -10.398 -2.015 1.00 0.00 H new ATOM 0 HB VAL A 35 9.080 -10.303 -2.142 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.433 -10.238 -0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.503 -8.738 -0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 35 8.959 -9.950 0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 35 9.564 -12.389 -0.921 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.050 -12.198 -0.006 1.00 0.00 H new ATOM 0 HG23 VAL A 35 7.999 -12.462 -1.765 1.00 0.00 H new ATOM 568 N SER A 36 6.018 -11.346 0.334 1.00 0.00 N ATOM 569 CA SER A 36 5.339 -11.686 1.579 1.00 0.00 C ATOM 570 C SER A 36 6.185 -12.633 2.425 1.00 0.00 C ATOM 571 O SER A 36 6.638 -13.672 1.946 1.00 0.00 O ATOM 572 CB SER A 36 3.979 -12.322 1.285 1.00 0.00 C ATOM 573 OG SER A 36 4.113 -13.699 0.980 1.00 0.00 O ATOM 0 H SER A 36 6.092 -12.115 -0.331 1.00 0.00 H new ATOM 0 HA SER A 36 5.189 -10.765 2.142 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.323 -12.200 2.147 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.506 -11.806 0.449 1.00 0.00 H new ATOM 0 HG SER A 36 5.046 -13.972 1.103 1.00 0.00 H new ATOM 579 N THR A 37 6.393 -12.264 3.685 1.00 0.00 N ATOM 580 CA THR A 37 7.184 -13.079 4.600 1.00 0.00 C ATOM 581 C THR A 37 6.293 -14.040 5.381 1.00 0.00 C ATOM 582 O THR A 37 5.090 -13.813 5.520 1.00 0.00 O ATOM 583 CB THR A 37 7.963 -12.188 5.567 1.00 0.00 C ATOM 584 OG1 THR A 37 7.116 -11.203 6.132 1.00 0.00 O ATOM 585 CG2 THR A 37 9.129 -11.473 4.918 1.00 0.00 C ATOM 0 H THR A 37 6.025 -11.406 4.096 1.00 0.00 H new ATOM 0 HA THR A 37 7.889 -13.664 4.009 1.00 0.00 H new ATOM 0 HB THR A 37 8.352 -12.862 6.331 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.513 -10.317 6.002 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.638 -10.858 5.661 1.00 0.00 H new ATOM 0 HG22 THR A 37 9.827 -12.207 4.515 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.763 -10.838 4.111 1.00 0.00 H new ATOM 593 N LYS A 38 6.895 -15.112 5.889 1.00 0.00 N ATOM 594 CA LYS A 38 6.164 -16.117 6.658 1.00 0.00 C ATOM 595 C LYS A 38 5.365 -15.485 7.795 1.00 0.00 C ATOM 596 O LYS A 38 4.389 -16.063 8.274 1.00 0.00 O ATOM 597 CB LYS A 38 7.134 -17.158 7.221 1.00 0.00 C ATOM 598 CG LYS A 38 6.440 -18.336 7.888 1.00 0.00 C ATOM 599 CD LYS A 38 5.461 -19.013 6.943 1.00 0.00 C ATOM 600 CE LYS A 38 5.494 -20.526 7.095 1.00 0.00 C ATOM 601 NZ LYS A 38 6.881 -21.062 7.028 1.00 0.00 N ATOM 0 H LYS A 38 7.890 -15.308 5.782 1.00 0.00 H new ATOM 0 HA LYS A 38 5.460 -16.603 5.982 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.766 -17.528 6.414 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.791 -16.676 7.945 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.186 -19.058 8.220 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.911 -17.992 8.777 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.453 -18.649 7.140 1.00 0.00 H new ATOM 0 HD3 LYS A 38 5.702 -18.744 5.914 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.043 -20.805 8.047 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.890 -20.983 6.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 6.985 -21.842 7.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 7.072 -21.412 6.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 7.557 -20.307 7.262 1.00 0.00 H new ATOM 615 N CYS A 39 5.782 -14.297 8.228 1.00 0.00 N ATOM 616 CA CYS A 39 5.098 -13.598 9.311 1.00 0.00 C ATOM 617 C CYS A 39 4.009 -12.671 8.774 1.00 0.00 C ATOM 618 O CYS A 39 3.632 -11.699 9.429 1.00 0.00 O ATOM 619 CB CYS A 39 6.101 -12.796 10.141 1.00 0.00 C ATOM 620 SG CYS A 39 5.475 -12.279 11.756 1.00 0.00 S ATOM 0 H CYS A 39 6.587 -13.801 7.846 1.00 0.00 H new ATOM 0 HA CYS A 39 4.624 -14.348 9.944 1.00 0.00 H new ATOM 0 HB2 CYS A 39 6.999 -13.397 10.286 1.00 0.00 H new ATOM 0 HB3 CYS A 39 6.397 -11.911 9.578 1.00 0.00 H new ATOM 625 N ASP A 40 3.504 -12.975 7.580 1.00 0.00 N ATOM 626 CA ASP A 40 2.456 -12.168 6.962 1.00 0.00 C ATOM 627 C ASP A 40 2.874 -10.703 6.872 1.00 0.00 C ATOM 628 O ASP A 40 2.069 -9.802 7.112 1.00 0.00 O ATOM 629 CB ASP A 40 1.155 -12.293 7.755 1.00 0.00 C ATOM 630 CG ASP A 40 -0.006 -11.594 7.075 1.00 0.00 C ATOM 631 OD1 ASP A 40 -0.471 -12.096 6.029 1.00 0.00 O ATOM 632 OD2 ASP A 40 -0.450 -10.545 7.587 1.00 0.00 O ATOM 0 H ASP A 40 3.804 -13.774 7.022 1.00 0.00 H new ATOM 0 HA ASP A 40 2.295 -12.541 5.950 1.00 0.00 H new ATOM 0 HB2 ASP A 40 0.913 -13.348 7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 40 1.297 -11.871 8.750 1.00 0.00 H new ATOM 637 N HIS A 41 4.135 -10.470 6.523 1.00 0.00 N ATOM 638 CA HIS A 41 4.655 -9.112 6.401 1.00 0.00 C ATOM 639 C HIS A 41 5.220 -8.870 5.006 1.00 0.00 C ATOM 640 O HIS A 41 5.191 -9.756 4.151 1.00 0.00 O ATOM 641 CB HIS A 41 5.731 -8.857 7.456 1.00 0.00 C ATOM 642 CG HIS A 41 5.177 -8.477 8.794 1.00 0.00 C ATOM 643 ND1 HIS A 41 4.558 -7.276 9.057 1.00 0.00 N ATOM 644 CD2 HIS A 41 5.156 -9.172 9.959 1.00 0.00 C ATOM 645 CE1 HIS A 41 4.190 -7.277 10.344 1.00 0.00 C ATOM 646 NE2 HIS A 41 4.529 -8.405 10.937 1.00 0.00 N ATOM 0 H HIS A 41 4.815 -11.202 6.320 1.00 0.00 H new ATOM 0 HA HIS A 41 3.831 -8.418 6.563 1.00 0.00 H new ATOM 0 HB2 HIS A 41 6.341 -9.754 7.565 1.00 0.00 H new ATOM 0 HB3 HIS A 41 6.391 -8.063 7.106 1.00 0.00 H new ATOM 0 HD2 HIS A 41 5.561 -10.162 10.104 1.00 0.00 H new ATOM 0 HE1 HIS A 41 3.681 -6.460 10.833 1.00 0.00 H new ATOM 0 HE2 HIS A 41 4.366 -8.662 11.910 1.00 0.00 H new ATOM 654 N ILE A 42 5.730 -7.663 4.778 1.00 0.00 N ATOM 655 CA ILE A 42 6.297 -7.307 3.483 1.00 0.00 C ATOM 656 C ILE A 42 7.763 -6.901 3.607 1.00 0.00 C ATOM 657 O ILE A 42 8.178 -6.334 4.617 1.00 0.00 O ATOM 658 CB ILE A 42 5.511 -6.158 2.823 1.00 0.00 C ATOM 659 CG1 ILE A 42 4.014 -6.475 2.816 1.00 0.00 C ATOM 660 CG2 ILE A 42 6.012 -5.914 1.407 1.00 0.00 C ATOM 661 CD1 ILE A 42 3.670 -7.755 2.084 1.00 0.00 C ATOM 0 H ILE A 42 5.762 -6.917 5.473 1.00 0.00 H new ATOM 0 HA ILE A 42 6.226 -8.196 2.856 1.00 0.00 H new ATOM 0 HB ILE A 42 5.670 -5.249 3.404 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.662 -6.549 3.845 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.478 -5.646 2.354 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.446 -5.099 0.956 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.069 -5.649 1.436 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.881 -6.819 0.814 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.593 -7.916 2.120 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.991 -7.678 1.045 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.178 -8.594 2.560 1.00 0.00 H new ATOM 673 N PHE A 43 8.539 -7.197 2.569 1.00 0.00 N ATOM 674 CA PHE A 43 9.960 -6.865 2.552 1.00 0.00 C ATOM 675 C PHE A 43 10.416 -6.523 1.136 1.00 0.00 C ATOM 676 O PHE A 43 9.614 -6.508 0.203 1.00 0.00 O ATOM 677 CB PHE A 43 10.784 -8.034 3.096 1.00 0.00 C ATOM 678 CG PHE A 43 10.821 -8.099 4.597 1.00 0.00 C ATOM 679 CD1 PHE A 43 9.715 -8.527 5.313 1.00 0.00 C ATOM 680 CD2 PHE A 43 11.963 -7.732 5.291 1.00 0.00 C ATOM 681 CE1 PHE A 43 9.747 -8.589 6.693 1.00 0.00 C ATOM 682 CE2 PHE A 43 12.001 -7.792 6.671 1.00 0.00 C ATOM 683 CZ PHE A 43 10.892 -8.220 7.372 1.00 0.00 C ATOM 0 H PHE A 43 8.207 -7.667 1.727 1.00 0.00 H new ATOM 0 HA PHE A 43 10.115 -5.994 3.188 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.373 -8.967 2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.804 -7.955 2.719 1.00 0.00 H new ATOM 0 HD1 PHE A 43 8.817 -8.816 4.786 1.00 0.00 H new ATOM 0 HD2 PHE A 43 12.833 -7.395 4.747 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.878 -8.925 7.240 1.00 0.00 H new ATOM 0 HE2 PHE A 43 12.897 -7.504 7.200 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.919 -8.266 8.451 1.00 0.00 H new ATOM 693 N CYS A 44 11.709 -6.253 0.982 1.00 0.00 N ATOM 694 CA CYS A 44 12.266 -5.915 -0.324 1.00 0.00 C ATOM 695 C CYS A 44 12.955 -7.122 -0.955 1.00 0.00 C ATOM 696 O CYS A 44 13.848 -6.972 -1.788 1.00 0.00 O ATOM 697 CB CYS A 44 13.262 -4.759 -0.200 1.00 0.00 C ATOM 698 SG CYS A 44 12.713 -3.419 0.882 1.00 0.00 S ATOM 0 H CYS A 44 12.389 -6.262 1.742 1.00 0.00 H new ATOM 0 HA CYS A 44 11.441 -5.609 -0.968 1.00 0.00 H new ATOM 0 HB2 CYS A 44 14.208 -5.149 0.175 1.00 0.00 H new ATOM 0 HB3 CYS A 44 13.455 -4.353 -1.193 1.00 0.00 H new ATOM 703 N LYS A 45 12.534 -8.320 -0.551 1.00 0.00 N ATOM 704 CA LYS A 45 13.110 -9.553 -1.076 1.00 0.00 C ATOM 705 C LYS A 45 14.549 -9.729 -0.598 1.00 0.00 C ATOM 706 O LYS A 45 14.853 -10.649 0.161 1.00 0.00 O ATOM 707 CB LYS A 45 13.065 -9.560 -2.607 1.00 0.00 C ATOM 708 CG LYS A 45 13.340 -10.925 -3.218 1.00 0.00 C ATOM 709 CD LYS A 45 12.229 -11.915 -2.902 1.00 0.00 C ATOM 710 CE LYS A 45 12.687 -12.970 -1.907 1.00 0.00 C ATOM 711 NZ LYS A 45 12.186 -12.693 -0.532 1.00 0.00 N ATOM 0 H LYS A 45 11.796 -8.461 0.139 1.00 0.00 H new ATOM 0 HA LYS A 45 12.515 -10.386 -0.701 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.084 -9.215 -2.935 1.00 0.00 H new ATOM 0 HB3 LYS A 45 13.797 -8.847 -2.987 1.00 0.00 H new ATOM 0 HG2 LYS A 45 13.443 -10.826 -4.299 1.00 0.00 H new ATOM 0 HG3 LYS A 45 14.288 -11.309 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.369 -11.381 -2.497 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.900 -12.399 -3.821 1.00 0.00 H new ATOM 0 HE2 LYS A 45 12.336 -13.950 -2.230 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.776 -13.009 -1.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.788 -13.564 -0.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.971 -12.361 0.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.448 -11.961 -0.572 1.00 0.00 H new ATOM 725 N PHE A 46 15.431 -8.842 -1.049 1.00 0.00 N ATOM 726 CA PHE A 46 16.837 -8.899 -0.667 1.00 0.00 C ATOM 727 C PHE A 46 16.998 -8.801 0.847 1.00 0.00 C ATOM 728 O PHE A 46 17.942 -9.348 1.417 1.00 0.00 O ATOM 729 CB PHE A 46 17.617 -7.773 -1.348 1.00 0.00 C ATOM 730 CG PHE A 46 19.009 -8.165 -1.751 1.00 0.00 C ATOM 731 CD1 PHE A 46 19.222 -9.238 -2.604 1.00 0.00 C ATOM 732 CD2 PHE A 46 20.106 -7.462 -1.279 1.00 0.00 C ATOM 733 CE1 PHE A 46 20.502 -9.600 -2.977 1.00 0.00 C ATOM 734 CE2 PHE A 46 21.389 -7.821 -1.648 1.00 0.00 C ATOM 735 CZ PHE A 46 21.587 -8.892 -2.499 1.00 0.00 C ATOM 0 H PHE A 46 15.196 -8.075 -1.679 1.00 0.00 H new ATOM 0 HA PHE A 46 17.236 -9.859 -0.993 1.00 0.00 H new ATOM 0 HB2 PHE A 46 17.070 -7.447 -2.232 1.00 0.00 H new ATOM 0 HB3 PHE A 46 17.670 -6.919 -0.673 1.00 0.00 H new ATOM 0 HD1 PHE A 46 18.378 -9.797 -2.981 1.00 0.00 H new ATOM 0 HD2 PHE A 46 19.957 -6.624 -0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 46 20.654 -10.437 -3.643 1.00 0.00 H new ATOM 0 HE2 PHE A 46 22.235 -7.265 -1.272 1.00 0.00 H new ATOM 0 HZ PHE A 46 22.588 -9.175 -2.789 1.00 0.00 H new ATOM 745 N CYS A 47 16.069 -8.102 1.493 1.00 0.00 N ATOM 746 CA CYS A 47 16.109 -7.934 2.942 1.00 0.00 C ATOM 747 C CYS A 47 16.104 -9.287 3.647 1.00 0.00 C ATOM 748 O CYS A 47 16.721 -9.452 4.699 1.00 0.00 O ATOM 749 CB CYS A 47 14.919 -7.097 3.415 1.00 0.00 C ATOM 750 SG CYS A 47 14.890 -5.414 2.753 1.00 0.00 S ATOM 0 H CYS A 47 15.280 -7.643 1.037 1.00 0.00 H new ATOM 0 HA CYS A 47 17.033 -7.414 3.195 1.00 0.00 H new ATOM 0 HB2 CYS A 47 13.997 -7.604 3.131 1.00 0.00 H new ATOM 0 HB3 CYS A 47 14.933 -7.047 4.504 1.00 0.00 H new ATOM 755 N MET A 48 15.406 -10.252 3.058 1.00 0.00 N ATOM 756 CA MET A 48 15.322 -11.591 3.628 1.00 0.00 C ATOM 757 C MET A 48 16.676 -12.290 3.575 1.00 0.00 C ATOM 758 O MET A 48 17.061 -12.991 4.511 1.00 0.00 O ATOM 759 CB MET A 48 14.276 -12.421 2.880 1.00 0.00 C ATOM 760 CG MET A 48 12.845 -12.093 3.273 1.00 0.00 C ATOM 761 SD MET A 48 12.222 -13.165 4.582 1.00 0.00 S ATOM 762 CE MET A 48 12.007 -11.986 5.913 1.00 0.00 C ATOM 0 H MET A 48 14.890 -10.132 2.186 1.00 0.00 H new ATOM 0 HA MET A 48 15.023 -11.497 4.672 1.00 0.00 H new ATOM 0 HB2 MET A 48 14.396 -12.261 1.808 1.00 0.00 H new ATOM 0 HB3 MET A 48 14.462 -13.479 3.067 1.00 0.00 H new ATOM 0 HG2 MET A 48 12.791 -11.055 3.602 1.00 0.00 H new ATOM 0 HG3 MET A 48 12.202 -12.183 2.398 1.00 0.00 H new ATOM 0 HE1 MET A 48 11.114 -12.241 6.484 1.00 0.00 H new ATOM 0 HE2 MET A 48 12.878 -12.014 6.568 1.00 0.00 H new ATOM 0 HE3 MET A 48 11.898 -10.984 5.498 1.00 0.00 H new ATOM 772 N LEU A 49 17.394 -12.097 2.473 1.00 0.00 N ATOM 773 CA LEU A 49 18.706 -12.708 2.299 1.00 0.00 C ATOM 774 C LEU A 49 19.671 -12.245 3.385 1.00 0.00 C ATOM 775 O LEU A 49 20.278 -13.059 4.078 1.00 0.00 O ATOM 776 CB LEU A 49 19.271 -12.366 0.919 1.00 0.00 C ATOM 777 CG LEU A 49 18.769 -13.252 -0.224 1.00 0.00 C ATOM 778 CD1 LEU A 49 17.438 -12.738 -0.751 1.00 0.00 C ATOM 779 CD2 LEU A 49 19.799 -13.314 -1.341 1.00 0.00 C ATOM 0 H LEU A 49 17.089 -11.522 1.688 1.00 0.00 H new ATOM 0 HA LEU A 49 18.589 -13.789 2.379 1.00 0.00 H new ATOM 0 HB2 LEU A 49 19.026 -11.329 0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 49 20.358 -12.434 0.961 1.00 0.00 H new ATOM 0 HG LEU A 49 18.619 -14.261 0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 49 17.096 -13.380 -1.563 1.00 0.00 H new ATOM 0 HD12 LEU A 49 16.701 -12.745 0.052 1.00 0.00 H new ATOM 0 HD13 LEU A 49 17.562 -11.720 -1.120 1.00 0.00 H new ATOM 0 HD21 LEU A 49 19.426 -13.948 -2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 49 19.980 -12.310 -1.725 1.00 0.00 H new ATOM 0 HD23 LEU A 49 20.730 -13.728 -0.955 1.00 0.00 H new ATOM 791 N LYS A 50 19.806 -10.930 3.527 1.00 0.00 N ATOM 792 CA LYS A 50 20.697 -10.357 4.530 1.00 0.00 C ATOM 793 C LYS A 50 20.273 -10.772 5.935 1.00 0.00 C ATOM 794 O LYS A 50 21.105 -11.154 6.758 1.00 0.00 O ATOM 795 CB LYS A 50 20.711 -8.831 4.419 1.00 0.00 C ATOM 796 CG LYS A 50 21.768 -8.301 3.464 1.00 0.00 C ATOM 797 CD LYS A 50 21.257 -8.261 2.033 1.00 0.00 C ATOM 798 CE LYS A 50 21.719 -9.476 1.244 1.00 0.00 C ATOM 799 NZ LYS A 50 23.203 -9.524 1.115 1.00 0.00 N ATOM 0 H LYS A 50 19.310 -10.242 2.961 1.00 0.00 H new ATOM 0 HA LYS A 50 21.702 -10.737 4.346 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.730 -8.490 4.088 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.880 -8.404 5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 50 22.069 -7.300 3.772 1.00 0.00 H new ATOM 0 HG3 LYS A 50 22.656 -8.931 3.517 1.00 0.00 H new ATOM 0 HD2 LYS A 50 20.168 -8.220 2.035 1.00 0.00 H new ATOM 0 HD3 LYS A 50 21.610 -7.353 1.545 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.368 -10.383 1.736 1.00 0.00 H new ATOM 0 HE3 LYS A 50 21.269 -9.457 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 23.459 -10.026 0.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 23.580 -8.555 1.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 23.607 -10.024 1.933 1.00 0.00 H new ATOM 813 N LEU A 51 18.973 -10.695 6.202 1.00 0.00 N ATOM 814 CA LEU A 51 18.439 -11.063 7.508 1.00 0.00 C ATOM 815 C LEU A 51 18.557 -12.566 7.740 1.00 0.00 C ATOM 816 O LEU A 51 18.727 -13.017 8.873 1.00 0.00 O ATOM 817 CB LEU A 51 16.976 -10.629 7.624 1.00 0.00 C ATOM 818 CG LEU A 51 16.557 -10.123 9.008 1.00 0.00 C ATOM 819 CD1 LEU A 51 15.930 -8.741 8.908 1.00 0.00 C ATOM 820 CD2 LEU A 51 15.594 -11.099 9.667 1.00 0.00 C ATOM 0 H LEU A 51 18.271 -10.381 5.532 1.00 0.00 H new ATOM 0 HA LEU A 51 19.024 -10.550 8.271 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.788 -9.842 6.894 1.00 0.00 H new ATOM 0 HB3 LEU A 51 16.340 -11.472 7.355 1.00 0.00 H new ATOM 0 HG LEU A 51 17.450 -10.050 9.628 1.00 0.00 H new ATOM 0 HD11 LEU A 51 15.640 -8.400 9.902 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.652 -8.044 8.482 1.00 0.00 H new ATOM 0 HD13 LEU A 51 15.049 -8.787 8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 51 15.308 -10.721 10.649 1.00 0.00 H new ATOM 0 HD22 LEU A 51 14.704 -11.207 9.047 1.00 0.00 H new ATOM 0 HD23 LEU A 51 16.078 -12.069 9.778 1.00 0.00 H new ATOM 832 N LEU A 52 18.468 -13.335 6.661 1.00 0.00 N ATOM 833 CA LEU A 52 18.567 -14.788 6.747 1.00 0.00 C ATOM 834 C LEU A 52 20.006 -15.221 7.003 1.00 0.00 C ATOM 835 O LEU A 52 20.274 -16.022 7.898 1.00 0.00 O ATOM 836 CB LEU A 52 18.048 -15.433 5.459 1.00 0.00 C ATOM 837 CG LEU A 52 16.531 -15.612 5.389 1.00 0.00 C ATOM 838 CD1 LEU A 52 16.069 -15.688 3.943 1.00 0.00 C ATOM 839 CD2 LEU A 52 16.107 -16.859 6.152 1.00 0.00 C ATOM 0 H LEU A 52 18.327 -12.977 5.716 1.00 0.00 H new ATOM 0 HA LEU A 52 17.953 -15.120 7.584 1.00 0.00 H new ATOM 0 HB2 LEU A 52 18.366 -14.824 4.613 1.00 0.00 H new ATOM 0 HB3 LEU A 52 18.519 -16.409 5.344 1.00 0.00 H new ATOM 0 HG LEU A 52 16.060 -14.746 5.854 1.00 0.00 H new ATOM 0 HD11 LEU A 52 14.987 -15.815 3.913 1.00 0.00 H new ATOM 0 HD12 LEU A 52 16.341 -14.768 3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 52 16.548 -16.535 3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.024 -16.972 6.092 1.00 0.00 H new ATOM 0 HD22 LEU A 52 16.588 -17.734 5.715 1.00 0.00 H new ATOM 0 HD23 LEU A 52 16.405 -16.765 7.196 1.00 0.00 H new ATOM 851 N ASN A 53 20.929 -14.686 6.210 1.00 0.00 N ATOM 852 CA ASN A 53 22.342 -15.017 6.351 1.00 0.00 C ATOM 853 C ASN A 53 22.871 -14.577 7.712 1.00 0.00 C ATOM 854 O ASN A 53 23.638 -15.295 8.353 1.00 0.00 O ATOM 855 CB ASN A 53 23.156 -14.356 5.237 1.00 0.00 C ATOM 856 CG ASN A 53 22.788 -14.881 3.863 1.00 0.00 C ATOM 857 OD1 ASN A 53 21.789 -15.582 3.701 1.00 0.00 O ATOM 858 ND2 ASN A 53 23.595 -14.543 2.865 1.00 0.00 N ATOM 0 H ASN A 53 20.724 -14.022 5.464 1.00 0.00 H new ATOM 0 HA ASN A 53 22.445 -16.099 6.274 1.00 0.00 H new ATOM 0 HB2 ASN A 53 22.997 -13.278 5.266 1.00 0.00 H new ATOM 0 HB3 ASN A 53 24.218 -14.527 5.416 1.00 0.00 H new ATOM 0 HD21 ASN A 53 23.398 -14.866 1.918 1.00 0.00 H new ATOM 0 HD22 ASN A 53 24.412 -13.960 3.045 1.00 0.00 H new ATOM 865 N GLN A 54 22.455 -13.392 8.148 1.00 0.00 N ATOM 866 CA GLN A 54 22.886 -12.856 9.434 1.00 0.00 C ATOM 867 C GLN A 54 22.469 -13.778 10.575 1.00 0.00 C ATOM 868 O GLN A 54 21.440 -14.448 10.501 1.00 0.00 O ATOM 869 CB GLN A 54 22.300 -11.460 9.651 1.00 0.00 C ATOM 870 CG GLN A 54 23.130 -10.589 10.579 1.00 0.00 C ATOM 871 CD GLN A 54 24.043 -9.641 9.827 1.00 0.00 C ATOM 872 OE1 GLN A 54 23.581 -8.752 9.111 1.00 0.00 O ATOM 873 NE2 GLN A 54 25.349 -9.826 9.986 1.00 0.00 N ATOM 0 H GLN A 54 21.820 -12.785 7.630 1.00 0.00 H new ATOM 0 HA GLN A 54 23.974 -12.788 9.425 1.00 0.00 H new ATOM 0 HB2 GLN A 54 22.205 -10.961 8.687 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.294 -11.557 10.060 1.00 0.00 H new ATOM 0 HG2 GLN A 54 22.465 -10.013 11.222 1.00 0.00 H new ATOM 0 HG3 GLN A 54 23.730 -11.226 11.229 1.00 0.00 H new ATOM 0 HE21 GLN A 54 25.688 -10.575 10.589 1.00 0.00 H new ATOM 0 HE22 GLN A 54 26.012 -9.219 9.505 1.00 0.00 H new ATOM 882 N LYS A 55 23.278 -13.809 11.630 1.00 0.00 N ATOM 883 CA LYS A 55 22.993 -14.649 12.787 1.00 0.00 C ATOM 884 C LYS A 55 22.969 -16.124 12.395 1.00 0.00 C ATOM 885 O LYS A 55 22.691 -16.466 11.245 1.00 0.00 O ATOM 886 CB LYS A 55 21.656 -14.254 13.415 1.00 0.00 C ATOM 887 CG LYS A 55 21.640 -14.363 14.931 1.00 0.00 C ATOM 888 CD LYS A 55 21.023 -15.675 15.389 1.00 0.00 C ATOM 889 CE LYS A 55 20.873 -15.722 16.901 1.00 0.00 C ATOM 890 NZ LYS A 55 22.111 -15.272 17.596 1.00 0.00 N ATOM 0 H LYS A 55 24.136 -13.262 11.707 1.00 0.00 H new ATOM 0 HA LYS A 55 23.787 -14.498 13.518 1.00 0.00 H new ATOM 0 HB2 LYS A 55 21.419 -13.229 13.130 1.00 0.00 H new ATOM 0 HB3 LYS A 55 20.870 -14.888 13.005 1.00 0.00 H new ATOM 0 HG2 LYS A 55 22.658 -14.285 15.313 1.00 0.00 H new ATOM 0 HG3 LYS A 55 21.078 -13.529 15.351 1.00 0.00 H new ATOM 0 HD2 LYS A 55 20.047 -15.802 14.921 1.00 0.00 H new ATOM 0 HD3 LYS A 55 21.646 -16.506 15.058 1.00 0.00 H new ATOM 0 HE2 LYS A 55 20.037 -15.091 17.203 1.00 0.00 H new ATOM 0 HE3 LYS A 55 20.632 -16.739 17.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 22.166 -15.721 18.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 22.943 -15.542 17.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 22.090 -14.238 17.708 1.00 0.00 H new ATOM 904 N LYS A 56 23.261 -16.992 13.358 1.00 0.00 N ATOM 905 CA LYS A 56 23.273 -18.429 13.112 1.00 0.00 C ATOM 906 C LYS A 56 21.854 -18.992 13.112 1.00 0.00 C ATOM 907 O LYS A 56 21.225 -19.117 14.161 1.00 0.00 O ATOM 908 CB LYS A 56 24.115 -19.142 14.172 1.00 0.00 C ATOM 909 CG LYS A 56 25.587 -18.761 14.135 1.00 0.00 C ATOM 910 CD LYS A 56 25.820 -17.381 14.726 1.00 0.00 C ATOM 911 CE LYS A 56 27.285 -17.163 15.068 1.00 0.00 C ATOM 912 NZ LYS A 56 27.999 -16.413 13.997 1.00 0.00 N ATOM 0 H LYS A 56 23.492 -16.726 14.315 1.00 0.00 H new ATOM 0 HA LYS A 56 23.714 -18.601 12.130 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.713 -18.912 15.159 1.00 0.00 H new ATOM 0 HB3 LYS A 56 24.023 -20.219 14.033 1.00 0.00 H new ATOM 0 HG2 LYS A 56 26.169 -19.498 14.689 1.00 0.00 H new ATOM 0 HG3 LYS A 56 25.944 -18.782 13.105 1.00 0.00 H new ATOM 0 HD2 LYS A 56 25.493 -16.620 14.017 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.214 -17.261 15.624 1.00 0.00 H new ATOM 0 HE2 LYS A 56 27.361 -16.615 16.007 1.00 0.00 H new ATOM 0 HE3 LYS A 56 27.770 -18.127 15.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 28.995 -16.285 14.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 27.949 -16.947 13.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 27.553 -15.482 13.868 1.00 0.00 H new ATOM 926 N GLY A 57 21.359 -19.331 11.926 1.00 0.00 N ATOM 927 CA GLY A 57 20.019 -19.877 11.810 1.00 0.00 C ATOM 928 C GLY A 57 19.096 -18.985 11.001 1.00 0.00 C ATOM 929 O GLY A 57 19.516 -17.936 10.512 1.00 0.00 O ATOM 0 H GLY A 57 21.862 -19.237 11.043 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.070 -20.860 11.343 1.00 0.00 H new ATOM 0 HA3 GLY A 57 19.600 -20.019 12.806 1.00 0.00 H new ATOM 933 N PRO A 58 17.820 -19.379 10.843 1.00 0.00 N ATOM 934 CA PRO A 58 16.840 -18.597 10.081 1.00 0.00 C ATOM 935 C PRO A 58 16.806 -17.131 10.506 1.00 0.00 C ATOM 936 O PRO A 58 17.504 -16.729 11.436 1.00 0.00 O ATOM 937 CB PRO A 58 15.512 -19.278 10.414 1.00 0.00 C ATOM 938 CG PRO A 58 15.882 -20.683 10.735 1.00 0.00 C ATOM 939 CD PRO A 58 17.234 -20.617 11.390 1.00 0.00 C ATOM 0 HA PRO A 58 17.074 -18.578 9.016 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.019 -18.795 11.258 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.821 -19.232 9.572 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.148 -21.137 11.400 1.00 0.00 H new ATOM 0 HG3 PRO A 58 15.915 -21.294 9.833 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.152 -20.577 12.476 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.841 -21.490 11.148 1.00 0.00 H new ATOM 947 N SER A 59 15.990 -16.341 9.817 1.00 0.00 N ATOM 948 CA SER A 59 15.862 -14.921 10.121 1.00 0.00 C ATOM 949 C SER A 59 14.777 -14.686 11.168 1.00 0.00 C ATOM 950 O SER A 59 13.897 -15.524 11.362 1.00 0.00 O ATOM 951 CB SER A 59 15.542 -14.132 8.850 1.00 0.00 C ATOM 952 OG SER A 59 15.032 -14.981 7.836 1.00 0.00 O ATOM 0 H SER A 59 15.407 -16.660 9.044 1.00 0.00 H new ATOM 0 HA SER A 59 16.813 -14.573 10.525 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.814 -13.353 9.076 1.00 0.00 H new ATOM 0 HB3 SER A 59 16.442 -13.633 8.492 1.00 0.00 H new ATOM 0 HG SER A 59 14.416 -14.476 7.266 1.00 0.00 H new ATOM 958 N GLN A 60 14.847 -13.542 11.839 1.00 0.00 N ATOM 959 CA GLN A 60 13.870 -13.196 12.864 1.00 0.00 C ATOM 960 C GLN A 60 13.043 -11.987 12.442 1.00 0.00 C ATOM 961 O GLN A 60 13.566 -10.881 12.312 1.00 0.00 O ATOM 962 CB GLN A 60 14.573 -12.910 14.192 1.00 0.00 C ATOM 963 CG GLN A 60 15.031 -14.163 14.920 1.00 0.00 C ATOM 964 CD GLN A 60 14.863 -14.059 16.423 1.00 0.00 C ATOM 965 OE1 GLN A 60 15.829 -14.178 17.178 1.00 0.00 O ATOM 966 NE2 GLN A 60 13.631 -13.835 16.867 1.00 0.00 N ATOM 0 H GLN A 60 15.570 -12.838 11.691 1.00 0.00 H new ATOM 0 HA GLN A 60 13.199 -14.045 12.992 1.00 0.00 H new ATOM 0 HB2 GLN A 60 15.437 -12.272 14.006 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.897 -12.351 14.839 1.00 0.00 H new ATOM 0 HG2 GLN A 60 14.465 -15.019 14.553 1.00 0.00 H new ATOM 0 HG3 GLN A 60 16.079 -14.351 14.688 1.00 0.00 H new ATOM 0 HE21 GLN A 60 12.860 -13.743 16.206 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.457 -13.755 17.869 1.00 0.00 H new ATOM 975 N CYS A 61 11.748 -12.205 12.231 1.00 0.00 N ATOM 976 CA CYS A 61 10.848 -11.131 11.824 1.00 0.00 C ATOM 977 C CYS A 61 10.894 -9.975 12.824 1.00 0.00 C ATOM 978 O CYS A 61 10.408 -10.098 13.947 1.00 0.00 O ATOM 979 CB CYS A 61 9.417 -11.658 11.702 1.00 0.00 C ATOM 980 SG CYS A 61 8.211 -10.410 11.190 1.00 0.00 S ATOM 0 H CYS A 61 11.299 -13.115 12.335 1.00 0.00 H new ATOM 0 HA CYS A 61 11.177 -10.761 10.853 1.00 0.00 H new ATOM 0 HB2 CYS A 61 9.403 -12.477 10.983 1.00 0.00 H new ATOM 0 HB3 CYS A 61 9.110 -12.071 12.663 1.00 0.00 H new ATOM 985 N PRO A 62 11.482 -8.830 12.429 1.00 0.00 N ATOM 986 CA PRO A 62 11.587 -7.655 13.303 1.00 0.00 C ATOM 987 C PRO A 62 10.243 -6.968 13.531 1.00 0.00 C ATOM 988 O PRO A 62 10.137 -6.053 14.347 1.00 0.00 O ATOM 989 CB PRO A 62 12.536 -6.731 12.539 1.00 0.00 C ATOM 990 CG PRO A 62 12.365 -7.111 11.110 1.00 0.00 C ATOM 991 CD PRO A 62 12.093 -8.590 11.107 1.00 0.00 C ATOM 0 HA PRO A 62 11.936 -7.923 14.300 1.00 0.00 H new ATOM 0 HB2 PRO A 62 12.285 -5.683 12.703 1.00 0.00 H new ATOM 0 HB3 PRO A 62 13.568 -6.866 12.864 1.00 0.00 H new ATOM 0 HG2 PRO A 62 11.541 -6.561 10.656 1.00 0.00 H new ATOM 0 HG3 PRO A 62 13.260 -6.877 10.534 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.421 -8.873 10.297 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.009 -9.166 10.977 1.00 0.00 H new ATOM 999 N LEU A 63 9.218 -7.407 12.803 1.00 0.00 N ATOM 1000 CA LEU A 63 7.888 -6.823 12.931 1.00 0.00 C ATOM 1001 C LEU A 63 7.115 -7.457 14.085 1.00 0.00 C ATOM 1002 O LEU A 63 6.252 -6.820 14.688 1.00 0.00 O ATOM 1003 CB LEU A 63 7.109 -6.989 11.625 1.00 0.00 C ATOM 1004 CG LEU A 63 7.835 -6.491 10.372 1.00 0.00 C ATOM 1005 CD1 LEU A 63 8.444 -7.658 9.608 1.00 0.00 C ATOM 1006 CD2 LEU A 63 6.889 -5.703 9.477 1.00 0.00 C ATOM 0 H LEU A 63 9.284 -8.163 12.121 1.00 0.00 H new ATOM 0 HA LEU A 63 8.007 -5.761 13.144 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.870 -8.044 11.493 1.00 0.00 H new ATOM 0 HB3 LEU A 63 6.162 -6.457 11.714 1.00 0.00 H new ATOM 0 HG LEU A 63 8.640 -5.826 10.686 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.956 -7.285 8.721 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.158 -8.178 10.247 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.655 -8.348 9.308 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.426 -5.359 8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.060 -6.342 9.172 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.502 -4.843 10.024 1.00 0.00 H new ATOM 1018 N CYS A 64 7.427 -8.713 14.387 1.00 0.00 N ATOM 1019 CA CYS A 64 6.754 -9.426 15.469 1.00 0.00 C ATOM 1020 C CYS A 64 7.708 -10.389 16.174 1.00 0.00 C ATOM 1021 O CYS A 64 7.276 -11.376 16.768 1.00 0.00 O ATOM 1022 CB CYS A 64 5.547 -10.193 14.929 1.00 0.00 C ATOM 1023 SG CYS A 64 4.475 -9.218 13.849 1.00 0.00 S ATOM 0 H CYS A 64 8.139 -9.257 13.900 1.00 0.00 H new ATOM 0 HA CYS A 64 6.415 -8.687 16.195 1.00 0.00 H new ATOM 0 HB2 CYS A 64 5.901 -11.066 14.380 1.00 0.00 H new ATOM 0 HB3 CYS A 64 4.959 -10.562 15.769 1.00 0.00 H new ATOM 1028 N LYS A 65 9.003 -10.096 16.105 1.00 0.00 N ATOM 1029 CA LYS A 65 10.015 -10.937 16.738 1.00 0.00 C ATOM 1030 C LYS A 65 9.832 -12.405 16.356 1.00 0.00 C ATOM 1031 O LYS A 65 10.206 -13.303 17.110 1.00 0.00 O ATOM 1032 CB LYS A 65 9.955 -10.785 18.258 1.00 0.00 C ATOM 1033 CG LYS A 65 9.940 -9.337 18.724 1.00 0.00 C ATOM 1034 CD LYS A 65 9.108 -9.167 19.985 1.00 0.00 C ATOM 1035 CE LYS A 65 9.724 -9.904 21.163 1.00 0.00 C ATOM 1036 NZ LYS A 65 8.974 -9.660 22.425 1.00 0.00 N ATOM 0 H LYS A 65 9.377 -9.282 15.617 1.00 0.00 H new ATOM 0 HA LYS A 65 10.992 -10.610 16.382 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.062 -11.287 18.630 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.813 -11.291 18.700 1.00 0.00 H new ATOM 0 HG2 LYS A 65 10.961 -9.004 18.912 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.538 -8.703 17.933 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.020 -8.107 20.224 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.099 -9.539 19.809 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.742 -10.973 20.953 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.759 -9.586 21.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.426 -10.180 23.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.978 -8.642 22.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.993 -9.987 22.314 1.00 0.00 H new ATOM 1050 N ASN A 66 9.254 -12.640 15.183 1.00 0.00 N ATOM 1051 CA ASN A 66 9.020 -13.998 14.704 1.00 0.00 C ATOM 1052 C ASN A 66 10.299 -14.599 14.126 1.00 0.00 C ATOM 1053 O ASN A 66 11.388 -14.053 14.301 1.00 0.00 O ATOM 1054 CB ASN A 66 7.914 -14.005 13.647 1.00 0.00 C ATOM 1055 CG ASN A 66 6.987 -15.196 13.788 1.00 0.00 C ATOM 1056 OD1 ASN A 66 7.102 -16.179 13.056 1.00 0.00 O ATOM 1057 ND2 ASN A 66 6.058 -15.112 14.735 1.00 0.00 N ATOM 0 H ASN A 66 8.939 -11.908 14.546 1.00 0.00 H new ATOM 0 HA ASN A 66 8.705 -14.607 15.551 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.334 -13.085 13.726 1.00 0.00 H new ATOM 0 HB3 ASN A 66 8.364 -14.014 12.654 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.404 -15.882 14.878 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.999 -14.278 15.319 1.00 0.00 H new ATOM 1064 N ASP A 67 10.158 -15.728 13.437 1.00 0.00 N ATOM 1065 CA ASP A 67 11.300 -16.403 12.835 1.00 0.00 C ATOM 1066 C ASP A 67 10.979 -16.856 11.414 1.00 0.00 C ATOM 1067 O ASP A 67 10.213 -17.799 11.210 1.00 0.00 O ATOM 1068 CB ASP A 67 11.715 -17.606 13.686 1.00 0.00 C ATOM 1069 CG ASP A 67 13.221 -17.745 13.795 1.00 0.00 C ATOM 1070 OD1 ASP A 67 13.909 -17.581 12.766 1.00 0.00 O ATOM 1071 OD2 ASP A 67 13.712 -18.020 14.910 1.00 0.00 O ATOM 0 H ASP A 67 9.264 -16.193 13.283 1.00 0.00 H new ATOM 0 HA ASP A 67 12.127 -15.695 12.792 1.00 0.00 H new ATOM 0 HB2 ASP A 67 11.289 -17.506 14.684 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.299 -18.515 13.252 1.00 0.00 H new ATOM 1076 N ILE A 68 11.570 -16.179 10.435 1.00 0.00 N ATOM 1077 CA ILE A 68 11.346 -16.511 9.032 1.00 0.00 C ATOM 1078 C ILE A 68 12.440 -17.432 8.504 1.00 0.00 C ATOM 1079 O ILE A 68 13.540 -17.485 9.053 1.00 0.00 O ATOM 1080 CB ILE A 68 11.291 -15.245 8.156 1.00 0.00 C ATOM 1081 CG1 ILE A 68 10.363 -14.200 8.782 1.00 0.00 C ATOM 1082 CG2 ILE A 68 10.836 -15.595 6.748 1.00 0.00 C ATOM 1083 CD1 ILE A 68 11.058 -12.896 9.113 1.00 0.00 C ATOM 0 H ILE A 68 12.208 -15.397 10.587 1.00 0.00 H new ATOM 0 HA ILE A 68 10.385 -17.023 8.978 1.00 0.00 H new ATOM 0 HB ILE A 68 12.293 -14.819 8.097 1.00 0.00 H new ATOM 0 HG12 ILE A 68 9.539 -14.000 8.097 1.00 0.00 H new ATOM 0 HG13 ILE A 68 9.927 -14.612 9.692 1.00 0.00 H new ATOM 0 HG21 ILE A 68 10.802 -14.690 6.141 1.00 0.00 H new ATOM 0 HG22 ILE A 68 11.536 -16.303 6.305 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.843 -16.043 6.787 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.341 -12.203 9.553 1.00 0.00 H new ATOM 0 HD12 ILE A 68 11.864 -13.083 9.823 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.470 -12.462 8.202 1.00 0.00 H new ATOM 1095 N THR A 69 12.131 -18.156 7.433 1.00 0.00 N ATOM 1096 CA THR A 69 13.089 -19.075 6.827 1.00 0.00 C ATOM 1097 C THR A 69 13.069 -18.955 5.307 1.00 0.00 C ATOM 1098 O THR A 69 12.023 -18.714 4.706 1.00 0.00 O ATOM 1099 CB THR A 69 12.780 -20.516 7.244 1.00 0.00 C ATOM 1100 OG1 THR A 69 11.453 -20.627 7.723 1.00 0.00 O ATOM 1101 CG2 THR A 69 13.703 -21.037 8.323 1.00 0.00 C ATOM 0 H THR A 69 11.224 -18.124 6.966 1.00 0.00 H new ATOM 0 HA THR A 69 14.085 -18.809 7.181 1.00 0.00 H new ATOM 0 HB THR A 69 12.925 -21.114 6.344 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.275 -21.555 7.982 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.430 -22.062 8.572 1.00 0.00 H new ATOM 0 HG22 THR A 69 14.732 -21.013 7.965 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.613 -20.412 9.211 1.00 0.00 H new ATOM 1109 N LYS A 70 14.234 -19.126 4.690 1.00 0.00 N ATOM 1110 CA LYS A 70 14.351 -19.038 3.238 1.00 0.00 C ATOM 1111 C LYS A 70 13.625 -20.196 2.563 1.00 0.00 C ATOM 1112 O LYS A 70 14.236 -21.206 2.213 1.00 0.00 O ATOM 1113 CB LYS A 70 15.823 -19.033 2.824 1.00 0.00 C ATOM 1114 CG LYS A 70 16.591 -20.260 3.289 1.00 0.00 C ATOM 1115 CD LYS A 70 17.621 -19.907 4.352 1.00 0.00 C ATOM 1116 CE LYS A 70 18.646 -18.915 3.827 1.00 0.00 C ATOM 1117 NZ LYS A 70 19.883 -18.903 4.656 1.00 0.00 N ATOM 0 H LYS A 70 15.110 -19.326 5.172 1.00 0.00 H new ATOM 0 HA LYS A 70 13.887 -18.105 2.917 1.00 0.00 H new ATOM 0 HB2 LYS A 70 15.886 -18.966 1.738 1.00 0.00 H new ATOM 0 HB3 LYS A 70 16.302 -18.141 3.227 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.894 -20.997 3.688 1.00 0.00 H new ATOM 0 HG3 LYS A 70 17.090 -20.722 2.437 1.00 0.00 H new ATOM 0 HD2 LYS A 70 17.118 -19.485 5.222 1.00 0.00 H new ATOM 0 HD3 LYS A 70 18.127 -20.813 4.685 1.00 0.00 H new ATOM 0 HE2 LYS A 70 18.901 -19.167 2.798 1.00 0.00 H new ATOM 0 HE3 LYS A 70 18.210 -17.916 3.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 20.556 -18.214 4.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 19.644 -18.637 5.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 20.314 -19.850 4.650 1.00 0.00 H new ATOM 1131 N ARG A 71 12.316 -20.043 2.382 1.00 0.00 N ATOM 1132 CA ARG A 71 11.505 -21.078 1.749 1.00 0.00 C ATOM 1133 C ARG A 71 10.043 -20.650 1.661 1.00 0.00 C ATOM 1134 O ARG A 71 9.360 -20.941 0.679 1.00 0.00 O ATOM 1135 CB ARG A 71 11.617 -22.392 2.525 1.00 0.00 C ATOM 1136 CG ARG A 71 11.615 -23.626 1.637 1.00 0.00 C ATOM 1137 CD ARG A 71 12.959 -23.822 0.954 1.00 0.00 C ATOM 1138 NE ARG A 71 12.877 -24.772 -0.153 1.00 0.00 N ATOM 1139 CZ ARG A 71 13.795 -24.875 -1.110 1.00 0.00 C ATOM 1140 NH1 ARG A 71 14.866 -24.090 -1.101 1.00 0.00 N ATOM 1141 NH2 ARG A 71 13.644 -25.766 -2.081 1.00 0.00 N ATOM 0 H ARG A 71 11.795 -19.213 2.665 1.00 0.00 H new ATOM 0 HA ARG A 71 11.882 -21.228 0.737 1.00 0.00 H new ATOM 0 HB2 ARG A 71 12.535 -22.380 3.113 1.00 0.00 H new ATOM 0 HB3 ARG A 71 10.788 -22.460 3.229 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.378 -24.506 2.235 1.00 0.00 H new ATOM 0 HG3 ARG A 71 10.833 -23.532 0.884 1.00 0.00 H new ATOM 0 HD2 ARG A 71 13.320 -22.863 0.583 1.00 0.00 H new ATOM 0 HD3 ARG A 71 13.688 -24.177 1.683 1.00 0.00 H new ATOM 0 HE ARG A 71 12.069 -25.393 -0.194 1.00 0.00 H new ATOM 0 HH11 ARG A 71 14.988 -23.403 -0.357 1.00 0.00 H new ATOM 0 HH12 ARG A 71 15.566 -24.174 -1.838 1.00 0.00 H new ATOM 0 HH21 ARG A 71 12.824 -26.372 -2.094 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.348 -25.845 -2.815 1.00 0.00 H new ATOM 1155 N SER A 72 9.570 -19.961 2.694 1.00 0.00 N ATOM 1156 CA SER A 72 8.188 -19.495 2.732 1.00 0.00 C ATOM 1157 C SER A 72 8.083 -18.049 2.260 1.00 0.00 C ATOM 1158 O SER A 72 7.292 -17.267 2.789 1.00 0.00 O ATOM 1159 CB SER A 72 7.627 -19.622 4.151 1.00 0.00 C ATOM 1160 OG SER A 72 7.028 -20.891 4.351 1.00 0.00 O ATOM 0 H SER A 72 10.122 -19.713 3.515 1.00 0.00 H new ATOM 0 HA SER A 72 7.603 -20.119 2.056 1.00 0.00 H new ATOM 0 HB2 SER A 72 8.427 -19.476 4.876 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.891 -18.837 4.326 1.00 0.00 H new ATOM 0 HG SER A 72 6.107 -20.874 4.017 1.00 0.00 H new ATOM 1166 N LEU A 73 8.883 -17.698 1.257 1.00 0.00 N ATOM 1167 CA LEU A 73 8.876 -16.346 0.711 1.00 0.00 C ATOM 1168 C LEU A 73 8.355 -16.340 -0.722 1.00 0.00 C ATOM 1169 O LEU A 73 9.011 -16.844 -1.633 1.00 0.00 O ATOM 1170 CB LEU A 73 10.284 -15.747 0.758 1.00 0.00 C ATOM 1171 CG LEU A 73 10.733 -15.254 2.134 1.00 0.00 C ATOM 1172 CD1 LEU A 73 9.932 -14.032 2.551 1.00 0.00 C ATOM 1173 CD2 LEU A 73 10.596 -16.362 3.167 1.00 0.00 C ATOM 0 H LEU A 73 9.544 -18.331 0.807 1.00 0.00 H new ATOM 0 HA LEU A 73 8.209 -15.738 1.322 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.993 -16.497 0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.331 -14.913 0.057 1.00 0.00 H new ATOM 0 HG LEU A 73 11.783 -14.970 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.266 -13.696 3.533 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.081 -13.234 1.824 1.00 0.00 H new ATOM 0 HD13 LEU A 73 8.874 -14.289 2.596 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.920 -15.994 4.141 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.554 -16.677 3.226 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.216 -17.210 2.875 1.00 0.00 H new ATOM 1185 N GLN A 74 7.171 -15.767 -0.913 1.00 0.00 N ATOM 1186 CA GLN A 74 6.561 -15.696 -2.237 1.00 0.00 C ATOM 1187 C GLN A 74 6.350 -14.246 -2.661 1.00 0.00 C ATOM 1188 O GLN A 74 5.547 -13.525 -2.068 1.00 0.00 O ATOM 1189 CB GLN A 74 5.226 -16.442 -2.247 1.00 0.00 C ATOM 1190 CG GLN A 74 4.339 -16.116 -1.057 1.00 0.00 C ATOM 1191 CD GLN A 74 2.891 -16.502 -1.287 1.00 0.00 C ATOM 1192 OE1 GLN A 74 2.419 -16.538 -2.423 1.00 0.00 O ATOM 1193 NE2 GLN A 74 2.177 -16.795 -0.205 1.00 0.00 N ATOM 0 H GLN A 74 6.615 -15.345 -0.169 1.00 0.00 H new ATOM 0 HA GLN A 74 7.238 -16.169 -2.948 1.00 0.00 H new ATOM 0 HB2 GLN A 74 4.691 -16.200 -3.165 1.00 0.00 H new ATOM 0 HB3 GLN A 74 5.419 -17.515 -2.263 1.00 0.00 H new ATOM 0 HG2 GLN A 74 4.714 -16.636 -0.175 1.00 0.00 H new ATOM 0 HG3 GLN A 74 4.398 -15.048 -0.846 1.00 0.00 H new ATOM 0 HE21 GLN A 74 2.609 -16.752 0.718 1.00 0.00 H new ATOM 0 HE22 GLN A 74 1.197 -17.063 -0.298 1.00 0.00 H new ATOM 1202 N GLU A 75 7.075 -13.825 -3.692 1.00 0.00 N ATOM 1203 CA GLU A 75 6.967 -12.460 -4.196 1.00 0.00 C ATOM 1204 C GLU A 75 5.563 -12.187 -4.726 1.00 0.00 C ATOM 1205 O GLU A 75 5.220 -12.589 -5.838 1.00 0.00 O ATOM 1206 CB GLU A 75 7.997 -12.218 -5.299 1.00 0.00 C ATOM 1207 CG GLU A 75 9.385 -12.739 -4.961 1.00 0.00 C ATOM 1208 CD GLU A 75 10.466 -12.123 -5.826 1.00 0.00 C ATOM 1209 OE1 GLU A 75 10.281 -10.973 -6.278 1.00 0.00 O ATOM 1210 OE2 GLU A 75 11.498 -12.789 -6.053 1.00 0.00 O ATOM 0 H GLU A 75 7.743 -14.409 -4.195 1.00 0.00 H new ATOM 0 HA GLU A 75 7.164 -11.777 -3.370 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.653 -12.695 -6.217 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.058 -11.148 -5.499 1.00 0.00 H new ATOM 0 HG2 GLU A 75 9.601 -12.532 -3.913 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.402 -13.822 -5.082 1.00 0.00 H new ATOM 1217 N SER A 76 4.756 -11.501 -3.924 1.00 0.00 N ATOM 1218 CA SER A 76 3.390 -11.173 -4.313 1.00 0.00 C ATOM 1219 C SER A 76 3.318 -9.773 -4.916 1.00 0.00 C ATOM 1220 O SER A 76 3.737 -8.796 -4.293 1.00 0.00 O ATOM 1221 CB SER A 76 2.456 -11.269 -3.106 1.00 0.00 C ATOM 1222 OG SER A 76 2.516 -12.556 -2.516 1.00 0.00 O ATOM 0 H SER A 76 5.025 -11.161 -3.000 1.00 0.00 H new ATOM 0 HA SER A 76 3.071 -11.892 -5.068 1.00 0.00 H new ATOM 0 HB2 SER A 76 2.730 -10.514 -2.369 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.433 -11.055 -3.416 1.00 0.00 H new ATOM 0 HG SER A 76 1.814 -13.124 -2.898 1.00 0.00 H new ATOM 1228 N THR A 77 2.786 -9.683 -6.129 1.00 0.00 N ATOM 1229 CA THR A 77 2.662 -8.402 -6.816 1.00 0.00 C ATOM 1230 C THR A 77 1.399 -7.667 -6.372 1.00 0.00 C ATOM 1231 O THR A 77 0.540 -7.337 -7.190 1.00 0.00 O ATOM 1232 CB THR A 77 2.643 -8.611 -8.332 1.00 0.00 C ATOM 1233 OG1 THR A 77 3.838 -9.235 -8.766 1.00 0.00 O ATOM 1234 CG2 THR A 77 2.487 -7.323 -9.112 1.00 0.00 C ATOM 0 H THR A 77 2.434 -10.481 -6.657 1.00 0.00 H new ATOM 0 HA THR A 77 3.526 -7.791 -6.554 1.00 0.00 H new ATOM 0 HB THR A 77 1.775 -9.241 -8.527 1.00 0.00 H new ATOM 0 HG1 THR A 77 3.657 -10.174 -8.981 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.481 -7.543 -10.180 1.00 0.00 H new ATOM 0 HG22 THR A 77 1.549 -6.842 -8.835 1.00 0.00 H new ATOM 0 HG23 THR A 77 3.318 -6.656 -8.883 1.00 0.00 H new ATOM 1242 N ARG A 78 1.295 -7.410 -5.073 1.00 0.00 N ATOM 1243 CA ARG A 78 0.139 -6.711 -4.526 1.00 0.00 C ATOM 1244 C ARG A 78 0.533 -5.329 -4.012 1.00 0.00 C ATOM 1245 O ARG A 78 -0.267 -4.394 -4.039 1.00 0.00 O ATOM 1246 CB ARG A 78 -0.496 -7.529 -3.398 1.00 0.00 C ATOM 1247 CG ARG A 78 0.406 -7.701 -2.187 1.00 0.00 C ATOM 1248 CD ARG A 78 -0.396 -8.037 -0.940 1.00 0.00 C ATOM 1249 NE ARG A 78 0.403 -8.760 0.047 1.00 0.00 N ATOM 1250 CZ ARG A 78 0.660 -10.064 -0.019 1.00 0.00 C ATOM 1251 NH1 ARG A 78 0.187 -10.792 -1.024 1.00 0.00 N ATOM 1252 NH2 ARG A 78 1.392 -10.643 0.923 1.00 0.00 N ATOM 0 H ARG A 78 1.996 -7.675 -4.381 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.591 -6.587 -5.326 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.421 -7.044 -3.085 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -0.766 -8.513 -3.782 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.130 -8.493 -2.380 1.00 0.00 H new ATOM 0 HG3 ARG A 78 0.973 -6.785 -2.021 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -0.776 -7.118 -0.495 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -1.261 -8.639 -1.217 1.00 0.00 H new ATOM 0 HE ARG A 78 0.786 -8.234 0.833 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.377 -10.352 -1.751 1.00 0.00 H new ATOM 0 HH12 ARG A 78 0.388 -11.791 -1.069 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.758 -10.089 1.697 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.589 -11.642 0.873 1.00 0.00 H new ATOM 1266 N PHE A 79 1.773 -5.207 -3.547 1.00 0.00 N ATOM 1267 CA PHE A 79 2.274 -3.938 -3.031 1.00 0.00 C ATOM 1268 C PHE A 79 3.261 -3.306 -4.010 1.00 0.00 C ATOM 1269 O PHE A 79 4.163 -2.572 -3.609 1.00 0.00 O ATOM 1270 CB PHE A 79 2.946 -4.146 -1.673 1.00 0.00 C ATOM 1271 CG PHE A 79 2.020 -3.954 -0.504 1.00 0.00 C ATOM 1272 CD1 PHE A 79 0.722 -4.441 -0.544 1.00 0.00 C ATOM 1273 CD2 PHE A 79 2.446 -3.288 0.634 1.00 0.00 C ATOM 1274 CE1 PHE A 79 -0.131 -4.266 0.529 1.00 0.00 C ATOM 1275 CE2 PHE A 79 1.597 -3.111 1.709 1.00 0.00 C ATOM 1276 CZ PHE A 79 0.307 -3.601 1.657 1.00 0.00 C ATOM 0 H PHE A 79 2.448 -5.971 -3.517 1.00 0.00 H new ATOM 0 HA PHE A 79 1.427 -3.263 -2.909 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.362 -5.153 -1.634 1.00 0.00 H new ATOM 0 HB3 PHE A 79 3.782 -3.452 -1.581 1.00 0.00 H new ATOM 0 HD1 PHE A 79 0.374 -4.963 -1.423 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.454 -2.903 0.681 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.140 -4.649 0.485 1.00 0.00 H new ATOM 0 HE2 PHE A 79 1.942 -2.590 2.590 1.00 0.00 H new ATOM 0 HZ PHE A 79 -0.358 -3.464 2.497 1.00 0.00 H new ATOM 1286 N SER A 80 3.082 -3.598 -5.295 1.00 0.00 N ATOM 1287 CA SER A 80 3.955 -3.059 -6.331 1.00 0.00 C ATOM 1288 C SER A 80 3.432 -1.721 -6.840 1.00 0.00 C ATOM 1289 O SER A 80 4.095 -0.692 -6.703 1.00 0.00 O ATOM 1290 CB SER A 80 4.074 -4.048 -7.492 1.00 0.00 C ATOM 1291 OG SER A 80 4.604 -3.418 -8.647 1.00 0.00 O ATOM 0 H SER A 80 2.340 -4.205 -5.643 1.00 0.00 H new ATOM 0 HA SER A 80 4.941 -2.901 -5.895 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.715 -4.880 -7.201 1.00 0.00 H new ATOM 0 HB3 SER A 80 3.093 -4.466 -7.720 1.00 0.00 H new ATOM 0 HG SER A 80 4.672 -4.071 -9.374 1.00 0.00 H new ATOM 1297 N GLN A 81 2.240 -1.741 -7.425 1.00 0.00 N ATOM 1298 CA GLN A 81 1.627 -0.529 -7.954 1.00 0.00 C ATOM 1299 C GLN A 81 1.471 0.521 -6.859 1.00 0.00 C ATOM 1300 O GLN A 81 1.532 1.722 -7.124 1.00 0.00 O ATOM 1301 CB GLN A 81 0.263 -0.849 -8.568 1.00 0.00 C ATOM 1302 CG GLN A 81 0.323 -1.887 -9.678 1.00 0.00 C ATOM 1303 CD GLN A 81 0.405 -1.261 -11.056 1.00 0.00 C ATOM 1304 OE1 GLN A 81 -0.237 -0.247 -11.330 1.00 0.00 O ATOM 1305 NE2 GLN A 81 1.196 -1.867 -11.935 1.00 0.00 N ATOM 0 H GLN A 81 1.679 -2.584 -7.545 1.00 0.00 H new ATOM 0 HA GLN A 81 2.281 -0.128 -8.728 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -0.404 -1.206 -7.784 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.172 0.069 -8.963 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.189 -2.530 -9.523 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -0.560 -2.523 -9.624 1.00 0.00 H new ATOM 0 HE21 GLN A 81 1.710 -2.706 -11.665 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.289 -1.494 -12.880 1.00 0.00 H new ATOM 1314 N LEU A 82 1.270 0.061 -5.629 1.00 0.00 N ATOM 1315 CA LEU A 82 1.108 0.960 -4.492 1.00 0.00 C ATOM 1316 C LEU A 82 2.344 1.835 -4.310 1.00 0.00 C ATOM 1317 O LEU A 82 2.253 3.062 -4.306 1.00 0.00 O ATOM 1318 CB LEU A 82 0.838 0.160 -3.217 1.00 0.00 C ATOM 1319 CG LEU A 82 -0.397 -0.742 -3.270 1.00 0.00 C ATOM 1320 CD1 LEU A 82 -0.501 -1.583 -2.008 1.00 0.00 C ATOM 1321 CD2 LEU A 82 -1.654 0.092 -3.463 1.00 0.00 C ATOM 0 H LEU A 82 1.215 -0.930 -5.394 1.00 0.00 H new ATOM 0 HA LEU A 82 0.255 1.608 -4.691 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.711 -0.456 -3.001 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.726 0.856 -2.386 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.296 -1.416 -4.121 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.386 -2.217 -2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.388 -2.207 -1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.580 -0.928 -1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.524 -0.564 -3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.759 0.789 -2.632 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.581 0.649 -4.397 1.00 0.00 H new ATOM 1333 N VAL A 83 3.499 1.194 -4.160 1.00 0.00 N ATOM 1334 CA VAL A 83 4.755 1.915 -3.981 1.00 0.00 C ATOM 1335 C VAL A 83 5.031 2.828 -5.172 1.00 0.00 C ATOM 1336 O VAL A 83 5.285 4.022 -5.006 1.00 0.00 O ATOM 1337 CB VAL A 83 5.939 0.945 -3.804 1.00 0.00 C ATOM 1338 CG1 VAL A 83 7.196 1.705 -3.406 1.00 0.00 C ATOM 1339 CG2 VAL A 83 5.608 -0.128 -2.774 1.00 0.00 C ATOM 0 H VAL A 83 3.591 0.178 -4.159 1.00 0.00 H new ATOM 0 HA VAL A 83 4.654 2.517 -3.078 1.00 0.00 H new ATOM 0 HB VAL A 83 6.124 0.452 -4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 83 8.022 1.004 -3.285 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.445 2.429 -4.182 1.00 0.00 H new ATOM 0 HG13 VAL A 83 7.023 2.227 -2.465 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.458 -0.802 -2.665 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.392 0.343 -1.815 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.737 -0.693 -3.105 1.00 0.00 H new ATOM 1349 N GLU A 84 4.973 2.259 -6.370 1.00 0.00 N ATOM 1350 CA GLU A 84 5.213 3.022 -7.590 1.00 0.00 C ATOM 1351 C GLU A 84 4.192 4.146 -7.731 1.00 0.00 C ATOM 1352 O GLU A 84 4.513 5.232 -8.215 1.00 0.00 O ATOM 1353 CB GLU A 84 5.150 2.104 -8.812 1.00 0.00 C ATOM 1354 CG GLU A 84 6.431 1.320 -9.050 1.00 0.00 C ATOM 1355 CD GLU A 84 7.537 2.176 -9.637 1.00 0.00 C ATOM 1356 OE1 GLU A 84 7.218 3.147 -10.355 1.00 0.00 O ATOM 1357 OE2 GLU A 84 8.721 1.875 -9.379 1.00 0.00 O ATOM 0 H GLU A 84 4.762 1.273 -6.523 1.00 0.00 H new ATOM 0 HA GLU A 84 6.209 3.461 -7.527 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.323 1.404 -8.688 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.931 2.703 -9.696 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.770 0.890 -8.107 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.224 0.488 -9.723 1.00 0.00 H new ATOM 1364 N GLU A 85 2.962 3.880 -7.301 1.00 0.00 N ATOM 1365 CA GLU A 85 1.896 4.872 -7.375 1.00 0.00 C ATOM 1366 C GLU A 85 2.275 6.130 -6.604 1.00 0.00 C ATOM 1367 O GLU A 85 2.063 7.247 -7.075 1.00 0.00 O ATOM 1368 CB GLU A 85 0.591 4.294 -6.822 1.00 0.00 C ATOM 1369 CG GLU A 85 -0.281 3.638 -7.881 1.00 0.00 C ATOM 1370 CD GLU A 85 -0.993 4.649 -8.757 1.00 0.00 C ATOM 1371 OE1 GLU A 85 -1.888 5.353 -8.243 1.00 0.00 O ATOM 1372 OE2 GLU A 85 -0.656 4.738 -9.955 1.00 0.00 O ATOM 0 H GLU A 85 2.680 2.986 -6.898 1.00 0.00 H new ATOM 0 HA GLU A 85 1.751 5.137 -8.422 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.826 3.560 -6.051 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.025 5.092 -6.340 1.00 0.00 H new ATOM 0 HG2 GLU A 85 0.336 2.992 -8.506 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -1.019 3.000 -7.395 1.00 0.00 H new ATOM 1379 N LEU A 86 2.846 5.941 -5.418 1.00 0.00 N ATOM 1380 CA LEU A 86 3.261 7.061 -4.583 1.00 0.00 C ATOM 1381 C LEU A 86 4.245 7.953 -5.333 1.00 0.00 C ATOM 1382 O LEU A 86 4.137 9.179 -5.301 1.00 0.00 O ATOM 1383 CB LEU A 86 3.897 6.550 -3.286 1.00 0.00 C ATOM 1384 CG LEU A 86 3.072 6.798 -2.022 1.00 0.00 C ATOM 1385 CD1 LEU A 86 2.773 8.282 -1.861 1.00 0.00 C ATOM 1386 CD2 LEU A 86 1.783 5.991 -2.061 1.00 0.00 C ATOM 0 H LEU A 86 3.031 5.023 -5.015 1.00 0.00 H new ATOM 0 HA LEU A 86 2.378 7.650 -4.335 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.073 5.479 -3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.871 7.024 -3.165 1.00 0.00 H new ATOM 0 HG LEU A 86 3.654 6.472 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.185 8.439 -0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.709 8.836 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.210 8.636 -2.725 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.208 6.179 -1.154 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.196 6.285 -2.931 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.020 4.929 -2.126 1.00 0.00 H new ATOM 1398 N LEU A 87 5.202 7.328 -6.012 1.00 0.00 N ATOM 1399 CA LEU A 87 6.203 8.064 -6.774 1.00 0.00 C ATOM 1400 C LEU A 87 5.540 8.957 -7.820 1.00 0.00 C ATOM 1401 O LEU A 87 6.065 10.013 -8.173 1.00 0.00 O ATOM 1402 CB LEU A 87 7.172 7.093 -7.454 1.00 0.00 C ATOM 1403 CG LEU A 87 8.479 6.848 -6.697 1.00 0.00 C ATOM 1404 CD1 LEU A 87 9.345 8.097 -6.709 1.00 0.00 C ATOM 1405 CD2 LEU A 87 8.192 6.408 -5.270 1.00 0.00 C ATOM 0 H LEU A 87 5.305 6.314 -6.050 1.00 0.00 H new ATOM 0 HA LEU A 87 6.760 8.696 -6.082 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.666 6.138 -7.595 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.411 7.476 -8.446 1.00 0.00 H new ATOM 0 HG LEU A 87 9.025 6.049 -7.200 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.270 7.904 -6.166 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.579 8.368 -7.739 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.808 8.916 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 87 9.132 6.238 -4.746 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.626 7.185 -4.757 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.612 5.485 -5.283 1.00 0.00 H new ATOM 1417 N LYS A 88 4.382 8.525 -8.311 1.00 0.00 N ATOM 1418 CA LYS A 88 3.645 9.285 -9.314 1.00 0.00 C ATOM 1419 C LYS A 88 2.783 10.359 -8.660 1.00 0.00 C ATOM 1420 O LYS A 88 2.739 11.500 -9.120 1.00 0.00 O ATOM 1421 CB LYS A 88 2.770 8.350 -10.150 1.00 0.00 C ATOM 1422 CG LYS A 88 3.563 7.373 -11.001 1.00 0.00 C ATOM 1423 CD LYS A 88 2.648 6.474 -11.817 1.00 0.00 C ATOM 1424 CE LYS A 88 3.253 5.094 -12.016 1.00 0.00 C ATOM 1425 NZ LYS A 88 4.397 5.122 -12.969 1.00 0.00 N ATOM 0 H LYS A 88 3.934 7.653 -8.030 1.00 0.00 H new ATOM 0 HA LYS A 88 4.368 9.775 -9.966 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.113 7.789 -9.485 1.00 0.00 H new ATOM 0 HB3 LYS A 88 2.131 8.948 -10.799 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.224 7.925 -11.670 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.197 6.762 -10.359 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.685 6.381 -11.314 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.458 6.932 -12.788 1.00 0.00 H new ATOM 0 HE2 LYS A 88 3.590 4.703 -11.056 1.00 0.00 H new ATOM 0 HE3 LYS A 88 2.488 4.412 -12.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.782 4.162 -13.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.071 5.471 -13.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.138 5.753 -12.603 1.00 0.00 H new ATOM 1439 N ILE A 89 2.097 9.987 -7.582 1.00 0.00 N ATOM 1440 CA ILE A 89 1.237 10.920 -6.865 1.00 0.00 C ATOM 1441 C ILE A 89 2.048 12.070 -6.274 1.00 0.00 C ATOM 1442 O ILE A 89 1.604 13.218 -6.268 1.00 0.00 O ATOM 1443 CB ILE A 89 0.458 10.215 -5.736 1.00 0.00 C ATOM 1444 CG1 ILE A 89 -0.315 9.018 -6.290 1.00 0.00 C ATOM 1445 CG2 ILE A 89 -0.489 11.189 -5.050 1.00 0.00 C ATOM 1446 CD1 ILE A 89 -0.606 7.952 -5.255 1.00 0.00 C ATOM 0 H ILE A 89 2.121 9.047 -7.187 1.00 0.00 H new ATOM 0 HA ILE A 89 0.526 11.317 -7.589 1.00 0.00 H new ATOM 0 HB ILE A 89 1.173 9.854 -4.997 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.257 9.368 -6.713 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.255 8.574 -7.106 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.030 10.673 -4.257 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.083 12.013 -4.623 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.200 11.580 -5.778 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -1.157 7.134 -5.720 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.332 7.573 -4.849 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.203 8.380 -4.450 1.00 0.00 H new ATOM 1458 N ILE A 90 3.240 11.753 -5.778 1.00 0.00 N ATOM 1459 CA ILE A 90 4.112 12.761 -5.187 1.00 0.00 C ATOM 1460 C ILE A 90 4.718 13.659 -6.262 1.00 0.00 C ATOM 1461 O ILE A 90 4.827 14.872 -6.082 1.00 0.00 O ATOM 1462 CB ILE A 90 5.249 12.114 -4.371 1.00 0.00 C ATOM 1463 CG1 ILE A 90 4.680 11.113 -3.363 1.00 0.00 C ATOM 1464 CG2 ILE A 90 6.067 13.182 -3.658 1.00 0.00 C ATOM 1465 CD1 ILE A 90 5.592 9.934 -3.103 1.00 0.00 C ATOM 0 H ILE A 90 3.623 10.808 -5.774 1.00 0.00 H new ATOM 0 HA ILE A 90 3.495 13.362 -4.519 1.00 0.00 H new ATOM 0 HB ILE A 90 5.905 11.578 -5.057 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.487 11.627 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.721 10.747 -3.729 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.865 12.708 -3.087 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.500 13.860 -4.393 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.422 13.744 -2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.125 9.266 -2.379 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.765 9.396 -4.035 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.543 10.290 -2.707 1.00 0.00 H new ATOM 1477 N CYS A 91 5.110 13.054 -7.378 1.00 0.00 N ATOM 1478 CA CYS A 91 5.705 13.799 -8.482 1.00 0.00 C ATOM 1479 C CYS A 91 4.732 14.844 -9.019 1.00 0.00 C ATOM 1480 O CYS A 91 5.119 15.977 -9.306 1.00 0.00 O ATOM 1481 CB CYS A 91 6.118 12.845 -9.604 1.00 0.00 C ATOM 1482 SG CYS A 91 7.805 12.212 -9.450 1.00 0.00 S ATOM 0 H CYS A 91 5.027 12.051 -7.542 1.00 0.00 H new ATOM 0 HA CYS A 91 6.590 14.312 -8.107 1.00 0.00 H new ATOM 0 HB2 CYS A 91 5.426 12.003 -9.624 1.00 0.00 H new ATOM 0 HB3 CYS A 91 6.020 13.361 -10.559 1.00 0.00 H new ATOM 0 HG CYS A 91 7.774 11.009 -8.959 1.00 0.00 H new ATOM 1488 N ALA A 92 3.469 14.454 -9.153 1.00 0.00 N ATOM 1489 CA ALA A 92 2.440 15.357 -9.656 1.00 0.00 C ATOM 1490 C ALA A 92 2.266 16.558 -8.734 1.00 0.00 C ATOM 1491 O ALA A 92 2.074 17.684 -9.194 1.00 0.00 O ATOM 1492 CB ALA A 92 1.121 14.616 -9.817 1.00 0.00 C ATOM 0 H ALA A 92 3.133 13.519 -8.921 1.00 0.00 H new ATOM 0 HA ALA A 92 2.759 15.725 -10.631 1.00 0.00 H new ATOM 0 HB1 ALA A 92 0.362 15.302 -10.193 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.249 13.794 -10.522 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.806 14.220 -8.852 1.00 0.00 H new ATOM 1498 N PHE A 93 2.335 16.311 -7.429 1.00 0.00 N ATOM 1499 CA PHE A 93 2.185 17.373 -6.441 1.00 0.00 C ATOM 1500 C PHE A 93 3.250 18.449 -6.631 1.00 0.00 C ATOM 1501 O PHE A 93 2.937 19.636 -6.723 1.00 0.00 O ATOM 1502 CB PHE A 93 2.273 16.798 -5.027 1.00 0.00 C ATOM 1503 CG PHE A 93 1.962 17.798 -3.951 1.00 0.00 C ATOM 1504 CD1 PHE A 93 0.667 18.258 -3.766 1.00 0.00 C ATOM 1505 CD2 PHE A 93 2.964 18.279 -3.123 1.00 0.00 C ATOM 1506 CE1 PHE A 93 0.378 19.178 -2.777 1.00 0.00 C ATOM 1507 CE2 PHE A 93 2.680 19.201 -2.132 1.00 0.00 C ATOM 1508 CZ PHE A 93 1.385 19.650 -1.959 1.00 0.00 C ATOM 0 H PHE A 93 2.494 15.385 -7.032 1.00 0.00 H new ATOM 0 HA PHE A 93 1.205 17.829 -6.581 1.00 0.00 H new ATOM 0 HB2 PHE A 93 1.583 15.959 -4.942 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.276 16.404 -4.866 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.125 17.893 -4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.978 17.930 -3.253 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -0.635 19.528 -2.644 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.470 19.570 -1.494 1.00 0.00 H new ATOM 0 HZ PHE A 93 1.161 20.369 -1.185 1.00 0.00 H new ATOM 1518 N GLN A 94 4.508 18.026 -6.691 1.00 0.00 N ATOM 1519 CA GLN A 94 5.618 18.952 -6.872 1.00 0.00 C ATOM 1520 C GLN A 94 5.584 19.581 -8.262 1.00 0.00 C ATOM 1521 O GLN A 94 6.025 20.715 -8.453 1.00 0.00 O ATOM 1522 CB GLN A 94 6.951 18.232 -6.659 1.00 0.00 C ATOM 1523 CG GLN A 94 7.130 17.688 -5.251 1.00 0.00 C ATOM 1524 CD GLN A 94 8.401 16.876 -5.097 1.00 0.00 C ATOM 1525 OE1 GLN A 94 8.378 15.647 -5.151 1.00 0.00 O ATOM 1526 NE2 GLN A 94 9.522 17.563 -4.904 1.00 0.00 N ATOM 0 H GLN A 94 4.784 17.047 -6.617 1.00 0.00 H new ATOM 0 HA GLN A 94 5.518 19.746 -6.132 1.00 0.00 H new ATOM 0 HB2 GLN A 94 7.028 17.409 -7.370 1.00 0.00 H new ATOM 0 HB3 GLN A 94 7.766 18.921 -6.880 1.00 0.00 H new ATOM 0 HG2 GLN A 94 7.145 18.518 -4.544 1.00 0.00 H new ATOM 0 HG3 GLN A 94 6.273 17.066 -4.994 1.00 0.00 H new ATOM 0 HE21 GLN A 94 9.496 18.582 -4.866 1.00 0.00 H new ATOM 0 HE22 GLN A 94 10.409 17.071 -4.794 1.00 0.00 H new ATOM 1535 N LEU A 95 5.057 18.838 -9.230 1.00 0.00 N ATOM 1536 CA LEU A 95 4.965 19.322 -10.602 1.00 0.00 C ATOM 1537 C LEU A 95 4.139 20.602 -10.674 1.00 0.00 C ATOM 1538 O LEU A 95 4.382 21.463 -11.519 1.00 0.00 O ATOM 1539 CB LEU A 95 4.347 18.251 -11.503 1.00 0.00 C ATOM 1540 CG LEU A 95 5.341 17.246 -12.089 1.00 0.00 C ATOM 1541 CD1 LEU A 95 4.605 16.121 -12.800 1.00 0.00 C ATOM 1542 CD2 LEU A 95 6.303 17.942 -13.041 1.00 0.00 C ATOM 0 H LEU A 95 4.687 17.898 -9.089 1.00 0.00 H new ATOM 0 HA LEU A 95 5.974 19.542 -10.951 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.596 17.705 -10.931 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.826 18.744 -12.324 1.00 0.00 H new ATOM 0 HG LEU A 95 5.918 16.815 -11.271 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.328 15.416 -13.210 1.00 0.00 H new ATOM 0 HD12 LEU A 95 3.957 15.605 -12.091 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.002 16.535 -13.608 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.003 17.213 -13.449 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.741 18.400 -13.855 1.00 0.00 H new ATOM 0 HD23 LEU A 95 6.855 18.712 -12.502 1.00 0.00 H new ATOM 1554 N ASP A 96 3.160 20.720 -9.782 1.00 0.00 N ATOM 1555 CA ASP A 96 2.297 21.895 -9.746 1.00 0.00 C ATOM 1556 C ASP A 96 2.576 22.736 -8.504 1.00 0.00 C ATOM 1557 O ASP A 96 3.088 23.852 -8.600 1.00 0.00 O ATOM 1558 CB ASP A 96 0.826 21.474 -9.770 1.00 0.00 C ATOM 1559 CG ASP A 96 0.439 20.804 -11.073 1.00 0.00 C ATOM 1560 OD1 ASP A 96 1.325 20.208 -11.721 1.00 0.00 O ATOM 1561 OD2 ASP A 96 -0.751 20.877 -11.448 1.00 0.00 O ATOM 0 H ASP A 96 2.945 20.017 -9.075 1.00 0.00 H new ATOM 0 HA ASP A 96 2.510 22.499 -10.628 1.00 0.00 H new ATOM 0 HB2 ASP A 96 0.632 20.792 -8.942 1.00 0.00 H new ATOM 0 HB3 ASP A 96 0.197 22.351 -9.614 1.00 0.00 H new ATOM 1566 N THR A 97 2.236 22.195 -7.338 1.00 0.00 N ATOM 1567 CA THR A 97 2.450 22.898 -6.078 1.00 0.00 C ATOM 1568 C THR A 97 3.930 23.200 -5.869 1.00 0.00 C ATOM 1569 O THR A 97 4.294 24.278 -5.398 1.00 0.00 O ATOM 1570 CB THR A 97 1.918 22.066 -4.910 1.00 0.00 C ATOM 1571 OG1 THR A 97 2.783 20.981 -4.631 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.537 21.499 -5.159 1.00 0.00 C ATOM 0 H THR A 97 1.812 21.273 -7.240 1.00 0.00 H new ATOM 0 HA THR A 97 1.907 23.842 -6.120 1.00 0.00 H new ATOM 0 HB THR A 97 1.864 22.755 -4.067 1.00 0.00 H new ATOM 0 HG1 THR A 97 3.077 20.573 -5.472 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.220 20.920 -4.292 1.00 0.00 H new ATOM 0 HG22 THR A 97 -0.166 22.315 -5.328 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.562 20.854 -6.037 1.00 0.00 H new ATOM 1580 N GLY A 98 4.781 22.241 -6.221 1.00 0.00 N ATOM 1581 CA GLY A 98 6.212 22.424 -6.064 1.00 0.00 C ATOM 1582 C GLY A 98 6.625 22.546 -4.611 1.00 0.00 C ATOM 1583 O GLY A 98 7.626 23.188 -4.295 1.00 0.00 O ATOM 0 H GLY A 98 4.505 21.340 -6.612 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.735 21.582 -6.518 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.522 23.319 -6.603 1.00 0.00 H new ATOM 1587 N LEU A 99 5.852 21.928 -3.723 1.00 0.00 N ATOM 1588 CA LEU A 99 6.143 21.971 -2.295 1.00 0.00 C ATOM 1589 C LEU A 99 6.988 20.772 -1.877 1.00 0.00 C ATOM 1590 O LEU A 99 7.083 19.783 -2.602 1.00 0.00 O ATOM 1591 CB LEU A 99 4.843 21.999 -1.489 1.00 0.00 C ATOM 1592 CG LEU A 99 4.252 23.391 -1.261 1.00 0.00 C ATOM 1593 CD1 LEU A 99 3.539 23.881 -2.512 1.00 0.00 C ATOM 1594 CD2 LEU A 99 3.301 23.378 -0.074 1.00 0.00 C ATOM 0 H LEU A 99 5.020 21.392 -3.968 1.00 0.00 H new ATOM 0 HA LEU A 99 6.708 22.881 -2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.102 21.386 -2.002 1.00 0.00 H new ATOM 0 HB3 LEU A 99 5.024 21.535 -0.520 1.00 0.00 H new ATOM 0 HG LEU A 99 5.068 24.079 -1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.125 24.873 -2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.247 23.929 -3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.733 23.192 -2.765 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.890 24.377 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.489 22.676 -0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.841 23.072 0.822 1.00 0.00 H new ATOM 1606 N GLU A 100 7.602 20.869 -0.701 1.00 0.00 N ATOM 1607 CA GLU A 100 8.440 19.793 -0.186 1.00 0.00 C ATOM 1608 C GLU A 100 7.609 18.544 0.096 1.00 0.00 C ATOM 1609 O GLU A 100 6.380 18.597 0.122 1.00 0.00 O ATOM 1610 CB GLU A 100 9.156 20.243 1.089 1.00 0.00 C ATOM 1611 CG GLU A 100 10.004 21.490 0.903 1.00 0.00 C ATOM 1612 CD GLU A 100 10.631 21.966 2.198 1.00 0.00 C ATOM 1613 OE1 GLU A 100 11.726 21.475 2.544 1.00 0.00 O ATOM 1614 OE2 GLU A 100 10.028 22.832 2.867 1.00 0.00 O ATOM 0 H GLU A 100 7.534 21.681 -0.088 1.00 0.00 H new ATOM 0 HA GLU A 100 9.183 19.549 -0.945 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.414 20.431 1.865 1.00 0.00 H new ATOM 0 HB3 GLU A 100 9.791 19.432 1.445 1.00 0.00 H new ATOM 0 HG2 GLU A 100 10.790 21.285 0.176 1.00 0.00 H new ATOM 0 HG3 GLU A 100 9.386 22.287 0.488 1.00 0.00 H new ATOM 1621 N TYR A 101 8.290 17.423 0.307 1.00 0.00 N ATOM 1622 CA TYR A 101 7.617 16.160 0.588 1.00 0.00 C ATOM 1623 C TYR A 101 8.121 15.552 1.893 1.00 0.00 C ATOM 1624 O TYR A 101 7.385 15.470 2.876 1.00 0.00 O ATOM 1625 CB TYR A 101 7.833 15.176 -0.563 1.00 0.00 C ATOM 1626 CG TYR A 101 7.039 13.896 -0.424 1.00 0.00 C ATOM 1627 CD1 TYR A 101 5.662 13.927 -0.245 1.00 0.00 C ATOM 1628 CD2 TYR A 101 7.668 12.659 -0.469 1.00 0.00 C ATOM 1629 CE1 TYR A 101 4.933 12.759 -0.116 1.00 0.00 C ATOM 1630 CE2 TYR A 101 6.946 11.486 -0.341 1.00 0.00 C ATOM 1631 CZ TYR A 101 5.581 11.543 -0.165 1.00 0.00 C ATOM 1632 OH TYR A 101 4.859 10.378 -0.038 1.00 0.00 O ATOM 0 H TYR A 101 9.308 17.363 0.289 1.00 0.00 H new ATOM 0 HA TYR A 101 6.551 16.361 0.690 1.00 0.00 H new ATOM 0 HB2 TYR A 101 7.562 15.662 -1.500 1.00 0.00 H new ATOM 0 HB3 TYR A 101 8.893 14.931 -0.626 1.00 0.00 H new ATOM 0 HD1 TYR A 101 5.152 14.878 -0.206 1.00 0.00 H new ATOM 0 HD2 TYR A 101 8.738 12.612 -0.606 1.00 0.00 H new ATOM 0 HE1 TYR A 101 3.863 12.799 0.022 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.449 10.531 -0.379 1.00 0.00 H new ATOM 0 HH TYR A 101 3.903 10.589 0.003 1.00 0.00 H new ATOM 1642 N ALA A 102 9.380 15.128 1.893 1.00 0.00 N ATOM 1643 CA ALA A 102 9.983 14.528 3.077 1.00 0.00 C ATOM 1644 C ALA A 102 11.474 14.286 2.872 1.00 0.00 C ATOM 1645 O ALA A 102 11.878 13.603 1.930 1.00 0.00 O ATOM 1646 CB ALA A 102 9.278 13.226 3.426 1.00 0.00 C ATOM 0 H ALA A 102 10.002 15.189 1.087 1.00 0.00 H new ATOM 0 HA ALA A 102 9.866 15.225 3.906 1.00 0.00 H new ATOM 0 HB1 ALA A 102 9.739 12.789 4.312 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.225 13.424 3.625 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.365 12.530 2.591 1.00 0.00 H new ATOM 1652 N ASN A 103 12.288 14.850 3.757 1.00 0.00 N ATOM 1653 CA ASN A 103 13.736 14.695 3.672 1.00 0.00 C ATOM 1654 C ASN A 103 14.267 15.255 2.357 1.00 0.00 C ATOM 1655 O ASN A 103 14.115 14.573 1.321 1.00 0.00 O ATOM 1656 CB ASN A 103 14.121 13.220 3.805 1.00 0.00 C ATOM 1657 CG ASN A 103 15.434 13.029 4.538 1.00 0.00 C ATOM 1658 OD1 ASN A 103 16.509 13.234 3.974 1.00 0.00 O ATOM 1659 ND2 ASN A 103 15.354 12.633 5.802 1.00 0.00 N ATOM 0 H ASN A 103 11.970 15.419 4.542 1.00 0.00 H new ATOM 0 HA ASN A 103 14.185 15.256 4.492 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.331 12.688 4.335 1.00 0.00 H new ATOM 0 HB3 ASN A 103 14.194 12.776 2.812 1.00 0.00 H new ATOM 0 HD21 ASN A 103 16.205 12.487 6.345 1.00 0.00 H new ATOM 0 HD22 ASN A 103 14.442 12.475 6.230 1.00 0.00 H new TER 1666 ASN A 103 ATOM 1667 N MET B 26 -11.955 28.091 -20.281 1.00 0.00 N ATOM 1668 CA MET B 26 -12.949 27.610 -19.287 1.00 0.00 C ATOM 1669 C MET B 26 -13.728 26.411 -19.820 1.00 0.00 C ATOM 1670 O MET B 26 -14.929 26.285 -19.584 1.00 0.00 O ATOM 1671 CB MET B 26 -13.905 28.758 -18.960 1.00 0.00 C ATOM 1672 CG MET B 26 -13.290 29.829 -18.075 1.00 0.00 C ATOM 1673 SD MET B 26 -13.944 31.474 -18.418 1.00 0.00 S ATOM 1674 CE MET B 26 -12.494 32.483 -18.119 1.00 0.00 C ATOM 0 HA MET B 26 -12.427 27.287 -18.386 1.00 0.00 H new ATOM 0 HB2 MET B 26 -14.241 29.216 -19.890 1.00 0.00 H new ATOM 0 HB3 MET B 26 -14.789 28.354 -18.466 1.00 0.00 H new ATOM 0 HG2 MET B 26 -13.473 29.580 -17.030 1.00 0.00 H new ATOM 0 HG3 MET B 26 -12.209 29.835 -18.217 1.00 0.00 H new ATOM 0 HE1 MET B 26 -12.739 33.531 -18.290 1.00 0.00 H new ATOM 0 HE2 MET B 26 -12.165 32.351 -17.088 1.00 0.00 H new ATOM 0 HE3 MET B 26 -11.695 32.182 -18.796 1.00 0.00 H new ATOM 1686 N GLU B 27 -13.035 25.536 -20.540 1.00 0.00 N ATOM 1687 CA GLU B 27 -13.662 24.346 -21.107 1.00 0.00 C ATOM 1688 C GLU B 27 -14.045 23.355 -20.010 1.00 0.00 C ATOM 1689 O GLU B 27 -15.218 23.027 -19.841 1.00 0.00 O ATOM 1690 CB GLU B 27 -12.722 23.680 -22.116 1.00 0.00 C ATOM 1691 CG GLU B 27 -13.288 23.617 -23.524 1.00 0.00 C ATOM 1692 CD GLU B 27 -12.242 23.898 -24.586 1.00 0.00 C ATOM 1693 OE1 GLU B 27 -11.496 22.964 -24.946 1.00 0.00 O ATOM 1694 OE2 GLU B 27 -12.169 25.053 -25.055 1.00 0.00 O ATOM 0 H GLU B 27 -12.040 25.627 -20.745 1.00 0.00 H new ATOM 0 HA GLU B 27 -14.572 24.654 -21.621 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -11.779 24.226 -22.137 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -12.497 22.668 -21.778 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -13.718 22.630 -23.695 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -14.099 24.339 -23.618 1.00 0.00 H new ATOM 1701 N PRO B 28 -13.053 22.864 -19.244 1.00 0.00 N ATOM 1702 CA PRO B 28 -13.294 21.907 -18.161 1.00 0.00 C ATOM 1703 C PRO B 28 -13.973 22.553 -16.958 1.00 0.00 C ATOM 1704 O PRO B 28 -14.229 23.757 -16.949 1.00 0.00 O ATOM 1705 CB PRO B 28 -11.890 21.431 -17.791 1.00 0.00 C ATOM 1706 CG PRO B 28 -10.998 22.563 -18.166 1.00 0.00 C ATOM 1707 CD PRO B 28 -11.622 23.202 -19.376 1.00 0.00 C ATOM 0 HA PRO B 28 -13.964 21.104 -18.467 1.00 0.00 H new ATOM 0 HB2 PRO B 28 -11.816 21.204 -16.728 1.00 0.00 H new ATOM 0 HB3 PRO B 28 -11.625 20.522 -18.331 1.00 0.00 H new ATOM 0 HG2 PRO B 28 -10.912 23.279 -17.348 1.00 0.00 H new ATOM 0 HG3 PRO B 28 -9.991 22.209 -18.388 1.00 0.00 H new ATOM 0 HD2 PRO B 28 -11.464 24.280 -19.387 1.00 0.00 H new ATOM 0 HD3 PRO B 28 -11.200 22.808 -20.301 1.00 0.00 H new ATOM 1715 N ASP B 29 -14.263 21.744 -15.944 1.00 0.00 N ATOM 1716 CA ASP B 29 -14.912 22.238 -14.734 1.00 0.00 C ATOM 1717 C ASP B 29 -14.231 21.685 -13.487 1.00 0.00 C ATOM 1718 O ASP B 29 -13.587 20.637 -13.532 1.00 0.00 O ATOM 1719 CB ASP B 29 -16.393 21.854 -14.733 1.00 0.00 C ATOM 1720 CG ASP B 29 -17.101 22.277 -16.006 1.00 0.00 C ATOM 1721 OD1 ASP B 29 -17.330 23.491 -16.182 1.00 0.00 O ATOM 1722 OD2 ASP B 29 -17.425 21.391 -16.826 1.00 0.00 O ATOM 0 H ASP B 29 -14.059 20.745 -15.936 1.00 0.00 H new ATOM 0 HA ASP B 29 -14.825 23.324 -14.722 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -16.486 20.775 -14.610 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -16.885 22.315 -13.877 1.00 0.00 H new ATOM 1727 N GLY B 30 -14.378 22.397 -12.374 1.00 0.00 N ATOM 1728 CA GLY B 30 -13.772 21.961 -11.130 1.00 0.00 C ATOM 1729 C GLY B 30 -12.449 22.651 -10.857 1.00 0.00 C ATOM 1730 O GLY B 30 -11.477 22.010 -10.459 1.00 0.00 O ATOM 0 H GLY B 30 -14.906 23.268 -12.312 1.00 0.00 H new ATOM 0 HA2 GLY B 30 -14.458 22.158 -10.306 1.00 0.00 H new ATOM 0 HA3 GLY B 30 -13.616 20.883 -11.164 1.00 0.00 H new ATOM 1734 N ARG B 31 -12.413 23.962 -11.070 1.00 0.00 N ATOM 1735 CA ARG B 31 -11.200 24.741 -10.844 1.00 0.00 C ATOM 1736 C ARG B 31 -10.063 24.246 -11.733 1.00 0.00 C ATOM 1737 O ARG B 31 -10.167 23.193 -12.362 1.00 0.00 O ATOM 1738 CB ARG B 31 -10.786 24.663 -9.374 1.00 0.00 C ATOM 1739 CG ARG B 31 -11.597 25.571 -8.465 1.00 0.00 C ATOM 1740 CD ARG B 31 -11.147 27.019 -8.576 1.00 0.00 C ATOM 1741 NE ARG B 31 -9.879 27.252 -7.889 1.00 0.00 N ATOM 1742 CZ ARG B 31 -9.189 28.387 -7.973 1.00 0.00 C ATOM 1743 NH1 ARG B 31 -9.639 29.392 -8.713 1.00 0.00 N ATOM 1744 NH2 ARG B 31 -8.044 28.517 -7.315 1.00 0.00 N ATOM 0 H ARG B 31 -13.209 24.508 -11.399 1.00 0.00 H new ATOM 0 HA ARG B 31 -11.411 25.779 -11.100 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -10.888 23.634 -9.030 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -9.731 24.925 -9.288 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -12.653 25.497 -8.724 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -11.497 25.236 -7.432 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -11.044 27.287 -9.627 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -11.913 27.670 -8.154 1.00 0.00 H new ATOM 0 HE ARG B 31 -9.500 26.501 -7.311 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -10.518 29.297 -9.221 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -9.106 30.259 -8.773 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -7.693 27.747 -6.745 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -7.515 29.387 -7.379 1.00 0.00 H new ATOM 1758 N GLY B 32 -8.978 25.011 -11.778 1.00 0.00 N ATOM 1759 CA GLY B 32 -7.838 24.634 -12.591 1.00 0.00 C ATOM 1760 C GLY B 32 -6.685 24.101 -11.762 1.00 0.00 C ATOM 1761 O GLY B 32 -5.564 24.601 -11.852 1.00 0.00 O ATOM 0 H GLY B 32 -8.868 25.886 -11.265 1.00 0.00 H new ATOM 0 HA2 GLY B 32 -8.144 23.876 -13.311 1.00 0.00 H new ATOM 0 HA3 GLY B 32 -7.501 25.499 -13.162 1.00 0.00 H new ATOM 1765 N ALA B 33 -6.962 23.083 -10.953 1.00 0.00 N ATOM 1766 CA ALA B 33 -5.941 22.482 -10.105 1.00 0.00 C ATOM 1767 C ALA B 33 -6.398 21.130 -9.570 1.00 0.00 C ATOM 1768 O ALA B 33 -7.568 20.768 -9.686 1.00 0.00 O ATOM 1769 CB ALA B 33 -5.592 23.416 -8.956 1.00 0.00 C ATOM 0 H ALA B 33 -7.885 22.658 -10.868 1.00 0.00 H new ATOM 0 HA ALA B 33 -5.049 22.321 -10.711 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -4.828 22.954 -8.331 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -5.214 24.358 -9.354 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -6.483 23.607 -8.358 1.00 0.00 H new ATOM 1775 N TRP B 34 -5.465 20.386 -8.983 1.00 0.00 N ATOM 1776 CA TRP B 34 -5.773 19.072 -8.430 1.00 0.00 C ATOM 1777 C TRP B 34 -6.285 18.130 -9.515 1.00 0.00 C ATOM 1778 O TRP B 34 -7.164 17.304 -9.271 1.00 0.00 O ATOM 1779 CB TRP B 34 -6.812 19.196 -7.314 1.00 0.00 C ATOM 1780 CG TRP B 34 -6.431 20.183 -6.254 1.00 0.00 C ATOM 1781 CD1 TRP B 34 -7.199 21.202 -5.768 1.00 0.00 C ATOM 1782 CD2 TRP B 34 -5.186 20.246 -5.548 1.00 0.00 C ATOM 1783 NE1 TRP B 34 -6.508 21.894 -4.803 1.00 0.00 N ATOM 1784 CE2 TRP B 34 -5.270 21.327 -4.651 1.00 0.00 C ATOM 1785 CE3 TRP B 34 -4.009 19.493 -5.588 1.00 0.00 C ATOM 1786 CZ2 TRP B 34 -4.223 21.673 -3.800 1.00 0.00 C ATOM 1787 CZ3 TRP B 34 -2.970 19.837 -4.744 1.00 0.00 C ATOM 1788 CH2 TRP B 34 -3.082 20.918 -3.861 1.00 0.00 C ATOM 0 H TRP B 34 -4.491 20.670 -8.878 1.00 0.00 H new ATOM 0 HA TRP B 34 -4.854 18.655 -8.017 1.00 0.00 H new ATOM 0 HB2 TRP B 34 -7.767 19.491 -7.748 1.00 0.00 H new ATOM 0 HB3 TRP B 34 -6.959 18.219 -6.854 1.00 0.00 H new ATOM 0 HD1 TRP B 34 -8.203 21.431 -6.094 1.00 0.00 H new ATOM 0 HE1 TRP B 34 -6.859 22.699 -4.284 1.00 0.00 H new ATOM 0 HE3 TRP B 34 -3.913 18.658 -6.266 1.00 0.00 H new ATOM 0 HZ2 TRP B 34 -4.308 22.506 -3.117 1.00 0.00 H new ATOM 0 HZ3 TRP B 34 -2.056 19.262 -4.766 1.00 0.00 H new ATOM 0 HH2 TRP B 34 -2.252 21.161 -3.215 1.00 0.00 H new ATOM 1799 N ALA B 35 -5.728 18.260 -10.714 1.00 0.00 N ATOM 1800 CA ALA B 35 -6.128 17.421 -11.837 1.00 0.00 C ATOM 1801 C ALA B 35 -5.308 16.137 -11.882 1.00 0.00 C ATOM 1802 O ALA B 35 -5.858 15.036 -11.876 1.00 0.00 O ATOM 1803 CB ALA B 35 -5.984 18.187 -13.145 1.00 0.00 C ATOM 0 H ALA B 35 -4.998 18.938 -10.933 1.00 0.00 H new ATOM 0 HA ALA B 35 -7.175 17.148 -11.701 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -6.286 17.549 -13.975 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -6.618 19.073 -13.119 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -4.945 18.488 -13.278 1.00 0.00 H new ATOM 1809 N HIS B 36 -3.987 16.285 -11.928 1.00 0.00 N ATOM 1810 CA HIS B 36 -3.091 15.135 -11.973 1.00 0.00 C ATOM 1811 C HIS B 36 -3.271 14.254 -10.741 1.00 0.00 C ATOM 1812 O HIS B 36 -3.088 13.038 -10.804 1.00 0.00 O ATOM 1813 CB HIS B 36 -1.636 15.599 -12.073 1.00 0.00 C ATOM 1814 CG HIS B 36 -1.285 16.688 -11.106 1.00 0.00 C ATOM 1815 ND1 HIS B 36 -2.156 17.074 -10.117 1.00 0.00 N ATOM 1816 CD2 HIS B 36 -0.157 17.432 -11.020 1.00 0.00 C ATOM 1817 CE1 HIS B 36 -1.544 18.039 -9.454 1.00 0.00 C ATOM 1818 NE2 HIS B 36 -0.329 18.291 -9.964 1.00 0.00 N ATOM 0 H HIS B 36 -3.514 17.189 -11.935 1.00 0.00 H new ATOM 0 HA HIS B 36 -3.341 14.548 -12.857 1.00 0.00 H new ATOM 0 HB2 HIS B 36 -0.979 14.746 -11.901 1.00 0.00 H new ATOM 0 HB3 HIS B 36 -1.444 15.950 -13.087 1.00 0.00 H new ATOM 0 HD2 HIS B 36 0.711 17.363 -11.659 1.00 0.00 H new ATOM 0 HE1 HIS B 36 -1.968 18.559 -8.608 1.00 0.00 H new ATOM 0 HE2 HIS B 36 0.338 18.987 -9.631 1.00 0.00 H new ATOM 1826 N SER B 37 -3.632 14.875 -9.623 1.00 0.00 N ATOM 1827 CA SER B 37 -3.837 14.146 -8.376 1.00 0.00 C ATOM 1828 C SER B 37 -5.057 13.236 -8.473 1.00 0.00 C ATOM 1829 O SER B 37 -5.044 12.110 -7.976 1.00 0.00 O ATOM 1830 CB SER B 37 -4.007 15.123 -7.212 1.00 0.00 C ATOM 1831 OG SER B 37 -4.317 14.438 -6.011 1.00 0.00 O ATOM 0 H SER B 37 -3.789 15.881 -9.555 1.00 0.00 H new ATOM 0 HA SER B 37 -2.958 13.528 -8.197 1.00 0.00 H new ATOM 0 HB2 SER B 37 -3.091 15.699 -7.080 1.00 0.00 H new ATOM 0 HB3 SER B 37 -4.800 15.834 -7.443 1.00 0.00 H new ATOM 0 HG SER B 37 -4.109 15.012 -5.244 1.00 0.00 H new ATOM 1837 N ARG B 38 -6.110 13.732 -9.115 1.00 0.00 N ATOM 1838 CA ARG B 38 -7.338 12.963 -9.277 1.00 0.00 C ATOM 1839 C ARG B 38 -7.085 11.696 -10.089 1.00 0.00 C ATOM 1840 O ARG B 38 -7.701 10.658 -9.847 1.00 0.00 O ATOM 1841 CB ARG B 38 -8.412 13.813 -9.959 1.00 0.00 C ATOM 1842 CG ARG B 38 -9.830 13.423 -9.577 1.00 0.00 C ATOM 1843 CD ARG B 38 -10.856 14.352 -10.208 1.00 0.00 C ATOM 1844 NE ARG B 38 -10.480 15.758 -10.075 1.00 0.00 N ATOM 1845 CZ ARG B 38 -9.722 16.412 -10.954 1.00 0.00 C ATOM 1846 NH1 ARG B 38 -9.249 15.795 -12.029 1.00 0.00 N ATOM 1847 NH2 ARG B 38 -9.434 17.693 -10.756 1.00 0.00 N ATOM 0 H ARG B 38 -6.137 14.663 -9.531 1.00 0.00 H new ATOM 0 HA ARG B 38 -7.688 12.674 -8.286 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -8.251 14.860 -9.704 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -8.299 13.727 -11.040 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -10.024 12.398 -9.893 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -9.935 13.447 -8.492 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -10.967 14.105 -11.264 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -11.827 14.191 -9.739 1.00 0.00 H new ATOM 0 HE ARG B 38 -10.818 16.269 -9.260 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -9.465 14.811 -12.189 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -8.670 16.305 -12.696 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -9.793 18.175 -9.932 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -8.854 18.195 -11.428 1.00 0.00 H new ATOM 1861 N ALA B 39 -6.174 11.790 -11.052 1.00 0.00 N ATOM 1862 CA ALA B 39 -5.839 10.651 -11.899 1.00 0.00 C ATOM 1863 C ALA B 39 -5.029 9.613 -11.129 1.00 0.00 C ATOM 1864 O ALA B 39 -5.407 8.444 -11.059 1.00 0.00 O ATOM 1865 CB ALA B 39 -5.070 11.117 -13.126 1.00 0.00 C ATOM 0 H ALA B 39 -5.655 12.642 -11.265 1.00 0.00 H new ATOM 0 HA ALA B 39 -6.769 10.182 -12.221 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -4.826 10.258 -13.750 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -5.682 11.817 -13.695 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -4.150 11.611 -12.813 1.00 0.00 H new ATOM 1871 N ALA B 40 -3.914 10.049 -10.551 1.00 0.00 N ATOM 1872 CA ALA B 40 -3.052 9.159 -9.785 1.00 0.00 C ATOM 1873 C ALA B 40 -3.802 8.545 -8.608 1.00 0.00 C ATOM 1874 O ALA B 40 -3.515 7.423 -8.192 1.00 0.00 O ATOM 1875 CB ALA B 40 -1.822 9.907 -9.296 1.00 0.00 C ATOM 0 H ALA B 40 -3.587 11.014 -10.599 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.734 8.349 -10.442 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -1.187 9.229 -8.725 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.266 10.291 -10.151 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.130 10.737 -8.661 1.00 0.00 H new ATOM 1881 N LEU B 41 -4.766 9.290 -8.074 1.00 0.00 N ATOM 1882 CA LEU B 41 -5.559 8.819 -6.945 1.00 0.00 C ATOM 1883 C LEU B 41 -6.300 7.533 -7.297 1.00 0.00 C ATOM 1884 O LEU B 41 -6.159 6.517 -6.617 1.00 0.00 O ATOM 1885 CB LEU B 41 -6.557 9.895 -6.512 1.00 0.00 C ATOM 1886 CG LEU B 41 -7.485 9.493 -5.364 1.00 0.00 C ATOM 1887 CD1 LEU B 41 -6.677 9.017 -4.167 1.00 0.00 C ATOM 1888 CD2 LEU B 41 -8.383 10.657 -4.974 1.00 0.00 C ATOM 0 H LEU B 41 -5.016 10.222 -8.406 1.00 0.00 H new ATOM 0 HA LEU B 41 -4.879 8.609 -6.119 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -6.002 10.785 -6.216 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -7.167 10.171 -7.372 1.00 0.00 H new ATOM 0 HG LEU B 41 -8.115 8.670 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.354 8.735 -3.360 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -6.075 8.155 -4.454 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -6.022 9.820 -3.828 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -9.037 10.354 -4.156 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -7.769 11.499 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -8.988 10.953 -5.831 1.00 0.00 H new ATOM 1900 N ASP B 42 -7.091 7.586 -8.364 1.00 0.00 N ATOM 1901 CA ASP B 42 -7.855 6.425 -8.808 1.00 0.00 C ATOM 1902 C ASP B 42 -6.929 5.260 -9.143 1.00 0.00 C ATOM 1903 O ASP B 42 -7.277 4.098 -8.936 1.00 0.00 O ATOM 1904 CB ASP B 42 -8.705 6.784 -10.027 1.00 0.00 C ATOM 1905 CG ASP B 42 -9.618 5.650 -10.449 1.00 0.00 C ATOM 1906 OD1 ASP B 42 -10.068 4.890 -9.566 1.00 0.00 O ATOM 1907 OD2 ASP B 42 -9.885 5.523 -11.662 1.00 0.00 O ATOM 0 H ASP B 42 -7.220 8.420 -8.937 1.00 0.00 H new ATOM 0 HA ASP B 42 -8.512 6.120 -7.993 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -9.305 7.665 -9.801 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.051 7.048 -10.858 1.00 0.00 H new ATOM 1912 N ARG B 43 -5.748 5.581 -9.663 1.00 0.00 N ATOM 1913 CA ARG B 43 -4.772 4.560 -10.028 1.00 0.00 C ATOM 1914 C ARG B 43 -4.388 3.715 -8.817 1.00 0.00 C ATOM 1915 O ARG B 43 -4.248 2.496 -8.917 1.00 0.00 O ATOM 1916 CB ARG B 43 -3.523 5.211 -10.626 1.00 0.00 C ATOM 1917 CG ARG B 43 -3.754 5.822 -11.999 1.00 0.00 C ATOM 1918 CD ARG B 43 -2.514 6.541 -12.504 1.00 0.00 C ATOM 1919 NE ARG B 43 -2.847 7.624 -13.426 1.00 0.00 N ATOM 1920 CZ ARG B 43 -3.161 7.437 -14.707 1.00 0.00 C ATOM 1921 NH1 ARG B 43 -3.186 6.213 -15.219 1.00 0.00 N ATOM 1922 NH2 ARG B 43 -3.451 8.477 -15.476 1.00 0.00 N ATOM 0 H ARG B 43 -5.444 6.538 -9.841 1.00 0.00 H new ATOM 0 HA ARG B 43 -5.227 3.908 -10.773 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -3.167 5.986 -9.948 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -2.733 4.464 -10.698 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -4.035 5.040 -12.704 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -4.588 6.522 -11.951 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -1.958 6.944 -11.657 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -1.860 5.827 -13.004 1.00 0.00 H new ATOM 0 HE ARG B 43 -2.839 8.579 -13.068 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -2.964 5.410 -14.631 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -3.427 6.076 -16.201 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -3.434 9.420 -15.087 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -3.692 8.335 -16.457 1.00 0.00 H new ATOM 1936 N LEU B 44 -4.221 4.371 -7.673 1.00 0.00 N ATOM 1937 CA LEU B 44 -3.855 3.679 -6.442 1.00 0.00 C ATOM 1938 C LEU B 44 -5.028 2.864 -5.908 1.00 0.00 C ATOM 1939 O LEU B 44 -4.839 1.822 -5.281 1.00 0.00 O ATOM 1940 CB LEU B 44 -3.393 4.683 -5.385 1.00 0.00 C ATOM 1941 CG LEU B 44 -2.859 4.063 -4.092 1.00 0.00 C ATOM 1942 CD1 LEU B 44 -1.679 4.861 -3.562 1.00 0.00 C ATOM 1943 CD2 LEU B 44 -3.962 3.980 -3.047 1.00 0.00 C ATOM 0 H LEU B 44 -4.333 5.380 -7.573 1.00 0.00 H new ATOM 0 HA LEU B 44 -3.035 2.998 -6.668 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.614 5.310 -5.818 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -4.229 5.338 -5.138 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.516 3.052 -4.312 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.314 4.404 -2.642 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.881 4.868 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.994 5.884 -3.358 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.565 3.537 -2.134 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.336 4.981 -2.832 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -4.776 3.363 -3.426 1.00 0.00 H new ATOM 1955 N GLU B 45 -6.240 3.348 -6.158 1.00 0.00 N ATOM 1956 CA GLU B 45 -7.447 2.666 -5.703 1.00 0.00 C ATOM 1957 C GLU B 45 -7.574 1.288 -6.346 1.00 0.00 C ATOM 1958 O GLU B 45 -8.164 0.375 -5.769 1.00 0.00 O ATOM 1959 CB GLU B 45 -8.684 3.506 -6.022 1.00 0.00 C ATOM 1960 CG GLU B 45 -8.791 4.774 -5.190 1.00 0.00 C ATOM 1961 CD GLU B 45 -10.052 5.561 -5.485 1.00 0.00 C ATOM 1962 OE1 GLU B 45 -10.393 5.710 -6.677 1.00 0.00 O ATOM 1963 OE2 GLU B 45 -10.699 6.028 -4.524 1.00 0.00 O ATOM 0 H GLU B 45 -6.413 4.211 -6.674 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.372 2.536 -4.623 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.668 3.775 -7.078 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.576 2.900 -5.861 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.770 4.513 -4.132 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -7.922 5.403 -5.380 1.00 0.00 H new ATOM 1970 N LYS B 46 -7.018 1.144 -7.547 1.00 0.00 N ATOM 1971 CA LYS B 46 -7.071 -0.123 -8.268 1.00 0.00 C ATOM 1972 C LYS B 46 -6.509 -1.260 -7.420 1.00 0.00 C ATOM 1973 O LYS B 46 -6.929 -2.411 -7.547 1.00 0.00 O ATOM 1974 CB LYS B 46 -6.295 -0.018 -9.583 1.00 0.00 C ATOM 1975 CG LYS B 46 -7.172 0.300 -10.783 1.00 0.00 C ATOM 1976 CD LYS B 46 -7.090 1.771 -11.160 1.00 0.00 C ATOM 1977 CE LYS B 46 -6.008 2.020 -12.196 1.00 0.00 C ATOM 1978 NZ LYS B 46 -6.285 3.238 -13.007 1.00 0.00 N ATOM 0 H LYS B 46 -6.526 1.889 -8.040 1.00 0.00 H new ATOM 0 HA LYS B 46 -8.116 -0.343 -8.487 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -5.533 0.756 -9.485 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -5.773 -0.958 -9.764 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -6.865 -0.312 -11.631 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.206 0.038 -10.559 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.052 2.102 -11.551 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -6.886 2.365 -10.269 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -5.045 2.128 -11.697 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -5.930 1.155 -12.855 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -5.407 3.558 -13.464 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -6.993 3.016 -13.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -6.648 3.991 -12.389 1.00 0.00 H new ATOM 1992 N LEU B 47 -5.555 -0.931 -6.554 1.00 0.00 N ATOM 1993 CA LEU B 47 -4.935 -1.923 -5.685 1.00 0.00 C ATOM 1994 C LEU B 47 -5.822 -2.221 -4.480 1.00 0.00 C ATOM 1995 O LEU B 47 -5.805 -3.329 -3.944 1.00 0.00 O ATOM 1996 CB LEU B 47 -3.563 -1.436 -5.216 1.00 0.00 C ATOM 1997 CG LEU B 47 -2.484 -1.395 -6.301 1.00 0.00 C ATOM 1998 CD1 LEU B 47 -2.398 -2.731 -7.021 1.00 0.00 C ATOM 1999 CD2 LEU B 47 -2.763 -0.271 -7.287 1.00 0.00 C ATOM 0 H LEU B 47 -5.195 0.016 -6.436 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.809 -2.842 -6.257 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.673 -0.436 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.221 -2.084 -4.409 1.00 0.00 H new ATOM 0 HG LEU B 47 -1.523 -1.202 -5.824 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.625 -2.682 -7.788 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -2.149 -3.515 -6.305 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -3.358 -2.956 -7.486 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.986 -0.256 -8.051 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -3.733 -0.433 -7.758 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.770 0.683 -6.759 1.00 0.00 H new ATOM 2011 N LEU B 48 -6.594 -1.225 -4.059 1.00 0.00 N ATOM 2012 CA LEU B 48 -7.488 -1.381 -2.917 1.00 0.00 C ATOM 2013 C LEU B 48 -8.774 -2.096 -3.322 1.00 0.00 C ATOM 2014 O LEU B 48 -9.402 -2.772 -2.509 1.00 0.00 O ATOM 2015 CB LEU B 48 -7.818 -0.016 -2.311 1.00 0.00 C ATOM 2016 CG LEU B 48 -6.713 0.595 -1.448 1.00 0.00 C ATOM 2017 CD1 LEU B 48 -6.283 -0.381 -0.363 1.00 0.00 C ATOM 2018 CD2 LEU B 48 -5.525 0.994 -2.309 1.00 0.00 C ATOM 0 H LEU B 48 -6.619 -0.301 -4.491 1.00 0.00 H new ATOM 0 HA LEU B 48 -6.978 -1.989 -2.170 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -8.051 0.677 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -8.719 -0.113 -1.705 1.00 0.00 H new ATOM 0 HG LEU B 48 -7.106 1.491 -0.968 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -5.496 0.070 0.241 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -7.137 -0.619 0.272 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -5.908 -1.295 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.748 1.427 -1.679 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -5.132 0.113 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.843 1.728 -3.049 1.00 0.00 H new ATOM 2030 N ARG B 49 -9.161 -1.939 -4.586 1.00 0.00 N ATOM 2031 CA ARG B 49 -10.373 -2.569 -5.099 1.00 0.00 C ATOM 2032 C ARG B 49 -10.339 -4.080 -4.881 1.00 0.00 C ATOM 2033 O ARG B 49 -9.435 -4.766 -5.360 1.00 0.00 O ATOM 2034 CB ARG B 49 -10.540 -2.259 -6.587 1.00 0.00 C ATOM 2035 CG ARG B 49 -11.789 -2.871 -7.202 1.00 0.00 C ATOM 2036 CD ARG B 49 -11.461 -4.112 -8.015 1.00 0.00 C ATOM 2037 NE ARG B 49 -11.377 -3.823 -9.444 1.00 0.00 N ATOM 2038 CZ ARG B 49 -11.392 -4.758 -10.392 1.00 0.00 C ATOM 2039 NH1 ARG B 49 -11.487 -6.041 -10.067 1.00 0.00 N ATOM 2040 NH2 ARG B 49 -11.310 -4.409 -11.669 1.00 0.00 N ATOM 0 H ARG B 49 -8.653 -1.381 -5.272 1.00 0.00 H new ATOM 0 HA ARG B 49 -11.224 -2.163 -4.551 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -10.571 -1.178 -6.723 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -9.665 -2.623 -7.125 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -12.495 -3.128 -6.413 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -12.279 -2.136 -7.841 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -10.514 -4.530 -7.673 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -12.224 -4.871 -7.843 1.00 0.00 H new ATOM 0 HE ARG B 49 -11.302 -2.848 -9.733 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -11.549 -6.316 -9.087 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -11.498 -6.753 -10.798 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -11.235 -3.424 -11.925 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -11.321 -5.125 -12.395 1.00 0.00 H new ATOM 2054 N CYS B 50 -11.327 -4.590 -4.154 1.00 0.00 N ATOM 2055 CA CYS B 50 -11.410 -6.017 -3.870 1.00 0.00 C ATOM 2056 C CYS B 50 -11.648 -6.816 -5.147 1.00 0.00 C ATOM 2057 O CYS B 50 -12.156 -6.288 -6.136 1.00 0.00 O ATOM 2058 CB CYS B 50 -12.532 -6.294 -2.867 1.00 0.00 C ATOM 2059 SG CYS B 50 -12.630 -8.016 -2.326 1.00 0.00 S ATOM 0 H CYS B 50 -12.082 -4.035 -3.751 1.00 0.00 H new ATOM 0 HA CYS B 50 -10.459 -6.330 -3.439 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -12.389 -5.658 -1.994 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -13.484 -6.011 -3.316 1.00 0.00 H new ATOM 2064 N SER B 51 -11.278 -8.092 -5.118 1.00 0.00 N ATOM 2065 CA SER B 51 -11.451 -8.966 -6.273 1.00 0.00 C ATOM 2066 C SER B 51 -12.903 -9.413 -6.402 1.00 0.00 C ATOM 2067 O SER B 51 -13.414 -9.588 -7.508 1.00 0.00 O ATOM 2068 CB SER B 51 -10.537 -10.188 -6.158 1.00 0.00 C ATOM 2069 OG SER B 51 -9.291 -9.954 -6.791 1.00 0.00 O ATOM 0 H SER B 51 -10.856 -8.544 -4.307 1.00 0.00 H new ATOM 0 HA SER B 51 -11.181 -8.403 -7.167 1.00 0.00 H new ATOM 0 HB2 SER B 51 -10.375 -10.427 -5.107 1.00 0.00 H new ATOM 0 HB3 SER B 51 -11.022 -11.053 -6.611 1.00 0.00 H new ATOM 0 HG SER B 51 -8.725 -10.749 -6.702 1.00 0.00 H new ATOM 2075 N ARG B 52 -13.564 -9.595 -5.263 1.00 0.00 N ATOM 2076 CA ARG B 52 -14.959 -10.020 -5.248 1.00 0.00 C ATOM 2077 C ARG B 52 -15.884 -8.829 -5.023 1.00 0.00 C ATOM 2078 O ARG B 52 -16.766 -8.551 -5.837 1.00 0.00 O ATOM 2079 CB ARG B 52 -15.180 -11.073 -4.158 1.00 0.00 C ATOM 2080 CG ARG B 52 -15.591 -12.432 -4.701 1.00 0.00 C ATOM 2081 CD ARG B 52 -14.560 -12.978 -5.674 1.00 0.00 C ATOM 2082 NE ARG B 52 -15.135 -13.968 -6.582 1.00 0.00 N ATOM 2083 CZ ARG B 52 -14.593 -14.309 -7.749 1.00 0.00 C ATOM 2084 NH1 ARG B 52 -13.460 -13.746 -8.153 1.00 0.00 N ATOM 2085 NH2 ARG B 52 -15.183 -15.218 -8.514 1.00 0.00 N ATOM 0 H ARG B 52 -13.156 -9.455 -4.339 1.00 0.00 H new ATOM 0 HA ARG B 52 -15.194 -10.460 -6.217 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -14.263 -11.184 -3.580 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -15.948 -10.718 -3.471 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -15.719 -13.131 -3.875 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -16.556 -12.349 -5.201 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -14.138 -12.157 -6.253 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -13.740 -13.430 -5.117 1.00 0.00 H new ATOM 0 HE ARG B 52 -16.004 -14.425 -6.305 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -13.000 -13.048 -7.568 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -13.050 -14.011 -9.048 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -16.052 -15.656 -8.208 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -14.768 -15.479 -9.408 1.00 0.00 H new ATOM 2099 N CYS B 53 -15.676 -8.127 -3.914 1.00 0.00 N ATOM 2100 CA CYS B 53 -16.489 -6.963 -3.580 1.00 0.00 C ATOM 2101 C CYS B 53 -16.371 -5.881 -4.654 1.00 0.00 C ATOM 2102 O CYS B 53 -17.217 -4.991 -4.741 1.00 0.00 O ATOM 2103 CB CYS B 53 -16.070 -6.397 -2.223 1.00 0.00 C ATOM 2104 SG CYS B 53 -16.842 -7.219 -0.810 1.00 0.00 S ATOM 0 H CYS B 53 -14.951 -8.344 -3.231 1.00 0.00 H new ATOM 0 HA CYS B 53 -17.530 -7.283 -3.530 1.00 0.00 H new ATOM 0 HB2 CYS B 53 -14.987 -6.475 -2.128 1.00 0.00 H new ATOM 0 HB3 CYS B 53 -16.317 -5.336 -2.192 1.00 0.00 H new ATOM 2109 N THR B 54 -15.314 -5.961 -5.464 1.00 0.00 N ATOM 2110 CA THR B 54 -15.079 -4.991 -6.533 1.00 0.00 C ATOM 2111 C THR B 54 -15.298 -3.560 -6.045 1.00 0.00 C ATOM 2112 O THR B 54 -16.073 -2.803 -6.629 1.00 0.00 O ATOM 2113 CB THR B 54 -15.986 -5.284 -7.733 1.00 0.00 C ATOM 2114 OG1 THR B 54 -15.753 -4.354 -8.775 1.00 0.00 O ATOM 2115 CG2 THR B 54 -17.462 -5.239 -7.401 1.00 0.00 C ATOM 0 H THR B 54 -14.605 -6.691 -5.399 1.00 0.00 H new ATOM 0 HA THR B 54 -14.039 -5.087 -6.843 1.00 0.00 H new ATOM 0 HB THR B 54 -15.733 -6.299 -8.041 1.00 0.00 H new ATOM 0 HG1 THR B 54 -15.904 -3.445 -8.442 1.00 0.00 H new ATOM 0 HG21 THR B 54 -18.043 -5.456 -8.297 1.00 0.00 H new ATOM 0 HG22 THR B 54 -17.685 -5.982 -6.635 1.00 0.00 H new ATOM 0 HG23 THR B 54 -17.722 -4.247 -7.031 1.00 0.00 H new ATOM 2123 N ASN B 55 -14.606 -3.199 -4.968 1.00 0.00 N ATOM 2124 CA ASN B 55 -14.719 -1.862 -4.397 1.00 0.00 C ATOM 2125 C ASN B 55 -13.782 -1.705 -3.203 1.00 0.00 C ATOM 2126 O ASN B 55 -12.979 -2.592 -2.912 1.00 0.00 O ATOM 2127 CB ASN B 55 -16.162 -1.587 -3.970 1.00 0.00 C ATOM 2128 CG ASN B 55 -16.922 -0.766 -4.995 1.00 0.00 C ATOM 2129 OD1 ASN B 55 -16.325 -0.125 -5.859 1.00 0.00 O ATOM 2130 ND2 ASN B 55 -18.247 -0.784 -4.903 1.00 0.00 N ATOM 0 H ASN B 55 -13.961 -3.815 -4.473 1.00 0.00 H new ATOM 0 HA ASN B 55 -14.432 -1.139 -5.161 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -16.678 -2.534 -3.812 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -16.162 -1.061 -3.015 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -18.811 -0.252 -5.565 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -18.700 -1.330 -4.170 1.00 0.00 H new ATOM 2137 N ILE B 56 -13.890 -0.574 -2.515 1.00 0.00 N ATOM 2138 CA ILE B 56 -13.052 -0.306 -1.352 1.00 0.00 C ATOM 2139 C ILE B 56 -13.240 -1.382 -0.287 1.00 0.00 C ATOM 2140 O ILE B 56 -14.344 -1.891 -0.094 1.00 0.00 O ATOM 2141 CB ILE B 56 -13.363 1.073 -0.737 1.00 0.00 C ATOM 2142 CG1 ILE B 56 -13.308 2.162 -1.811 1.00 0.00 C ATOM 2143 CG2 ILE B 56 -12.387 1.386 0.389 1.00 0.00 C ATOM 2144 CD1 ILE B 56 -11.992 2.212 -2.556 1.00 0.00 C ATOM 0 H ILE B 56 -14.549 0.171 -2.742 1.00 0.00 H new ATOM 0 HA ILE B 56 -12.018 -0.312 -1.696 1.00 0.00 H new ATOM 0 HB ILE B 56 -14.371 1.047 -0.323 1.00 0.00 H new ATOM 0 HG12 ILE B 56 -14.114 1.997 -2.526 1.00 0.00 H new ATOM 0 HG13 ILE B 56 -13.489 3.130 -1.344 1.00 0.00 H new ATOM 0 HG21 ILE B 56 -12.621 2.363 0.812 1.00 0.00 H new ATOM 0 HG22 ILE B 56 -12.471 0.625 1.165 1.00 0.00 H new ATOM 0 HG23 ILE B 56 -11.370 1.394 -0.003 1.00 0.00 H new ATOM 0 HD11 ILE B 56 -12.026 3.007 -3.301 1.00 0.00 H new ATOM 0 HD12 ILE B 56 -11.183 2.408 -1.852 1.00 0.00 H new ATOM 0 HD13 ILE B 56 -11.818 1.257 -3.052 1.00 0.00 H new ATOM 2156 N LEU B 57 -12.155 -1.725 0.401 1.00 0.00 N ATOM 2157 CA LEU B 57 -12.203 -2.741 1.444 1.00 0.00 C ATOM 2158 C LEU B 57 -11.691 -2.188 2.770 1.00 0.00 C ATOM 2159 O LEU B 57 -10.878 -1.266 2.798 1.00 0.00 O ATOM 2160 CB LEU B 57 -11.388 -3.977 1.040 1.00 0.00 C ATOM 2161 CG LEU B 57 -10.272 -3.745 0.012 1.00 0.00 C ATOM 2162 CD1 LEU B 57 -8.931 -3.571 0.709 1.00 0.00 C ATOM 2163 CD2 LEU B 57 -10.211 -4.900 -0.977 1.00 0.00 C ATOM 0 H LEU B 57 -11.233 -1.314 0.254 1.00 0.00 H new ATOM 0 HA LEU B 57 -13.245 -3.036 1.571 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -10.943 -4.403 1.939 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -12.073 -4.724 0.639 1.00 0.00 H new ATOM 0 HG LEU B 57 -10.496 -2.830 -0.537 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -8.152 -3.408 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -8.978 -2.713 1.379 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -8.701 -4.468 1.284 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -9.414 -4.719 -1.699 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -10.011 -5.828 -0.441 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -11.163 -4.981 -1.501 1.00 0.00 H new ATOM 2175 N ARG B 58 -12.172 -2.761 3.869 1.00 0.00 N ATOM 2176 CA ARG B 58 -11.765 -2.329 5.201 1.00 0.00 C ATOM 2177 C ARG B 58 -11.367 -3.527 6.057 1.00 0.00 C ATOM 2178 O ARG B 58 -12.144 -4.469 6.221 1.00 0.00 O ATOM 2179 CB ARG B 58 -12.895 -1.550 5.878 1.00 0.00 C ATOM 2180 CG ARG B 58 -12.534 -0.108 6.195 1.00 0.00 C ATOM 2181 CD ARG B 58 -13.398 0.452 7.315 1.00 0.00 C ATOM 2182 NE ARG B 58 -14.352 1.446 6.826 1.00 0.00 N ATOM 2183 CZ ARG B 58 -15.504 1.140 6.233 1.00 0.00 C ATOM 2184 NH1 ARG B 58 -15.850 -0.129 6.053 1.00 0.00 N ATOM 2185 NH2 ARG B 58 -16.313 2.105 5.819 1.00 0.00 N ATOM 0 H ARG B 58 -12.845 -3.527 3.863 1.00 0.00 H new ATOM 0 HA ARG B 58 -10.900 -1.674 5.098 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -13.772 -1.563 5.231 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -13.173 -2.058 6.802 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -11.484 -0.050 6.481 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -12.655 0.503 5.301 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -13.938 -0.362 7.798 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -12.760 0.905 8.074 1.00 0.00 H new ATOM 0 HE ARG B 58 -14.121 2.432 6.946 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -15.232 -0.876 6.370 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -16.734 -0.357 5.598 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -16.053 3.082 5.955 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -17.196 1.871 5.365 1.00 0.00 H new ATOM 2199 N GLU B 59 -10.152 -3.490 6.593 1.00 0.00 N ATOM 2200 CA GLU B 59 -9.651 -4.579 7.426 1.00 0.00 C ATOM 2201 C GLU B 59 -9.759 -5.915 6.690 1.00 0.00 C ATOM 2202 O GLU B 59 -10.325 -6.877 7.211 1.00 0.00 O ATOM 2203 CB GLU B 59 -10.427 -4.639 8.744 1.00 0.00 C ATOM 2204 CG GLU B 59 -9.950 -5.738 9.681 1.00 0.00 C ATOM 2205 CD GLU B 59 -9.957 -5.307 11.134 1.00 0.00 C ATOM 2206 OE1 GLU B 59 -11.032 -5.366 11.766 1.00 0.00 O ATOM 2207 OE2 GLU B 59 -8.885 -4.911 11.640 1.00 0.00 O ATOM 0 H GLU B 59 -9.496 -2.719 6.466 1.00 0.00 H new ATOM 0 HA GLU B 59 -8.600 -4.389 7.644 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -10.341 -3.678 9.251 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -11.484 -4.791 8.527 1.00 0.00 H new ATOM 0 HG2 GLU B 59 -10.588 -6.614 9.562 1.00 0.00 H new ATOM 0 HG3 GLU B 59 -8.941 -6.038 9.399 1.00 0.00 H new ATOM 2214 N PRO B 60 -9.220 -5.987 5.461 1.00 0.00 N ATOM 2215 CA PRO B 60 -9.263 -7.206 4.649 1.00 0.00 C ATOM 2216 C PRO B 60 -8.267 -8.259 5.120 1.00 0.00 C ATOM 2217 O PRO B 60 -7.545 -8.056 6.096 1.00 0.00 O ATOM 2218 CB PRO B 60 -8.887 -6.705 3.255 1.00 0.00 C ATOM 2219 CG PRO B 60 -8.010 -5.528 3.507 1.00 0.00 C ATOM 2220 CD PRO B 60 -8.530 -4.883 4.764 1.00 0.00 C ATOM 0 HA PRO B 60 -10.235 -7.697 4.700 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -8.366 -7.473 2.684 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -9.771 -6.426 2.681 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -6.971 -5.835 3.627 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -8.042 -4.831 2.669 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -7.721 -4.471 5.368 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -9.211 -4.062 4.541 1.00 0.00 H new ATOM 2228 N VAL B 61 -8.235 -9.384 4.415 1.00 0.00 N ATOM 2229 CA VAL B 61 -7.329 -10.474 4.751 1.00 0.00 C ATOM 2230 C VAL B 61 -6.576 -10.953 3.514 1.00 0.00 C ATOM 2231 O VAL B 61 -7.117 -10.951 2.408 1.00 0.00 O ATOM 2232 CB VAL B 61 -8.087 -11.665 5.370 1.00 0.00 C ATOM 2233 CG1 VAL B 61 -7.111 -12.726 5.856 1.00 0.00 C ATOM 2234 CG2 VAL B 61 -8.987 -11.197 6.504 1.00 0.00 C ATOM 0 H VAL B 61 -8.828 -9.565 3.605 1.00 0.00 H new ATOM 0 HA VAL B 61 -6.620 -10.087 5.483 1.00 0.00 H new ATOM 0 HB VAL B 61 -8.717 -12.110 4.599 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -7.665 -13.559 6.290 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -6.515 -13.084 5.016 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -6.452 -12.296 6.611 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -9.513 -12.052 6.928 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -8.382 -10.724 7.277 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -9.712 -10.479 6.121 1.00 0.00 H new ATOM 2244 N CYS B 62 -5.327 -11.362 3.706 1.00 0.00 N ATOM 2245 CA CYS B 62 -4.506 -11.841 2.600 1.00 0.00 C ATOM 2246 C CYS B 62 -5.175 -13.026 1.902 1.00 0.00 C ATOM 2247 O CYS B 62 -6.046 -12.839 1.052 1.00 0.00 O ATOM 2248 CB CYS B 62 -3.109 -12.221 3.101 1.00 0.00 C ATOM 2249 SG CYS B 62 -1.980 -10.820 3.275 1.00 0.00 S ATOM 0 H CYS B 62 -4.862 -11.372 4.614 1.00 0.00 H new ATOM 0 HA CYS B 62 -4.403 -11.037 1.871 1.00 0.00 H new ATOM 0 HB2 CYS B 62 -3.204 -12.719 4.066 1.00 0.00 H new ATOM 0 HB3 CYS B 62 -2.671 -12.943 2.411 1.00 0.00 H new ATOM 0 HG CYS B 62 -2.665 -9.719 3.369 1.00 0.00 H new ATOM 2255 N LEU B 63 -4.769 -14.242 2.261 1.00 0.00 N ATOM 2256 CA LEU B 63 -5.330 -15.456 1.669 1.00 0.00 C ATOM 2257 C LEU B 63 -4.788 -15.679 0.263 1.00 0.00 C ATOM 2258 O LEU B 63 -4.264 -16.749 -0.051 1.00 0.00 O ATOM 2259 CB LEU B 63 -6.859 -15.380 1.630 1.00 0.00 C ATOM 2260 CG LEU B 63 -7.575 -16.730 1.626 1.00 0.00 C ATOM 2261 CD1 LEU B 63 -7.230 -17.514 0.370 1.00 0.00 C ATOM 2262 CD2 LEU B 63 -7.214 -17.526 2.871 1.00 0.00 C ATOM 0 H LEU B 63 -4.049 -14.414 2.963 1.00 0.00 H new ATOM 0 HA LEU B 63 -5.032 -16.298 2.294 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.201 -14.807 2.492 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.157 -14.825 0.740 1.00 0.00 H new ATOM 0 HG LEU B 63 -8.650 -16.551 1.632 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -7.749 -18.472 0.385 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -7.539 -16.948 -0.509 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -6.154 -17.685 0.332 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -7.732 -18.485 2.853 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.138 -17.696 2.895 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.513 -16.969 3.759 1.00 0.00 H new ATOM 2274 N GLY B 64 -4.917 -14.664 -0.581 1.00 0.00 N ATOM 2275 CA GLY B 64 -4.438 -14.766 -1.945 1.00 0.00 C ATOM 2276 C GLY B 64 -2.929 -14.684 -2.037 1.00 0.00 C ATOM 2277 O GLY B 64 -2.382 -13.689 -2.513 1.00 0.00 O ATOM 0 H GLY B 64 -5.346 -13.769 -0.344 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -4.774 -15.709 -2.375 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -4.879 -13.968 -2.542 1.00 0.00 H new ATOM 2281 N GLY B 65 -2.252 -15.735 -1.581 1.00 0.00 N ATOM 2282 CA GLY B 65 -0.801 -15.759 -1.626 1.00 0.00 C ATOM 2283 C GLY B 65 -0.263 -15.436 -3.005 1.00 0.00 C ATOM 2284 O GLY B 65 0.765 -14.772 -3.141 1.00 0.00 O ATOM 0 H GLY B 65 -2.682 -16.569 -1.182 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -0.406 -15.042 -0.907 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -0.447 -16.744 -1.322 1.00 0.00 H new ATOM 2288 N CYS B 66 -0.963 -15.906 -4.032 1.00 0.00 N ATOM 2289 CA CYS B 66 -0.554 -15.665 -5.414 1.00 0.00 C ATOM 2290 C CYS B 66 -0.410 -14.166 -5.687 1.00 0.00 C ATOM 2291 O CYS B 66 0.681 -13.610 -5.563 1.00 0.00 O ATOM 2292 CB CYS B 66 -1.544 -16.300 -6.405 1.00 0.00 C ATOM 2293 SG CYS B 66 -3.268 -16.348 -5.847 1.00 0.00 S ATOM 0 H CYS B 66 -1.816 -16.456 -3.935 1.00 0.00 H new ATOM 0 HA CYS B 66 0.418 -16.136 -5.558 1.00 0.00 H new ATOM 0 HB2 CYS B 66 -1.498 -15.749 -7.344 1.00 0.00 H new ATOM 0 HB3 CYS B 66 -1.219 -17.318 -6.617 1.00 0.00 H new ATOM 2298 N GLU B 67 -1.511 -13.515 -6.055 1.00 0.00 N ATOM 2299 CA GLU B 67 -1.494 -12.085 -6.338 1.00 0.00 C ATOM 2300 C GLU B 67 -2.888 -11.480 -6.185 1.00 0.00 C ATOM 2301 O GLU B 67 -3.190 -10.442 -6.773 1.00 0.00 O ATOM 2302 CB GLU B 67 -0.966 -11.831 -7.752 1.00 0.00 C ATOM 2303 CG GLU B 67 0.494 -11.413 -7.791 1.00 0.00 C ATOM 2304 CD GLU B 67 1.112 -11.579 -9.166 1.00 0.00 C ATOM 2305 OE1 GLU B 67 0.434 -11.254 -10.164 1.00 0.00 O ATOM 2306 OE2 GLU B 67 2.273 -12.034 -9.245 1.00 0.00 O ATOM 0 H GLU B 67 -2.424 -13.956 -6.164 1.00 0.00 H new ATOM 0 HA GLU B 67 -0.831 -11.606 -5.618 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -1.092 -12.736 -8.346 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -1.570 -11.055 -8.222 1.00 0.00 H new ATOM 0 HG2 GLU B 67 0.578 -10.371 -7.482 1.00 0.00 H new ATOM 0 HG3 GLU B 67 1.057 -12.005 -7.070 1.00 0.00 H new ATOM 2313 N HIS B 68 -3.736 -12.136 -5.395 1.00 0.00 N ATOM 2314 CA HIS B 68 -5.097 -11.657 -5.174 1.00 0.00 C ATOM 2315 C HIS B 68 -5.320 -11.292 -3.709 1.00 0.00 C ATOM 2316 O HIS B 68 -4.598 -11.754 -2.825 1.00 0.00 O ATOM 2317 CB HIS B 68 -6.108 -12.719 -5.606 1.00 0.00 C ATOM 2318 CG HIS B 68 -6.437 -12.673 -7.065 1.00 0.00 C ATOM 2319 ND1 HIS B 68 -6.851 -13.792 -7.742 1.00 0.00 N ATOM 2320 CD2 HIS B 68 -6.394 -11.625 -7.925 1.00 0.00 C ATOM 2321 CE1 HIS B 68 -7.050 -13.408 -8.990 1.00 0.00 C ATOM 2322 NE2 HIS B 68 -6.787 -12.102 -9.150 1.00 0.00 N ATOM 0 H HIS B 68 -3.505 -12.997 -4.900 1.00 0.00 H new ATOM 0 HA HIS B 68 -5.240 -10.760 -5.776 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -5.713 -13.705 -5.362 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -7.025 -12.591 -5.031 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -6.979 -14.729 -7.360 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -6.106 -10.611 -7.691 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -7.383 -14.063 -9.782 1.00 0.00 H new ATOM 2330 N ILE B 69 -6.329 -10.461 -3.462 1.00 0.00 N ATOM 2331 CA ILE B 69 -6.657 -10.032 -2.107 1.00 0.00 C ATOM 2332 C ILE B 69 -8.156 -9.791 -1.963 1.00 0.00 C ATOM 2333 O ILE B 69 -8.821 -9.385 -2.916 1.00 0.00 O ATOM 2334 CB ILE B 69 -5.905 -8.741 -1.717 1.00 0.00 C ATOM 2335 CG1 ILE B 69 -4.487 -8.746 -2.296 1.00 0.00 C ATOM 2336 CG2 ILE B 69 -5.862 -8.591 -0.205 1.00 0.00 C ATOM 2337 CD1 ILE B 69 -3.754 -7.436 -2.105 1.00 0.00 C ATOM 0 H ILE B 69 -6.934 -10.071 -4.185 1.00 0.00 H new ATOM 0 HA ILE B 69 -6.346 -10.835 -1.439 1.00 0.00 H new ATOM 0 HB ILE B 69 -6.442 -7.890 -2.136 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -3.914 -9.546 -1.827 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -4.538 -8.973 -3.361 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -5.329 -7.677 0.055 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -6.879 -8.541 0.185 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -5.348 -9.447 0.231 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -2.757 -7.510 -2.539 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -4.305 -6.635 -2.598 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -3.671 -7.217 -1.040 1.00 0.00 H new ATOM 2349 N PHE B 70 -8.684 -10.043 -0.770 1.00 0.00 N ATOM 2350 CA PHE B 70 -10.108 -9.850 -0.514 1.00 0.00 C ATOM 2351 C PHE B 70 -10.344 -9.321 0.897 1.00 0.00 C ATOM 2352 O PHE B 70 -9.408 -9.178 1.683 1.00 0.00 O ATOM 2353 CB PHE B 70 -10.873 -11.162 -0.712 1.00 0.00 C ATOM 2354 CG PHE B 70 -10.373 -11.987 -1.864 1.00 0.00 C ATOM 2355 CD1 PHE B 70 -9.245 -12.781 -1.728 1.00 0.00 C ATOM 2356 CD2 PHE B 70 -11.030 -11.968 -3.084 1.00 0.00 C ATOM 2357 CE1 PHE B 70 -8.782 -13.540 -2.785 1.00 0.00 C ATOM 2358 CE2 PHE B 70 -10.572 -12.725 -4.146 1.00 0.00 C ATOM 2359 CZ PHE B 70 -9.447 -13.513 -3.996 1.00 0.00 C ATOM 0 H PHE B 70 -8.151 -10.380 0.032 1.00 0.00 H new ATOM 0 HA PHE B 70 -10.477 -9.112 -1.227 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -10.806 -11.752 0.202 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -11.928 -10.937 -0.869 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -8.722 -12.806 -0.784 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -11.910 -11.354 -3.206 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -7.901 -14.154 -2.665 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -11.093 -12.701 -5.092 1.00 0.00 H new ATOM 0 HZ PHE B 70 -9.088 -14.107 -4.824 1.00 0.00 H new ATOM 2369 N CYS B 71 -11.604 -9.030 1.209 1.00 0.00 N ATOM 2370 CA CYS B 71 -11.968 -8.514 2.524 1.00 0.00 C ATOM 2371 C CYS B 71 -11.919 -9.618 3.575 1.00 0.00 C ATOM 2372 O CYS B 71 -11.551 -10.756 3.280 1.00 0.00 O ATOM 2373 CB CYS B 71 -13.367 -7.897 2.484 1.00 0.00 C ATOM 2374 SG CYS B 71 -13.659 -6.819 1.061 1.00 0.00 S ATOM 0 H CYS B 71 -12.390 -9.143 0.569 1.00 0.00 H new ATOM 0 HA CYS B 71 -11.246 -7.744 2.796 1.00 0.00 H new ATOM 0 HB2 CYS B 71 -14.106 -8.698 2.477 1.00 0.00 H new ATOM 0 HB3 CYS B 71 -13.526 -7.325 3.398 1.00 0.00 H new ATOM 2379 N SER B 72 -12.292 -9.274 4.803 1.00 0.00 N ATOM 2380 CA SER B 72 -12.291 -10.235 5.900 1.00 0.00 C ATOM 2381 C SER B 72 -13.427 -11.240 5.746 1.00 0.00 C ATOM 2382 O SER B 72 -13.267 -12.424 6.043 1.00 0.00 O ATOM 2383 CB SER B 72 -12.414 -9.509 7.241 1.00 0.00 C ATOM 2384 OG SER B 72 -13.113 -8.285 7.097 1.00 0.00 O ATOM 0 H SER B 72 -12.599 -8.337 5.064 1.00 0.00 H new ATOM 0 HA SER B 72 -11.346 -10.777 5.873 1.00 0.00 H new ATOM 0 HB2 SER B 72 -12.934 -10.146 7.956 1.00 0.00 H new ATOM 0 HB3 SER B 72 -11.421 -9.318 7.647 1.00 0.00 H new ATOM 0 HG SER B 72 -12.474 -7.542 7.094 1.00 0.00 H new ATOM 2390 N ASN B 73 -14.577 -10.761 5.282 1.00 0.00 N ATOM 2391 CA ASN B 73 -15.740 -11.618 5.088 1.00 0.00 C ATOM 2392 C ASN B 73 -15.833 -12.106 3.644 1.00 0.00 C ATOM 2393 O ASN B 73 -16.897 -12.534 3.193 1.00 0.00 O ATOM 2394 CB ASN B 73 -17.017 -10.868 5.465 1.00 0.00 C ATOM 2395 CG ASN B 73 -17.424 -11.104 6.907 1.00 0.00 C ATOM 2396 OD1 ASN B 73 -18.604 -11.281 7.209 1.00 0.00 O ATOM 2397 ND2 ASN B 73 -16.446 -11.110 7.804 1.00 0.00 N ATOM 0 H ASN B 73 -14.728 -9.783 5.033 1.00 0.00 H new ATOM 0 HA ASN B 73 -15.627 -12.487 5.736 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -16.869 -9.800 5.303 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -17.827 -11.181 4.806 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -16.659 -11.266 8.789 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -15.482 -10.959 7.508 1.00 0.00 H new ATOM 2404 N CYS B 74 -14.720 -12.038 2.923 1.00 0.00 N ATOM 2405 CA CYS B 74 -14.682 -12.472 1.532 1.00 0.00 C ATOM 2406 C CYS B 74 -14.154 -13.899 1.419 1.00 0.00 C ATOM 2407 O CYS B 74 -14.780 -14.754 0.793 1.00 0.00 O ATOM 2408 CB CYS B 74 -13.810 -11.526 0.704 1.00 0.00 C ATOM 2409 SG CYS B 74 -14.719 -10.162 -0.058 1.00 0.00 S ATOM 0 H CYS B 74 -13.831 -11.686 3.279 1.00 0.00 H new ATOM 0 HA CYS B 74 -15.700 -12.450 1.144 1.00 0.00 H new ATOM 0 HB2 CYS B 74 -13.029 -11.115 1.344 1.00 0.00 H new ATOM 0 HB3 CYS B 74 -13.312 -12.099 -0.078 1.00 0.00 H new ATOM 2414 N VAL B 75 -13.000 -14.149 2.027 1.00 0.00 N ATOM 2415 CA VAL B 75 -12.390 -15.473 1.993 1.00 0.00 C ATOM 2416 C VAL B 75 -13.005 -16.395 3.041 1.00 0.00 C ATOM 2417 O VAL B 75 -13.025 -17.614 2.874 1.00 0.00 O ATOM 2418 CB VAL B 75 -10.869 -15.401 2.224 1.00 0.00 C ATOM 2419 CG1 VAL B 75 -10.184 -14.683 1.073 1.00 0.00 C ATOM 2420 CG2 VAL B 75 -10.558 -14.720 3.549 1.00 0.00 C ATOM 0 H VAL B 75 -12.468 -13.453 2.549 1.00 0.00 H new ATOM 0 HA VAL B 75 -12.582 -15.878 0.999 1.00 0.00 H new ATOM 0 HB VAL B 75 -10.481 -16.419 2.267 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -9.110 -14.643 1.256 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -10.374 -15.221 0.144 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -10.576 -13.669 0.992 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -9.478 -14.680 3.693 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -10.961 -13.707 3.541 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -11.011 -15.285 4.364 1.00 0.00 H new ATOM 2430 N SER B 76 -13.505 -15.805 4.125 1.00 0.00 N ATOM 2431 CA SER B 76 -14.118 -16.573 5.207 1.00 0.00 C ATOM 2432 C SER B 76 -15.098 -17.612 4.666 1.00 0.00 C ATOM 2433 O SER B 76 -15.315 -18.654 5.285 1.00 0.00 O ATOM 2434 CB SER B 76 -14.836 -15.636 6.179 1.00 0.00 C ATOM 2435 OG SER B 76 -13.926 -14.736 6.787 1.00 0.00 O ATOM 0 H SER B 76 -13.498 -14.796 4.277 1.00 0.00 H new ATOM 0 HA SER B 76 -13.323 -17.099 5.735 1.00 0.00 H new ATOM 0 HB2 SER B 76 -15.606 -15.076 5.648 1.00 0.00 H new ATOM 0 HB3 SER B 76 -15.341 -16.222 6.947 1.00 0.00 H new ATOM 0 HG SER B 76 -13.646 -14.062 6.133 1.00 0.00 H new ATOM 2441 N ASP B 77 -15.684 -17.323 3.508 1.00 0.00 N ATOM 2442 CA ASP B 77 -16.638 -18.234 2.886 1.00 0.00 C ATOM 2443 C ASP B 77 -16.029 -19.620 2.693 1.00 0.00 C ATOM 2444 O ASP B 77 -16.743 -20.623 2.666 1.00 0.00 O ATOM 2445 CB ASP B 77 -17.103 -17.677 1.538 1.00 0.00 C ATOM 2446 CG ASP B 77 -15.945 -17.237 0.664 1.00 0.00 C ATOM 2447 OD1 ASP B 77 -14.797 -17.637 0.950 1.00 0.00 O ATOM 2448 OD2 ASP B 77 -16.187 -16.490 -0.308 1.00 0.00 O ATOM 0 H ASP B 77 -15.515 -16.466 2.982 1.00 0.00 H new ATOM 0 HA ASP B 77 -17.497 -18.326 3.551 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -17.682 -18.438 1.014 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -17.769 -16.831 1.708 1.00 0.00 H new ATOM 2453 N CYS B 78 -14.706 -19.672 2.557 1.00 0.00 N ATOM 2454 CA CYS B 78 -14.007 -20.938 2.367 1.00 0.00 C ATOM 2455 C CYS B 78 -12.496 -20.731 2.332 1.00 0.00 C ATOM 2456 O CYS B 78 -11.895 -20.652 1.260 1.00 0.00 O ATOM 2457 CB CYS B 78 -14.473 -21.609 1.072 1.00 0.00 C ATOM 2458 SG CYS B 78 -15.633 -22.973 1.324 1.00 0.00 S ATOM 0 H CYS B 78 -14.098 -18.853 2.575 1.00 0.00 H new ATOM 0 HA CYS B 78 -14.244 -21.585 3.212 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -14.943 -20.859 0.436 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -13.601 -21.982 0.535 1.00 0.00 H new ATOM 0 HG CYS B 78 -16.623 -22.570 2.064 1.00 0.00 H new ATOM 2464 N ILE B 79 -11.884 -20.651 3.511 1.00 0.00 N ATOM 2465 CA ILE B 79 -10.442 -20.460 3.608 1.00 0.00 C ATOM 2466 C ILE B 79 -9.700 -21.758 3.314 1.00 0.00 C ATOM 2467 O ILE B 79 -8.612 -21.747 2.738 1.00 0.00 O ATOM 2468 CB ILE B 79 -10.028 -19.947 5.001 1.00 0.00 C ATOM 2469 CG1 ILE B 79 -10.860 -18.724 5.385 1.00 0.00 C ATOM 2470 CG2 ILE B 79 -8.544 -19.608 5.023 1.00 0.00 C ATOM 2471 CD1 ILE B 79 -10.643 -17.546 4.468 1.00 0.00 C ATOM 0 H ILE B 79 -12.364 -20.715 4.409 1.00 0.00 H new ATOM 0 HA ILE B 79 -10.173 -19.710 2.864 1.00 0.00 H new ATOM 0 HB ILE B 79 -10.213 -20.736 5.730 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -11.916 -18.994 5.376 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -10.615 -18.432 6.406 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -8.268 -19.247 6.014 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -7.964 -20.500 4.787 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -8.337 -18.834 4.284 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -11.263 -16.711 4.795 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -9.594 -17.252 4.496 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -10.916 -17.823 3.450 1.00 0.00 H new ATOM 2483 N GLY B 80 -10.296 -22.879 3.711 1.00 0.00 N ATOM 2484 CA GLY B 80 -9.678 -24.172 3.478 1.00 0.00 C ATOM 2485 C GLY B 80 -9.311 -24.383 2.021 1.00 0.00 C ATOM 2486 O GLY B 80 -8.411 -25.163 1.707 1.00 0.00 O ATOM 0 H GLY B 80 -11.196 -22.915 4.190 1.00 0.00 H new ATOM 0 HA2 GLY B 80 -8.782 -24.259 4.092 1.00 0.00 H new ATOM 0 HA3 GLY B 80 -10.360 -24.960 3.796 1.00 0.00 H new ATOM 2490 N THR B 81 -10.009 -23.685 1.131 1.00 0.00 N ATOM 2491 CA THR B 81 -9.753 -23.794 -0.299 1.00 0.00 C ATOM 2492 C THR B 81 -8.595 -22.888 -0.711 1.00 0.00 C ATOM 2493 O THR B 81 -7.484 -23.358 -0.957 1.00 0.00 O ATOM 2494 CB THR B 81 -11.014 -23.434 -1.089 1.00 0.00 C ATOM 2495 OG1 THR B 81 -12.058 -24.348 -0.806 1.00 0.00 O ATOM 2496 CG2 THR B 81 -10.806 -23.428 -2.589 1.00 0.00 C ATOM 0 H THR B 81 -10.757 -23.037 1.376 1.00 0.00 H new ATOM 0 HA THR B 81 -9.478 -24.825 -0.522 1.00 0.00 H new ATOM 0 HB THR B 81 -11.272 -22.423 -0.772 1.00 0.00 H new ATOM 0 HG1 THR B 81 -12.856 -24.102 -1.318 1.00 0.00 H new ATOM 0 HG21 THR B 81 -11.740 -23.165 -3.085 1.00 0.00 H new ATOM 0 HG22 THR B 81 -10.040 -22.697 -2.847 1.00 0.00 H new ATOM 0 HG23 THR B 81 -10.488 -24.418 -2.916 1.00 0.00 H new ATOM 2504 N GLY B 82 -8.862 -21.588 -0.782 1.00 0.00 N ATOM 2505 CA GLY B 82 -7.833 -20.639 -1.162 1.00 0.00 C ATOM 2506 C GLY B 82 -8.383 -19.487 -1.978 1.00 0.00 C ATOM 2507 O GLY B 82 -9.160 -18.675 -1.477 1.00 0.00 O ATOM 0 H GLY B 82 -9.773 -21.175 -0.583 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -7.353 -20.249 -0.264 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -7.063 -21.153 -1.737 1.00 0.00 H new ATOM 2511 N CYS B 83 -7.979 -19.416 -3.242 1.00 0.00 N ATOM 2512 CA CYS B 83 -8.436 -18.358 -4.135 1.00 0.00 C ATOM 2513 C CYS B 83 -9.412 -18.908 -5.175 1.00 0.00 C ATOM 2514 O CYS B 83 -9.166 -19.956 -5.771 1.00 0.00 O ATOM 2515 CB CYS B 83 -7.245 -17.700 -4.833 1.00 0.00 C ATOM 2516 SG CYS B 83 -7.678 -16.253 -5.826 1.00 0.00 S ATOM 0 H CYS B 83 -7.335 -20.080 -3.671 1.00 0.00 H new ATOM 0 HA CYS B 83 -8.954 -17.609 -3.536 1.00 0.00 H new ATOM 0 HB2 CYS B 83 -6.514 -17.405 -4.080 1.00 0.00 H new ATOM 0 HB3 CYS B 83 -6.762 -18.436 -5.475 1.00 0.00 H new ATOM 2521 N PRO B 84 -10.538 -18.209 -5.406 1.00 0.00 N ATOM 2522 CA PRO B 84 -11.549 -18.641 -6.373 1.00 0.00 C ATOM 2523 C PRO B 84 -11.160 -18.333 -7.819 1.00 0.00 C ATOM 2524 O PRO B 84 -11.792 -18.824 -8.754 1.00 0.00 O ATOM 2525 CB PRO B 84 -12.778 -17.831 -5.969 1.00 0.00 C ATOM 2526 CG PRO B 84 -12.224 -16.573 -5.395 1.00 0.00 C ATOM 2527 CD PRO B 84 -10.922 -16.950 -4.736 1.00 0.00 C ATOM 0 HA PRO B 84 -11.696 -19.721 -6.351 1.00 0.00 H new ATOM 0 HB2 PRO B 84 -13.419 -17.627 -6.827 1.00 0.00 H new ATOM 0 HB3 PRO B 84 -13.384 -18.367 -5.239 1.00 0.00 H new ATOM 0 HG2 PRO B 84 -12.065 -15.827 -6.173 1.00 0.00 H new ATOM 0 HG3 PRO B 84 -12.914 -16.138 -4.673 1.00 0.00 H new ATOM 0 HD2 PRO B 84 -10.166 -16.177 -4.874 1.00 0.00 H new ATOM 0 HD3 PRO B 84 -11.043 -17.090 -3.662 1.00 0.00 H new ATOM 2535 N VAL B 85 -10.125 -17.517 -8.001 1.00 0.00 N ATOM 2536 CA VAL B 85 -9.673 -17.152 -9.339 1.00 0.00 C ATOM 2537 C VAL B 85 -8.352 -17.830 -9.683 1.00 0.00 C ATOM 2538 O VAL B 85 -8.294 -18.695 -10.559 1.00 0.00 O ATOM 2539 CB VAL B 85 -9.507 -15.627 -9.481 1.00 0.00 C ATOM 2540 CG1 VAL B 85 -9.250 -15.251 -10.932 1.00 0.00 C ATOM 2541 CG2 VAL B 85 -10.733 -14.904 -8.944 1.00 0.00 C ATOM 0 H VAL B 85 -9.586 -17.098 -7.243 1.00 0.00 H new ATOM 0 HA VAL B 85 -10.442 -17.493 -10.032 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.644 -15.317 -8.891 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -9.135 -14.170 -11.013 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -8.339 -15.739 -11.279 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -10.091 -15.574 -11.546 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -10.597 -13.828 -9.053 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -11.614 -15.217 -9.504 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -10.867 -15.148 -7.890 1.00 0.00 H new ATOM 2551 N CYS B 86 -7.292 -17.432 -8.990 1.00 0.00 N ATOM 2552 CA CYS B 86 -5.967 -17.996 -9.218 1.00 0.00 C ATOM 2553 C CYS B 86 -5.927 -19.479 -8.855 1.00 0.00 C ATOM 2554 O CYS B 86 -4.996 -20.191 -9.230 1.00 0.00 O ATOM 2555 CB CYS B 86 -4.926 -17.234 -8.397 1.00 0.00 C ATOM 2556 SG CYS B 86 -4.676 -15.524 -8.925 1.00 0.00 S ATOM 0 H CYS B 86 -7.325 -16.718 -8.262 1.00 0.00 H new ATOM 0 HA CYS B 86 -5.737 -17.898 -10.279 1.00 0.00 H new ATOM 0 HB2 CYS B 86 -5.230 -17.239 -7.350 1.00 0.00 H new ATOM 0 HB3 CYS B 86 -3.975 -17.763 -8.455 1.00 0.00 H new ATOM 2561 N TYR B 87 -6.937 -19.940 -8.120 1.00 0.00 N ATOM 2562 CA TYR B 87 -7.005 -21.336 -7.706 1.00 0.00 C ATOM 2563 C TYR B 87 -5.855 -21.680 -6.761 1.00 0.00 C ATOM 2564 O TYR B 87 -5.515 -22.849 -6.583 1.00 0.00 O ATOM 2565 CB TYR B 87 -6.974 -22.259 -8.927 1.00 0.00 C ATOM 2566 CG TYR B 87 -8.343 -22.731 -9.365 1.00 0.00 C ATOM 2567 CD1 TYR B 87 -9.336 -21.821 -9.704 1.00 0.00 C ATOM 2568 CD2 TYR B 87 -8.641 -24.086 -9.438 1.00 0.00 C ATOM 2569 CE1 TYR B 87 -10.588 -22.248 -10.105 1.00 0.00 C ATOM 2570 CE2 TYR B 87 -9.890 -24.521 -9.838 1.00 0.00 C ATOM 2571 CZ TYR B 87 -10.859 -23.598 -10.170 1.00 0.00 C ATOM 2572 OH TYR B 87 -12.105 -24.027 -10.568 1.00 0.00 O ATOM 0 H TYR B 87 -7.718 -19.367 -7.800 1.00 0.00 H new ATOM 0 HA TYR B 87 -7.945 -21.485 -7.175 1.00 0.00 H new ATOM 0 HB2 TYR B 87 -6.497 -21.735 -9.756 1.00 0.00 H new ATOM 0 HB3 TYR B 87 -6.355 -23.127 -8.700 1.00 0.00 H new ATOM 0 HD1 TYR B 87 -9.127 -20.763 -9.653 1.00 0.00 H new ATOM 0 HD2 TYR B 87 -7.884 -24.811 -9.178 1.00 0.00 H new ATOM 0 HE1 TYR B 87 -11.350 -21.528 -10.366 1.00 0.00 H new ATOM 0 HE2 TYR B 87 -10.106 -25.578 -9.890 1.00 0.00 H new ATOM 0 HH TYR B 87 -12.131 -25.007 -10.561 1.00 0.00 H new ATOM 2582 N THR B 88 -5.262 -20.653 -6.157 1.00 0.00 N ATOM 2583 CA THR B 88 -4.153 -20.850 -5.231 1.00 0.00 C ATOM 2584 C THR B 88 -4.669 -21.184 -3.832 1.00 0.00 C ATOM 2585 O THR B 88 -5.652 -20.603 -3.373 1.00 0.00 O ATOM 2586 CB THR B 88 -3.278 -19.595 -5.179 1.00 0.00 C ATOM 2587 OG1 THR B 88 -2.761 -19.292 -6.463 1.00 0.00 O ATOM 2588 CG2 THR B 88 -2.105 -19.719 -4.230 1.00 0.00 C ATOM 0 H THR B 88 -5.531 -19.679 -6.293 1.00 0.00 H new ATOM 0 HA THR B 88 -3.554 -21.688 -5.589 1.00 0.00 H new ATOM 0 HB THR B 88 -3.933 -18.802 -4.818 1.00 0.00 H new ATOM 0 HG1 THR B 88 -2.985 -18.367 -6.696 1.00 0.00 H new ATOM 0 HG21 THR B 88 -1.528 -18.795 -4.243 1.00 0.00 H new ATOM 0 HG22 THR B 88 -2.472 -19.904 -3.220 1.00 0.00 H new ATOM 0 HG23 THR B 88 -1.470 -20.548 -4.543 1.00 0.00 H new ATOM 2596 N PRO B 89 -4.013 -22.127 -3.134 1.00 0.00 N ATOM 2597 CA PRO B 89 -4.418 -22.531 -1.782 1.00 0.00 C ATOM 2598 C PRO B 89 -4.184 -21.427 -0.757 1.00 0.00 C ATOM 2599 O PRO B 89 -3.217 -20.671 -0.854 1.00 0.00 O ATOM 2600 CB PRO B 89 -3.522 -23.735 -1.484 1.00 0.00 C ATOM 2601 CG PRO B 89 -2.329 -23.547 -2.355 1.00 0.00 C ATOM 2602 CD PRO B 89 -2.829 -22.873 -3.601 1.00 0.00 C ATOM 0 HA PRO B 89 -5.483 -22.754 -1.725 1.00 0.00 H new ATOM 0 HB2 PRO B 89 -3.242 -23.768 -0.431 1.00 0.00 H new ATOM 0 HB3 PRO B 89 -4.031 -24.672 -1.708 1.00 0.00 H new ATOM 0 HG2 PRO B 89 -1.575 -22.937 -1.857 1.00 0.00 H new ATOM 0 HG3 PRO B 89 -1.862 -24.504 -2.589 1.00 0.00 H new ATOM 0 HD2 PRO B 89 -2.078 -22.208 -4.028 1.00 0.00 H new ATOM 0 HD3 PRO B 89 -3.089 -23.597 -4.373 1.00 0.00 H new ATOM 2610 N ALA B 90 -5.077 -21.338 0.224 1.00 0.00 N ATOM 2611 CA ALA B 90 -4.966 -20.325 1.268 1.00 0.00 C ATOM 2612 C ALA B 90 -3.632 -20.434 1.998 1.00 0.00 C ATOM 2613 O ALA B 90 -3.475 -21.250 2.906 1.00 0.00 O ATOM 2614 CB ALA B 90 -6.120 -20.453 2.251 1.00 0.00 C ATOM 0 H ALA B 90 -5.884 -21.954 0.318 1.00 0.00 H new ATOM 0 HA ALA B 90 -5.013 -19.344 0.795 1.00 0.00 H new ATOM 0 HB1 ALA B 90 -6.025 -19.691 3.025 1.00 0.00 H new ATOM 0 HB2 ALA B 90 -7.064 -20.318 1.723 1.00 0.00 H new ATOM 0 HB3 ALA B 90 -6.099 -21.441 2.710 1.00 0.00 H new ATOM 2620 N TRP B 91 -2.673 -19.607 1.595 1.00 0.00 N ATOM 2621 CA TRP B 91 -1.350 -19.612 2.211 1.00 0.00 C ATOM 2622 C TRP B 91 -1.438 -19.352 3.711 1.00 0.00 C ATOM 2623 O TRP B 91 -0.541 -19.720 4.469 1.00 0.00 O ATOM 2624 CB TRP B 91 -0.452 -18.563 1.551 1.00 0.00 C ATOM 2625 CG TRP B 91 0.998 -18.936 1.554 1.00 0.00 C ATOM 2626 CD1 TRP B 91 1.617 -19.830 0.729 1.00 0.00 C ATOM 2627 CD2 TRP B 91 2.013 -18.427 2.427 1.00 0.00 C ATOM 2628 NE1 TRP B 91 2.955 -19.907 1.034 1.00 0.00 N ATOM 2629 CE2 TRP B 91 3.222 -19.056 2.074 1.00 0.00 C ATOM 2630 CE3 TRP B 91 2.016 -17.501 3.475 1.00 0.00 C ATOM 2631 CZ2 TRP B 91 4.420 -18.786 2.729 1.00 0.00 C ATOM 2632 CZ3 TRP B 91 3.207 -17.235 4.124 1.00 0.00 C ATOM 2633 CH2 TRP B 91 4.395 -17.875 3.750 1.00 0.00 C ATOM 0 H TRP B 91 -2.787 -18.925 0.845 1.00 0.00 H new ATOM 0 HA TRP B 91 -0.916 -20.600 2.061 1.00 0.00 H new ATOM 0 HB2 TRP B 91 -0.779 -18.411 0.522 1.00 0.00 H new ATOM 0 HB3 TRP B 91 -0.576 -17.612 2.068 1.00 0.00 H new ATOM 0 HD1 TRP B 91 1.127 -20.395 -0.050 1.00 0.00 H new ATOM 0 HE1 TRP B 91 3.638 -20.501 0.563 1.00 0.00 H new ATOM 0 HE3 TRP B 91 1.105 -17.003 3.772 1.00 0.00 H new ATOM 0 HZ2 TRP B 91 5.337 -19.278 2.442 1.00 0.00 H new ATOM 0 HZ3 TRP B 91 3.222 -16.521 4.934 1.00 0.00 H new ATOM 0 HH2 TRP B 91 5.309 -17.645 4.277 1.00 0.00 H new ATOM 2644 N ILE B 92 -2.524 -18.716 4.134 1.00 0.00 N ATOM 2645 CA ILE B 92 -2.728 -18.408 5.544 1.00 0.00 C ATOM 2646 C ILE B 92 -3.831 -19.274 6.142 1.00 0.00 C ATOM 2647 O ILE B 92 -5.008 -19.109 5.821 1.00 0.00 O ATOM 2648 CB ILE B 92 -3.089 -16.924 5.751 1.00 0.00 C ATOM 2649 CG1 ILE B 92 -4.170 -16.493 4.757 1.00 0.00 C ATOM 2650 CG2 ILE B 92 -1.851 -16.051 5.607 1.00 0.00 C ATOM 2651 CD1 ILE B 92 -5.156 -15.498 5.328 1.00 0.00 C ATOM 0 H ILE B 92 -3.277 -18.404 3.521 1.00 0.00 H new ATOM 0 HA ILE B 92 -1.787 -18.619 6.051 1.00 0.00 H new ATOM 0 HB ILE B 92 -3.481 -16.800 6.760 1.00 0.00 H new ATOM 0 HG12 ILE B 92 -3.692 -16.056 3.880 1.00 0.00 H new ATOM 0 HG13 ILE B 92 -4.712 -17.375 4.418 1.00 0.00 H new ATOM 0 HG21 ILE B 92 -2.123 -15.006 5.756 1.00 0.00 H new ATOM 0 HG22 ILE B 92 -1.111 -16.343 6.352 1.00 0.00 H new ATOM 0 HG23 ILE B 92 -1.431 -16.178 4.609 1.00 0.00 H new ATOM 0 HD11 ILE B 92 -5.892 -15.238 4.568 1.00 0.00 H new ATOM 0 HD12 ILE B 92 -5.662 -15.939 6.187 1.00 0.00 H new ATOM 0 HD13 ILE B 92 -4.625 -14.599 5.641 1.00 0.00 H new ATOM 2663 N GLN B 93 -3.443 -20.199 7.014 1.00 0.00 N ATOM 2664 CA GLN B 93 -4.399 -21.093 7.658 1.00 0.00 C ATOM 2665 C GLN B 93 -5.438 -20.303 8.445 1.00 0.00 C ATOM 2666 O GLN B 93 -6.590 -20.720 8.568 1.00 0.00 O ATOM 2667 CB GLN B 93 -3.672 -22.068 8.586 1.00 0.00 C ATOM 2668 CG GLN B 93 -2.532 -22.815 7.912 1.00 0.00 C ATOM 2669 CD GLN B 93 -1.326 -22.975 8.816 1.00 0.00 C ATOM 2670 OE1 GLN B 93 -1.042 -22.115 9.650 1.00 0.00 O ATOM 2671 NE2 GLN B 93 -0.609 -24.081 8.656 1.00 0.00 N ATOM 0 H GLN B 93 -2.473 -20.349 7.291 1.00 0.00 H new ATOM 0 HA GLN B 93 -4.912 -21.657 6.879 1.00 0.00 H new ATOM 0 HB2 GLN B 93 -3.279 -21.518 9.441 1.00 0.00 H new ATOM 0 HB3 GLN B 93 -4.390 -22.791 8.974 1.00 0.00 H new ATOM 0 HG2 GLN B 93 -2.881 -23.799 7.601 1.00 0.00 H new ATOM 0 HG3 GLN B 93 -2.236 -22.281 7.009 1.00 0.00 H new ATOM 0 HE21 GLN B 93 -0.881 -24.768 7.952 1.00 0.00 H new ATOM 0 HE22 GLN B 93 0.213 -24.244 9.237 1.00 0.00 H new ATOM 2680 N ASP B 94 -5.024 -19.157 8.977 1.00 0.00 N ATOM 2681 CA ASP B 94 -5.919 -18.306 9.752 1.00 0.00 C ATOM 2682 C ASP B 94 -6.344 -17.085 8.941 1.00 0.00 C ATOM 2683 O ASP B 94 -6.081 -17.003 7.742 1.00 0.00 O ATOM 2684 CB ASP B 94 -5.238 -17.861 11.047 1.00 0.00 C ATOM 2685 CG ASP B 94 -6.192 -17.844 12.225 1.00 0.00 C ATOM 2686 OD1 ASP B 94 -6.843 -16.801 12.448 1.00 0.00 O ATOM 2687 OD2 ASP B 94 -6.291 -18.874 12.926 1.00 0.00 O ATOM 0 H ASP B 94 -4.074 -18.797 8.885 1.00 0.00 H new ATOM 0 HA ASP B 94 -6.809 -18.885 9.998 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -4.407 -18.531 11.266 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -4.817 -16.865 10.909 1.00 0.00 H new ATOM 2692 N LEU B 95 -7.002 -16.141 9.605 1.00 0.00 N ATOM 2693 CA LEU B 95 -7.462 -14.924 8.946 1.00 0.00 C ATOM 2694 C LEU B 95 -6.596 -13.731 9.340 1.00 0.00 C ATOM 2695 O LEU B 95 -6.917 -12.999 10.276 1.00 0.00 O ATOM 2696 CB LEU B 95 -8.928 -14.652 9.297 1.00 0.00 C ATOM 2697 CG LEU B 95 -9.837 -14.365 8.102 1.00 0.00 C ATOM 2698 CD1 LEU B 95 -9.932 -15.584 7.198 1.00 0.00 C ATOM 2699 CD2 LEU B 95 -11.219 -13.940 8.575 1.00 0.00 C ATOM 0 H LEU B 95 -7.229 -16.195 10.598 1.00 0.00 H new ATOM 0 HA LEU B 95 -7.377 -15.067 7.869 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -9.323 -15.514 9.836 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -8.971 -13.803 9.979 1.00 0.00 H new ATOM 0 HG LEU B 95 -9.403 -13.546 7.528 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -10.583 -15.360 6.353 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -8.939 -15.844 6.832 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -10.342 -16.423 7.760 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -11.853 -13.740 7.712 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -11.660 -14.738 9.172 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -11.135 -13.038 9.181 1.00 0.00 H new ATOM 2711 N LYS B 96 -5.495 -13.543 8.619 1.00 0.00 N ATOM 2712 CA LYS B 96 -4.581 -12.440 8.893 1.00 0.00 C ATOM 2713 C LYS B 96 -5.201 -11.107 8.489 1.00 0.00 C ATOM 2714 O LYS B 96 -6.264 -11.068 7.870 1.00 0.00 O ATOM 2715 CB LYS B 96 -3.260 -12.648 8.149 1.00 0.00 C ATOM 2716 CG LYS B 96 -2.659 -14.029 8.353 1.00 0.00 C ATOM 2717 CD LYS B 96 -2.267 -14.258 9.804 1.00 0.00 C ATOM 2718 CE LYS B 96 -0.779 -14.035 10.020 1.00 0.00 C ATOM 2719 NZ LYS B 96 -0.463 -12.602 10.276 1.00 0.00 N ATOM 0 H LYS B 96 -5.214 -14.140 7.841 1.00 0.00 H new ATOM 0 HA LYS B 96 -4.387 -12.420 9.965 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -3.423 -12.485 7.084 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -2.544 -11.896 8.480 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -3.378 -14.789 8.045 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -1.782 -14.143 7.716 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -2.834 -13.584 10.446 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -2.530 -15.274 10.097 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -0.440 -14.638 10.863 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -0.230 -14.377 9.143 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 0.557 -12.497 10.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -0.732 -12.034 9.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -0.993 -12.273 11.108 1.00 0.00 H new ATOM 2733 N ILE B 97 -4.532 -10.015 8.845 1.00 0.00 N ATOM 2734 CA ILE B 97 -5.021 -8.680 8.519 1.00 0.00 C ATOM 2735 C ILE B 97 -3.931 -7.838 7.867 1.00 0.00 C ATOM 2736 O ILE B 97 -2.773 -7.872 8.283 1.00 0.00 O ATOM 2737 CB ILE B 97 -5.537 -7.951 9.774 1.00 0.00 C ATOM 2738 CG1 ILE B 97 -6.500 -8.849 10.554 1.00 0.00 C ATOM 2739 CG2 ILE B 97 -6.215 -6.645 9.389 1.00 0.00 C ATOM 2740 CD1 ILE B 97 -7.769 -9.176 9.797 1.00 0.00 C ATOM 0 H ILE B 97 -3.651 -10.028 9.359 1.00 0.00 H new ATOM 0 HA ILE B 97 -5.845 -8.807 7.816 1.00 0.00 H new ATOM 0 HB ILE B 97 -4.687 -7.720 10.415 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -5.990 -9.778 10.811 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -6.762 -8.359 11.492 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -6.574 -6.143 10.287 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -5.501 -6.002 8.874 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -7.057 -6.853 8.729 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -8.404 -9.816 10.410 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -8.301 -8.254 9.563 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -7.517 -9.694 8.872 1.00 0.00 H new ATOM 2752 N ASN B 98 -4.312 -7.077 6.846 1.00 0.00 N ATOM 2753 CA ASN B 98 -3.368 -6.220 6.137 1.00 0.00 C ATOM 2754 C ASN B 98 -3.378 -4.810 6.716 1.00 0.00 C ATOM 2755 O ASN B 98 -4.055 -3.920 6.201 1.00 0.00 O ATOM 2756 CB ASN B 98 -3.708 -6.175 4.646 1.00 0.00 C ATOM 2757 CG ASN B 98 -3.129 -7.351 3.885 1.00 0.00 C ATOM 2758 OD1 ASN B 98 -3.827 -8.321 3.591 1.00 0.00 O ATOM 2759 ND2 ASN B 98 -1.843 -7.270 3.561 1.00 0.00 N ATOM 0 H ASN B 98 -5.267 -7.036 6.491 1.00 0.00 H new ATOM 0 HA ASN B 98 -2.369 -6.638 6.261 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -4.791 -6.164 4.523 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -3.329 -5.247 4.218 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -1.397 -8.031 3.048 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -1.301 -6.447 3.825 1.00 0.00 H new ATOM 2766 N ARG B 99 -2.625 -4.614 7.794 1.00 0.00 N ATOM 2767 CA ARG B 99 -2.548 -3.313 8.448 1.00 0.00 C ATOM 2768 C ARG B 99 -2.062 -2.239 7.478 1.00 0.00 C ATOM 2769 O ARG B 99 -2.428 -1.070 7.599 1.00 0.00 O ATOM 2770 CB ARG B 99 -1.616 -3.383 9.659 1.00 0.00 C ATOM 2771 CG ARG B 99 -2.326 -3.748 10.952 1.00 0.00 C ATOM 2772 CD ARG B 99 -3.245 -2.631 11.423 1.00 0.00 C ATOM 2773 NE ARG B 99 -2.520 -1.594 12.153 1.00 0.00 N ATOM 2774 CZ ARG B 99 -1.976 -0.520 11.582 1.00 0.00 C ATOM 2775 NH1 ARG B 99 -2.064 -0.335 10.269 1.00 0.00 N ATOM 2776 NH2 ARG B 99 -1.339 0.374 12.326 1.00 0.00 N ATOM 0 H ARG B 99 -2.059 -5.340 8.233 1.00 0.00 H new ATOM 0 HA ARG B 99 -3.550 -3.044 8.783 1.00 0.00 H new ATOM 0 HB2 ARG B 99 -0.834 -4.117 9.464 1.00 0.00 H new ATOM 0 HB3 ARG B 99 -1.123 -2.419 9.784 1.00 0.00 H new ATOM 0 HG2 ARG B 99 -2.906 -4.659 10.804 1.00 0.00 H new ATOM 0 HG3 ARG B 99 -1.588 -3.962 11.725 1.00 0.00 H new ATOM 0 HD2 ARG B 99 -3.745 -2.186 10.562 1.00 0.00 H new ATOM 0 HD3 ARG B 99 -4.023 -3.048 12.063 1.00 0.00 H new ATOM 0 HE ARG B 99 -2.424 -1.699 13.163 1.00 0.00 H new ATOM 0 HH11 ARG B 99 -2.551 -1.018 9.689 1.00 0.00 H new ATOM 0 HH12 ARG B 99 -1.644 0.490 9.841 1.00 0.00 H new ATOM 0 HH21 ARG B 99 -1.266 0.239 13.334 1.00 0.00 H new ATOM 0 HH22 ARG B 99 -0.922 1.196 11.890 1.00 0.00 H new ATOM 2790 N GLN B 100 -1.236 -2.642 6.519 1.00 0.00 N ATOM 2791 CA GLN B 100 -0.703 -1.711 5.531 1.00 0.00 C ATOM 2792 C GLN B 100 -1.768 -1.335 4.508 1.00 0.00 C ATOM 2793 O GLN B 100 -2.012 -0.154 4.257 1.00 0.00 O ATOM 2794 CB GLN B 100 0.513 -2.319 4.827 1.00 0.00 C ATOM 2795 CG GLN B 100 1.700 -2.559 5.748 1.00 0.00 C ATOM 2796 CD GLN B 100 1.988 -1.378 6.656 1.00 0.00 C ATOM 2797 OE1 GLN B 100 2.304 -1.546 7.834 1.00 0.00 O ATOM 2798 NE2 GLN B 100 1.880 -0.171 6.110 1.00 0.00 N ATOM 0 H GLN B 100 -0.921 -3.605 6.405 1.00 0.00 H new ATOM 0 HA GLN B 100 -0.393 -0.805 6.052 1.00 0.00 H new ATOM 0 HB2 GLN B 100 0.222 -3.265 4.371 1.00 0.00 H new ATOM 0 HB3 GLN B 100 0.821 -1.657 4.018 1.00 0.00 H new ATOM 0 HG2 GLN B 100 1.508 -3.442 6.358 1.00 0.00 H new ATOM 0 HG3 GLN B 100 2.583 -2.773 5.146 1.00 0.00 H new ATOM 0 HE21 GLN B 100 1.615 -0.077 5.129 1.00 0.00 H new ATOM 0 HE22 GLN B 100 2.062 0.661 6.672 1.00 0.00 H new ATOM 2807 N LEU B 101 -2.401 -2.344 3.918 1.00 0.00 N ATOM 2808 CA LEU B 101 -3.442 -2.114 2.923 1.00 0.00 C ATOM 2809 C LEU B 101 -4.590 -1.304 3.515 1.00 0.00 C ATOM 2810 O LEU B 101 -5.209 -0.491 2.829 1.00 0.00 O ATOM 2811 CB LEU B 101 -3.965 -3.446 2.382 1.00 0.00 C ATOM 2812 CG LEU B 101 -4.402 -3.425 0.916 1.00 0.00 C ATOM 2813 CD1 LEU B 101 -3.282 -2.893 0.033 1.00 0.00 C ATOM 2814 CD2 LEU B 101 -4.824 -4.815 0.466 1.00 0.00 C ATOM 0 H LEU B 101 -2.212 -3.327 4.111 1.00 0.00 H new ATOM 0 HA LEU B 101 -3.006 -1.545 2.102 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -3.187 -4.200 2.502 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -4.811 -3.761 2.993 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.259 -2.759 0.821 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.611 -2.885 -1.006 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.027 -1.879 0.341 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -2.406 -3.533 0.132 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -5.132 -4.781 -0.579 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -3.986 -5.503 0.575 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -5.658 -5.158 1.079 1.00 0.00 H new ATOM 2826 N ASP B 102 -4.867 -1.529 4.796 1.00 0.00 N ATOM 2827 CA ASP B 102 -5.939 -0.816 5.482 1.00 0.00 C ATOM 2828 C ASP B 102 -5.649 0.680 5.528 1.00 0.00 C ATOM 2829 O ASP B 102 -6.529 1.503 5.269 1.00 0.00 O ATOM 2830 CB ASP B 102 -6.114 -1.359 6.902 1.00 0.00 C ATOM 2831 CG ASP B 102 -7.348 -0.803 7.585 1.00 0.00 C ATOM 2832 OD1 ASP B 102 -8.447 -0.904 6.998 1.00 0.00 O ATOM 2833 OD2 ASP B 102 -7.217 -0.268 8.705 1.00 0.00 O ATOM 0 H ASP B 102 -4.365 -2.198 5.379 1.00 0.00 H new ATOM 0 HA ASP B 102 -6.863 -0.973 4.926 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -6.180 -2.446 6.867 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -5.232 -1.113 7.494 1.00 0.00 H new ATOM 2838 N SER B 103 -4.407 1.026 5.854 1.00 0.00 N ATOM 2839 CA SER B 103 -3.998 2.423 5.931 1.00 0.00 C ATOM 2840 C SER B 103 -4.228 3.125 4.597 1.00 0.00 C ATOM 2841 O SER B 103 -4.538 4.315 4.555 1.00 0.00 O ATOM 2842 CB SER B 103 -2.524 2.525 6.326 1.00 0.00 C ATOM 2843 OG SER B 103 -2.166 3.863 6.623 1.00 0.00 O ATOM 0 H SER B 103 -3.667 0.358 6.069 1.00 0.00 H new ATOM 0 HA SER B 103 -4.604 2.914 6.693 1.00 0.00 H new ATOM 0 HB2 SER B 103 -2.332 1.893 7.193 1.00 0.00 H new ATOM 0 HB3 SER B 103 -1.900 2.150 5.514 1.00 0.00 H new ATOM 0 HG SER B 103 -1.272 3.881 7.025 1.00 0.00 H new ATOM 2849 N MET B 104 -4.078 2.377 3.509 1.00 0.00 N ATOM 2850 CA MET B 104 -4.275 2.924 2.171 1.00 0.00 C ATOM 2851 C MET B 104 -5.741 3.273 1.942 1.00 0.00 C ATOM 2852 O MET B 104 -6.060 4.233 1.241 1.00 0.00 O ATOM 2853 CB MET B 104 -3.806 1.925 1.113 1.00 0.00 C ATOM 2854 CG MET B 104 -2.343 1.541 1.248 1.00 0.00 C ATOM 2855 SD MET B 104 -1.528 1.336 -0.347 1.00 0.00 S ATOM 2856 CE MET B 104 -0.921 2.996 -0.632 1.00 0.00 C ATOM 0 H MET B 104 -3.821 1.390 3.527 1.00 0.00 H new ATOM 0 HA MET B 104 -3.683 3.835 2.086 1.00 0.00 H new ATOM 0 HB2 MET B 104 -4.417 1.025 1.179 1.00 0.00 H new ATOM 0 HB3 MET B 104 -3.972 2.351 0.124 1.00 0.00 H new ATOM 0 HG2 MET B 104 -1.822 2.307 1.822 1.00 0.00 H new ATOM 0 HG3 MET B 104 -2.266 0.612 1.813 1.00 0.00 H new ATOM 0 HE1 MET B 104 -0.245 2.995 -1.487 1.00 0.00 H new ATOM 0 HE2 MET B 104 -1.761 3.661 -0.834 1.00 0.00 H new ATOM 0 HE3 MET B 104 -0.387 3.345 0.252 1.00 0.00 H new ATOM 2866 N ILE B 105 -6.628 2.488 2.544 1.00 0.00 N ATOM 2867 CA ILE B 105 -8.062 2.712 2.411 1.00 0.00 C ATOM 2868 C ILE B 105 -8.445 4.091 2.938 1.00 0.00 C ATOM 2869 O ILE B 105 -9.158 4.845 2.276 1.00 0.00 O ATOM 2870 CB ILE B 105 -8.872 1.639 3.167 1.00 0.00 C ATOM 2871 CG1 ILE B 105 -8.455 0.236 2.714 1.00 0.00 C ATOM 2872 CG2 ILE B 105 -10.366 1.851 2.957 1.00 0.00 C ATOM 2873 CD1 ILE B 105 -8.901 -0.110 1.309 1.00 0.00 C ATOM 0 H ILE B 105 -6.378 1.691 3.129 1.00 0.00 H new ATOM 0 HA ILE B 105 -8.300 2.649 1.349 1.00 0.00 H new ATOM 0 HB ILE B 105 -8.661 1.732 4.232 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -7.370 0.153 2.771 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -8.868 -0.497 3.407 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -10.922 1.085 3.498 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -10.650 2.836 3.329 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -10.597 1.785 1.894 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -8.569 -1.118 1.060 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -9.988 -0.061 1.250 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -8.467 0.600 0.604 1.00 0.00 H new ATOM 2885 N GLN B 106 -7.963 4.414 4.135 1.00 0.00 N ATOM 2886 CA GLN B 106 -8.251 5.703 4.751 1.00 0.00 C ATOM 2887 C GLN B 106 -7.442 6.814 4.089 1.00 0.00 C ATOM 2888 O GLN B 106 -7.885 7.960 4.015 1.00 0.00 O ATOM 2889 CB GLN B 106 -7.947 5.653 6.250 1.00 0.00 C ATOM 2890 CG GLN B 106 -9.090 6.152 7.120 1.00 0.00 C ATOM 2891 CD GLN B 106 -8.934 7.607 7.512 1.00 0.00 C ATOM 2892 OE1 GLN B 106 -9.840 8.416 7.317 1.00 0.00 O ATOM 2893 NE2 GLN B 106 -7.777 7.948 8.069 1.00 0.00 N ATOM 0 H GLN B 106 -7.372 3.801 4.696 1.00 0.00 H new ATOM 0 HA GLN B 106 -9.310 5.919 4.611 1.00 0.00 H new ATOM 0 HB2 GLN B 106 -7.710 4.627 6.530 1.00 0.00 H new ATOM 0 HB3 GLN B 106 -7.059 6.252 6.452 1.00 0.00 H new ATOM 0 HG2 GLN B 106 -10.031 6.023 6.586 1.00 0.00 H new ATOM 0 HG3 GLN B 106 -9.149 5.541 8.021 1.00 0.00 H new ATOM 0 HE21 GLN B 106 -7.053 7.244 8.212 1.00 0.00 H new ATOM 0 HE22 GLN B 106 -7.613 8.914 8.354 1.00 0.00 H new ATOM 2902 N LEU B 107 -6.252 6.467 3.608 1.00 0.00 N ATOM 2903 CA LEU B 107 -5.380 7.433 2.952 1.00 0.00 C ATOM 2904 C LEU B 107 -5.938 7.832 1.589 1.00 0.00 C ATOM 2905 O LEU B 107 -6.079 9.018 1.287 1.00 0.00 O ATOM 2906 CB LEU B 107 -3.972 6.853 2.792 1.00 0.00 C ATOM 2907 CG LEU B 107 -2.928 7.416 3.758 1.00 0.00 C ATOM 2908 CD1 LEU B 107 -2.756 8.911 3.543 1.00 0.00 C ATOM 2909 CD2 LEU B 107 -3.324 7.125 5.198 1.00 0.00 C ATOM 0 H LEU B 107 -5.870 5.523 3.661 1.00 0.00 H new ATOM 0 HA LEU B 107 -5.329 8.324 3.578 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -4.023 5.772 2.925 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -3.635 7.033 1.771 1.00 0.00 H new ATOM 0 HG LEU B 107 -1.974 6.928 3.558 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -2.010 9.295 4.238 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -2.428 9.096 2.520 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -3.707 9.415 3.716 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -2.570 7.532 5.872 1.00 0.00 H new ATOM 0 HD22 LEU B 107 -4.288 7.586 5.410 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -3.397 6.047 5.345 1.00 0.00 H new ATOM 2921 N CYS B 108 -6.256 6.835 0.770 1.00 0.00 N ATOM 2922 CA CYS B 108 -6.800 7.082 -0.561 1.00 0.00 C ATOM 2923 C CYS B 108 -8.106 7.865 -0.479 1.00 0.00 C ATOM 2924 O CYS B 108 -8.424 8.657 -1.366 1.00 0.00 O ATOM 2925 CB CYS B 108 -7.029 5.759 -1.294 1.00 0.00 C ATOM 2926 SG CYS B 108 -6.669 5.824 -3.065 1.00 0.00 S ATOM 0 H CYS B 108 -6.147 5.848 1.004 1.00 0.00 H new ATOM 0 HA CYS B 108 -6.076 7.677 -1.118 1.00 0.00 H new ATOM 0 HB2 CYS B 108 -6.407 4.990 -0.836 1.00 0.00 H new ATOM 0 HB3 CYS B 108 -8.066 5.454 -1.156 1.00 0.00 H new ATOM 0 HG CYS B 108 -6.685 4.620 -3.555 1.00 0.00 H new ATOM 2932 N SER B 109 -8.861 7.637 0.591 1.00 0.00 N ATOM 2933 CA SER B 109 -10.133 8.322 0.790 1.00 0.00 C ATOM 2934 C SER B 109 -9.915 9.802 1.084 1.00 0.00 C ATOM 2935 O SER B 109 -10.740 10.643 0.729 1.00 0.00 O ATOM 2936 CB SER B 109 -10.913 7.671 1.934 1.00 0.00 C ATOM 2937 OG SER B 109 -12.282 8.031 1.888 1.00 0.00 O ATOM 0 H SER B 109 -8.614 6.983 1.334 1.00 0.00 H new ATOM 0 HA SER B 109 -10.711 8.236 -0.130 1.00 0.00 H new ATOM 0 HB2 SER B 109 -10.817 6.587 1.873 1.00 0.00 H new ATOM 0 HB3 SER B 109 -10.486 7.976 2.889 1.00 0.00 H new ATOM 0 HG SER B 109 -12.758 7.601 2.629 1.00 0.00 H new ATOM 2943 N LYS B 110 -8.797 10.113 1.733 1.00 0.00 N ATOM 2944 CA LYS B 110 -8.471 11.493 2.075 1.00 0.00 C ATOM 2945 C LYS B 110 -8.270 12.332 0.818 1.00 0.00 C ATOM 2946 O LYS B 110 -8.800 13.438 0.707 1.00 0.00 O ATOM 2947 CB LYS B 110 -7.211 11.540 2.941 1.00 0.00 C ATOM 2948 CG LYS B 110 -7.489 11.397 4.429 1.00 0.00 C ATOM 2949 CD LYS B 110 -6.437 10.539 5.114 1.00 0.00 C ATOM 2950 CE LYS B 110 -5.046 11.134 4.963 1.00 0.00 C ATOM 2951 NZ LYS B 110 -4.909 12.420 5.702 1.00 0.00 N ATOM 0 H LYS B 110 -8.102 9.429 2.032 1.00 0.00 H new ATOM 0 HA LYS B 110 -9.307 11.910 2.637 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -6.535 10.744 2.628 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -6.695 12.484 2.765 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -7.513 12.384 4.892 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -8.474 10.953 4.575 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -6.679 10.441 6.172 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -6.452 9.535 4.689 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -4.305 10.424 5.330 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -4.834 11.298 3.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -3.915 12.724 5.688 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -5.500 13.146 5.248 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -5.217 12.289 6.687 1.00 0.00 H new ATOM 2965 N LEU B 111 -7.502 11.800 -0.127 1.00 0.00 N ATOM 2966 CA LEU B 111 -7.231 12.501 -1.377 1.00 0.00 C ATOM 2967 C LEU B 111 -8.526 12.800 -2.126 1.00 0.00 C ATOM 2968 O LEU B 111 -8.703 13.890 -2.671 1.00 0.00 O ATOM 2969 CB LEU B 111 -6.298 11.671 -2.262 1.00 0.00 C ATOM 2970 CG LEU B 111 -4.835 11.641 -1.815 1.00 0.00 C ATOM 2971 CD1 LEU B 111 -3.986 10.879 -2.819 1.00 0.00 C ATOM 2972 CD2 LEU B 111 -4.305 13.056 -1.633 1.00 0.00 C ATOM 0 H LEU B 111 -7.056 10.886 -0.051 1.00 0.00 H new ATOM 0 HA LEU B 111 -6.745 13.446 -1.135 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.672 10.648 -2.298 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -6.343 12.063 -3.278 1.00 0.00 H new ATOM 0 HG LEU B 111 -4.778 11.126 -0.856 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -2.949 10.868 -2.484 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -4.351 9.855 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -4.048 11.366 -3.792 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -3.263 13.016 -1.315 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -4.376 13.595 -2.578 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -4.896 13.571 -0.876 1.00 0.00 H new ATOM 2984 N ARG B 112 -9.430 11.826 -2.146 1.00 0.00 N ATOM 2985 CA ARG B 112 -10.710 11.985 -2.828 1.00 0.00 C ATOM 2986 C ARG B 112 -11.504 13.143 -2.230 1.00 0.00 C ATOM 2987 O ARG B 112 -12.126 13.920 -2.955 1.00 0.00 O ATOM 2988 CB ARG B 112 -11.523 10.693 -2.738 1.00 0.00 C ATOM 2989 CG ARG B 112 -12.365 10.417 -3.972 1.00 0.00 C ATOM 2990 CD ARG B 112 -12.570 8.926 -4.186 1.00 0.00 C ATOM 2991 NE ARG B 112 -13.892 8.626 -4.729 1.00 0.00 N ATOM 2992 CZ ARG B 112 -15.011 8.642 -4.010 1.00 0.00 C ATOM 2993 NH1 ARG B 112 -14.972 8.942 -2.717 1.00 0.00 N ATOM 2994 NH2 ARG B 112 -16.172 8.357 -4.582 1.00 0.00 N ATOM 0 H ARG B 112 -9.300 10.919 -1.698 1.00 0.00 H new ATOM 0 HA ARG B 112 -10.511 12.208 -3.876 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -10.843 9.856 -2.578 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -12.176 10.744 -1.867 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -13.333 10.907 -3.870 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -11.880 10.848 -4.848 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -11.805 8.549 -4.865 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -12.440 8.403 -3.239 1.00 0.00 H new ATOM 0 HE ARG B 112 -13.961 8.390 -5.719 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -14.081 9.161 -2.271 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -15.833 8.953 -2.170 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -16.208 8.125 -5.575 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -17.029 8.370 -4.030 1.00 0.00 H new ATOM 3008 N ASN B 113 -11.478 13.251 -0.907 1.00 0.00 N ATOM 3009 CA ASN B 113 -12.195 14.313 -0.212 1.00 0.00 C ATOM 3010 C ASN B 113 -11.510 15.660 -0.422 1.00 0.00 C ATOM 3011 O ASN B 113 -12.170 16.676 -0.637 1.00 0.00 O ATOM 3012 CB ASN B 113 -12.288 14.002 1.283 1.00 0.00 C ATOM 3013 CG ASN B 113 -13.508 13.169 1.626 1.00 0.00 C ATOM 3014 OD1 ASN B 113 -14.367 12.928 0.778 1.00 0.00 O ATOM 3015 ND2 ASN B 113 -13.589 12.726 2.874 1.00 0.00 N ATOM 0 H ASN B 113 -10.968 12.616 -0.294 1.00 0.00 H new ATOM 0 HA ASN B 113 -13.201 14.369 -0.627 1.00 0.00 H new ATOM 0 HB2 ASN B 113 -11.389 13.471 1.597 1.00 0.00 H new ATOM 0 HB3 ASN B 113 -12.320 14.936 1.844 1.00 0.00 H new ATOM 0 HD21 ASN B 113 -14.387 12.161 3.164 1.00 0.00 H new ATOM 0 HD22 ASN B 113 -12.853 12.950 3.544 1.00 0.00 H new ATOM 3022 N LEU B 114 -10.183 15.660 -0.355 1.00 0.00 N ATOM 3023 CA LEU B 114 -9.407 16.881 -0.538 1.00 0.00 C ATOM 3024 C LEU B 114 -9.557 17.412 -1.960 1.00 0.00 C ATOM 3025 O LEU B 114 -9.545 18.622 -2.185 1.00 0.00 O ATOM 3026 CB LEU B 114 -7.931 16.625 -0.229 1.00 0.00 C ATOM 3027 CG LEU B 114 -7.619 16.328 1.239 1.00 0.00 C ATOM 3028 CD1 LEU B 114 -6.317 15.552 1.361 1.00 0.00 C ATOM 3029 CD2 LEU B 114 -7.549 17.620 2.038 1.00 0.00 C ATOM 0 H LEU B 114 -9.622 14.827 -0.175 1.00 0.00 H new ATOM 0 HA LEU B 114 -9.789 17.632 0.154 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -7.589 15.786 -0.834 1.00 0.00 H new ATOM 0 HB3 LEU B 114 -7.354 17.497 -0.538 1.00 0.00 H new ATOM 0 HG LEU B 114 -8.422 15.714 1.646 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -6.111 15.350 2.412 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -6.403 14.610 0.820 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -5.502 16.140 0.938 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -7.326 17.392 3.080 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -6.764 18.258 1.631 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -8.506 18.138 1.977 1.00 0.00 H new ATOM 3041 N LEU B 115 -9.697 16.499 -2.915 1.00 0.00 N ATOM 3042 CA LEU B 115 -9.848 16.877 -4.316 1.00 0.00 C ATOM 3043 C LEU B 115 -11.265 17.365 -4.599 1.00 0.00 C ATOM 3044 O LEU B 115 -11.472 18.260 -5.417 1.00 0.00 O ATOM 3045 CB LEU B 115 -9.514 15.691 -5.224 1.00 0.00 C ATOM 3046 CG LEU B 115 -8.088 15.154 -5.091 1.00 0.00 C ATOM 3047 CD1 LEU B 115 -8.057 13.653 -5.330 1.00 0.00 C ATOM 3048 CD2 LEU B 115 -7.158 15.869 -6.058 1.00 0.00 C ATOM 0 H LEU B 115 -9.709 15.493 -2.745 1.00 0.00 H new ATOM 0 HA LEU B 115 -9.155 17.692 -4.523 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -10.212 14.882 -5.010 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -9.679 15.988 -6.260 1.00 0.00 H new ATOM 0 HG LEU B 115 -7.742 15.345 -4.075 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -7.034 13.290 -5.231 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -8.691 13.155 -4.597 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -8.423 13.437 -6.334 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -6.148 15.475 -5.950 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -7.503 15.709 -7.080 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -7.156 16.937 -5.839 1.00 0.00 H new ATOM 3060 N HIS B 116 -12.237 16.770 -3.916 1.00 0.00 N ATOM 3061 CA HIS B 116 -13.635 17.144 -4.093 1.00 0.00 C ATOM 3062 C HIS B 116 -13.854 18.612 -3.742 1.00 0.00 C ATOM 3063 O HIS B 116 -14.029 19.453 -4.625 1.00 0.00 O ATOM 3064 CB HIS B 116 -14.535 16.261 -3.226 1.00 0.00 C ATOM 3065 CG HIS B 116 -15.006 15.022 -3.922 1.00 0.00 C ATOM 3066 ND1 HIS B 116 -16.322 14.628 -3.869 1.00 0.00 N ATOM 3067 CD2 HIS B 116 -14.306 14.132 -4.665 1.00 0.00 C ATOM 3068 CE1 HIS B 116 -16.393 13.515 -4.577 1.00 0.00 C ATOM 3069 NE2 HIS B 116 -15.196 13.174 -5.079 1.00 0.00 N ATOM 0 H HIS B 116 -12.082 16.027 -3.235 1.00 0.00 H new ATOM 0 HA HIS B 116 -13.894 16.997 -5.141 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -13.992 15.977 -2.324 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -15.401 16.841 -2.908 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -13.250 14.169 -4.889 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -17.300 12.950 -4.732 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -14.988 12.360 -5.657 1.00 0.00 H new ATOM 3077 N ASP B 117 -13.844 18.914 -2.448 1.00 0.00 N ATOM 3078 CA ASP B 117 -14.041 20.282 -1.980 1.00 0.00 C ATOM 3079 C ASP B 117 -12.989 20.659 -0.942 1.00 0.00 C ATOM 3080 O ASP B 117 -12.237 19.807 -0.467 1.00 0.00 O ATOM 3081 CB ASP B 117 -15.441 20.442 -1.387 1.00 0.00 C ATOM 3082 CG ASP B 117 -15.770 19.359 -0.378 1.00 0.00 C ATOM 3083 OD1 ASP B 117 -15.847 18.179 -0.779 1.00 0.00 O ATOM 3084 OD2 ASP B 117 -15.951 19.691 0.812 1.00 0.00 O ATOM 0 H ASP B 117 -13.702 18.230 -1.704 1.00 0.00 H new ATOM 0 HA ASP B 117 -13.937 20.951 -2.834 1.00 0.00 H new ATOM 0 HB2 ASP B 117 -15.520 21.418 -0.907 1.00 0.00 H new ATOM 0 HB3 ASP B 117 -16.177 20.422 -2.191 1.00 0.00 H new ATOM 3089 N ASN B 118 -12.942 21.941 -0.594 1.00 0.00 N ATOM 3090 CA ASN B 118 -11.982 22.431 0.388 1.00 0.00 C ATOM 3091 C ASN B 118 -12.673 22.751 1.710 1.00 0.00 C ATOM 3092 O ASN B 118 -12.150 22.450 2.783 1.00 0.00 O ATOM 3093 CB ASN B 118 -11.269 23.676 -0.142 1.00 0.00 C ATOM 3094 CG ASN B 118 -10.522 23.408 -1.433 1.00 0.00 C ATOM 3095 OD1 ASN B 118 -11.034 22.743 -2.335 1.00 0.00 O ATOM 3096 ND2 ASN B 118 -9.302 23.926 -1.530 1.00 0.00 N ATOM 0 H ASN B 118 -13.557 22.659 -0.977 1.00 0.00 H new ATOM 0 HA ASN B 118 -11.246 21.646 0.563 1.00 0.00 H new ATOM 0 HB2 ASN B 118 -12.000 24.468 -0.306 1.00 0.00 H new ATOM 0 HB3 ASN B 118 -10.569 24.039 0.611 1.00 0.00 H new ATOM 0 HD21 ASN B 118 -8.751 23.779 -2.376 1.00 0.00 H new ATOM 0 HD22 ASN B 118 -8.916 24.471 -0.759 1.00 0.00 H new ATOM 3103 N GLU B 119 -13.849 23.363 1.625 1.00 0.00 N ATOM 3104 CA GLU B 119 -14.612 23.722 2.814 1.00 0.00 C ATOM 3105 C GLU B 119 -15.183 22.481 3.491 1.00 0.00 C ATOM 3106 O GLU B 119 -16.298 22.054 3.188 1.00 0.00 O ATOM 3107 CB GLU B 119 -15.743 24.685 2.449 1.00 0.00 C ATOM 3108 CG GLU B 119 -16.015 25.737 3.512 1.00 0.00 C ATOM 3109 CD GLU B 119 -15.044 26.899 3.443 1.00 0.00 C ATOM 3110 OE1 GLU B 119 -13.829 26.669 3.612 1.00 0.00 O ATOM 3111 OE2 GLU B 119 -15.500 28.040 3.219 1.00 0.00 O ATOM 0 H GLU B 119 -14.295 23.621 0.744 1.00 0.00 H new ATOM 0 HA GLU B 119 -13.936 24.215 3.513 1.00 0.00 H new ATOM 0 HB2 GLU B 119 -15.496 25.183 1.512 1.00 0.00 H new ATOM 0 HB3 GLU B 119 -16.654 24.113 2.275 1.00 0.00 H new ATOM 0 HG2 GLU B 119 -17.032 26.111 3.396 1.00 0.00 H new ATOM 0 HG3 GLU B 119 -15.955 25.276 4.498 1.00 0.00 H new ATOM 3118 N LEU B 120 -14.413 21.906 4.409 1.00 0.00 N ATOM 3119 CA LEU B 120 -14.843 20.713 5.129 1.00 0.00 C ATOM 3120 C LEU B 120 -15.778 21.078 6.277 1.00 0.00 C ATOM 3121 O LEU B 120 -15.455 21.927 7.109 1.00 0.00 O ATOM 3122 CB LEU B 120 -13.631 19.951 5.667 1.00 0.00 C ATOM 3123 CG LEU B 120 -13.845 18.451 5.868 1.00 0.00 C ATOM 3124 CD1 LEU B 120 -13.975 17.745 4.527 1.00 0.00 C ATOM 3125 CD2 LEU B 120 -12.705 17.853 6.677 1.00 0.00 C ATOM 0 H LEU B 120 -13.488 22.247 4.672 1.00 0.00 H new ATOM 0 HA LEU B 120 -15.385 20.074 4.431 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -12.797 20.094 4.980 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -13.338 20.391 6.620 1.00 0.00 H new ATOM 0 HG LEU B 120 -14.772 18.308 6.423 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -14.127 16.678 4.691 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -14.826 18.153 3.982 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -13.065 17.897 3.946 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -12.875 16.785 6.810 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -11.764 18.008 6.149 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -12.658 18.337 7.652 1.00 0.00 H new ATOM 3137 N SER B 121 -16.938 20.432 6.317 1.00 0.00 N ATOM 3138 CA SER B 121 -17.921 20.688 7.363 1.00 0.00 C ATOM 3139 C SER B 121 -18.708 19.424 7.693 1.00 0.00 C ATOM 3140 O SER B 121 -18.701 18.956 8.833 1.00 0.00 O ATOM 3141 CB SER B 121 -18.879 21.800 6.932 1.00 0.00 C ATOM 3142 OG SER B 121 -18.391 23.073 7.318 1.00 0.00 O ATOM 0 H SER B 121 -17.221 19.727 5.637 1.00 0.00 H new ATOM 0 HA SER B 121 -17.386 21.005 8.258 1.00 0.00 H new ATOM 0 HB2 SER B 121 -19.012 21.771 5.850 1.00 0.00 H new ATOM 0 HB3 SER B 121 -19.859 21.633 7.378 1.00 0.00 H new ATOM 0 HG SER B 121 -17.412 23.051 7.354 1.00 0.00 H new ATOM 3148 N ASP B 122 -19.384 18.876 6.690 1.00 0.00 N ATOM 3149 CA ASP B 122 -20.176 17.664 6.873 1.00 0.00 C ATOM 3150 C ASP B 122 -21.274 17.883 7.910 1.00 0.00 C ATOM 3151 O ASP B 122 -22.437 18.085 7.505 1.00 0.00 O ATOM 3152 CB ASP B 122 -19.278 16.502 7.302 1.00 0.00 C ATOM 3153 CG ASP B 122 -19.881 15.153 6.969 1.00 0.00 C ATOM 3154 OD1 ASP B 122 -20.369 14.984 5.831 1.00 0.00 O ATOM 3155 OD2 ASP B 122 -19.865 14.263 7.846 1.00 0.00 O ATOM 0 H ASP B 122 -19.400 19.251 5.742 1.00 0.00 H new ATOM 0 HA ASP B 122 -20.645 17.419 5.920 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -18.309 16.595 6.811 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -19.099 16.562 8.376 1.00 0.00 H new TER 3160 ASP B 122 HETATM 3161 ZN ZN A 123 14.459 -3.064 2.502 1.00 0.00 ZN HETATM 3162 ZN ZN A 124 6.092 -10.012 12.257 1.00 0.00 ZN HETATM 3163 ZN ZN B 143 -14.545 -7.915 -0.882 1.00 0.00 ZN HETATM 3164 ZN ZN B 144 -5.464 -15.711 -6.649 1.00 0.00 ZN