USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 890 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 THR OG1 : rot -50:sc= 0.421 USER MOD Set 1.2: A 75 ASN : amide:sc= 0 X(o=-0.018,f=-0.2) USER MOD Set 1.3: A 81 GLN :FLIP amide:sc= -0.439 X(o=-0.22,f=-0.018) USER MOD Set 2.1: A 16 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.11) USER MOD Set 2.2: A 40 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 9 ASN : amide:sc= -0.62 K(o=-0.62,f=-1.7!) USER MOD Set 3.2: A 11 TYR OH : rot -122:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.0727 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 35:sc= 0.339 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= -0.774 USER MOD Single : A 15 MET CE :methyl -137:sc= -0.623 (180deg=-2.08) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.0897 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.294 K(o=-0.29,f=-4.8!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.022 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.521 K(o=-0.52,f=-3.8) USER MOD Single : A 33 ASN : amide:sc= 0.677 K(o=0.68,f=-3.2!) USER MOD Single : A 43 ASN : amide:sc= -4.38! X(o=-4.4!,f=-3.9) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 SER OG : rot -58:sc= 0.83 USER MOD Single : A 48 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.54) USER MOD Single : A 49 GLN :FLIP amide:sc= -0.41 F(o=-1.1,f=-0.41) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -12.5! C(o=-13!,f=-13!) USER MOD Single : A 71 THR OG1 : rot -47:sc= -0.225 USER MOD Single : A 78 SER OG : rot 180:sc= -0.069 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 149:sc= -0.476 (180deg=-1.47!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 HIS : no HE2:sc= -1.02 X(o=-1,f=-1.4) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.183 K(o=-0.18,f=-2.3!) USER MOD Single : A 102 CYS SG : rot -51:sc= -6.28! USER MOD Single : A 103 THR OG1 : rot 21:sc= 1.37 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 106 HIS : no HD1:sc= -1.81 X(o=-1.8,f=-1.5) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -0.0908 K(o=-0.091,f=-1.6!) USER MOD Single : A 114 ASN : amide:sc=-0.00762 K(o=-0.0076,f=-2.3) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 29:sc= 0.0337 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.762 2.581 -0.099 1.00 0.00 N ATOM 2 CA GLY A 1 -16.722 1.987 0.721 1.00 0.00 C ATOM 3 C GLY A 1 -16.854 2.359 2.184 1.00 0.00 C ATOM 4 O GLY A 1 -17.871 2.912 2.602 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.210 1.844 -0.680 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.478 3.022 0.513 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.345 3.304 -0.719 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.759 0.902 0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.747 2.308 0.354 1.00 0.00 H new ATOM 8 N SER A 2 -15.823 2.054 2.966 1.00 0.00 N ATOM 9 CA SER A 2 -15.830 2.356 4.393 1.00 0.00 C ATOM 10 C SER A 2 -14.671 3.277 4.759 1.00 0.00 C ATOM 11 O SER A 2 -13.508 2.962 4.506 1.00 0.00 O ATOM 12 CB SER A 2 -15.747 1.064 5.209 1.00 0.00 C ATOM 13 OG SER A 2 -16.773 0.159 4.837 1.00 0.00 O ATOM 0 H SER A 2 -14.972 1.598 2.636 1.00 0.00 H new ATOM 0 HA SER A 2 -16.764 2.866 4.627 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.774 0.597 5.059 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.829 1.295 6.271 1.00 0.00 H new ATOM 0 HG SER A 2 -16.697 -0.659 5.371 1.00 0.00 H new ATOM 19 N SER A 3 -14.997 4.419 5.358 1.00 0.00 N ATOM 20 CA SER A 3 -13.984 5.389 5.756 1.00 0.00 C ATOM 21 C SER A 3 -13.255 4.928 7.014 1.00 0.00 C ATOM 22 O SER A 3 -13.830 4.890 8.101 1.00 0.00 O ATOM 23 CB SER A 3 -14.625 6.757 5.998 1.00 0.00 C ATOM 24 OG SER A 3 -15.708 6.659 6.907 1.00 0.00 O ATOM 0 H SER A 3 -15.954 4.694 5.578 1.00 0.00 H new ATOM 0 HA SER A 3 -13.259 5.473 4.946 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.878 7.448 6.390 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.976 7.170 5.052 1.00 0.00 H new ATOM 0 HG SER A 3 -15.507 5.978 7.583 1.00 0.00 H new ATOM 30 N GLY A 4 -11.982 4.577 6.858 1.00 0.00 N ATOM 31 CA GLY A 4 -11.193 4.122 7.988 1.00 0.00 C ATOM 32 C GLY A 4 -10.725 5.265 8.866 1.00 0.00 C ATOM 33 O GLY A 4 -9.547 5.623 8.855 1.00 0.00 O ATOM 0 H GLY A 4 -11.483 4.600 5.969 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.785 3.428 8.585 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.327 3.570 7.624 1.00 0.00 H new ATOM 37 N SER A 5 -11.649 5.842 9.627 1.00 0.00 N ATOM 38 CA SER A 5 -11.326 6.955 10.511 1.00 0.00 C ATOM 39 C SER A 5 -10.019 6.697 11.255 1.00 0.00 C ATOM 40 O SER A 5 -9.095 7.509 11.210 1.00 0.00 O ATOM 41 CB SER A 5 -12.460 7.185 11.513 1.00 0.00 C ATOM 42 OG SER A 5 -13.442 8.056 10.980 1.00 0.00 O ATOM 0 H SER A 5 -12.628 5.557 9.649 1.00 0.00 H new ATOM 0 HA SER A 5 -11.205 7.849 9.899 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.918 6.231 11.774 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.056 7.607 12.433 1.00 0.00 H new ATOM 0 HG SER A 5 -14.156 8.186 11.638 1.00 0.00 H new ATOM 48 N SER A 6 -9.951 5.560 11.940 1.00 0.00 N ATOM 49 CA SER A 6 -8.759 5.194 12.697 1.00 0.00 C ATOM 50 C SER A 6 -7.821 4.337 11.854 1.00 0.00 C ATOM 51 O SER A 6 -8.263 3.548 11.021 1.00 0.00 O ATOM 52 CB SER A 6 -9.150 4.441 13.971 1.00 0.00 C ATOM 53 OG SER A 6 -8.106 4.483 14.928 1.00 0.00 O ATOM 0 H SER A 6 -10.707 4.877 11.987 1.00 0.00 H new ATOM 0 HA SER A 6 -8.237 6.111 12.970 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.053 4.880 14.394 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.383 3.404 13.728 1.00 0.00 H new ATOM 0 HG SER A 6 -8.381 3.997 15.733 1.00 0.00 H new ATOM 59 N GLY A 7 -6.520 4.500 12.077 1.00 0.00 N ATOM 60 CA GLY A 7 -5.538 3.736 11.330 1.00 0.00 C ATOM 61 C GLY A 7 -4.537 3.041 12.231 1.00 0.00 C ATOM 62 O GLY A 7 -3.765 3.695 12.932 1.00 0.00 O ATOM 0 H GLY A 7 -6.129 5.147 12.761 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.049 2.993 10.718 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.008 4.400 10.647 1.00 0.00 H new ATOM 66 N GLU A 8 -4.549 1.712 12.214 1.00 0.00 N ATOM 67 CA GLU A 8 -3.636 0.929 13.038 1.00 0.00 C ATOM 68 C GLU A 8 -2.651 0.151 12.170 1.00 0.00 C ATOM 69 O GLU A 8 -2.931 -0.147 11.010 1.00 0.00 O ATOM 70 CB GLU A 8 -4.420 -0.036 13.931 1.00 0.00 C ATOM 71 CG GLU A 8 -4.903 0.591 15.228 1.00 0.00 C ATOM 72 CD GLU A 8 -3.761 1.010 16.133 1.00 0.00 C ATOM 73 OE1 GLU A 8 -2.719 0.322 16.134 1.00 0.00 O ATOM 74 OE2 GLU A 8 -3.910 2.028 16.842 1.00 0.00 O ATOM 0 H GLU A 8 -5.181 1.155 11.639 1.00 0.00 H new ATOM 0 HA GLU A 8 -3.073 1.618 13.667 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -5.280 -0.413 13.377 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -3.790 -0.894 14.165 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -5.519 1.461 15.000 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -5.539 -0.120 15.756 1.00 0.00 H new ATOM 81 N ASN A 9 -1.497 -0.175 12.743 1.00 0.00 N ATOM 82 CA ASN A 9 -0.469 -0.917 12.022 1.00 0.00 C ATOM 83 C ASN A 9 -0.927 -2.344 11.738 1.00 0.00 C ATOM 84 O ASN A 9 -1.329 -3.071 12.646 1.00 0.00 O ATOM 85 CB ASN A 9 0.833 -0.938 12.826 1.00 0.00 C ATOM 86 CG ASN A 9 0.589 -1.036 14.319 1.00 0.00 C ATOM 87 OD1 ASN A 9 -0.448 -1.534 14.758 1.00 0.00 O ATOM 88 ND2 ASN A 9 1.546 -0.560 15.108 1.00 0.00 N ATOM 0 H ASN A 9 -1.250 0.063 13.704 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.293 -0.414 11.071 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.442 -1.783 12.504 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.403 -0.034 12.612 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.438 -0.599 16.121 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.389 -0.156 14.700 1.00 0.00 H new ATOM 95 N VAL A 10 -0.863 -2.740 10.470 1.00 0.00 N ATOM 96 CA VAL A 10 -1.269 -4.080 10.066 1.00 0.00 C ATOM 97 C VAL A 10 -0.061 -4.996 9.905 1.00 0.00 C ATOM 98 O VAL A 10 0.864 -4.693 9.151 1.00 0.00 O ATOM 99 CB VAL A 10 -2.058 -4.052 8.743 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.604 -5.434 8.418 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.182 -3.029 8.815 1.00 0.00 C ATOM 0 H VAL A 10 -0.534 -2.151 9.705 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.912 -4.467 10.856 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.380 -3.758 7.942 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.158 -5.395 7.480 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.778 -6.138 8.322 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.268 -5.760 9.219 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.729 -3.022 7.872 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.861 -3.291 9.627 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.762 -2.040 8.998 1.00 0.00 H new ATOM 111 N TYR A 11 -0.076 -6.116 10.618 1.00 0.00 N ATOM 112 CA TYR A 11 1.020 -7.076 10.556 1.00 0.00 C ATOM 113 C TYR A 11 0.503 -8.503 10.711 1.00 0.00 C ATOM 114 O TYR A 11 -0.583 -8.729 11.243 1.00 0.00 O ATOM 115 CB TYR A 11 2.051 -6.775 11.645 1.00 0.00 C ATOM 116 CG TYR A 11 1.457 -6.151 12.887 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.333 -6.698 13.493 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.017 -5.012 13.453 1.00 0.00 C ATOM 119 CE1 TYR A 11 -0.215 -6.131 14.628 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.477 -4.439 14.588 1.00 0.00 C ATOM 121 CZ TYR A 11 0.362 -5.002 15.171 1.00 0.00 C ATOM 122 OH TYR A 11 -0.180 -4.433 16.301 1.00 0.00 O ATOM 0 H TYR A 11 -0.835 -6.382 11.246 1.00 0.00 H new ATOM 0 HA TYR A 11 1.495 -6.984 9.579 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.557 -7.701 11.920 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.810 -6.105 11.240 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.121 -7.582 13.070 1.00 0.00 H new ATOM 0 HD2 TYR A 11 2.889 -4.567 12.998 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -1.089 -6.569 15.087 1.00 0.00 H new ATOM 0 HE2 TYR A 11 1.926 -3.555 15.016 1.00 0.00 H new ATOM 0 HH TYR A 11 -0.423 -3.502 16.114 1.00 0.00 H new ATOM 132 N GLY A 12 1.292 -9.465 10.241 1.00 0.00 N ATOM 133 CA GLY A 12 0.899 -10.859 10.336 1.00 0.00 C ATOM 134 C GLY A 12 1.866 -11.784 9.624 1.00 0.00 C ATOM 135 O GLY A 12 2.562 -11.371 8.697 1.00 0.00 O ATOM 0 H GLY A 12 2.196 -9.304 9.796 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.835 -11.144 11.386 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.097 -10.982 9.910 1.00 0.00 H new ATOM 139 N TYR A 13 1.911 -13.038 10.060 1.00 0.00 N ATOM 140 CA TYR A 13 2.804 -14.023 9.461 1.00 0.00 C ATOM 141 C TYR A 13 2.279 -14.479 8.102 1.00 0.00 C ATOM 142 O TYR A 13 1.201 -15.066 8.005 1.00 0.00 O ATOM 143 CB TYR A 13 2.964 -15.229 10.389 1.00 0.00 C ATOM 144 CG TYR A 13 4.105 -15.089 11.371 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.189 -13.989 12.216 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.098 -16.057 11.455 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.230 -13.856 13.115 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.141 -15.933 12.352 1.00 0.00 C ATOM 149 CZ TYR A 13 6.203 -14.832 13.179 1.00 0.00 C ATOM 150 OH TYR A 13 7.242 -14.705 14.073 1.00 0.00 O ATOM 0 H TYR A 13 1.340 -13.396 10.825 1.00 0.00 H new ATOM 0 HA TYR A 13 3.777 -13.553 9.316 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.036 -15.378 10.941 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.122 -16.123 9.786 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.427 -13.225 12.169 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.054 -16.921 10.808 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.282 -12.994 13.763 1.00 0.00 H new ATOM 0 HE2 TYR A 13 6.904 -16.695 12.405 1.00 0.00 H new ATOM 0 HH TYR A 13 7.840 -15.477 13.992 1.00 0.00 H new ATOM 160 N LEU A 14 3.050 -14.205 7.056 1.00 0.00 N ATOM 161 CA LEU A 14 2.665 -14.587 5.701 1.00 0.00 C ATOM 162 C LEU A 14 3.723 -15.484 5.067 1.00 0.00 C ATOM 163 O LEU A 14 4.867 -15.525 5.518 1.00 0.00 O ATOM 164 CB LEU A 14 2.453 -13.341 4.840 1.00 0.00 C ATOM 165 CG LEU A 14 1.456 -12.314 5.378 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.635 -10.977 4.676 1.00 0.00 C ATOM 167 CD2 LEU A 14 0.030 -12.819 5.212 1.00 0.00 C ATOM 0 H LEU A 14 3.945 -13.720 7.119 1.00 0.00 H new ATOM 0 HA LEU A 14 1.730 -15.144 5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.416 -12.848 4.707 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.119 -13.659 3.852 1.00 0.00 H new ATOM 0 HG LEU A 14 1.649 -12.171 6.441 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.917 -10.259 5.072 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.647 -10.609 4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.470 -11.103 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.667 -12.076 5.600 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.174 -12.991 4.155 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.092 -13.752 5.762 1.00 0.00 H new ATOM 179 N MET A 15 3.333 -16.199 4.017 1.00 0.00 N ATOM 180 CA MET A 15 4.250 -17.092 3.318 1.00 0.00 C ATOM 181 C MET A 15 4.741 -16.460 2.019 1.00 0.00 C ATOM 182 O MET A 15 3.978 -16.304 1.065 1.00 0.00 O ATOM 183 CB MET A 15 3.567 -18.429 3.022 1.00 0.00 C ATOM 184 CG MET A 15 2.978 -19.096 4.254 1.00 0.00 C ATOM 185 SD MET A 15 2.774 -20.876 4.050 1.00 0.00 S ATOM 186 CE MET A 15 4.482 -21.413 4.037 1.00 0.00 C ATOM 0 H MET A 15 2.389 -16.178 3.632 1.00 0.00 H new ATOM 0 HA MET A 15 5.110 -17.267 3.964 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.774 -18.269 2.292 1.00 0.00 H new ATOM 0 HB3 MET A 15 4.290 -19.104 2.564 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.625 -18.904 5.110 1.00 0.00 H new ATOM 0 HG3 MET A 15 2.011 -18.647 4.478 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.624 -22.156 3.253 1.00 0.00 H new ATOM 0 HE2 MET A 15 5.131 -20.558 3.848 1.00 0.00 H new ATOM 0 HE3 MET A 15 4.733 -21.852 5.003 1.00 0.00 H new ATOM 196 N LYS A 16 6.019 -16.098 1.989 1.00 0.00 N ATOM 197 CA LYS A 16 6.613 -15.483 0.808 1.00 0.00 C ATOM 198 C LYS A 16 7.314 -16.528 -0.054 1.00 0.00 C ATOM 199 O LYS A 16 7.954 -17.445 0.462 1.00 0.00 O ATOM 200 CB LYS A 16 7.607 -14.395 1.219 1.00 0.00 C ATOM 201 CG LYS A 16 7.949 -13.429 0.098 1.00 0.00 C ATOM 202 CD LYS A 16 8.623 -12.174 0.629 1.00 0.00 C ATOM 203 CE LYS A 16 9.538 -11.550 -0.412 1.00 0.00 C ATOM 204 NZ LYS A 16 10.785 -12.343 -0.602 1.00 0.00 N ATOM 0 H LYS A 16 6.664 -16.220 2.770 1.00 0.00 H new ATOM 0 HA LYS A 16 5.812 -15.032 0.222 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.193 -13.834 2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.524 -14.867 1.573 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.607 -13.921 -0.619 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.040 -13.156 -0.438 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.864 -11.451 0.928 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.199 -12.419 1.521 1.00 0.00 H new ATOM 0 HE2 LYS A 16 9.008 -11.473 -1.362 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.796 -10.536 -0.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 11.492 -11.765 -1.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.161 -12.626 0.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 10.574 -13.192 -1.164 1.00 0.00 H new ATOM 218 N TYR A 17 7.191 -16.383 -1.369 1.00 0.00 N ATOM 219 CA TYR A 17 7.813 -17.315 -2.302 1.00 0.00 C ATOM 220 C TYR A 17 9.287 -16.981 -2.505 1.00 0.00 C ATOM 221 O TYR A 17 9.629 -15.976 -3.131 1.00 0.00 O ATOM 222 CB TYR A 17 7.082 -17.287 -3.646 1.00 0.00 C ATOM 223 CG TYR A 17 7.137 -18.600 -4.393 1.00 0.00 C ATOM 224 CD1 TYR A 17 8.177 -18.880 -5.270 1.00 0.00 C ATOM 225 CD2 TYR A 17 6.149 -19.562 -4.220 1.00 0.00 C ATOM 226 CE1 TYR A 17 8.230 -20.079 -5.955 1.00 0.00 C ATOM 227 CE2 TYR A 17 6.195 -20.764 -4.899 1.00 0.00 C ATOM 228 CZ TYR A 17 7.237 -21.017 -5.766 1.00 0.00 C ATOM 229 OH TYR A 17 7.288 -22.213 -6.445 1.00 0.00 O ATOM 0 H TYR A 17 6.666 -15.629 -1.813 1.00 0.00 H new ATOM 0 HA TYR A 17 7.742 -18.316 -1.877 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.039 -17.018 -3.477 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.516 -16.505 -4.270 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.957 -18.148 -5.419 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.331 -19.366 -3.543 1.00 0.00 H new ATOM 0 HE1 TYR A 17 9.045 -20.280 -6.635 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.420 -21.501 -4.752 1.00 0.00 H new ATOM 0 HH TYR A 17 6.515 -22.762 -6.199 1.00 0.00 H new ATOM 239 N THR A 18 10.159 -17.831 -1.972 1.00 0.00 N ATOM 240 CA THR A 18 11.597 -17.628 -2.093 1.00 0.00 C ATOM 241 C THR A 18 12.134 -18.249 -3.377 1.00 0.00 C ATOM 242 O THR A 18 13.018 -17.690 -4.025 1.00 0.00 O ATOM 243 CB THR A 18 12.352 -18.227 -0.891 1.00 0.00 C ATOM 244 OG1 THR A 18 13.765 -18.124 -1.100 1.00 0.00 O ATOM 245 CG2 THR A 18 11.970 -19.685 -0.685 1.00 0.00 C ATOM 0 H THR A 18 9.894 -18.667 -1.452 1.00 0.00 H new ATOM 0 HA THR A 18 11.763 -16.551 -2.117 1.00 0.00 H new ATOM 0 HB THR A 18 12.075 -17.665 0.001 1.00 0.00 H new ATOM 0 HG1 THR A 18 14.238 -18.505 -0.331 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.515 -20.087 0.169 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.899 -19.758 -0.498 1.00 0.00 H new ATOM 0 HG23 THR A 18 12.222 -20.257 -1.578 1.00 0.00 H new ATOM 253 N ASN A 19 11.593 -19.407 -3.740 1.00 0.00 N ATOM 254 CA ASN A 19 12.019 -20.104 -4.948 1.00 0.00 C ATOM 255 C ASN A 19 11.121 -21.305 -5.228 1.00 0.00 C ATOM 256 O ASN A 19 10.141 -21.541 -4.520 1.00 0.00 O ATOM 257 CB ASN A 19 13.473 -20.560 -4.814 1.00 0.00 C ATOM 258 CG ASN A 19 14.168 -20.681 -6.156 1.00 0.00 C ATOM 259 OD1 ASN A 19 13.565 -20.443 -7.203 1.00 0.00 O ATOM 260 ND2 ASN A 19 15.442 -21.054 -6.132 1.00 0.00 N ATOM 0 H ASN A 19 10.859 -19.883 -3.215 1.00 0.00 H new ATOM 0 HA ASN A 19 11.939 -19.410 -5.785 1.00 0.00 H new ATOM 0 HB2 ASN A 19 14.017 -19.852 -4.189 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.503 -21.523 -4.304 1.00 0.00 H new ATOM 0 HD21 ASN A 19 15.961 -21.154 -7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 19 15.902 -21.241 -5.241 1.00 0.00 H new ATOM 267 N LEU A 20 11.462 -22.063 -6.265 1.00 0.00 N ATOM 268 CA LEU A 20 10.687 -23.241 -6.639 1.00 0.00 C ATOM 269 C LEU A 20 10.984 -24.407 -5.702 1.00 0.00 C ATOM 270 O LEU A 20 10.082 -24.947 -5.061 1.00 0.00 O ATOM 271 CB LEU A 20 10.996 -23.641 -8.083 1.00 0.00 C ATOM 272 CG LEU A 20 10.384 -22.756 -9.170 1.00 0.00 C ATOM 273 CD1 LEU A 20 11.336 -21.630 -9.541 1.00 0.00 C ATOM 274 CD2 LEU A 20 10.031 -23.585 -10.397 1.00 0.00 C ATOM 0 H LEU A 20 12.270 -21.883 -6.861 1.00 0.00 H new ATOM 0 HA LEU A 20 9.629 -22.992 -6.556 1.00 0.00 H new ATOM 0 HB2 LEU A 20 12.078 -23.647 -8.214 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.651 -24.663 -8.238 1.00 0.00 H new ATOM 0 HG LEU A 20 9.468 -22.315 -8.779 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.883 -21.011 -10.316 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.538 -21.020 -8.661 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.270 -22.051 -9.913 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.597 -22.939 -11.160 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.932 -24.055 -10.790 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.311 -24.355 -10.121 1.00 0.00 H new ATOM 286 N VAL A 21 12.255 -24.791 -5.627 1.00 0.00 N ATOM 287 CA VAL A 21 12.671 -25.891 -4.765 1.00 0.00 C ATOM 288 C VAL A 21 12.132 -25.716 -3.350 1.00 0.00 C ATOM 289 O VAL A 21 11.445 -26.591 -2.822 1.00 0.00 O ATOM 290 CB VAL A 21 14.206 -26.008 -4.707 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.835 -24.650 -4.435 1.00 0.00 C ATOM 292 CG2 VAL A 21 14.623 -27.020 -3.650 1.00 0.00 C ATOM 0 H VAL A 21 13.014 -24.357 -6.153 1.00 0.00 H new ATOM 0 HA VAL A 21 12.260 -26.804 -5.196 1.00 0.00 H new ATOM 0 HB VAL A 21 14.564 -26.360 -5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.920 -24.752 -4.397 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.563 -23.957 -5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.474 -24.266 -3.481 1.00 0.00 H new ATOM 0 HG21 VAL A 21 15.710 -27.090 -3.622 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.255 -26.700 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.203 -27.996 -3.894 1.00 0.00 H new ATOM 302 N THR A 22 12.446 -24.577 -2.739 1.00 0.00 N ATOM 303 CA THR A 22 11.994 -24.286 -1.385 1.00 0.00 C ATOM 304 C THR A 22 10.488 -24.056 -1.346 1.00 0.00 C ATOM 305 O THR A 22 9.796 -24.556 -0.460 1.00 0.00 O ATOM 306 CB THR A 22 12.707 -23.048 -0.808 1.00 0.00 C ATOM 307 OG1 THR A 22 14.027 -22.946 -1.353 1.00 0.00 O ATOM 308 CG2 THR A 22 12.782 -23.126 0.709 1.00 0.00 C ATOM 0 H THR A 22 13.012 -23.841 -3.162 1.00 0.00 H new ATOM 0 HA THR A 22 12.242 -25.155 -0.775 1.00 0.00 H new ATOM 0 HB THR A 22 12.133 -22.163 -1.082 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.473 -22.156 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.289 -22.241 1.094 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.774 -23.174 1.121 1.00 0.00 H new ATOM 0 HG23 THR A 22 13.336 -24.018 1.000 1.00 0.00 H new ATOM 316 N GLY A 23 9.985 -23.294 -2.313 1.00 0.00 N ATOM 317 CA GLY A 23 8.562 -23.011 -2.371 1.00 0.00 C ATOM 318 C GLY A 23 8.163 -21.864 -1.465 1.00 0.00 C ATOM 319 O GLY A 23 8.684 -20.756 -1.589 1.00 0.00 O ATOM 0 H GLY A 23 10.537 -22.868 -3.057 1.00 0.00 H new ATOM 0 HA2 GLY A 23 8.283 -22.773 -3.398 1.00 0.00 H new ATOM 0 HA3 GLY A 23 8.005 -23.904 -2.088 1.00 0.00 H new ATOM 323 N TRP A 24 7.234 -22.128 -0.552 1.00 0.00 N ATOM 324 CA TRP A 24 6.764 -21.107 0.377 1.00 0.00 C ATOM 325 C TRP A 24 7.516 -21.188 1.701 1.00 0.00 C ATOM 326 O TRP A 24 8.035 -22.243 2.066 1.00 0.00 O ATOM 327 CB TRP A 24 5.262 -21.263 0.620 1.00 0.00 C ATOM 328 CG TRP A 24 4.445 -21.174 -0.634 1.00 0.00 C ATOM 329 CD1 TRP A 24 4.296 -22.143 -1.586 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.668 -20.055 -1.073 1.00 0.00 C ATOM 331 NE1 TRP A 24 3.473 -21.693 -2.589 1.00 0.00 N ATOM 332 CE2 TRP A 24 3.073 -20.415 -2.298 1.00 0.00 C ATOM 333 CE3 TRP A 24 3.414 -18.784 -0.550 1.00 0.00 C ATOM 334 CZ2 TRP A 24 2.244 -19.550 -3.006 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.591 -17.926 -1.253 1.00 0.00 C ATOM 336 CH2 TRP A 24 2.013 -18.312 -2.470 1.00 0.00 C ATOM 0 H TRP A 24 6.792 -23.040 -0.436 1.00 0.00 H new ATOM 0 HA TRP A 24 6.954 -20.130 -0.068 1.00 0.00 H new ATOM 0 HB2 TRP A 24 5.077 -22.225 1.098 1.00 0.00 H new ATOM 0 HB3 TRP A 24 4.932 -20.492 1.316 1.00 0.00 H new ATOM 0 HD1 TRP A 24 4.757 -23.119 -1.554 1.00 0.00 H new ATOM 0 HE1 TRP A 24 3.203 -22.224 -3.417 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.854 -18.478 0.388 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 1.799 -19.845 -3.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 2.390 -16.941 -0.858 1.00 0.00 H new ATOM 0 HH2 TRP A 24 1.373 -17.619 -2.995 1.00 0.00 H new ATOM 347 N GLN A 25 7.570 -20.068 2.415 1.00 0.00 N ATOM 348 CA GLN A 25 8.260 -20.014 3.698 1.00 0.00 C ATOM 349 C GLN A 25 7.620 -18.978 4.617 1.00 0.00 C ATOM 350 O GLN A 25 7.634 -17.782 4.324 1.00 0.00 O ATOM 351 CB GLN A 25 9.740 -19.686 3.492 1.00 0.00 C ATOM 352 CG GLN A 25 10.537 -20.828 2.884 1.00 0.00 C ATOM 353 CD GLN A 25 11.998 -20.802 3.290 1.00 0.00 C ATOM 354 OE1 GLN A 25 12.480 -21.703 3.975 1.00 0.00 O ATOM 355 NE2 GLN A 25 12.711 -19.764 2.867 1.00 0.00 N ATOM 0 H GLN A 25 7.145 -19.187 2.127 1.00 0.00 H new ATOM 0 HA GLN A 25 8.175 -20.993 4.169 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.823 -18.812 2.846 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.181 -19.417 4.452 1.00 0.00 H new ATOM 0 HG2 GLN A 25 10.096 -21.777 3.190 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.465 -20.778 1.798 1.00 0.00 H new ATOM 0 HE21 GLN A 25 12.270 -19.039 2.301 1.00 0.00 H new ATOM 0 HE22 GLN A 25 13.699 -19.692 3.109 1.00 0.00 H new ATOM 364 N TYR A 26 7.061 -19.445 5.728 1.00 0.00 N ATOM 365 CA TYR A 26 6.414 -18.559 6.688 1.00 0.00 C ATOM 366 C TYR A 26 7.363 -17.450 7.132 1.00 0.00 C ATOM 367 O TYR A 26 8.531 -17.700 7.430 1.00 0.00 O ATOM 368 CB TYR A 26 5.935 -19.354 7.904 1.00 0.00 C ATOM 369 CG TYR A 26 4.531 -19.895 7.760 1.00 0.00 C ATOM 370 CD1 TYR A 26 3.465 -19.050 7.477 1.00 0.00 C ATOM 371 CD2 TYR A 26 4.270 -21.252 7.904 1.00 0.00 C ATOM 372 CE1 TYR A 26 2.180 -19.540 7.345 1.00 0.00 C ATOM 373 CE2 TYR A 26 2.989 -21.752 7.773 1.00 0.00 C ATOM 374 CZ TYR A 26 1.947 -20.892 7.493 1.00 0.00 C ATOM 375 OH TYR A 26 0.669 -21.384 7.361 1.00 0.00 O ATOM 0 H TYR A 26 7.043 -20.432 5.986 1.00 0.00 H new ATOM 0 HA TYR A 26 5.554 -18.101 6.200 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.619 -20.185 8.077 1.00 0.00 H new ATOM 0 HB3 TYR A 26 5.980 -18.715 8.786 1.00 0.00 H new ATOM 0 HD1 TYR A 26 3.644 -17.992 7.358 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.083 -21.928 8.122 1.00 0.00 H new ATOM 0 HE1 TYR A 26 1.363 -18.869 7.127 1.00 0.00 H new ATOM 0 HE2 TYR A 26 2.804 -22.810 7.889 1.00 0.00 H new ATOM 0 HH TYR A 26 0.677 -22.355 7.493 1.00 0.00 H new ATOM 385 N ARG A 27 6.851 -16.225 7.174 1.00 0.00 N ATOM 386 CA ARG A 27 7.652 -15.076 7.581 1.00 0.00 C ATOM 387 C ARG A 27 6.775 -13.997 8.209 1.00 0.00 C ATOM 388 O ARG A 27 5.548 -14.042 8.107 1.00 0.00 O ATOM 389 CB ARG A 27 8.405 -14.501 6.380 1.00 0.00 C ATOM 390 CG ARG A 27 9.629 -15.311 5.985 1.00 0.00 C ATOM 391 CD ARG A 27 10.587 -14.493 5.133 1.00 0.00 C ATOM 392 NE ARG A 27 11.419 -15.338 4.280 1.00 0.00 N ATOM 393 CZ ARG A 27 12.555 -14.930 3.725 1.00 0.00 C ATOM 394 NH1 ARG A 27 12.992 -13.695 3.933 1.00 0.00 N ATOM 395 NH2 ARG A 27 13.256 -15.757 2.960 1.00 0.00 N ATOM 0 H ARG A 27 5.886 -16.002 6.931 1.00 0.00 H new ATOM 0 HA ARG A 27 8.373 -15.413 8.326 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.726 -14.445 5.529 1.00 0.00 H new ATOM 0 HB3 ARG A 27 8.713 -13.481 6.609 1.00 0.00 H new ATOM 0 HG2 ARG A 27 10.143 -15.657 6.882 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.317 -16.198 5.434 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.019 -13.800 4.513 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.225 -13.892 5.781 1.00 0.00 H new ATOM 0 HE ARG A 27 11.111 -16.294 4.101 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.456 -13.056 4.520 1.00 0.00 H new ATOM 0 HH12 ARG A 27 13.864 -13.384 3.506 1.00 0.00 H new ATOM 0 HH21 ARG A 27 12.923 -16.707 2.797 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.128 -15.442 2.534 1.00 0.00 H new ATOM 409 N PHE A 28 7.411 -13.028 8.858 1.00 0.00 N ATOM 410 CA PHE A 28 6.689 -11.937 9.503 1.00 0.00 C ATOM 411 C PHE A 28 6.667 -10.698 8.614 1.00 0.00 C ATOM 412 O PHE A 28 7.650 -10.385 7.941 1.00 0.00 O ATOM 413 CB PHE A 28 7.330 -11.601 10.851 1.00 0.00 C ATOM 414 CG PHE A 28 6.689 -10.433 11.545 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.341 -10.455 11.864 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.434 -9.313 11.878 1.00 0.00 C ATOM 417 CE1 PHE A 28 4.748 -9.381 12.502 1.00 0.00 C ATOM 418 CE2 PHE A 28 6.847 -8.237 12.516 1.00 0.00 C ATOM 419 CZ PHE A 28 5.503 -8.271 12.829 1.00 0.00 C ATOM 0 H PHE A 28 8.425 -12.976 8.952 1.00 0.00 H new ATOM 0 HA PHE A 28 5.662 -12.261 9.668 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.272 -12.475 11.500 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.388 -11.387 10.698 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.747 -11.321 11.612 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.486 -9.281 11.636 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.696 -9.410 12.744 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.439 -7.370 12.770 1.00 0.00 H new ATOM 0 HZ PHE A 28 5.042 -7.432 13.329 1.00 0.00 H new ATOM 429 N PHE A 29 5.539 -9.995 8.616 1.00 0.00 N ATOM 430 CA PHE A 29 5.387 -8.790 7.808 1.00 0.00 C ATOM 431 C PHE A 29 4.784 -7.656 8.632 1.00 0.00 C ATOM 432 O PHE A 29 3.982 -7.889 9.536 1.00 0.00 O ATOM 433 CB PHE A 29 4.507 -9.075 6.590 1.00 0.00 C ATOM 434 CG PHE A 29 5.205 -9.860 5.516 1.00 0.00 C ATOM 435 CD1 PHE A 29 5.477 -11.208 5.691 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.588 -9.251 4.332 1.00 0.00 C ATOM 437 CE1 PHE A 29 6.119 -11.932 4.705 1.00 0.00 C ATOM 438 CE2 PHE A 29 6.231 -9.971 3.342 1.00 0.00 C ATOM 439 CZ PHE A 29 6.496 -11.313 3.529 1.00 0.00 C ATOM 0 H PHE A 29 4.717 -10.239 9.168 1.00 0.00 H new ATOM 0 HA PHE A 29 6.376 -8.483 7.468 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.621 -9.623 6.912 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.162 -8.129 6.172 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.184 -11.697 6.608 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.382 -8.202 4.181 1.00 0.00 H new ATOM 0 HE1 PHE A 29 6.326 -12.982 4.854 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.525 -9.484 2.424 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.997 -11.878 2.757 1.00 0.00 H new ATOM 449 N VAL A 30 5.177 -6.427 8.312 1.00 0.00 N ATOM 450 CA VAL A 30 4.676 -5.256 9.021 1.00 0.00 C ATOM 451 C VAL A 30 4.420 -4.100 8.061 1.00 0.00 C ATOM 452 O VAL A 30 5.346 -3.578 7.439 1.00 0.00 O ATOM 453 CB VAL A 30 5.662 -4.795 10.111 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.126 -3.566 10.831 1.00 0.00 C ATOM 455 CG2 VAL A 30 5.933 -5.923 11.095 1.00 0.00 C ATOM 0 H VAL A 30 5.841 -6.217 7.566 1.00 0.00 H new ATOM 0 HA VAL A 30 3.737 -5.549 9.491 1.00 0.00 H new ATOM 0 HB VAL A 30 6.604 -4.525 9.634 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.836 -3.255 11.597 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.987 -2.756 10.115 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.170 -3.805 11.297 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.632 -5.580 11.858 1.00 0.00 H new ATOM 0 HG22 VAL A 30 4.999 -6.226 11.568 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.363 -6.773 10.565 1.00 0.00 H new ATOM 465 N LEU A 31 3.157 -3.704 7.944 1.00 0.00 N ATOM 466 CA LEU A 31 2.778 -2.608 7.059 1.00 0.00 C ATOM 467 C LEU A 31 3.031 -1.258 7.724 1.00 0.00 C ATOM 468 O LEU A 31 2.886 -1.117 8.937 1.00 0.00 O ATOM 469 CB LEU A 31 1.304 -2.728 6.668 1.00 0.00 C ATOM 470 CG LEU A 31 0.733 -1.576 5.841 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.283 -1.610 4.424 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.788 -1.633 5.827 1.00 0.00 C ATOM 0 H LEU A 31 2.378 -4.125 8.451 1.00 0.00 H new ATOM 0 HA LEU A 31 3.392 -2.671 6.161 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.172 -3.653 6.106 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.714 -2.822 7.579 1.00 0.00 H new ATOM 0 HG LEU A 31 1.038 -0.637 6.303 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.865 -0.782 3.851 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.369 -1.519 4.453 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.010 -2.553 3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.178 -0.806 5.234 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.113 -2.577 5.390 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.164 -1.557 6.847 1.00 0.00 H new ATOM 484 N ASN A 32 3.407 -0.269 6.920 1.00 0.00 N ATOM 485 CA ASN A 32 3.679 1.070 7.430 1.00 0.00 C ATOM 486 C ASN A 32 2.725 2.090 6.815 1.00 0.00 C ATOM 487 O ASN A 32 2.926 2.541 5.688 1.00 0.00 O ATOM 488 CB ASN A 32 5.127 1.466 7.136 1.00 0.00 C ATOM 489 CG ASN A 32 5.608 2.596 8.026 1.00 0.00 C ATOM 490 OD1 ASN A 32 4.809 3.286 8.659 1.00 0.00 O ATOM 491 ND2 ASN A 32 6.921 2.791 8.077 1.00 0.00 N ATOM 0 H ASN A 32 3.530 -0.369 5.912 1.00 0.00 H new ATOM 0 HA ASN A 32 3.525 1.060 8.509 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.773 0.599 7.273 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.214 1.767 6.092 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.304 3.537 8.658 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.547 2.195 7.535 1.00 0.00 H new ATOM 498 N ASN A 33 1.687 2.448 7.564 1.00 0.00 N ATOM 499 CA ASN A 33 0.703 3.415 7.092 1.00 0.00 C ATOM 500 C ASN A 33 1.294 4.821 7.058 1.00 0.00 C ATOM 501 O ASN A 33 0.959 5.624 6.188 1.00 0.00 O ATOM 502 CB ASN A 33 -0.536 3.392 7.990 1.00 0.00 C ATOM 503 CG ASN A 33 -0.181 3.340 9.464 1.00 0.00 C ATOM 504 OD1 ASN A 33 0.356 2.345 9.950 1.00 0.00 O ATOM 505 ND2 ASN A 33 -0.480 4.416 10.182 1.00 0.00 N ATOM 0 H ASN A 33 1.506 2.083 8.499 1.00 0.00 H new ATOM 0 HA ASN A 33 0.415 3.137 6.078 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -1.139 4.279 7.795 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -1.149 2.528 7.736 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -0.265 4.440 11.179 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.925 5.219 9.737 1.00 0.00 H new ATOM 512 N GLU A 34 2.174 5.110 8.011 1.00 0.00 N ATOM 513 CA GLU A 34 2.812 6.419 8.090 1.00 0.00 C ATOM 514 C GLU A 34 3.693 6.670 6.869 1.00 0.00 C ATOM 515 O GLU A 34 3.487 7.631 6.128 1.00 0.00 O ATOM 516 CB GLU A 34 3.648 6.529 9.367 1.00 0.00 C ATOM 517 CG GLU A 34 4.472 7.803 9.448 1.00 0.00 C ATOM 518 CD GLU A 34 5.089 8.012 10.817 1.00 0.00 C ATOM 519 OE1 GLU A 34 5.451 7.008 11.465 1.00 0.00 O ATOM 520 OE2 GLU A 34 5.209 9.181 11.240 1.00 0.00 O ATOM 0 H GLU A 34 2.461 4.456 8.739 1.00 0.00 H new ATOM 0 HA GLU A 34 2.027 7.175 8.112 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.985 6.480 10.231 1.00 0.00 H new ATOM 0 HB3 GLU A 34 4.316 5.670 9.429 1.00 0.00 H new ATOM 0 HG2 GLU A 34 5.263 7.768 8.699 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.839 8.657 9.204 1.00 0.00 H new ATOM 527 N ALA A 35 4.675 5.798 6.667 1.00 0.00 N ATOM 528 CA ALA A 35 5.587 5.923 5.536 1.00 0.00 C ATOM 529 C ALA A 35 4.948 5.398 4.255 1.00 0.00 C ATOM 530 O ALA A 35 5.038 6.027 3.202 1.00 0.00 O ATOM 531 CB ALA A 35 6.886 5.183 5.822 1.00 0.00 C ATOM 0 H ALA A 35 4.860 4.997 7.271 1.00 0.00 H new ATOM 0 HA ALA A 35 5.808 6.981 5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.558 5.284 4.970 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.358 5.606 6.709 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.674 4.128 5.993 1.00 0.00 H new ATOM 537 N GLY A 36 4.302 4.240 4.353 1.00 0.00 N ATOM 538 CA GLY A 36 3.658 3.650 3.194 1.00 0.00 C ATOM 539 C GLY A 36 4.526 2.608 2.516 1.00 0.00 C ATOM 540 O GLY A 36 4.422 2.394 1.307 1.00 0.00 O ATOM 0 H GLY A 36 4.213 3.700 5.214 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.717 3.192 3.499 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.413 4.436 2.479 1.00 0.00 H new ATOM 544 N LEU A 37 5.385 1.959 3.294 1.00 0.00 N ATOM 545 CA LEU A 37 6.277 0.935 2.761 1.00 0.00 C ATOM 546 C LEU A 37 6.011 -0.415 3.421 1.00 0.00 C ATOM 547 O LEU A 37 5.824 -0.498 4.635 1.00 0.00 O ATOM 548 CB LEU A 37 7.736 1.341 2.973 1.00 0.00 C ATOM 549 CG LEU A 37 8.332 2.276 1.920 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.412 3.153 2.536 1.00 0.00 C ATOM 551 CD2 LEU A 37 8.892 1.477 0.753 1.00 0.00 C ATOM 0 H LEU A 37 5.483 2.123 4.296 1.00 0.00 H new ATOM 0 HA LEU A 37 6.085 0.841 1.692 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.820 1.823 3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.342 0.436 3.011 1.00 0.00 H new ATOM 0 HG LEU A 37 7.539 2.922 1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.825 3.812 1.772 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.981 3.752 3.338 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.205 2.524 2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.312 2.159 0.013 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.672 0.806 1.112 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.094 0.893 0.296 1.00 0.00 H new ATOM 563 N LEU A 38 5.999 -1.469 2.614 1.00 0.00 N ATOM 564 CA LEU A 38 5.759 -2.817 3.119 1.00 0.00 C ATOM 565 C LEU A 38 7.071 -3.572 3.299 1.00 0.00 C ATOM 566 O LEU A 38 7.738 -3.918 2.324 1.00 0.00 O ATOM 567 CB LEU A 38 4.842 -3.585 2.165 1.00 0.00 C ATOM 568 CG LEU A 38 4.678 -5.078 2.449 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.702 -5.301 3.593 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.213 -5.810 1.198 1.00 0.00 C ATOM 0 H LEU A 38 6.153 -1.417 1.607 1.00 0.00 H new ATOM 0 HA LEU A 38 5.273 -2.733 4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.856 -3.121 2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.226 -3.468 1.151 1.00 0.00 H new ATOM 0 HG LEU A 38 5.647 -5.481 2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.599 -6.370 3.780 1.00 0.00 H new ATOM 0 HD12 LEU A 38 4.076 -4.810 4.491 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.730 -4.883 3.329 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.101 -6.872 1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.255 -5.404 0.874 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.949 -5.679 0.405 1.00 0.00 H new ATOM 582 N GLU A 39 7.435 -3.827 4.552 1.00 0.00 N ATOM 583 CA GLU A 39 8.667 -4.543 4.859 1.00 0.00 C ATOM 584 C GLU A 39 8.367 -5.952 5.362 1.00 0.00 C ATOM 585 O GLU A 39 7.210 -6.311 5.581 1.00 0.00 O ATOM 586 CB GLU A 39 9.480 -3.779 5.906 1.00 0.00 C ATOM 587 CG GLU A 39 9.324 -2.270 5.816 1.00 0.00 C ATOM 588 CD GLU A 39 9.998 -1.544 6.964 1.00 0.00 C ATOM 589 OE1 GLU A 39 10.849 -2.160 7.638 1.00 0.00 O ATOM 590 OE2 GLU A 39 9.673 -0.359 7.188 1.00 0.00 O ATOM 0 H GLU A 39 6.894 -3.548 5.371 1.00 0.00 H new ATOM 0 HA GLU A 39 9.250 -4.620 3.941 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.177 -4.108 6.900 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.534 -4.034 5.793 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.745 -1.921 4.873 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.264 -2.018 5.804 1.00 0.00 H new ATOM 597 N TYR A 40 9.417 -6.746 5.542 1.00 0.00 N ATOM 598 CA TYR A 40 9.266 -8.116 6.016 1.00 0.00 C ATOM 599 C TYR A 40 10.572 -8.633 6.613 1.00 0.00 C ATOM 600 O TYR A 40 11.656 -8.356 6.099 1.00 0.00 O ATOM 601 CB TYR A 40 8.820 -9.028 4.872 1.00 0.00 C ATOM 602 CG TYR A 40 9.913 -9.320 3.869 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.775 -10.395 4.044 1.00 0.00 C ATOM 604 CD2 TYR A 40 10.083 -8.520 2.745 1.00 0.00 C ATOM 605 CE1 TYR A 40 11.775 -10.665 3.131 1.00 0.00 C ATOM 606 CE2 TYR A 40 11.080 -8.784 1.825 1.00 0.00 C ATOM 607 CZ TYR A 40 11.924 -9.857 2.023 1.00 0.00 C ATOM 608 OH TYR A 40 12.918 -10.123 1.110 1.00 0.00 O ATOM 0 H TYR A 40 10.381 -6.464 5.367 1.00 0.00 H new ATOM 0 HA TYR A 40 8.503 -8.122 6.795 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.459 -9.969 5.288 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.979 -8.565 4.356 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.661 -11.031 4.909 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.425 -7.678 2.588 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.437 -11.504 3.284 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.198 -8.154 0.956 1.00 0.00 H new ATOM 0 HH TYR A 40 12.885 -9.460 0.389 1.00 0.00 H new ATOM 618 N PHE A 41 10.459 -9.386 7.702 1.00 0.00 N ATOM 619 CA PHE A 41 11.630 -9.942 8.371 1.00 0.00 C ATOM 620 C PHE A 41 11.500 -11.455 8.527 1.00 0.00 C ATOM 621 O PHE A 41 10.395 -11.986 8.636 1.00 0.00 O ATOM 622 CB PHE A 41 11.818 -9.291 9.743 1.00 0.00 C ATOM 623 CG PHE A 41 11.735 -7.792 9.710 1.00 0.00 C ATOM 624 CD1 PHE A 41 10.509 -7.150 9.783 1.00 0.00 C ATOM 625 CD2 PHE A 41 12.884 -7.024 9.608 1.00 0.00 C ATOM 626 CE1 PHE A 41 10.431 -5.771 9.753 1.00 0.00 C ATOM 627 CE2 PHE A 41 12.812 -5.644 9.578 1.00 0.00 C ATOM 628 CZ PHE A 41 11.584 -5.016 9.652 1.00 0.00 C ATOM 0 H PHE A 41 9.569 -9.625 8.140 1.00 0.00 H new ATOM 0 HA PHE A 41 12.504 -9.731 7.754 1.00 0.00 H new ATOM 0 HB2 PHE A 41 11.059 -9.674 10.425 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.787 -9.585 10.146 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.604 -7.734 9.864 1.00 0.00 H new ATOM 0 HD2 PHE A 41 13.847 -7.509 9.551 1.00 0.00 H new ATOM 0 HE1 PHE A 41 9.469 -5.283 9.808 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.715 -5.057 9.497 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.525 -3.938 9.631 1.00 0.00 H new ATOM 638 N VAL A 42 12.637 -12.143 8.536 1.00 0.00 N ATOM 639 CA VAL A 42 12.652 -13.594 8.679 1.00 0.00 C ATOM 640 C VAL A 42 11.623 -14.055 9.705 1.00 0.00 C ATOM 641 O VAL A 42 10.948 -15.065 9.512 1.00 0.00 O ATOM 642 CB VAL A 42 14.044 -14.102 9.099 1.00 0.00 C ATOM 643 CG1 VAL A 42 14.006 -15.599 9.369 1.00 0.00 C ATOM 644 CG2 VAL A 42 15.076 -13.771 8.031 1.00 0.00 C ATOM 0 H VAL A 42 13.560 -11.719 8.446 1.00 0.00 H new ATOM 0 HA VAL A 42 12.401 -14.011 7.704 1.00 0.00 H new ATOM 0 HB VAL A 42 14.334 -13.597 10.021 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.998 -15.941 9.664 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.297 -15.806 10.171 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.696 -16.124 8.466 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.054 -14.137 8.344 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.794 -14.247 7.092 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.121 -12.691 7.891 1.00 0.00 H new ATOM 654 N ASN A 43 11.509 -13.307 10.798 1.00 0.00 N ATOM 655 CA ASN A 43 10.562 -13.639 11.856 1.00 0.00 C ATOM 656 C ASN A 43 10.223 -12.407 12.689 1.00 0.00 C ATOM 657 O ASN A 43 10.694 -11.306 12.406 1.00 0.00 O ATOM 658 CB ASN A 43 11.136 -14.735 12.757 1.00 0.00 C ATOM 659 CG ASN A 43 11.266 -16.064 12.038 1.00 0.00 C ATOM 660 OD1 ASN A 43 12.316 -16.705 12.080 1.00 0.00 O ATOM 661 ND2 ASN A 43 10.195 -16.485 11.374 1.00 0.00 N ATOM 0 H ASN A 43 12.061 -12.467 10.974 1.00 0.00 H new ATOM 0 HA ASN A 43 9.647 -14.003 11.389 1.00 0.00 H new ATOM 0 HB2 ASN A 43 12.115 -14.425 13.123 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.494 -14.858 13.629 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.222 -17.372 10.872 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.345 -15.921 11.366 1.00 0.00 H new ATOM 668 N GLU A 44 9.403 -12.601 13.718 1.00 0.00 N ATOM 669 CA GLU A 44 9.001 -11.505 14.592 1.00 0.00 C ATOM 670 C GLU A 44 10.170 -11.042 15.456 1.00 0.00 C ATOM 671 O GLU A 44 10.283 -9.861 15.782 1.00 0.00 O ATOM 672 CB GLU A 44 7.834 -11.936 15.482 1.00 0.00 C ATOM 673 CG GLU A 44 6.967 -10.779 15.950 1.00 0.00 C ATOM 674 CD GLU A 44 6.311 -11.046 17.291 1.00 0.00 C ATOM 675 OE1 GLU A 44 6.925 -11.746 18.123 1.00 0.00 O ATOM 676 OE2 GLU A 44 5.183 -10.555 17.507 1.00 0.00 O ATOM 0 H GLU A 44 9.005 -13.507 13.966 1.00 0.00 H new ATOM 0 HA GLU A 44 8.683 -10.672 13.965 1.00 0.00 H new ATOM 0 HB2 GLU A 44 7.214 -12.646 14.935 1.00 0.00 H new ATOM 0 HB3 GLU A 44 8.227 -12.461 16.353 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.577 -9.879 16.021 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.196 -10.583 15.205 1.00 0.00 H new ATOM 683 N GLN A 45 11.036 -11.981 15.822 1.00 0.00 N ATOM 684 CA GLN A 45 12.196 -11.669 16.650 1.00 0.00 C ATOM 685 C GLN A 45 13.131 -10.701 15.933 1.00 0.00 C ATOM 686 O GLN A 45 14.093 -10.203 16.519 1.00 0.00 O ATOM 687 CB GLN A 45 12.949 -12.950 17.013 1.00 0.00 C ATOM 688 CG GLN A 45 12.298 -13.741 18.135 1.00 0.00 C ATOM 689 CD GLN A 45 13.214 -14.805 18.707 1.00 0.00 C ATOM 690 OE1 GLN A 45 13.319 -15.906 18.167 1.00 0.00 O ATOM 691 NE2 GLN A 45 13.884 -14.481 19.807 1.00 0.00 N ATOM 0 H GLN A 45 10.957 -12.963 15.559 1.00 0.00 H new ATOM 0 HA GLN A 45 11.841 -11.193 17.564 1.00 0.00 H new ATOM 0 HB2 GLN A 45 13.021 -13.582 16.128 1.00 0.00 H new ATOM 0 HB3 GLN A 45 13.967 -12.693 17.304 1.00 0.00 H new ATOM 0 HG2 GLN A 45 12.000 -13.058 18.930 1.00 0.00 H new ATOM 0 HG3 GLN A 45 11.389 -14.212 17.762 1.00 0.00 H new ATOM 0 HE21 GLN A 45 13.767 -13.556 20.222 1.00 0.00 H new ATOM 0 HE22 GLN A 45 14.516 -15.157 20.237 1.00 0.00 H new ATOM 700 N SER A 46 12.844 -10.439 14.662 1.00 0.00 N ATOM 701 CA SER A 46 13.662 -9.533 13.864 1.00 0.00 C ATOM 702 C SER A 46 12.900 -8.250 13.546 1.00 0.00 C ATOM 703 O SER A 46 12.821 -7.832 12.391 1.00 0.00 O ATOM 704 CB SER A 46 14.097 -10.216 12.566 1.00 0.00 C ATOM 705 OG SER A 46 14.874 -9.342 11.766 1.00 0.00 O ATOM 0 H SER A 46 12.051 -10.841 14.163 1.00 0.00 H new ATOM 0 HA SER A 46 14.547 -9.274 14.445 1.00 0.00 H new ATOM 0 HB2 SER A 46 14.674 -11.111 12.798 1.00 0.00 H new ATOM 0 HB3 SER A 46 13.218 -10.539 12.009 1.00 0.00 H new ATOM 0 HG SER A 46 14.354 -8.537 11.562 1.00 0.00 H new ATOM 711 N ARG A 47 12.340 -7.631 14.580 1.00 0.00 N ATOM 712 CA ARG A 47 11.583 -6.396 14.412 1.00 0.00 C ATOM 713 C ARG A 47 12.517 -5.192 14.335 1.00 0.00 C ATOM 714 O ARG A 47 12.518 -4.458 13.348 1.00 0.00 O ATOM 715 CB ARG A 47 10.597 -6.216 15.568 1.00 0.00 C ATOM 716 CG ARG A 47 9.235 -6.840 15.309 1.00 0.00 C ATOM 717 CD ARG A 47 8.136 -6.108 16.063 1.00 0.00 C ATOM 718 NE ARG A 47 6.985 -6.969 16.324 1.00 0.00 N ATOM 719 CZ ARG A 47 5.885 -6.557 16.945 1.00 0.00 C ATOM 720 NH1 ARG A 47 5.786 -5.303 17.364 1.00 0.00 N ATOM 721 NH2 ARG A 47 4.880 -7.400 17.146 1.00 0.00 N ATOM 0 H ARG A 47 12.396 -7.964 15.542 1.00 0.00 H new ATOM 0 HA ARG A 47 11.028 -6.464 13.476 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.023 -6.656 16.470 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.468 -5.151 15.762 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.021 -6.819 14.240 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.250 -7.887 15.611 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.531 -5.735 17.008 1.00 0.00 H new ATOM 0 HD3 ARG A 47 7.816 -5.240 15.486 1.00 0.00 H new ATOM 0 HE ARG A 47 7.028 -7.939 16.013 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.556 -4.652 17.210 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.940 -4.990 17.840 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.952 -8.365 16.824 1.00 0.00 H new ATOM 0 HH22 ARG A 47 4.036 -7.083 17.623 1.00 0.00 H new ATOM 735 N ASN A 48 13.310 -4.996 15.383 1.00 0.00 N ATOM 736 CA ASN A 48 14.248 -3.880 15.434 1.00 0.00 C ATOM 737 C ASN A 48 15.389 -4.083 14.442 1.00 0.00 C ATOM 738 O ASN A 48 15.975 -3.119 13.950 1.00 0.00 O ATOM 739 CB ASN A 48 14.810 -3.723 16.849 1.00 0.00 C ATOM 740 CG ASN A 48 16.147 -3.008 16.864 1.00 0.00 C ATOM 741 OD1 ASN A 48 16.273 -1.892 16.360 1.00 0.00 O ATOM 742 ND2 ASN A 48 17.154 -3.651 17.443 1.00 0.00 N ATOM 0 H ASN A 48 13.322 -5.595 16.208 1.00 0.00 H new ATOM 0 HA ASN A 48 13.709 -2.972 15.161 1.00 0.00 H new ATOM 0 HB2 ASN A 48 14.098 -3.169 17.460 1.00 0.00 H new ATOM 0 HB3 ASN A 48 14.922 -4.707 17.304 1.00 0.00 H new ATOM 0 HD21 ASN A 48 18.078 -3.221 17.483 1.00 0.00 H new ATOM 0 HD22 ASN A 48 17.004 -4.575 17.848 1.00 0.00 H new ATOM 749 N GLN A 49 15.697 -5.343 14.152 1.00 0.00 N ATOM 750 CA GLN A 49 16.767 -5.672 13.218 1.00 0.00 C ATOM 751 C GLN A 49 16.461 -5.129 11.826 1.00 0.00 C ATOM 752 O GLN A 49 15.309 -4.843 11.499 1.00 0.00 O ATOM 753 CB GLN A 49 16.970 -7.186 13.154 1.00 0.00 C ATOM 754 CG GLN A 49 17.979 -7.708 14.165 1.00 0.00 C ATOM 755 CD GLN A 49 17.345 -8.057 15.497 1.00 0.00 C ATOM 756 OE1 GLN A 49 16.630 -9.175 15.538 1.00 0.00 O flip ATOM 757 NE2 GLN A 49 17.495 -7.329 16.478 1.00 0.00 N flip ATOM 0 H GLN A 49 15.221 -6.152 14.550 1.00 0.00 H new ATOM 0 HA GLN A 49 17.684 -5.205 13.577 1.00 0.00 H new ATOM 0 HB2 GLN A 49 16.013 -7.680 13.320 1.00 0.00 H new ATOM 0 HB3 GLN A 49 17.299 -7.458 12.151 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.471 -8.592 13.758 1.00 0.00 H new ATOM 0 HG3 GLN A 49 18.753 -6.956 14.321 1.00 0.00 H new ATOM 0 HE21 GLN A 49 18.053 -6.479 16.401 1.00 0.00 H new ATOM 0 HE22 GLN A 49 17.061 -7.576 17.368 1.00 0.00 H new ATOM 766 N LYS A 50 17.500 -4.989 11.009 1.00 0.00 N ATOM 767 CA LYS A 50 17.343 -4.481 9.652 1.00 0.00 C ATOM 768 C LYS A 50 16.479 -5.420 8.816 1.00 0.00 C ATOM 769 O LYS A 50 16.621 -6.642 8.865 1.00 0.00 O ATOM 770 CB LYS A 50 18.712 -4.307 8.989 1.00 0.00 C ATOM 771 CG LYS A 50 18.650 -3.617 7.637 1.00 0.00 C ATOM 772 CD LYS A 50 18.537 -2.109 7.785 1.00 0.00 C ATOM 773 CE LYS A 50 19.907 -1.455 7.890 1.00 0.00 C ATOM 774 NZ LYS A 50 19.821 0.029 7.809 1.00 0.00 N ATOM 0 H LYS A 50 18.460 -5.221 11.264 1.00 0.00 H new ATOM 0 HA LYS A 50 16.847 -3.512 9.709 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.357 -3.731 9.652 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.174 -5.287 8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.543 -3.861 7.062 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.796 -3.993 7.074 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.001 -1.698 6.930 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.951 -1.872 8.673 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.374 -1.741 8.832 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.549 -1.826 7.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.775 0.437 7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.398 0.303 6.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 19.230 0.385 8.587 1.00 0.00 H new ATOM 788 N PRO A 51 15.561 -4.837 8.030 1.00 0.00 N ATOM 789 CA PRO A 51 14.657 -5.604 7.167 1.00 0.00 C ATOM 790 C PRO A 51 15.386 -6.258 5.998 1.00 0.00 C ATOM 791 O PRO A 51 16.444 -5.791 5.576 1.00 0.00 O ATOM 792 CB PRO A 51 13.672 -4.548 6.659 1.00 0.00 C ATOM 793 CG PRO A 51 14.422 -3.263 6.734 1.00 0.00 C ATOM 794 CD PRO A 51 15.336 -3.386 7.922 1.00 0.00 C ATOM 0 HA PRO A 51 14.183 -6.427 7.702 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.354 -4.762 5.639 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.772 -4.518 7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.991 -3.089 5.820 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.741 -2.420 6.851 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.270 -2.845 7.768 1.00 0.00 H new ATOM 0 HD3 PRO A 51 14.878 -2.982 8.825 1.00 0.00 H new ATOM 802 N ARG A 52 14.814 -7.340 5.481 1.00 0.00 N ATOM 803 CA ARG A 52 15.411 -8.058 4.361 1.00 0.00 C ATOM 804 C ARG A 52 15.093 -7.365 3.039 1.00 0.00 C ATOM 805 O ARG A 52 15.917 -7.339 2.126 1.00 0.00 O ATOM 806 CB ARG A 52 14.906 -9.502 4.327 1.00 0.00 C ATOM 807 CG ARG A 52 14.913 -10.182 5.686 1.00 0.00 C ATOM 808 CD ARG A 52 16.264 -10.812 5.987 1.00 0.00 C ATOM 809 NE ARG A 52 16.643 -11.800 4.981 1.00 0.00 N ATOM 810 CZ ARG A 52 17.887 -12.230 4.805 1.00 0.00 C ATOM 811 NH1 ARG A 52 18.868 -11.761 5.565 1.00 0.00 N ATOM 812 NH2 ARG A 52 18.153 -13.131 3.868 1.00 0.00 N ATOM 0 H ARG A 52 13.938 -7.739 5.819 1.00 0.00 H new ATOM 0 HA ARG A 52 16.492 -8.061 4.498 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.891 -9.514 3.930 1.00 0.00 H new ATOM 0 HB3 ARG A 52 15.524 -10.078 3.639 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.669 -9.454 6.460 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.138 -10.948 5.715 1.00 0.00 H new ATOM 0 HD2 ARG A 52 17.025 -10.033 6.035 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.232 -11.287 6.968 1.00 0.00 H new ATOM 0 HE ARG A 52 15.912 -12.181 4.380 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.668 -11.068 6.287 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.823 -12.093 5.428 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.401 -13.494 3.282 1.00 0.00 H new ATOM 0 HH22 ARG A 52 19.109 -13.460 3.734 1.00 0.00 H new ATOM 826 N GLY A 53 13.891 -6.805 2.945 1.00 0.00 N ATOM 827 CA GLY A 53 13.485 -6.120 1.731 1.00 0.00 C ATOM 828 C GLY A 53 12.268 -5.241 1.941 1.00 0.00 C ATOM 829 O GLY A 53 11.497 -5.446 2.879 1.00 0.00 O ATOM 0 H GLY A 53 13.191 -6.813 3.687 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.312 -5.510 1.368 1.00 0.00 H new ATOM 0 HA3 GLY A 53 13.268 -6.856 0.957 1.00 0.00 H new ATOM 833 N THR A 54 12.094 -4.255 1.066 1.00 0.00 N ATOM 834 CA THR A 54 10.964 -3.339 1.161 1.00 0.00 C ATOM 835 C THR A 54 10.306 -3.135 -0.199 1.00 0.00 C ATOM 836 O THR A 54 10.984 -3.081 -1.226 1.00 0.00 O ATOM 837 CB THR A 54 11.396 -1.971 1.721 1.00 0.00 C ATOM 838 OG1 THR A 54 12.267 -1.315 0.793 1.00 0.00 O ATOM 839 CG2 THR A 54 12.101 -2.132 3.059 1.00 0.00 C ATOM 0 H THR A 54 12.722 -4.071 0.283 1.00 0.00 H new ATOM 0 HA THR A 54 10.246 -3.792 1.844 1.00 0.00 H new ATOM 0 HB THR A 54 10.502 -1.365 1.870 1.00 0.00 H new ATOM 0 HG1 THR A 54 12.536 -0.445 1.156 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.397 -1.152 3.435 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.425 -2.605 3.772 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.987 -2.754 2.931 1.00 0.00 H new ATOM 847 N LEU A 55 8.983 -3.020 -0.199 1.00 0.00 N ATOM 848 CA LEU A 55 8.233 -2.820 -1.435 1.00 0.00 C ATOM 849 C LEU A 55 7.318 -1.604 -1.325 1.00 0.00 C ATOM 850 O LEU A 55 6.588 -1.451 -0.346 1.00 0.00 O ATOM 851 CB LEU A 55 7.407 -4.065 -1.761 1.00 0.00 C ATOM 852 CG LEU A 55 6.448 -3.944 -2.945 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.169 -4.246 -4.249 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.257 -4.874 -2.764 1.00 0.00 C ATOM 0 H LEU A 55 8.407 -3.062 0.642 1.00 0.00 H new ATOM 0 HA LEU A 55 8.947 -2.644 -2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 55 8.092 -4.890 -1.957 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.829 -4.334 -0.877 1.00 0.00 H new ATOM 0 HG LEU A 55 6.080 -2.919 -2.986 1.00 0.00 H new ATOM 0 HD11 LEU A 55 6.470 -4.155 -5.081 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.988 -3.539 -4.384 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.566 -5.261 -4.219 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.585 -4.774 -3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.607 -5.904 -2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.725 -4.610 -1.850 1.00 0.00 H new ATOM 866 N GLN A 56 7.362 -0.744 -2.337 1.00 0.00 N ATOM 867 CA GLN A 56 6.536 0.458 -2.355 1.00 0.00 C ATOM 868 C GLN A 56 5.095 0.122 -2.725 1.00 0.00 C ATOM 869 O GLN A 56 4.844 -0.624 -3.672 1.00 0.00 O ATOM 870 CB GLN A 56 7.104 1.479 -3.342 1.00 0.00 C ATOM 871 CG GLN A 56 8.130 2.416 -2.725 1.00 0.00 C ATOM 872 CD GLN A 56 9.082 2.996 -3.752 1.00 0.00 C ATOM 873 OE1 GLN A 56 8.657 3.566 -4.758 1.00 0.00 O ATOM 874 NE2 GLN A 56 10.379 2.853 -3.504 1.00 0.00 N ATOM 0 H GLN A 56 7.961 -0.857 -3.155 1.00 0.00 H new ATOM 0 HA GLN A 56 6.544 0.889 -1.354 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.564 0.949 -4.176 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.285 2.070 -3.752 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.613 3.229 -2.214 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.701 1.877 -1.969 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.687 2.374 -2.658 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.067 3.223 -4.160 1.00 0.00 H new ATOM 883 N LEU A 57 4.151 0.677 -1.972 1.00 0.00 N ATOM 884 CA LEU A 57 2.734 0.436 -2.221 1.00 0.00 C ATOM 885 C LEU A 57 2.125 1.570 -3.039 1.00 0.00 C ATOM 886 O LEU A 57 1.257 1.343 -3.882 1.00 0.00 O ATOM 887 CB LEU A 57 1.982 0.286 -0.897 1.00 0.00 C ATOM 888 CG LEU A 57 2.282 -0.981 -0.095 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.948 -0.775 1.374 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.508 -2.165 -0.658 1.00 0.00 C ATOM 0 H LEU A 57 4.341 1.297 -1.184 1.00 0.00 H new ATOM 0 HA LEU A 57 2.642 -0.489 -2.791 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.210 1.150 -0.273 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.912 0.316 -1.104 1.00 0.00 H new ATOM 0 HG LEU A 57 3.347 -1.196 -0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.168 -1.687 1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.546 0.045 1.772 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.890 -0.535 1.476 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.734 -3.058 -0.075 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.439 -1.959 -0.606 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.796 -2.327 -1.697 1.00 0.00 H new ATOM 902 N ALA A 58 2.586 2.790 -2.785 1.00 0.00 N ATOM 903 CA ALA A 58 2.089 3.959 -3.501 1.00 0.00 C ATOM 904 C ALA A 58 2.013 3.693 -5.000 1.00 0.00 C ATOM 905 O ALA A 58 3.027 3.707 -5.696 1.00 0.00 O ATOM 906 CB ALA A 58 2.974 5.164 -3.221 1.00 0.00 C ATOM 0 H ALA A 58 3.303 2.995 -2.089 1.00 0.00 H new ATOM 0 HA ALA A 58 1.081 4.172 -3.145 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.592 6.030 -3.762 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.974 5.375 -2.152 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.992 4.952 -3.549 1.00 0.00 H new ATOM 912 N GLY A 59 0.802 3.449 -5.493 1.00 0.00 N ATOM 913 CA GLY A 59 0.616 3.182 -6.907 1.00 0.00 C ATOM 914 C GLY A 59 0.683 1.703 -7.232 1.00 0.00 C ATOM 915 O GLY A 59 1.010 1.321 -8.355 1.00 0.00 O ATOM 0 H GLY A 59 -0.053 3.432 -4.938 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.349 3.577 -7.224 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.380 3.711 -7.477 1.00 0.00 H new ATOM 919 N ALA A 60 0.374 0.867 -6.245 1.00 0.00 N ATOM 920 CA ALA A 60 0.399 -0.578 -6.431 1.00 0.00 C ATOM 921 C ALA A 60 -1.006 -1.129 -6.647 1.00 0.00 C ATOM 922 O ALA A 60 -1.996 -0.420 -6.466 1.00 0.00 O ATOM 923 CB ALA A 60 1.055 -1.253 -5.235 1.00 0.00 C ATOM 0 H ALA A 60 0.103 1.167 -5.308 1.00 0.00 H new ATOM 0 HA ALA A 60 0.986 -0.794 -7.324 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.067 -2.332 -5.388 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.077 -0.890 -5.128 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.491 -1.020 -4.332 1.00 0.00 H new ATOM 929 N VAL A 61 -1.086 -2.398 -7.036 1.00 0.00 N ATOM 930 CA VAL A 61 -2.371 -3.044 -7.276 1.00 0.00 C ATOM 931 C VAL A 61 -2.427 -4.417 -6.617 1.00 0.00 C ATOM 932 O VAL A 61 -1.487 -5.206 -6.721 1.00 0.00 O ATOM 933 CB VAL A 61 -2.648 -3.199 -8.784 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.760 -4.209 -9.021 1.00 0.00 C ATOM 935 CG2 VAL A 61 -2.997 -1.853 -9.402 1.00 0.00 C ATOM 0 H VAL A 61 -0.276 -2.999 -7.192 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.135 -2.402 -6.837 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.744 -3.571 -9.266 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.942 -4.305 -10.091 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.466 -5.176 -8.614 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.671 -3.870 -8.527 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.190 -1.981 -10.467 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.887 -1.450 -8.918 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.165 -1.163 -9.264 1.00 0.00 H new ATOM 945 N ILE A 62 -3.535 -4.697 -5.939 1.00 0.00 N ATOM 946 CA ILE A 62 -3.714 -5.976 -5.263 1.00 0.00 C ATOM 947 C ILE A 62 -4.600 -6.910 -6.081 1.00 0.00 C ATOM 948 O ILE A 62 -5.720 -6.556 -6.448 1.00 0.00 O ATOM 949 CB ILE A 62 -4.334 -5.792 -3.865 1.00 0.00 C ATOM 950 CG1 ILE A 62 -3.361 -5.051 -2.946 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.709 -7.142 -3.271 1.00 0.00 C ATOM 952 CD1 ILE A 62 -3.162 -3.599 -3.322 1.00 0.00 C ATOM 0 H ILE A 62 -4.322 -4.055 -5.843 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.724 -6.419 -5.157 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.241 -5.194 -3.961 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.729 -5.106 -1.921 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.397 -5.559 -2.966 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.146 -6.996 -2.283 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.433 -7.636 -3.919 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.817 -7.762 -3.185 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.460 -3.136 -2.628 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.765 -3.537 -4.335 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.117 -3.077 -3.274 1.00 0.00 H new ATOM 964 N SER A 63 -4.090 -8.105 -6.361 1.00 0.00 N ATOM 965 CA SER A 63 -4.834 -9.090 -7.138 1.00 0.00 C ATOM 966 C SER A 63 -4.946 -10.408 -6.378 1.00 0.00 C ATOM 967 O SER A 63 -4.078 -11.278 -6.461 1.00 0.00 O ATOM 968 CB SER A 63 -4.157 -9.323 -8.489 1.00 0.00 C ATOM 969 OG SER A 63 -4.834 -10.321 -9.234 1.00 0.00 O ATOM 0 H SER A 63 -3.165 -8.415 -6.062 1.00 0.00 H new ATOM 0 HA SER A 63 -5.838 -8.701 -7.306 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.139 -8.392 -9.055 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.120 -9.622 -8.333 1.00 0.00 H new ATOM 0 HG SER A 63 -4.382 -10.450 -10.094 1.00 0.00 H new ATOM 975 N PRO A 64 -6.041 -10.561 -5.618 1.00 0.00 N ATOM 976 CA PRO A 64 -6.294 -11.770 -4.828 1.00 0.00 C ATOM 977 C PRO A 64 -6.613 -12.978 -5.703 1.00 0.00 C ATOM 978 O PRO A 64 -7.632 -13.005 -6.393 1.00 0.00 O ATOM 979 CB PRO A 64 -7.508 -11.391 -3.977 1.00 0.00 C ATOM 980 CG PRO A 64 -8.199 -10.326 -4.758 1.00 0.00 C ATOM 981 CD PRO A 64 -7.116 -9.566 -5.471 1.00 0.00 C ATOM 0 HA PRO A 64 -5.422 -12.064 -4.244 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.160 -12.249 -3.813 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.205 -11.029 -2.995 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -8.904 -10.758 -5.468 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -8.769 -9.669 -4.102 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.455 -9.195 -6.438 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.787 -8.701 -4.896 1.00 0.00 H new ATOM 989 N SER A 65 -5.735 -13.976 -5.669 1.00 0.00 N ATOM 990 CA SER A 65 -5.922 -15.185 -6.462 1.00 0.00 C ATOM 991 C SER A 65 -7.118 -15.986 -5.957 1.00 0.00 C ATOM 992 O SER A 65 -7.648 -15.718 -4.878 1.00 0.00 O ATOM 993 CB SER A 65 -4.660 -16.049 -6.419 1.00 0.00 C ATOM 994 OG SER A 65 -3.538 -15.337 -6.911 1.00 0.00 O ATOM 0 H SER A 65 -4.888 -13.971 -5.101 1.00 0.00 H new ATOM 0 HA SER A 65 -6.115 -14.888 -7.493 1.00 0.00 H new ATOM 0 HB2 SER A 65 -4.470 -16.370 -5.395 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.812 -16.950 -7.013 1.00 0.00 H new ATOM 0 HG SER A 65 -2.744 -15.910 -6.872 1.00 0.00 H new ATOM 1000 N ASP A 66 -7.538 -16.970 -6.744 1.00 0.00 N ATOM 1001 CA ASP A 66 -8.671 -17.812 -6.378 1.00 0.00 C ATOM 1002 C ASP A 66 -8.241 -19.269 -6.234 1.00 0.00 C ATOM 1003 O ASP A 66 -9.015 -20.112 -5.783 1.00 0.00 O ATOM 1004 CB ASP A 66 -9.779 -17.696 -7.425 1.00 0.00 C ATOM 1005 CG ASP A 66 -11.147 -18.026 -6.859 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -11.209 -18.712 -5.817 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -12.155 -17.597 -7.458 1.00 0.00 O ATOM 0 H ASP A 66 -7.111 -17.204 -7.640 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.053 -17.468 -5.417 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -9.790 -16.683 -7.827 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.561 -18.367 -8.256 1.00 0.00 H new ATOM 1012 N GLU A 67 -7.002 -19.556 -6.620 1.00 0.00 N ATOM 1013 CA GLU A 67 -6.470 -20.912 -6.535 1.00 0.00 C ATOM 1014 C GLU A 67 -6.729 -21.512 -5.156 1.00 0.00 C ATOM 1015 O GLU A 67 -7.465 -22.490 -5.021 1.00 0.00 O ATOM 1016 CB GLU A 67 -4.969 -20.914 -6.831 1.00 0.00 C ATOM 1017 CG GLU A 67 -4.639 -20.761 -8.306 1.00 0.00 C ATOM 1018 CD GLU A 67 -3.252 -21.268 -8.650 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -2.743 -22.145 -7.921 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -2.676 -20.787 -9.648 1.00 0.00 O ATOM 0 H GLU A 67 -6.348 -18.869 -6.994 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.980 -21.523 -7.280 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.497 -20.104 -6.276 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.536 -21.845 -6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.377 -21.303 -8.897 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.717 -19.710 -8.585 1.00 0.00 H new ATOM 1027 N ASP A 68 -6.119 -20.920 -4.136 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.283 -21.395 -2.767 1.00 0.00 C ATOM 1029 C ASP A 68 -7.131 -20.423 -1.952 1.00 0.00 C ATOM 1030 O ASP A 68 -7.281 -19.258 -2.318 1.00 0.00 O ATOM 1031 CB ASP A 68 -4.918 -21.580 -2.102 1.00 0.00 C ATOM 1032 CG ASP A 68 -4.331 -22.955 -2.357 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -5.063 -23.953 -2.190 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -3.141 -23.032 -2.726 1.00 0.00 O ATOM 0 H ASP A 68 -5.506 -20.110 -4.231 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.796 -22.356 -2.801 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.230 -20.820 -2.473 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -5.016 -21.424 -1.028 1.00 0.00 H new ATOM 1039 N SER A 69 -7.685 -20.912 -0.847 1.00 0.00 N ATOM 1040 CA SER A 69 -8.523 -20.088 0.016 1.00 0.00 C ATOM 1041 C SER A 69 -7.805 -18.797 0.398 1.00 0.00 C ATOM 1042 O SER A 69 -8.319 -17.700 0.179 1.00 0.00 O ATOM 1043 CB SER A 69 -8.908 -20.863 1.278 1.00 0.00 C ATOM 1044 OG SER A 69 -9.421 -22.144 0.954 1.00 0.00 O ATOM 0 H SER A 69 -7.569 -21.874 -0.529 1.00 0.00 H new ATOM 0 HA SER A 69 -9.428 -19.831 -0.535 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.036 -20.970 1.923 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.654 -20.301 1.840 1.00 0.00 H new ATOM 0 HG SER A 69 -9.658 -22.619 1.778 1.00 0.00 H new ATOM 1050 N HIS A 70 -6.614 -18.936 0.970 1.00 0.00 N ATOM 1051 CA HIS A 70 -5.824 -17.781 1.383 1.00 0.00 C ATOM 1052 C HIS A 70 -4.670 -17.539 0.415 1.00 0.00 C ATOM 1053 O HIS A 70 -3.675 -18.266 0.423 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.284 -17.985 2.798 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.176 -18.820 3.665 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -7.551 -18.807 3.563 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -5.882 -19.697 4.653 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -8.064 -19.640 4.451 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -7.072 -20.193 5.126 1.00 0.00 N ATOM 0 H HIS A 70 -6.174 -19.837 1.158 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.473 -16.905 1.373 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.303 -18.457 2.739 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.142 -17.012 3.268 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -4.895 -19.958 5.004 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -9.116 -19.836 4.600 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -7.173 -20.877 5.876 1.00 0.00 H new ATOM 1068 N THR A 71 -4.808 -16.513 -0.419 1.00 0.00 N ATOM 1069 CA THR A 71 -3.778 -16.177 -1.394 1.00 0.00 C ATOM 1070 C THR A 71 -4.020 -14.797 -1.995 1.00 0.00 C ATOM 1071 O THR A 71 -5.160 -14.412 -2.254 1.00 0.00 O ATOM 1072 CB THR A 71 -3.719 -17.215 -2.530 1.00 0.00 C ATOM 1073 OG1 THR A 71 -3.918 -18.531 -2.002 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.382 -17.151 -3.253 1.00 0.00 C ATOM 0 H THR A 71 -5.623 -15.900 -0.439 1.00 0.00 H new ATOM 0 HA THR A 71 -2.827 -16.178 -0.862 1.00 0.00 H new ATOM 0 HB THR A 71 -4.511 -16.986 -3.243 1.00 0.00 H new ATOM 0 HG1 THR A 71 -3.350 -18.656 -1.213 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.364 -17.893 -4.051 1.00 0.00 H new ATOM 0 HG22 THR A 71 -2.246 -16.157 -3.679 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.577 -17.357 -2.548 1.00 0.00 H new ATOM 1082 N PHE A 72 -2.939 -14.055 -2.215 1.00 0.00 N ATOM 1083 CA PHE A 72 -3.034 -12.716 -2.785 1.00 0.00 C ATOM 1084 C PHE A 72 -1.663 -12.217 -3.232 1.00 0.00 C ATOM 1085 O PHE A 72 -0.632 -12.658 -2.722 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.636 -11.746 -1.767 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.733 -11.466 -0.600 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -1.658 -10.602 -0.731 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -2.959 -12.066 0.628 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -0.825 -10.342 0.341 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -2.130 -11.809 1.704 1.00 0.00 C ATOM 1092 CZ PHE A 72 -1.061 -10.947 1.560 1.00 0.00 C ATOM 0 H PHE A 72 -1.988 -14.358 -2.007 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.685 -12.765 -3.658 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.872 -10.807 -2.267 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.576 -12.156 -1.399 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.469 -10.126 -1.682 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.793 -12.742 0.746 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.010 -9.666 0.226 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -2.318 -12.282 2.656 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.411 -10.746 2.399 1.00 0.00 H new ATOM 1102 N THR A 73 -1.659 -11.293 -4.188 1.00 0.00 N ATOM 1103 CA THR A 73 -0.416 -10.734 -4.705 1.00 0.00 C ATOM 1104 C THR A 73 -0.418 -9.213 -4.616 1.00 0.00 C ATOM 1105 O THR A 73 -1.445 -8.569 -4.836 1.00 0.00 O ATOM 1106 CB THR A 73 -0.179 -11.151 -6.169 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.359 -10.911 -6.944 1.00 0.00 O ATOM 1108 CG2 THR A 73 0.202 -12.621 -6.258 1.00 0.00 C ATOM 0 H THR A 73 -2.503 -10.916 -4.620 1.00 0.00 H new ATOM 0 HA THR A 73 0.390 -11.130 -4.087 1.00 0.00 H new ATOM 0 HB THR A 73 0.643 -10.554 -6.565 1.00 0.00 H new ATOM 0 HG1 THR A 73 -2.134 -11.302 -6.489 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.364 -12.892 -7.301 1.00 0.00 H new ATOM 0 HG22 THR A 73 1.117 -12.795 -5.691 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.602 -13.231 -5.845 1.00 0.00 H new ATOM 1116 N VAL A 74 0.737 -8.641 -4.291 1.00 0.00 N ATOM 1117 CA VAL A 74 0.869 -7.194 -4.174 1.00 0.00 C ATOM 1118 C VAL A 74 1.793 -6.638 -5.251 1.00 0.00 C ATOM 1119 O VAL A 74 3.015 -6.713 -5.133 1.00 0.00 O ATOM 1120 CB VAL A 74 1.409 -6.789 -2.790 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.886 -5.345 -2.804 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.346 -6.998 -1.722 1.00 0.00 C ATOM 0 H VAL A 74 1.596 -9.159 -4.104 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.129 -6.774 -4.303 1.00 0.00 H new ATOM 0 HB VAL A 74 2.261 -7.425 -2.551 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.264 -5.077 -1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.682 -5.232 -3.540 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.055 -4.690 -3.064 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.744 -6.707 -0.750 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.527 -6.388 -1.954 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.058 -8.049 -1.696 1.00 0.00 H new ATOM 1132 N ASN A 75 1.201 -6.078 -6.301 1.00 0.00 N ATOM 1133 CA ASN A 75 1.971 -5.508 -7.400 1.00 0.00 C ATOM 1134 C ASN A 75 2.638 -4.203 -6.977 1.00 0.00 C ATOM 1135 O ASN A 75 2.539 -3.789 -5.823 1.00 0.00 O ATOM 1136 CB ASN A 75 1.068 -5.264 -8.611 1.00 0.00 C ATOM 1137 CG ASN A 75 0.966 -6.481 -9.510 1.00 0.00 C ATOM 1138 OD1 ASN A 75 1.779 -6.667 -10.416 1.00 0.00 O ATOM 1139 ND2 ASN A 75 -0.037 -7.316 -9.264 1.00 0.00 N ATOM 0 H ASN A 75 0.190 -6.007 -6.414 1.00 0.00 H new ATOM 0 HA ASN A 75 2.749 -6.221 -7.674 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.072 -4.985 -8.268 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.455 -4.422 -9.186 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.157 -8.151 -9.837 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -0.687 -7.122 -8.502 1.00 0.00 H new ATOM 1146 N ALA A 76 3.317 -3.559 -7.921 1.00 0.00 N ATOM 1147 CA ALA A 76 3.998 -2.299 -7.648 1.00 0.00 C ATOM 1148 C ALA A 76 4.116 -1.453 -8.911 1.00 0.00 C ATOM 1149 O ALA A 76 4.404 -1.970 -9.990 1.00 0.00 O ATOM 1150 CB ALA A 76 5.374 -2.561 -7.055 1.00 0.00 C ATOM 0 H ALA A 76 3.410 -3.889 -8.882 1.00 0.00 H new ATOM 0 HA ALA A 76 3.403 -1.742 -6.924 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.871 -1.612 -6.856 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.269 -3.118 -6.124 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.969 -3.142 -7.760 1.00 0.00 H new ATOM 1156 N ALA A 77 3.890 -0.151 -8.769 1.00 0.00 N ATOM 1157 CA ALA A 77 3.973 0.766 -9.899 1.00 0.00 C ATOM 1158 C ALA A 77 5.245 0.529 -10.706 1.00 0.00 C ATOM 1159 O ALA A 77 5.227 0.572 -11.937 1.00 0.00 O ATOM 1160 CB ALA A 77 3.914 2.207 -9.414 1.00 0.00 C ATOM 0 H ALA A 77 3.648 0.292 -7.883 1.00 0.00 H new ATOM 0 HA ALA A 77 3.120 0.578 -10.551 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.977 2.881 -10.268 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.975 2.375 -8.887 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.748 2.398 -8.739 1.00 0.00 H new ATOM 1166 N SER A 78 6.347 0.279 -10.006 1.00 0.00 N ATOM 1167 CA SER A 78 7.629 0.040 -10.659 1.00 0.00 C ATOM 1168 C SER A 78 7.562 -1.194 -11.553 1.00 0.00 C ATOM 1169 O SER A 78 7.837 -1.123 -12.750 1.00 0.00 O ATOM 1170 CB SER A 78 8.732 -0.133 -9.613 1.00 0.00 C ATOM 1171 OG SER A 78 8.384 -1.125 -8.664 1.00 0.00 O ATOM 0 H SER A 78 6.378 0.237 -8.987 1.00 0.00 H new ATOM 0 HA SER A 78 7.859 0.905 -11.281 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.665 -0.408 -10.106 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.907 0.815 -9.105 1.00 0.00 H new ATOM 0 HG SER A 78 9.106 -1.218 -8.008 1.00 0.00 H new ATOM 1177 N GLY A 79 7.193 -2.326 -10.961 1.00 0.00 N ATOM 1178 CA GLY A 79 7.096 -3.561 -11.718 1.00 0.00 C ATOM 1179 C GLY A 79 7.549 -4.767 -10.920 1.00 0.00 C ATOM 1180 O GLY A 79 8.260 -5.629 -11.435 1.00 0.00 O ATOM 0 H GLY A 79 6.960 -2.410 -9.972 1.00 0.00 H new ATOM 0 HA2 GLY A 79 6.064 -3.707 -12.038 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.701 -3.479 -12.621 1.00 0.00 H new ATOM 1184 N GLU A 80 7.137 -4.828 -9.657 1.00 0.00 N ATOM 1185 CA GLU A 80 7.508 -5.937 -8.786 1.00 0.00 C ATOM 1186 C GLU A 80 6.302 -6.435 -7.995 1.00 0.00 C ATOM 1187 O GLU A 80 5.696 -5.684 -7.230 1.00 0.00 O ATOM 1188 CB GLU A 80 8.620 -5.510 -7.825 1.00 0.00 C ATOM 1189 CG GLU A 80 9.320 -6.676 -7.148 1.00 0.00 C ATOM 1190 CD GLU A 80 10.653 -6.284 -6.541 1.00 0.00 C ATOM 1191 OE1 GLU A 80 10.653 -5.656 -5.463 1.00 0.00 O ATOM 1192 OE2 GLU A 80 11.697 -6.606 -7.147 1.00 0.00 O ATOM 0 H GLU A 80 6.547 -4.123 -9.215 1.00 0.00 H new ATOM 0 HA GLU A 80 7.871 -6.751 -9.413 1.00 0.00 H new ATOM 0 HB2 GLU A 80 9.357 -4.923 -8.373 1.00 0.00 H new ATOM 0 HB3 GLU A 80 8.198 -4.857 -7.061 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.674 -7.079 -6.368 1.00 0.00 H new ATOM 0 HG3 GLU A 80 9.477 -7.473 -7.875 1.00 0.00 H new ATOM 1199 N GLN A 81 5.959 -7.704 -8.187 1.00 0.00 N ATOM 1200 CA GLN A 81 4.824 -8.302 -7.493 1.00 0.00 C ATOM 1201 C GLN A 81 5.292 -9.161 -6.323 1.00 0.00 C ATOM 1202 O GLN A 81 6.357 -9.776 -6.379 1.00 0.00 O ATOM 1203 CB GLN A 81 3.995 -9.147 -8.462 1.00 0.00 C ATOM 1204 CG GLN A 81 2.817 -9.848 -7.803 1.00 0.00 C ATOM 1205 CD GLN A 81 2.139 -10.842 -8.725 1.00 0.00 C ATOM 1206 OE1 GLN A 81 0.951 -10.491 -9.203 1.00 0.00 O flip ATOM 1207 NE2 GLN A 81 2.678 -11.913 -9.005 1.00 0.00 N flip ATOM 0 H GLN A 81 6.450 -8.338 -8.817 1.00 0.00 H new ATOM 0 HA GLN A 81 4.203 -7.496 -7.102 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.625 -8.508 -9.263 1.00 0.00 H new ATOM 0 HB3 GLN A 81 4.641 -9.895 -8.923 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.162 -10.365 -6.908 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.090 -9.103 -7.481 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.592 -12.141 -8.614 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.210 -12.572 -9.628 1.00 0.00 H new ATOM 1216 N TYR A 82 4.491 -9.198 -5.265 1.00 0.00 N ATOM 1217 CA TYR A 82 4.825 -9.979 -4.080 1.00 0.00 C ATOM 1218 C TYR A 82 3.819 -11.107 -3.870 1.00 0.00 C ATOM 1219 O TYR A 82 2.610 -10.909 -3.993 1.00 0.00 O ATOM 1220 CB TYR A 82 4.863 -9.079 -2.844 1.00 0.00 C ATOM 1221 CG TYR A 82 6.218 -8.459 -2.588 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.997 -7.988 -3.638 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.719 -8.344 -1.297 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.236 -7.422 -3.409 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.956 -7.777 -1.059 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.711 -7.318 -2.118 1.00 0.00 C ATOM 1227 OH TYR A 82 9.944 -6.754 -1.885 1.00 0.00 O ATOM 0 H TYR A 82 3.605 -8.696 -5.203 1.00 0.00 H new ATOM 0 HA TYR A 82 5.811 -10.418 -4.232 1.00 0.00 H new ATOM 0 HB2 TYR A 82 4.126 -8.285 -2.960 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.569 -9.662 -1.971 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.628 -8.066 -4.650 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.131 -8.704 -0.466 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.830 -7.063 -4.236 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.330 -7.694 -0.049 1.00 0.00 H new ATOM 0 HH TYR A 82 10.128 -6.756 -0.922 1.00 0.00 H new ATOM 1237 N LYS A 83 4.328 -12.293 -3.553 1.00 0.00 N ATOM 1238 CA LYS A 83 3.477 -13.455 -3.323 1.00 0.00 C ATOM 1239 C LYS A 83 3.418 -13.801 -1.839 1.00 0.00 C ATOM 1240 O LYS A 83 4.380 -14.321 -1.273 1.00 0.00 O ATOM 1241 CB LYS A 83 3.995 -14.656 -4.117 1.00 0.00 C ATOM 1242 CG LYS A 83 2.905 -15.634 -4.521 1.00 0.00 C ATOM 1243 CD LYS A 83 3.303 -16.439 -5.746 1.00 0.00 C ATOM 1244 CE LYS A 83 2.088 -16.844 -6.566 1.00 0.00 C ATOM 1245 NZ LYS A 83 1.201 -15.683 -6.855 1.00 0.00 N ATOM 0 H LYS A 83 5.326 -12.475 -3.449 1.00 0.00 H new ATOM 0 HA LYS A 83 2.470 -13.210 -3.661 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.500 -14.297 -5.014 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.740 -15.182 -3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.697 -16.311 -3.692 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.984 -15.089 -4.727 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.981 -15.851 -6.365 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.847 -17.331 -5.435 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.416 -17.293 -7.504 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.525 -17.606 -6.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 0.729 -15.826 -7.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.485 -15.598 -6.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.769 -14.813 -6.891 1.00 0.00 H new ATOM 1259 N LEU A 84 2.282 -13.510 -1.214 1.00 0.00 N ATOM 1260 CA LEU A 84 2.096 -13.792 0.205 1.00 0.00 C ATOM 1261 C LEU A 84 0.846 -14.636 0.434 1.00 0.00 C ATOM 1262 O LEU A 84 0.031 -14.814 -0.472 1.00 0.00 O ATOM 1263 CB LEU A 84 1.995 -12.487 0.996 1.00 0.00 C ATOM 1264 CG LEU A 84 2.964 -11.377 0.586 1.00 0.00 C ATOM 1265 CD1 LEU A 84 2.521 -10.041 1.163 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.379 -11.711 1.036 1.00 0.00 C ATOM 0 H LEU A 84 1.476 -13.079 -1.667 1.00 0.00 H new ATOM 0 HA LEU A 84 2.961 -14.355 0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.978 -12.107 0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.156 -12.711 2.050 1.00 0.00 H new ATOM 0 HG LEU A 84 2.958 -11.300 -0.501 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.223 -9.264 0.861 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.526 -9.796 0.792 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.497 -10.105 2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.055 -10.910 0.736 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.401 -11.816 2.121 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.696 -12.646 0.574 1.00 0.00 H new ATOM 1278 N ARG A 85 0.701 -15.153 1.650 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.450 -15.977 1.997 1.00 0.00 C ATOM 1280 C ARG A 85 -0.955 -15.643 3.398 1.00 0.00 C ATOM 1281 O ARG A 85 -0.246 -15.831 4.386 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.085 -17.461 1.916 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.141 -18.381 2.505 1.00 0.00 C ATOM 1284 CD ARG A 85 -0.550 -19.723 2.908 1.00 0.00 C ATOM 1285 NE ARG A 85 -1.583 -20.725 3.152 1.00 0.00 N ATOM 1286 CZ ARG A 85 -2.230 -21.365 2.185 1.00 0.00 C ATOM 1287 NH1 ARG A 85 -1.952 -21.107 0.914 1.00 0.00 N ATOM 1288 NH2 ARG A 85 -3.158 -22.264 2.488 1.00 0.00 N ATOM 0 H ARG A 85 1.366 -15.016 2.411 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.245 -15.765 1.282 1.00 0.00 H new ATOM 0 HB2 ARG A 85 0.078 -17.730 0.872 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.858 -17.623 2.438 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.594 -17.906 3.375 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -1.937 -18.537 1.776 1.00 0.00 H new ATOM 0 HD2 ARG A 85 0.118 -20.075 2.122 1.00 0.00 H new ATOM 0 HD3 ARG A 85 0.053 -19.598 3.807 1.00 0.00 H new ATOM 0 HE ARG A 85 -1.821 -20.946 4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -1.240 -20.416 0.678 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -2.450 -21.600 0.173 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -3.375 -22.464 3.464 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -3.654 -22.755 1.744 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.185 -15.145 3.474 1.00 0.00 N ATOM 1303 CA ALA A 86 -2.786 -14.785 4.752 1.00 0.00 C ATOM 1304 C ALA A 86 -2.875 -15.995 5.676 1.00 0.00 C ATOM 1305 O ALA A 86 -2.802 -17.140 5.227 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.165 -14.181 4.536 1.00 0.00 C ATOM 0 H ALA A 86 -2.785 -14.982 2.665 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.147 -14.042 5.229 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.602 -13.917 5.499 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.078 -13.286 3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.805 -14.906 4.034 1.00 0.00 H new ATOM 1312 N THR A 87 -3.034 -15.736 6.971 1.00 0.00 N ATOM 1313 CA THR A 87 -3.131 -16.803 7.958 1.00 0.00 C ATOM 1314 C THR A 87 -4.375 -17.654 7.727 1.00 0.00 C ATOM 1315 O THR A 87 -4.333 -18.878 7.852 1.00 0.00 O ATOM 1316 CB THR A 87 -3.167 -16.241 9.392 1.00 0.00 C ATOM 1317 OG1 THR A 87 -2.796 -17.259 10.327 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.553 -15.714 9.732 1.00 0.00 C ATOM 0 H THR A 87 -3.098 -14.795 7.360 1.00 0.00 H new ATOM 0 HA THR A 87 -2.242 -17.423 7.841 1.00 0.00 H new ATOM 0 HB THR A 87 -2.457 -15.416 9.453 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.820 -16.893 11.236 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.554 -15.322 10.749 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.820 -14.918 9.037 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.279 -16.523 9.654 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.480 -16.999 7.389 1.00 0.00 N ATOM 1327 CA ASP A 88 -6.736 -17.696 7.138 1.00 0.00 C ATOM 1328 C ASP A 88 -7.530 -17.005 6.034 1.00 0.00 C ATOM 1329 O ASP A 88 -7.061 -16.043 5.427 1.00 0.00 O ATOM 1330 CB ASP A 88 -7.570 -17.764 8.418 1.00 0.00 C ATOM 1331 CG ASP A 88 -7.031 -18.778 9.407 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -6.369 -19.742 8.968 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -7.271 -18.608 10.621 1.00 0.00 O ATOM 0 H ASP A 88 -5.532 -15.986 7.282 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.502 -18.709 6.812 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -7.592 -16.780 8.887 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -8.599 -18.019 8.165 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.735 -17.504 5.778 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.594 -16.934 4.748 1.00 0.00 C ATOM 1340 C ALA A 89 -10.200 -15.612 5.208 1.00 0.00 C ATOM 1341 O ALA A 89 -10.611 -14.788 4.390 1.00 0.00 O ATOM 1342 CB ALA A 89 -10.693 -17.918 4.374 1.00 0.00 C ATOM 0 H ALA A 89 -9.138 -18.302 6.270 1.00 0.00 H new ATOM 0 HA ALA A 89 -8.982 -16.737 3.868 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.327 -17.479 3.604 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.245 -18.837 3.996 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.295 -18.143 5.255 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.251 -15.415 6.521 1.00 0.00 N ATOM 1349 CA LYS A 90 -10.805 -14.192 7.090 1.00 0.00 C ATOM 1350 C LYS A 90 -9.766 -13.076 7.099 1.00 0.00 C ATOM 1351 O LYS A 90 -10.092 -11.911 6.877 1.00 0.00 O ATOM 1352 CB LYS A 90 -11.305 -14.449 8.513 1.00 0.00 C ATOM 1353 CG LYS A 90 -11.701 -13.185 9.257 1.00 0.00 C ATOM 1354 CD LYS A 90 -10.488 -12.478 9.839 1.00 0.00 C ATOM 1355 CE LYS A 90 -10.860 -11.647 11.058 1.00 0.00 C ATOM 1356 NZ LYS A 90 -10.987 -12.485 12.282 1.00 0.00 N ATOM 0 H LYS A 90 -9.915 -16.087 7.211 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.643 -13.879 6.467 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -12.163 -15.120 8.472 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.525 -14.962 9.076 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.225 -12.512 8.579 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.396 -13.436 10.058 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.734 -13.215 10.116 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.042 -11.834 9.081 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.102 -10.880 11.220 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.802 -11.131 10.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.241 -11.882 13.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -11.727 -13.201 12.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -10.081 -12.958 12.474 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.514 -13.442 7.355 1.00 0.00 N ATOM 1371 CA GLU A 91 -7.427 -12.470 7.392 1.00 0.00 C ATOM 1372 C GLU A 91 -7.063 -12.008 5.984 1.00 0.00 C ATOM 1373 O GLU A 91 -6.491 -10.933 5.801 1.00 0.00 O ATOM 1374 CB GLU A 91 -6.198 -13.071 8.077 1.00 0.00 C ATOM 1375 CG GLU A 91 -5.124 -12.048 8.408 1.00 0.00 C ATOM 1376 CD GLU A 91 -5.421 -11.282 9.682 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -5.326 -11.884 10.772 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -5.750 -10.081 9.590 1.00 0.00 O ATOM 0 H GLU A 91 -8.227 -14.403 7.540 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.766 -11.606 7.964 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.511 -13.567 8.996 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.771 -13.838 7.431 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.164 -12.554 8.508 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.029 -11.346 7.580 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.398 -12.828 4.993 1.00 0.00 N ATOM 1386 CA ARG A 92 -7.105 -12.505 3.602 1.00 0.00 C ATOM 1387 C ARG A 92 -7.798 -11.211 3.187 1.00 0.00 C ATOM 1388 O ARG A 92 -7.189 -10.342 2.564 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.546 -13.649 2.687 1.00 0.00 C ATOM 1390 CG ARG A 92 -6.993 -13.547 1.275 1.00 0.00 C ATOM 1391 CD ARG A 92 -7.871 -12.670 0.395 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.171 -13.283 0.135 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.177 -12.649 -0.456 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -10.033 -11.390 -0.848 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.330 -13.274 -0.657 1.00 0.00 N ATOM 0 H ARG A 92 -7.872 -13.721 5.128 1.00 0.00 H new ATOM 0 HA ARG A 92 -6.028 -12.367 3.506 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.229 -14.596 3.125 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.635 -13.667 2.641 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -5.983 -13.137 1.307 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.919 -14.543 0.839 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.016 -11.703 0.877 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.363 -12.482 -0.551 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.314 -14.251 0.423 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -9.148 -10.907 -0.696 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -10.807 -10.905 -1.302 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.444 -14.242 -0.357 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.102 -12.786 -1.111 1.00 0.00 H new ATOM 1409 N GLN A 93 -9.075 -11.091 3.536 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.851 -9.903 3.198 1.00 0.00 C ATOM 1411 C GLN A 93 -9.317 -8.677 3.931 1.00 0.00 C ATOM 1412 O GLN A 93 -9.443 -7.550 3.451 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.326 -10.116 3.543 1.00 0.00 C ATOM 1414 CG GLN A 93 -11.972 -11.258 2.775 1.00 0.00 C ATOM 1415 CD GLN A 93 -13.483 -11.148 2.728 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -14.153 -11.200 3.760 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -14.029 -10.995 1.527 1.00 0.00 N ATOM 0 H GLN A 93 -9.594 -11.801 4.052 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.757 -9.732 2.126 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.416 -10.311 4.612 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.875 -9.196 3.340 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -11.581 -11.274 1.758 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -11.695 -12.205 3.238 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -13.436 -10.957 0.698 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -15.042 -10.915 1.434 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.720 -8.904 5.097 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.166 -7.818 5.896 1.00 0.00 C ATOM 1428 C HIS A 94 -6.979 -7.172 5.188 1.00 0.00 C ATOM 1429 O HIS A 94 -6.962 -5.962 4.962 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.735 -8.335 7.269 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.127 -7.281 8.143 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -7.874 -6.323 8.797 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -5.836 -7.037 8.469 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.068 -5.536 9.487 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -5.826 -5.948 9.305 1.00 0.00 N ATOM 0 H HIS A 94 -8.608 -9.830 5.509 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.943 -7.064 6.027 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.601 -8.760 7.776 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.016 -9.143 7.134 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -8.889 -6.236 8.754 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -4.974 -7.595 8.134 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.373 -4.698 10.096 1.00 0.00 H new ATOM 1444 N TRP A 95 -5.989 -7.986 4.841 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.798 -7.494 4.158 1.00 0.00 C ATOM 1446 C TRP A 95 -5.159 -6.868 2.816 1.00 0.00 C ATOM 1447 O TRP A 95 -4.903 -5.687 2.581 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.796 -8.631 3.952 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.912 -8.867 5.140 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -2.959 -9.928 5.998 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -1.853 -8.021 5.600 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -1.991 -9.794 6.964 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.299 -8.633 6.742 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.316 -6.809 5.159 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.237 -8.071 7.446 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.263 -6.252 5.858 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.268 -6.883 6.991 1.00 0.00 C ATOM 0 H TRP A 95 -5.987 -8.990 5.021 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.342 -6.727 4.784 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.340 -9.548 3.725 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.175 -8.406 3.085 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.654 -10.751 5.928 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.816 -10.452 7.723 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -1.718 -6.316 4.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.173 -8.555 8.320 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 0.158 -5.315 5.526 1.00 0.00 H new ATOM 0 HH2 TRP A 95 1.092 -6.423 7.516 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.756 -7.667 1.937 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.154 -7.191 0.618 1.00 0.00 C ATOM 1470 C VAL A 96 -6.820 -5.822 0.705 1.00 0.00 C ATOM 1471 O VAL A 96 -6.392 -4.869 0.055 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.120 -8.176 -0.067 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.613 -7.608 -1.389 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.446 -9.524 -0.275 1.00 0.00 C ATOM 0 H VAL A 96 -5.975 -8.647 2.115 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.244 -7.112 0.023 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.983 -8.323 0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.294 -8.318 -1.858 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.135 -6.668 -1.209 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.763 -7.430 -2.048 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.142 -10.208 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.565 -9.397 -0.904 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.147 -9.934 0.690 1.00 0.00 H new ATOM 1484 N SER A 97 -7.871 -5.732 1.515 1.00 0.00 N ATOM 1485 CA SER A 97 -8.599 -4.480 1.686 1.00 0.00 C ATOM 1486 C SER A 97 -7.683 -3.389 2.233 1.00 0.00 C ATOM 1487 O SER A 97 -7.434 -2.382 1.569 1.00 0.00 O ATOM 1488 CB SER A 97 -9.789 -4.682 2.626 1.00 0.00 C ATOM 1489 OG SER A 97 -10.809 -3.733 2.369 1.00 0.00 O ATOM 0 H SER A 97 -8.237 -6.511 2.063 1.00 0.00 H new ATOM 0 HA SER A 97 -8.966 -4.165 0.709 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.186 -5.690 2.503 1.00 0.00 H new ATOM 0 HB3 SER A 97 -9.458 -4.594 3.661 1.00 0.00 H new ATOM 0 HG SER A 97 -11.559 -3.885 2.982 1.00 0.00 H new ATOM 1495 N ARG A 98 -7.185 -3.598 3.447 1.00 0.00 N ATOM 1496 CA ARG A 98 -6.298 -2.632 4.085 1.00 0.00 C ATOM 1497 C ARG A 98 -5.304 -2.060 3.079 1.00 0.00 C ATOM 1498 O ARG A 98 -5.252 -0.849 2.861 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.546 -3.288 5.245 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.390 -3.462 6.497 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.693 -2.125 7.155 1.00 0.00 C ATOM 1502 NE ARG A 98 -6.981 -2.269 8.580 1.00 0.00 N ATOM 1503 CZ ARG A 98 -7.021 -1.248 9.428 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -6.794 -0.015 8.998 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -7.290 -1.459 10.710 1.00 0.00 N ATOM 0 H ARG A 98 -7.380 -4.427 4.008 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.908 -1.815 4.471 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -5.181 -4.264 4.925 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.671 -2.684 5.488 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.324 -3.963 6.241 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.866 -4.106 7.203 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.843 -1.455 7.023 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.545 -1.661 6.658 1.00 0.00 H new ATOM 0 HE ARG A 98 -7.161 -3.205 8.943 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.588 0.152 8.013 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -6.826 0.767 9.652 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.466 -2.406 11.045 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.320 -0.674 11.361 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.516 -2.939 2.468 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.522 -2.522 1.485 1.00 0.00 C ATOM 1521 C LEU A 99 -4.177 -1.751 0.343 1.00 0.00 C ATOM 1522 O LEU A 99 -3.819 -0.606 0.069 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.779 -3.740 0.934 1.00 0.00 C ATOM 1524 CG LEU A 99 -2.058 -4.609 1.965 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -2.002 -6.055 1.498 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.657 -4.076 2.226 1.00 0.00 C ATOM 0 H LEU A 99 -4.546 -3.945 2.636 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.809 -1.864 1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.494 -4.365 0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.047 -3.395 0.204 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.619 -4.572 2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.485 -6.659 2.244 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.015 -6.433 1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.465 -6.111 0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.159 -4.707 2.962 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.086 -4.082 1.297 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.721 -3.056 2.606 1.00 0.00 H new ATOM 1538 N GLN A 100 -5.138 -2.387 -0.319 1.00 0.00 N ATOM 1539 CA GLN A 100 -5.843 -1.761 -1.431 1.00 0.00 C ATOM 1540 C GLN A 100 -6.163 -0.302 -1.120 1.00 0.00 C ATOM 1541 O GLN A 100 -6.269 0.526 -2.024 1.00 0.00 O ATOM 1542 CB GLN A 100 -7.133 -2.523 -1.739 1.00 0.00 C ATOM 1543 CG GLN A 100 -6.949 -3.647 -2.746 1.00 0.00 C ATOM 1544 CD GLN A 100 -8.213 -3.940 -3.530 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -9.189 -3.192 -3.460 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -8.203 -5.035 -4.282 1.00 0.00 N ATOM 0 H GLN A 100 -5.446 -3.335 -0.105 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.193 -1.794 -2.305 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.530 -2.938 -0.813 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.877 -1.823 -2.120 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.150 -3.382 -3.438 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.632 -4.550 -2.224 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.373 -5.627 -4.311 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.026 -5.284 -4.831 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.314 0.004 0.164 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.621 1.363 0.594 1.00 0.00 C ATOM 1557 C ILE A 101 -5.347 2.174 0.805 1.00 0.00 C ATOM 1558 O ILE A 101 -5.305 3.370 0.514 1.00 0.00 O ATOM 1559 CB ILE A 101 -7.442 1.370 1.897 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.722 0.550 1.723 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.772 2.797 2.307 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -9.218 -0.075 3.008 1.00 0.00 C ATOM 0 H ILE A 101 -6.229 -0.670 0.925 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.212 1.819 -0.200 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.846 0.914 2.688 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.503 1.192 1.316 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.543 -0.237 0.991 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.352 2.786 3.230 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.848 3.353 2.467 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -8.352 3.277 1.519 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -10.128 -0.641 2.810 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.454 -0.743 3.406 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.429 0.708 3.736 1.00 0.00 H new ATOM 1574 N CYS A 102 -4.310 1.515 1.310 1.00 0.00 N ATOM 1575 CA CYS A 102 -3.033 2.174 1.558 1.00 0.00 C ATOM 1576 C CYS A 102 -2.361 2.570 0.248 1.00 0.00 C ATOM 1577 O CYS A 102 -1.718 3.617 0.158 1.00 0.00 O ATOM 1578 CB CYS A 102 -2.110 1.256 2.361 1.00 0.00 C ATOM 1579 SG CYS A 102 -1.123 0.130 1.347 1.00 0.00 S ATOM 0 H CYS A 102 -4.329 0.525 1.556 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.225 3.079 2.134 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -1.439 1.869 2.962 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -2.713 0.669 3.055 1.00 0.00 H new ATOM 0 HG CYS A 102 -1.899 -0.495 0.512 1.00 0.00 H new ATOM 1585 N THR A 103 -2.513 1.726 -0.768 1.00 0.00 N ATOM 1586 CA THR A 103 -1.919 1.987 -2.073 1.00 0.00 C ATOM 1587 C THR A 103 -2.561 3.199 -2.737 1.00 0.00 C ATOM 1588 O THR A 103 -1.900 3.942 -3.463 1.00 0.00 O ATOM 1589 CB THR A 103 -2.059 0.770 -3.007 1.00 0.00 C ATOM 1590 OG1 THR A 103 -1.177 0.907 -4.126 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.492 0.628 -3.499 1.00 0.00 C ATOM 0 H THR A 103 -3.042 0.856 -0.712 1.00 0.00 H new ATOM 0 HA THR A 103 -0.861 2.187 -1.904 1.00 0.00 H new ATOM 0 HB THR A 103 -1.794 -0.125 -2.444 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.460 1.537 -3.902 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.567 -0.238 -4.157 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.158 0.495 -2.646 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.779 1.526 -4.047 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.851 3.394 -2.484 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.581 4.518 -3.058 1.00 0.00 C ATOM 1601 C GLN A 104 -4.460 5.754 -2.174 1.00 0.00 C ATOM 1602 O GLN A 104 -3.994 6.804 -2.618 1.00 0.00 O ATOM 1603 CB GLN A 104 -6.055 4.153 -3.246 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.922 5.327 -3.670 1.00 0.00 C ATOM 1605 CD GLN A 104 -8.311 4.899 -4.104 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -9.284 5.073 -3.370 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -8.410 4.336 -5.303 1.00 0.00 N ATOM 0 H GLN A 104 -4.412 2.788 -1.885 1.00 0.00 H new ATOM 0 HA GLN A 104 -4.143 4.745 -4.030 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.133 3.365 -3.995 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.442 3.745 -2.312 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -7.005 6.031 -2.842 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.436 5.856 -4.490 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -7.577 4.211 -5.878 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -9.319 4.028 -5.648 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.882 5.624 -0.920 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.820 6.731 0.027 1.00 0.00 C ATOM 1618 C HIS A 105 -3.472 7.442 -0.055 1.00 0.00 C ATOM 1619 O HIS A 105 -3.358 8.619 0.288 1.00 0.00 O ATOM 1620 CB HIS A 105 -5.057 6.226 1.451 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.473 7.302 2.406 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -6.635 8.030 2.261 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -4.875 7.771 3.526 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -6.733 8.901 3.249 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -5.677 8.765 4.031 1.00 0.00 N ATOM 0 H HIS A 105 -5.271 4.763 -0.536 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.603 7.443 -0.233 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.825 5.453 1.430 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -4.144 5.758 1.819 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.941 7.427 3.945 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -7.539 9.605 3.393 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -5.488 9.309 4.873 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.454 6.719 -0.512 1.00 0.00 N ATOM 1635 CA HIS A 106 -1.114 7.280 -0.639 1.00 0.00 C ATOM 1636 C HIS A 106 -0.896 7.854 -2.036 1.00 0.00 C ATOM 1637 O HIS A 106 -0.705 9.060 -2.201 1.00 0.00 O ATOM 1638 CB HIS A 106 -0.061 6.213 -0.343 1.00 0.00 C ATOM 1639 CG HIS A 106 0.246 6.061 1.115 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.529 6.062 1.619 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.574 5.905 2.181 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.486 5.912 2.930 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.221 5.815 3.297 1.00 0.00 N ATOM 0 H HIS A 106 -2.532 5.744 -0.800 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.015 8.088 0.086 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.406 5.256 -0.735 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.857 6.463 -0.875 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.653 5.860 2.158 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.340 5.875 3.590 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -0.111 5.693 4.254 1.00 0.00 H new ATOM 1652 N THR A 107 -0.924 6.983 -3.039 1.00 0.00 N ATOM 1653 CA THR A 107 -0.727 7.402 -4.421 1.00 0.00 C ATOM 1654 C THR A 107 -1.507 8.676 -4.726 1.00 0.00 C ATOM 1655 O THR A 107 -1.074 9.502 -5.528 1.00 0.00 O ATOM 1656 CB THR A 107 -1.157 6.301 -5.409 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.450 6.448 -6.645 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.656 6.361 -5.666 1.00 0.00 C ATOM 0 H THR A 107 -1.081 5.982 -2.920 1.00 0.00 H new ATOM 0 HA THR A 107 0.339 7.594 -4.544 1.00 0.00 H new ATOM 0 HB THR A 107 -0.918 5.334 -4.968 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.728 5.743 -7.267 1.00 0.00 H new ATOM 0 HG21 THR A 107 -2.937 5.574 -6.366 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.192 6.219 -4.728 1.00 0.00 H new ATOM 0 HG23 THR A 107 -2.914 7.332 -6.088 1.00 0.00 H new ATOM 1666 N GLU A 108 -2.659 8.828 -4.080 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.499 10.002 -4.283 1.00 0.00 C ATOM 1668 C GLU A 108 -2.978 11.189 -3.478 1.00 0.00 C ATOM 1669 O GLU A 108 -2.978 12.324 -3.956 1.00 0.00 O ATOM 1670 CB GLU A 108 -4.945 9.697 -3.885 1.00 0.00 C ATOM 1671 CG GLU A 108 -5.818 10.936 -3.767 1.00 0.00 C ATOM 1672 CD GLU A 108 -6.300 11.439 -5.114 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -7.264 10.857 -5.654 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -5.713 12.415 -5.628 1.00 0.00 O ATOM 0 H GLU A 108 -3.031 8.153 -3.412 1.00 0.00 H new ATOM 0 HA GLU A 108 -3.468 10.261 -5.341 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.382 9.024 -4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.947 9.169 -2.931 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.679 10.711 -3.138 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -5.256 11.726 -3.268 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.535 10.919 -2.255 1.00 0.00 N ATOM 1682 CA ALA A 109 -2.010 11.964 -1.384 1.00 0.00 C ATOM 1683 C ALA A 109 -0.763 12.604 -1.985 1.00 0.00 C ATOM 1684 O ALA A 109 -0.535 13.804 -1.833 1.00 0.00 O ATOM 1685 CB ALA A 109 -1.702 11.397 -0.006 1.00 0.00 C ATOM 0 H ALA A 109 -2.529 9.985 -1.844 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.772 12.737 -1.285 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.311 12.188 0.634 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.614 10.993 0.433 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.960 10.603 -0.097 1.00 0.00 H new ATOM 1691 N ILE A 110 0.041 11.796 -2.668 1.00 0.00 N ATOM 1692 CA ILE A 110 1.264 12.284 -3.292 1.00 0.00 C ATOM 1693 C ILE A 110 0.960 13.355 -4.334 1.00 0.00 C ATOM 1694 O ILE A 110 0.378 13.071 -5.379 1.00 0.00 O ATOM 1695 CB ILE A 110 2.050 11.141 -3.961 1.00 0.00 C ATOM 1696 CG1 ILE A 110 2.310 10.016 -2.958 1.00 0.00 C ATOM 1697 CG2 ILE A 110 3.361 11.663 -4.532 1.00 0.00 C ATOM 1698 CD1 ILE A 110 2.408 8.648 -3.596 1.00 0.00 C ATOM 0 H ILE A 110 -0.133 10.800 -2.803 1.00 0.00 H new ATOM 0 HA ILE A 110 1.873 12.716 -2.498 1.00 0.00 H new ATOM 0 HB ILE A 110 1.453 10.740 -4.780 1.00 0.00 H new ATOM 0 HG12 ILE A 110 3.236 10.225 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 110 1.509 10.007 -2.219 1.00 0.00 H new ATOM 0 HG21 ILE A 110 3.905 10.844 -5.001 1.00 0.00 H new ATOM 0 HG22 ILE A 110 3.153 12.433 -5.275 1.00 0.00 H new ATOM 0 HG23 ILE A 110 3.965 12.086 -3.729 1.00 0.00 H new ATOM 0 HD11 ILE A 110 2.593 7.900 -2.825 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.474 8.418 -4.109 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.228 8.639 -4.314 1.00 0.00 H new ATOM 1710 N GLY A 111 1.361 14.589 -4.041 1.00 0.00 N ATOM 1711 CA GLY A 111 1.124 15.684 -4.963 1.00 0.00 C ATOM 1712 C GLY A 111 2.162 16.782 -4.838 1.00 0.00 C ATOM 1713 O GLY A 111 3.360 16.533 -4.977 1.00 0.00 O ATOM 0 H GLY A 111 1.845 14.849 -3.182 1.00 0.00 H new ATOM 0 HA2 GLY A 111 1.125 15.302 -5.984 1.00 0.00 H new ATOM 0 HA3 GLY A 111 0.134 16.102 -4.780 1.00 0.00 H new ATOM 1717 N LYS A 112 1.703 18.001 -4.577 1.00 0.00 N ATOM 1718 CA LYS A 112 2.599 19.142 -4.434 1.00 0.00 C ATOM 1719 C LYS A 112 3.901 18.730 -3.755 1.00 0.00 C ATOM 1720 O LYS A 112 3.889 18.125 -2.683 1.00 0.00 O ATOM 1721 CB LYS A 112 1.920 20.252 -3.627 1.00 0.00 C ATOM 1722 CG LYS A 112 1.067 21.182 -4.471 1.00 0.00 C ATOM 1723 CD LYS A 112 0.615 22.398 -3.679 1.00 0.00 C ATOM 1724 CE LYS A 112 -0.593 22.080 -2.811 1.00 0.00 C ATOM 1725 NZ LYS A 112 -1.860 22.110 -3.593 1.00 0.00 N ATOM 0 H LYS A 112 0.715 18.224 -4.460 1.00 0.00 H new ATOM 0 HA LYS A 112 2.832 19.516 -5.431 1.00 0.00 H new ATOM 0 HB2 LYS A 112 1.296 19.800 -2.856 1.00 0.00 H new ATOM 0 HB3 LYS A 112 2.684 20.837 -3.116 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.634 21.506 -5.344 1.00 0.00 H new ATOM 0 HG3 LYS A 112 0.195 20.642 -4.840 1.00 0.00 H new ATOM 0 HD2 LYS A 112 1.434 22.749 -3.051 1.00 0.00 H new ATOM 0 HD3 LYS A 112 0.369 23.209 -4.364 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -0.467 21.096 -2.360 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -0.653 22.799 -1.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -2.660 21.888 -2.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -1.993 23.057 -4.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -1.813 21.406 -4.357 1.00 0.00 H new ATOM 1739 N ASN A 113 5.023 19.062 -4.385 1.00 0.00 N ATOM 1740 CA ASN A 113 6.334 18.726 -3.841 1.00 0.00 C ATOM 1741 C ASN A 113 6.893 19.882 -3.017 1.00 0.00 C ATOM 1742 O ASN A 113 7.425 20.847 -3.565 1.00 0.00 O ATOM 1743 CB ASN A 113 7.303 18.374 -4.971 1.00 0.00 C ATOM 1744 CG ASN A 113 7.279 16.897 -5.315 1.00 0.00 C ATOM 1745 OD1 ASN A 113 6.430 16.150 -4.829 1.00 0.00 O ATOM 1746 ND2 ASN A 113 8.213 16.471 -6.157 1.00 0.00 N ATOM 0 H ASN A 113 5.051 19.563 -5.273 1.00 0.00 H new ATOM 0 HA ASN A 113 6.219 17.861 -3.188 1.00 0.00 H new ATOM 0 HB2 ASN A 113 7.049 18.955 -5.858 1.00 0.00 H new ATOM 0 HB3 ASN A 113 8.314 18.660 -4.681 1.00 0.00 H new ATOM 0 HD21 ASN A 113 8.247 15.488 -6.426 1.00 0.00 H new ATOM 0 HD22 ASN A 113 8.897 17.127 -6.535 1.00 0.00 H new ATOM 1753 N ASN A 114 6.768 19.777 -1.698 1.00 0.00 N ATOM 1754 CA ASN A 114 7.261 20.813 -0.799 1.00 0.00 C ATOM 1755 C ASN A 114 8.561 20.379 -0.128 1.00 0.00 C ATOM 1756 O ASN A 114 8.555 19.890 1.001 1.00 0.00 O ATOM 1757 CB ASN A 114 6.210 21.138 0.264 1.00 0.00 C ATOM 1758 CG ASN A 114 5.005 21.856 -0.314 1.00 0.00 C ATOM 1759 OD1 ASN A 114 4.869 21.981 -1.531 1.00 0.00 O ATOM 1760 ND2 ASN A 114 4.126 22.333 0.559 1.00 0.00 N ATOM 0 H ASN A 114 6.329 18.985 -1.228 1.00 0.00 H new ATOM 0 HA ASN A 114 7.459 21.707 -1.390 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.884 20.215 0.743 1.00 0.00 H new ATOM 0 HB3 ASN A 114 6.661 21.757 1.039 1.00 0.00 H new ATOM 0 HD21 ASN A 114 3.297 22.827 0.230 1.00 0.00 H new ATOM 0 HD22 ASN A 114 4.280 22.206 1.559 1.00 0.00 H new ATOM 1767 N SER A 115 9.673 20.561 -0.833 1.00 0.00 N ATOM 1768 CA SER A 115 10.981 20.185 -0.307 1.00 0.00 C ATOM 1769 C SER A 115 11.149 20.670 1.129 1.00 0.00 C ATOM 1770 O SER A 115 11.456 19.889 2.028 1.00 0.00 O ATOM 1771 CB SER A 115 12.092 20.762 -1.186 1.00 0.00 C ATOM 1772 OG SER A 115 13.370 20.474 -0.647 1.00 0.00 O ATOM 0 H SER A 115 9.695 20.966 -1.769 1.00 0.00 H new ATOM 0 HA SER A 115 11.049 19.097 -0.314 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.016 20.348 -2.192 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.966 21.841 -1.275 1.00 0.00 H new ATOM 0 HG SER A 115 14.063 20.852 -1.228 1.00 0.00 H new ATOM 1778 N GLY A 116 10.946 21.968 1.336 1.00 0.00 N ATOM 1779 CA GLY A 116 11.080 22.537 2.665 1.00 0.00 C ATOM 1780 C GLY A 116 12.313 23.409 2.800 1.00 0.00 C ATOM 1781 O GLY A 116 13.362 22.969 3.271 1.00 0.00 O ATOM 0 H GLY A 116 10.691 22.635 0.608 1.00 0.00 H new ATOM 0 HA2 GLY A 116 10.194 23.128 2.895 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.126 21.732 3.399 1.00 0.00 H new ATOM 1785 N PRO A 117 12.194 24.677 2.379 1.00 0.00 N ATOM 1786 CA PRO A 117 13.298 25.639 2.445 1.00 0.00 C ATOM 1787 C PRO A 117 13.631 26.043 3.877 1.00 0.00 C ATOM 1788 O PRO A 117 14.501 26.882 4.110 1.00 0.00 O ATOM 1789 CB PRO A 117 12.768 26.842 1.661 1.00 0.00 C ATOM 1790 CG PRO A 117 11.285 26.740 1.767 1.00 0.00 C ATOM 1791 CD PRO A 117 10.973 25.269 1.807 1.00 0.00 C ATOM 0 HA PRO A 117 14.223 25.225 2.044 1.00 0.00 H new ATOM 0 HB2 PRO A 117 13.131 27.780 2.081 1.00 0.00 H new ATOM 0 HB3 PRO A 117 13.094 26.811 0.621 1.00 0.00 H new ATOM 0 HG2 PRO A 117 10.923 27.240 2.665 1.00 0.00 H new ATOM 0 HG3 PRO A 117 10.799 27.219 0.917 1.00 0.00 H new ATOM 0 HD2 PRO A 117 10.098 25.060 2.423 1.00 0.00 H new ATOM 0 HD3 PRO A 117 10.763 24.875 0.812 1.00 0.00 H new ATOM 1799 N SER A 118 12.934 25.439 4.835 1.00 0.00 N ATOM 1800 CA SER A 118 13.154 25.738 6.245 1.00 0.00 C ATOM 1801 C SER A 118 12.991 24.484 7.098 1.00 0.00 C ATOM 1802 O SER A 118 11.997 23.766 6.982 1.00 0.00 O ATOM 1803 CB SER A 118 12.180 26.820 6.716 1.00 0.00 C ATOM 1804 OG SER A 118 10.838 26.443 6.464 1.00 0.00 O ATOM 0 H SER A 118 12.212 24.740 4.660 1.00 0.00 H new ATOM 0 HA SER A 118 14.175 26.103 6.359 1.00 0.00 H new ATOM 0 HB2 SER A 118 12.317 26.997 7.783 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.399 27.758 6.206 1.00 0.00 H new ATOM 0 HG SER A 118 10.765 25.466 6.478 1.00 0.00 H new ATOM 1810 N SER A 119 13.973 24.227 7.955 1.00 0.00 N ATOM 1811 CA SER A 119 13.942 23.057 8.826 1.00 0.00 C ATOM 1812 C SER A 119 14.389 23.420 10.239 1.00 0.00 C ATOM 1813 O SER A 119 14.799 24.550 10.501 1.00 0.00 O ATOM 1814 CB SER A 119 14.837 21.952 8.263 1.00 0.00 C ATOM 1815 OG SER A 119 16.199 22.345 8.271 1.00 0.00 O ATOM 0 H SER A 119 14.801 24.813 8.065 1.00 0.00 H new ATOM 0 HA SER A 119 12.915 22.695 8.871 1.00 0.00 H new ATOM 0 HB2 SER A 119 14.714 21.044 8.853 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.530 21.714 7.245 1.00 0.00 H new ATOM 0 HG SER A 119 16.751 21.621 7.908 1.00 0.00 H new ATOM 1821 N GLY A 120 14.307 22.451 11.146 1.00 0.00 N ATOM 1822 CA GLY A 120 14.706 22.687 12.521 1.00 0.00 C ATOM 1823 C GLY A 120 13.986 23.869 13.140 1.00 0.00 C ATOM 1824 O GLY A 120 13.932 24.001 14.362 1.00 0.00 O ATOM 0 H GLY A 120 13.971 21.507 10.953 1.00 0.00 H new ATOM 0 HA2 GLY A 120 14.506 21.794 13.112 1.00 0.00 H new ATOM 0 HA3 GLY A 120 15.781 22.860 12.559 1.00 0.00 H new TER 1828 GLY A 120