USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=30 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 13 TYR OH : rot -171:sc= 0.348 USER MOD Set 1.2: A 43 ASN : amide:sc= -0.311 K(o=0.037,f=-1.8!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 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 9 ASN : amide:sc= -0.71 X(o=-0.71,f=-1.2!) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -105:sc= -1.24 (180deg=-4.07!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 30:sc= -2.13 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.3 K(o=-1.3,f=-2.3) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00949 USER MOD Single : A 25 GLN : amide:sc= -1.43 K(o=-1.4,f=-0.3) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.105 K(o=-0.11,f=-2.2!) USER MOD Single : A 33 ASN : amide:sc= -1.37! C(o=-1.4!,f=-6.7!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 46 SER OG : rot -31:sc= 0.797 USER MOD Single : A 48 ASN : amide:sc= -0.0101 K(o=-0.01,f=-1.5) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) 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= -6.54! C(o=-6.5!,f=-6.4!) USER MOD Single : A 71 THR OG1 : rot -51:sc= -0.0692 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.458 X(o=-0.46,f=-0.9) USER MOD Single : A 94 HIS : no HE2:sc= -0.205 X(o=-0.2,f=-0.62) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.2 K(o=-0.2,f=-2.2!) USER MOD Single : A 102 CYS SG : rot 142:sc= -0.901 USER MOD Single : A 103 THR OG1 : rot 36:sc= 1.41 USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 105 HIS : no HD1:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 106 HIS : no HD1:sc= -2.6 K(o=-2.6,f=-3.3) USER MOD Single : A 107 THR OG1 : rot -36:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -0.966 K(o=-0.97,f=-2.4!) USER MOD Single : A 114 ASN : amide:sc= -1.64 K(o=-1.6,f=-4.5!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 31:sc= 0.145 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.067 10.930 9.418 1.00 0.00 N ATOM 2 CA GLY A 1 -21.096 9.817 10.349 1.00 0.00 C ATOM 3 C GLY A 1 -19.713 9.268 10.639 1.00 0.00 C ATOM 4 O GLY A 1 -19.145 9.526 11.700 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.036 11.269 9.252 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.493 11.701 9.816 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.651 10.618 8.517 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.559 10.139 11.282 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.721 9.022 9.941 1.00 0.00 H new ATOM 8 N SER A 2 -19.170 8.508 9.693 1.00 0.00 N ATOM 9 CA SER A 2 -17.847 7.916 9.854 1.00 0.00 C ATOM 10 C SER A 2 -16.801 8.701 9.069 1.00 0.00 C ATOM 11 O SER A 2 -16.929 8.889 7.859 1.00 0.00 O ATOM 12 CB SER A 2 -17.858 6.457 9.394 1.00 0.00 C ATOM 13 OG SER A 2 -16.620 5.826 9.670 1.00 0.00 O ATOM 0 H SER A 2 -19.626 8.288 8.807 1.00 0.00 H new ATOM 0 HA SER A 2 -17.586 7.954 10.912 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.663 5.920 9.896 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.063 6.411 8.324 1.00 0.00 H new ATOM 0 HG SER A 2 -16.653 4.894 9.368 1.00 0.00 H new ATOM 19 N SER A 3 -15.766 9.158 9.766 1.00 0.00 N ATOM 20 CA SER A 3 -14.699 9.927 9.136 1.00 0.00 C ATOM 21 C SER A 3 -13.459 9.063 8.924 1.00 0.00 C ATOM 22 O SER A 3 -12.965 8.930 7.805 1.00 0.00 O ATOM 23 CB SER A 3 -14.345 11.145 9.991 1.00 0.00 C ATOM 24 OG SER A 3 -15.261 12.204 9.773 1.00 0.00 O ATOM 0 H SER A 3 -15.643 9.009 10.768 1.00 0.00 H new ATOM 0 HA SER A 3 -15.055 10.266 8.163 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.349 10.867 11.045 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.335 11.479 9.754 1.00 0.00 H new ATOM 0 HG SER A 3 -15.014 12.970 10.332 1.00 0.00 H new ATOM 30 N GLY A 4 -12.962 8.476 10.008 1.00 0.00 N ATOM 31 CA GLY A 4 -11.784 7.632 9.921 1.00 0.00 C ATOM 32 C GLY A 4 -11.299 7.172 11.281 1.00 0.00 C ATOM 33 O GLY A 4 -12.101 6.898 12.174 1.00 0.00 O ATOM 0 H GLY A 4 -13.354 8.570 10.945 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.009 6.761 9.305 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.985 8.179 9.420 1.00 0.00 H new ATOM 37 N SER A 5 -9.982 7.084 11.440 1.00 0.00 N ATOM 38 CA SER A 5 -9.391 6.648 12.699 1.00 0.00 C ATOM 39 C SER A 5 -7.960 7.159 12.833 1.00 0.00 C ATOM 40 O SER A 5 -7.361 7.622 11.862 1.00 0.00 O ATOM 41 CB SER A 5 -9.411 5.122 12.795 1.00 0.00 C ATOM 42 OG SER A 5 -8.702 4.534 11.717 1.00 0.00 O ATOM 0 H SER A 5 -9.304 7.309 10.712 1.00 0.00 H new ATOM 0 HA SER A 5 -9.984 7.064 13.513 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.968 4.808 13.740 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.442 4.768 12.793 1.00 0.00 H new ATOM 0 HG SER A 5 -8.728 3.558 11.802 1.00 0.00 H new ATOM 48 N SER A 6 -7.417 7.071 14.043 1.00 0.00 N ATOM 49 CA SER A 6 -6.057 7.527 14.307 1.00 0.00 C ATOM 50 C SER A 6 -5.055 6.784 13.429 1.00 0.00 C ATOM 51 O SER A 6 -4.150 7.387 12.854 1.00 0.00 O ATOM 52 CB SER A 6 -5.707 7.328 15.782 1.00 0.00 C ATOM 53 OG SER A 6 -6.664 7.949 16.623 1.00 0.00 O ATOM 0 H SER A 6 -7.898 6.688 14.857 1.00 0.00 H new ATOM 0 HA SER A 6 -6.004 8.589 14.069 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.658 6.263 16.007 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.719 7.742 15.983 1.00 0.00 H new ATOM 0 HG SER A 6 -6.418 7.805 17.561 1.00 0.00 H new ATOM 59 N GLY A 7 -5.225 5.469 13.331 1.00 0.00 N ATOM 60 CA GLY A 7 -4.329 4.663 12.522 1.00 0.00 C ATOM 61 C GLY A 7 -3.804 3.453 13.269 1.00 0.00 C ATOM 62 O GLY A 7 -3.287 3.577 14.379 1.00 0.00 O ATOM 0 H GLY A 7 -5.967 4.947 13.797 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.852 4.333 11.625 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.490 5.276 12.194 1.00 0.00 H new ATOM 66 N GLU A 8 -3.939 2.279 12.659 1.00 0.00 N ATOM 67 CA GLU A 8 -3.477 1.041 13.276 1.00 0.00 C ATOM 68 C GLU A 8 -2.658 0.214 12.288 1.00 0.00 C ATOM 69 O GLU A 8 -3.211 -0.454 11.415 1.00 0.00 O ATOM 70 CB GLU A 8 -4.666 0.222 13.781 1.00 0.00 C ATOM 71 CG GLU A 8 -5.210 0.699 15.117 1.00 0.00 C ATOM 72 CD GLU A 8 -6.070 -0.344 15.804 1.00 0.00 C ATOM 73 OE1 GLU A 8 -5.520 -1.384 16.222 1.00 0.00 O ATOM 74 OE2 GLU A 8 -7.293 -0.121 15.921 1.00 0.00 O ATOM 0 H GLU A 8 -4.364 2.160 11.739 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.840 1.302 14.121 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -5.464 0.260 13.039 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.365 -0.822 13.873 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -4.378 0.965 15.769 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -5.797 1.604 14.963 1.00 0.00 H new ATOM 81 N ASN A 9 -1.338 0.266 12.433 1.00 0.00 N ATOM 82 CA ASN A 9 -0.443 -0.477 11.554 1.00 0.00 C ATOM 83 C ASN A 9 -0.853 -1.945 11.475 1.00 0.00 C ATOM 84 O ASN A 9 -1.118 -2.583 12.494 1.00 0.00 O ATOM 85 CB ASN A 9 1.000 -0.365 12.049 1.00 0.00 C ATOM 86 CG ASN A 9 1.090 -0.303 13.561 1.00 0.00 C ATOM 87 OD1 ASN A 9 0.240 -0.845 14.268 1.00 0.00 O ATOM 88 ND2 ASN A 9 2.124 0.361 14.066 1.00 0.00 N ATOM 0 H ASN A 9 -0.865 0.815 13.151 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.512 -0.045 10.556 1.00 0.00 H new ATOM 0 HB2 ASN A 9 1.572 -1.220 11.689 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.459 0.528 11.624 1.00 0.00 H new ATOM 0 HD21 ASN A 9 2.237 0.437 15.077 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.805 0.795 13.443 1.00 0.00 H new ATOM 95 N VAL A 10 -0.902 -2.475 10.257 1.00 0.00 N ATOM 96 CA VAL A 10 -1.278 -3.867 10.043 1.00 0.00 C ATOM 97 C VAL A 10 -0.045 -4.751 9.889 1.00 0.00 C ATOM 98 O VAL A 10 0.877 -4.424 9.143 1.00 0.00 O ATOM 99 CB VAL A 10 -2.167 -4.024 8.796 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.697 -5.446 8.693 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.311 -3.021 8.829 1.00 0.00 C ATOM 0 H VAL A 10 -0.686 -1.961 9.403 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.841 -4.181 10.922 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.562 -3.823 7.912 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.323 -5.538 7.806 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.861 -6.142 8.620 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.287 -5.679 9.579 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.930 -3.145 7.940 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.917 -3.189 9.719 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.907 -2.009 8.851 1.00 0.00 H new ATOM 111 N TYR A 11 -0.037 -5.874 10.599 1.00 0.00 N ATOM 112 CA TYR A 11 1.084 -6.805 10.543 1.00 0.00 C ATOM 113 C TYR A 11 0.611 -8.239 10.762 1.00 0.00 C ATOM 114 O TYR A 11 -0.501 -8.474 11.233 1.00 0.00 O ATOM 115 CB TYR A 11 2.134 -6.437 11.593 1.00 0.00 C ATOM 116 CG TYR A 11 1.554 -5.779 12.824 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.430 -6.302 13.451 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.129 -4.633 13.360 1.00 0.00 C ATOM 119 CE1 TYR A 11 -0.104 -5.704 14.577 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.603 -4.029 14.486 1.00 0.00 C ATOM 121 CZ TYR A 11 0.487 -4.568 15.090 1.00 0.00 C ATOM 122 OH TYR A 11 -0.041 -3.968 16.211 1.00 0.00 O ATOM 0 H TYR A 11 -0.794 -6.161 11.220 1.00 0.00 H new ATOM 0 HA TYR A 11 1.532 -6.736 9.552 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.669 -7.339 11.891 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.866 -5.766 11.143 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.035 -7.191 13.052 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.002 -4.207 12.888 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -0.978 -6.124 15.052 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.063 -3.140 14.891 1.00 0.00 H new ATOM 0 HH TYR A 11 0.494 -3.180 16.443 1.00 0.00 H new ATOM 132 N GLY A 12 1.467 -9.197 10.417 1.00 0.00 N ATOM 133 CA GLY A 12 1.121 -10.596 10.583 1.00 0.00 C ATOM 134 C GLY A 12 2.091 -11.522 9.875 1.00 0.00 C ATOM 135 O GLY A 12 2.789 -11.109 8.949 1.00 0.00 O ATOM 0 H GLY A 12 2.394 -9.028 10.026 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.102 -10.839 11.645 1.00 0.00 H new ATOM 0 HA3 GLY A 12 0.115 -10.766 10.199 1.00 0.00 H new ATOM 139 N TYR A 13 2.135 -12.775 10.312 1.00 0.00 N ATOM 140 CA TYR A 13 3.030 -13.760 9.717 1.00 0.00 C ATOM 141 C TYR A 13 2.424 -14.350 8.447 1.00 0.00 C ATOM 142 O TYR A 13 1.561 -15.227 8.506 1.00 0.00 O ATOM 143 CB TYR A 13 3.332 -14.877 10.718 1.00 0.00 C ATOM 144 CG TYR A 13 4.399 -14.515 11.726 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.213 -13.464 12.615 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.593 -15.223 11.788 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.185 -13.128 13.538 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.570 -14.895 12.708 1.00 0.00 C ATOM 149 CZ TYR A 13 6.362 -13.847 13.581 1.00 0.00 C ATOM 150 OH TYR A 13 7.333 -13.518 14.498 1.00 0.00 O ATOM 0 H TYR A 13 1.562 -13.133 11.076 1.00 0.00 H new ATOM 0 HA TYR A 13 3.960 -13.256 9.454 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.416 -15.135 11.249 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.646 -15.767 10.173 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.293 -12.900 12.584 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.760 -16.043 11.106 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.024 -12.308 14.222 1.00 0.00 H new ATOM 0 HE2 TYR A 13 7.492 -15.456 12.744 1.00 0.00 H new ATOM 0 HH TYR A 13 8.148 -14.028 14.309 1.00 0.00 H new ATOM 160 N LEU A 14 2.882 -13.863 7.299 1.00 0.00 N ATOM 161 CA LEU A 14 2.386 -14.341 6.013 1.00 0.00 C ATOM 162 C LEU A 14 3.413 -15.242 5.335 1.00 0.00 C ATOM 163 O LEU A 14 4.601 -15.193 5.650 1.00 0.00 O ATOM 164 CB LEU A 14 2.048 -13.159 5.103 1.00 0.00 C ATOM 165 CG LEU A 14 0.954 -12.216 5.606 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.100 -10.842 4.971 1.00 0.00 C ATOM 167 CD2 LEU A 14 -0.423 -12.796 5.317 1.00 0.00 C ATOM 0 H LEU A 14 3.596 -13.138 7.232 1.00 0.00 H new ATOM 0 HA LEU A 14 1.482 -14.923 6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.956 -12.578 4.944 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.745 -13.549 4.131 1.00 0.00 H new ATOM 0 HG LEU A 14 1.062 -12.108 6.685 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.313 -10.185 5.341 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.073 -10.424 5.229 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.019 -10.931 3.888 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.190 -12.112 5.681 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.541 -12.934 4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.526 -13.758 5.820 1.00 0.00 H new ATOM 179 N MET A 15 2.946 -16.064 4.401 1.00 0.00 N ATOM 180 CA MET A 15 3.825 -16.974 3.675 1.00 0.00 C ATOM 181 C MET A 15 4.307 -16.341 2.373 1.00 0.00 C ATOM 182 O MET A 15 3.528 -16.148 1.439 1.00 0.00 O ATOM 183 CB MET A 15 3.101 -18.289 3.379 1.00 0.00 C ATOM 184 CG MET A 15 2.901 -19.162 4.607 1.00 0.00 C ATOM 185 SD MET A 15 2.814 -20.917 4.205 1.00 0.00 S ATOM 186 CE MET A 15 4.479 -21.439 4.609 1.00 0.00 C ATOM 0 H MET A 15 1.964 -16.119 4.129 1.00 0.00 H new ATOM 0 HA MET A 15 4.693 -17.179 4.302 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.129 -18.068 2.938 1.00 0.00 H new ATOM 0 HB3 MET A 15 3.669 -18.847 2.635 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.721 -18.993 5.305 1.00 0.00 H new ATOM 0 HG3 MET A 15 1.984 -18.864 5.115 1.00 0.00 H new ATOM 0 HE1 MET A 15 5.044 -21.595 3.690 1.00 0.00 H new ATOM 0 HE2 MET A 15 4.966 -20.670 5.208 1.00 0.00 H new ATOM 0 HE3 MET A 15 4.441 -22.370 5.175 1.00 0.00 H new ATOM 196 N LYS A 16 5.595 -16.020 2.318 1.00 0.00 N ATOM 197 CA LYS A 16 6.182 -15.411 1.131 1.00 0.00 C ATOM 198 C LYS A 16 7.080 -16.402 0.398 1.00 0.00 C ATOM 199 O LYS A 16 7.975 -17.002 0.993 1.00 0.00 O ATOM 200 CB LYS A 16 6.986 -14.167 1.516 1.00 0.00 C ATOM 201 CG LYS A 16 7.785 -13.579 0.366 1.00 0.00 C ATOM 202 CD LYS A 16 8.920 -12.702 0.867 1.00 0.00 C ATOM 203 CE LYS A 16 9.474 -11.819 -0.242 1.00 0.00 C ATOM 204 NZ LYS A 16 10.323 -12.590 -1.192 1.00 0.00 N ATOM 0 H LYS A 16 6.253 -16.172 3.083 1.00 0.00 H new ATOM 0 HA LYS A 16 5.371 -15.120 0.464 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.304 -13.408 1.899 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.667 -14.422 2.328 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.190 -14.385 -0.247 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.126 -12.992 -0.274 1.00 0.00 H new ATOM 0 HD2 LYS A 16 8.564 -12.078 1.687 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.717 -13.329 1.266 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.649 -11.357 -0.785 1.00 0.00 H new ATOM 0 HE3 LYS A 16 10.060 -11.011 0.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.681 -11.954 -1.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.124 -13.010 -0.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 9.757 -13.345 -1.629 1.00 0.00 H new ATOM 218 N TYR A 17 6.836 -16.568 -0.897 1.00 0.00 N ATOM 219 CA TYR A 17 7.622 -17.487 -1.712 1.00 0.00 C ATOM 220 C TYR A 17 9.114 -17.211 -1.558 1.00 0.00 C ATOM 221 O TYR A 17 9.544 -16.058 -1.515 1.00 0.00 O ATOM 222 CB TYR A 17 7.219 -17.371 -3.183 1.00 0.00 C ATOM 223 CG TYR A 17 7.377 -18.660 -3.958 1.00 0.00 C ATOM 224 CD1 TYR A 17 6.387 -19.635 -3.931 1.00 0.00 C ATOM 225 CD2 TYR A 17 8.516 -18.903 -4.715 1.00 0.00 C ATOM 226 CE1 TYR A 17 6.528 -20.814 -4.637 1.00 0.00 C ATOM 227 CE2 TYR A 17 8.664 -20.078 -5.425 1.00 0.00 C ATOM 228 CZ TYR A 17 7.667 -21.031 -5.383 1.00 0.00 C ATOM 229 OH TYR A 17 7.812 -22.204 -6.088 1.00 0.00 O ATOM 0 H TYR A 17 6.100 -16.078 -1.405 1.00 0.00 H new ATOM 0 HA TYR A 17 7.421 -18.501 -1.367 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.180 -17.047 -3.242 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.822 -16.596 -3.656 1.00 0.00 H new ATOM 0 HD1 TYR A 17 5.493 -19.468 -3.349 1.00 0.00 H new ATOM 0 HD2 TYR A 17 9.299 -18.160 -4.749 1.00 0.00 H new ATOM 0 HE1 TYR A 17 5.750 -21.562 -4.605 1.00 0.00 H new ATOM 0 HE2 TYR A 17 9.555 -20.250 -6.010 1.00 0.00 H new ATOM 0 HH TYR A 17 6.930 -22.535 -6.357 1.00 0.00 H new ATOM 239 N THR A 18 9.902 -18.279 -1.477 1.00 0.00 N ATOM 240 CA THR A 18 11.346 -18.154 -1.328 1.00 0.00 C ATOM 241 C THR A 18 12.077 -18.769 -2.516 1.00 0.00 C ATOM 242 O THR A 18 13.022 -18.186 -3.045 1.00 0.00 O ATOM 243 CB THR A 18 11.838 -18.829 -0.033 1.00 0.00 C ATOM 244 OG1 THR A 18 13.210 -18.495 0.202 1.00 0.00 O ATOM 245 CG2 THR A 18 11.685 -20.340 -0.119 1.00 0.00 C ATOM 0 H THR A 18 9.564 -19.241 -1.512 1.00 0.00 H new ATOM 0 HA THR A 18 11.567 -17.088 -1.281 1.00 0.00 H new ATOM 0 HB THR A 18 11.229 -18.465 0.795 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.515 -18.926 1.027 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.039 -20.795 0.806 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.635 -20.591 -0.269 1.00 0.00 H new ATOM 0 HG23 THR A 18 12.272 -20.718 -0.956 1.00 0.00 H new ATOM 253 N ASN A 19 11.632 -19.950 -2.933 1.00 0.00 N ATOM 254 CA ASN A 19 12.244 -20.644 -4.060 1.00 0.00 C ATOM 255 C ASN A 19 11.348 -21.776 -4.553 1.00 0.00 C ATOM 256 O ASN A 19 10.390 -22.162 -3.882 1.00 0.00 O ATOM 257 CB ASN A 19 13.613 -21.197 -3.662 1.00 0.00 C ATOM 258 CG ASN A 19 14.730 -20.196 -3.888 1.00 0.00 C ATOM 259 OD1 ASN A 19 14.728 -19.460 -4.874 1.00 0.00 O ATOM 260 ND2 ASN A 19 15.691 -20.166 -2.973 1.00 0.00 N ATOM 0 H ASN A 19 10.849 -20.446 -2.507 1.00 0.00 H new ATOM 0 HA ASN A 19 12.372 -19.927 -4.871 1.00 0.00 H new ATOM 0 HB2 ASN A 19 13.594 -21.484 -2.611 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.817 -22.101 -4.236 1.00 0.00 H new ATOM 0 HD21 ASN A 19 16.469 -19.514 -3.072 1.00 0.00 H new ATOM 0 HD22 ASN A 19 15.651 -20.795 -2.171 1.00 0.00 H new ATOM 267 N LEU A 20 11.667 -22.305 -5.729 1.00 0.00 N ATOM 268 CA LEU A 20 10.892 -23.395 -6.313 1.00 0.00 C ATOM 269 C LEU A 20 10.948 -24.637 -5.430 1.00 0.00 C ATOM 270 O LEU A 20 9.955 -25.016 -4.810 1.00 0.00 O ATOM 271 CB LEU A 20 11.415 -23.726 -7.712 1.00 0.00 C ATOM 272 CG LEU A 20 10.383 -24.263 -8.704 1.00 0.00 C ATOM 273 CD1 LEU A 20 9.939 -25.663 -8.308 1.00 0.00 C ATOM 274 CD2 LEU A 20 9.187 -23.326 -8.790 1.00 0.00 C ATOM 0 H LEU A 20 12.456 -21.997 -6.297 1.00 0.00 H new ATOM 0 HA LEU A 20 9.854 -23.071 -6.387 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.861 -22.825 -8.134 1.00 0.00 H new ATOM 0 HB3 LEU A 20 12.213 -24.462 -7.615 1.00 0.00 H new ATOM 0 HG LEU A 20 10.848 -24.317 -9.688 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.205 -26.028 -9.026 1.00 0.00 H new ATOM 0 HD12 LEU A 20 10.801 -26.330 -8.300 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.492 -25.636 -7.314 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.463 -23.724 -9.501 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.722 -23.239 -7.808 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.519 -22.342 -9.123 1.00 0.00 H new ATOM 286 N VAL A 21 12.118 -25.266 -5.375 1.00 0.00 N ATOM 287 CA VAL A 21 12.305 -26.464 -4.565 1.00 0.00 C ATOM 288 C VAL A 21 11.679 -26.297 -3.185 1.00 0.00 C ATOM 289 O VAL A 21 10.943 -27.165 -2.715 1.00 0.00 O ATOM 290 CB VAL A 21 13.799 -26.803 -4.401 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.526 -25.679 -3.679 1.00 0.00 C ATOM 292 CG2 VAL A 21 13.967 -28.120 -3.660 1.00 0.00 C ATOM 0 H VAL A 21 12.951 -24.966 -5.882 1.00 0.00 H new ATOM 0 HA VAL A 21 11.810 -27.281 -5.089 1.00 0.00 H new ATOM 0 HB VAL A 21 14.240 -26.911 -5.392 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.580 -25.937 -3.573 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.434 -24.758 -4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.086 -25.536 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 21 15.028 -28.344 -3.553 1.00 0.00 H new ATOM 0 HG22 VAL A 21 13.511 -28.043 -2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 21 13.482 -28.918 -4.222 1.00 0.00 H new ATOM 302 N THR A 22 11.976 -25.174 -2.538 1.00 0.00 N ATOM 303 CA THR A 22 11.443 -24.892 -1.211 1.00 0.00 C ATOM 304 C THR A 22 9.932 -24.689 -1.257 1.00 0.00 C ATOM 305 O THR A 22 9.169 -25.518 -0.764 1.00 0.00 O ATOM 306 CB THR A 22 12.099 -23.642 -0.595 1.00 0.00 C ATOM 307 OG1 THR A 22 13.472 -23.564 -0.994 1.00 0.00 O ATOM 308 CG2 THR A 22 12.007 -23.675 0.923 1.00 0.00 C ATOM 0 H THR A 22 12.583 -24.445 -2.912 1.00 0.00 H new ATOM 0 HA THR A 22 11.672 -25.757 -0.589 1.00 0.00 H new ATOM 0 HB THR A 22 11.565 -22.763 -0.956 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.882 -22.766 -0.600 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.477 -22.782 1.335 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.960 -23.706 1.223 1.00 0.00 H new ATOM 0 HG23 THR A 22 12.518 -24.561 1.299 1.00 0.00 H new ATOM 316 N GLY A 23 9.507 -23.579 -1.853 1.00 0.00 N ATOM 317 CA GLY A 23 8.089 -23.287 -1.953 1.00 0.00 C ATOM 318 C GLY A 23 7.701 -22.031 -1.199 1.00 0.00 C ATOM 319 O GLY A 23 8.019 -20.920 -1.626 1.00 0.00 O ATOM 0 H GLY A 23 10.119 -22.877 -2.268 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.817 -23.175 -3.003 1.00 0.00 H new ATOM 0 HA3 GLY A 23 7.519 -24.131 -1.564 1.00 0.00 H new ATOM 323 N TRP A 24 7.013 -22.205 -0.077 1.00 0.00 N ATOM 324 CA TRP A 24 6.580 -21.075 0.737 1.00 0.00 C ATOM 325 C TRP A 24 7.293 -21.069 2.085 1.00 0.00 C ATOM 326 O TRP A 24 7.643 -22.123 2.615 1.00 0.00 O ATOM 327 CB TRP A 24 5.066 -21.123 0.948 1.00 0.00 C ATOM 328 CG TRP A 24 4.286 -21.101 -0.332 1.00 0.00 C ATOM 329 CD1 TRP A 24 4.258 -22.074 -1.290 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.425 -20.055 -0.793 1.00 0.00 C ATOM 331 NE1 TRP A 24 3.430 -21.695 -2.320 1.00 0.00 N ATOM 332 CE2 TRP A 24 2.907 -20.461 -2.039 1.00 0.00 C ATOM 333 CE3 TRP A 24 3.039 -18.816 -0.275 1.00 0.00 C ATOM 334 CZ2 TRP A 24 2.025 -19.671 -2.771 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.165 -18.032 -1.004 1.00 0.00 C ATOM 336 CH2 TRP A 24 1.665 -18.462 -2.240 1.00 0.00 C ATOM 0 H TRP A 24 6.743 -23.117 0.290 1.00 0.00 H new ATOM 0 HA TRP A 24 6.838 -20.158 0.207 1.00 0.00 H new ATOM 0 HB2 TRP A 24 4.812 -22.026 1.504 1.00 0.00 H new ATOM 0 HB3 TRP A 24 4.765 -20.275 1.563 1.00 0.00 H new ATOM 0 HD1 TRP A 24 4.805 -23.004 -1.245 1.00 0.00 H new ATOM 0 HE1 TRP A 24 3.237 -22.244 -3.158 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.417 -18.477 0.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 1.638 -20.000 -3.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 1.862 -17.071 -0.614 1.00 0.00 H new ATOM 0 HH2 TRP A 24 0.982 -17.827 -2.785 1.00 0.00 H new ATOM 347 N GLN A 25 7.506 -19.877 2.632 1.00 0.00 N ATOM 348 CA GLN A 25 8.179 -19.736 3.918 1.00 0.00 C ATOM 349 C GLN A 25 7.476 -18.701 4.790 1.00 0.00 C ATOM 350 O GLN A 25 7.009 -17.674 4.297 1.00 0.00 O ATOM 351 CB GLN A 25 9.641 -19.339 3.711 1.00 0.00 C ATOM 352 CG GLN A 25 10.514 -20.475 3.203 1.00 0.00 C ATOM 353 CD GLN A 25 10.509 -21.674 4.130 1.00 0.00 C ATOM 354 OE1 GLN A 25 10.727 -21.544 5.335 1.00 0.00 O ATOM 355 NE2 GLN A 25 10.259 -22.853 3.572 1.00 0.00 N ATOM 0 H GLN A 25 7.223 -18.995 2.205 1.00 0.00 H new ATOM 0 HA GLN A 25 8.140 -20.699 4.428 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.687 -18.512 3.003 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.047 -18.974 4.655 1.00 0.00 H new ATOM 0 HG2 GLN A 25 10.167 -20.782 2.216 1.00 0.00 H new ATOM 0 HG3 GLN A 25 11.537 -20.117 3.084 1.00 0.00 H new ATOM 0 HE21 GLN A 25 10.084 -22.916 2.569 1.00 0.00 H new ATOM 0 HE22 GLN A 25 10.242 -23.696 4.146 1.00 0.00 H new ATOM 364 N TYR A 26 7.404 -18.978 6.087 1.00 0.00 N ATOM 365 CA TYR A 26 6.756 -18.071 7.027 1.00 0.00 C ATOM 366 C TYR A 26 7.635 -16.856 7.307 1.00 0.00 C ATOM 367 O TYR A 26 8.802 -16.992 7.674 1.00 0.00 O ATOM 368 CB TYR A 26 6.441 -18.799 8.335 1.00 0.00 C ATOM 369 CG TYR A 26 5.493 -19.965 8.166 1.00 0.00 C ATOM 370 CD1 TYR A 26 4.188 -19.768 7.733 1.00 0.00 C ATOM 371 CD2 TYR A 26 5.904 -21.264 8.439 1.00 0.00 C ATOM 372 CE1 TYR A 26 3.319 -20.830 7.578 1.00 0.00 C ATOM 373 CE2 TYR A 26 5.042 -22.333 8.286 1.00 0.00 C ATOM 374 CZ TYR A 26 3.750 -22.111 7.856 1.00 0.00 C ATOM 375 OH TYR A 26 2.888 -23.172 7.701 1.00 0.00 O ATOM 0 H TYR A 26 7.786 -19.823 6.511 1.00 0.00 H new ATOM 0 HA TYR A 26 5.825 -17.726 6.577 1.00 0.00 H new ATOM 0 HB2 TYR A 26 7.372 -19.159 8.774 1.00 0.00 H new ATOM 0 HB3 TYR A 26 6.009 -18.090 9.041 1.00 0.00 H new ATOM 0 HD1 TYR A 26 3.847 -18.767 7.514 1.00 0.00 H new ATOM 0 HD2 TYR A 26 6.914 -21.441 8.777 1.00 0.00 H new ATOM 0 HE1 TYR A 26 2.307 -20.659 7.241 1.00 0.00 H new ATOM 0 HE2 TYR A 26 5.378 -23.337 8.502 1.00 0.00 H new ATOM 0 HH TYR A 26 3.348 -24.004 7.937 1.00 0.00 H new ATOM 385 N ARG A 27 7.065 -15.668 7.131 1.00 0.00 N ATOM 386 CA ARG A 27 7.796 -14.429 7.364 1.00 0.00 C ATOM 387 C ARG A 27 6.893 -13.377 8.001 1.00 0.00 C ATOM 388 O ARG A 27 5.711 -13.276 7.672 1.00 0.00 O ATOM 389 CB ARG A 27 8.370 -13.896 6.050 1.00 0.00 C ATOM 390 CG ARG A 27 9.554 -14.696 5.533 1.00 0.00 C ATOM 391 CD ARG A 27 10.853 -14.253 6.188 1.00 0.00 C ATOM 392 NE ARG A 27 12.024 -14.690 5.432 1.00 0.00 N ATOM 393 CZ ARG A 27 12.579 -15.890 5.565 1.00 0.00 C ATOM 394 NH1 ARG A 27 12.072 -16.767 6.420 1.00 0.00 N ATOM 395 NH2 ARG A 27 13.643 -16.214 4.841 1.00 0.00 N ATOM 0 H ARG A 27 6.100 -15.538 6.828 1.00 0.00 H new ATOM 0 HA ARG A 27 8.615 -14.643 8.050 1.00 0.00 H new ATOM 0 HB2 ARG A 27 7.585 -13.896 5.294 1.00 0.00 H new ATOM 0 HB3 ARG A 27 8.677 -12.860 6.191 1.00 0.00 H new ATOM 0 HG2 ARG A 27 9.391 -15.756 5.726 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.631 -14.577 4.452 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.863 -13.167 6.276 1.00 0.00 H new ATOM 0 HD3 ARG A 27 10.904 -14.655 7.200 1.00 0.00 H new ATOM 0 HE ARG A 27 12.438 -14.038 4.766 1.00 0.00 H new ATOM 0 HH11 ARG A 27 11.254 -16.521 6.978 1.00 0.00 H new ATOM 0 HH12 ARG A 27 12.500 -17.687 6.520 1.00 0.00 H new ATOM 0 HH21 ARG A 27 14.035 -15.542 4.182 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.068 -17.135 4.944 1.00 0.00 H new ATOM 409 N PHE A 28 7.457 -12.595 8.915 1.00 0.00 N ATOM 410 CA PHE A 28 6.703 -11.551 9.599 1.00 0.00 C ATOM 411 C PHE A 28 6.660 -10.274 8.765 1.00 0.00 C ATOM 412 O PHE A 28 7.698 -9.695 8.442 1.00 0.00 O ATOM 413 CB PHE A 28 7.323 -11.259 10.968 1.00 0.00 C ATOM 414 CG PHE A 28 6.704 -10.082 11.667 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.351 -10.072 11.969 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.474 -8.987 12.023 1.00 0.00 C ATOM 417 CE1 PHE A 28 4.779 -8.991 12.612 1.00 0.00 C ATOM 418 CE2 PHE A 28 6.907 -7.903 12.666 1.00 0.00 C ATOM 419 CZ PHE A 28 5.558 -7.905 12.962 1.00 0.00 C ATOM 0 H PHE A 28 8.434 -12.664 9.199 1.00 0.00 H new ATOM 0 HA PHE A 28 5.682 -11.907 9.738 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.221 -12.141 11.600 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.391 -11.077 10.843 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.737 -10.919 11.699 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.530 -8.980 11.795 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.724 -8.995 12.841 1.00 0.00 H new ATOM 0 HE2 PHE A 28 7.518 -7.055 12.937 1.00 0.00 H new ATOM 0 HZ PHE A 28 5.113 -7.060 13.466 1.00 0.00 H new ATOM 429 N PHE A 29 5.453 -9.842 8.417 1.00 0.00 N ATOM 430 CA PHE A 29 5.273 -8.635 7.619 1.00 0.00 C ATOM 431 C PHE A 29 4.719 -7.497 8.471 1.00 0.00 C ATOM 432 O PHE A 29 3.927 -7.720 9.386 1.00 0.00 O ATOM 433 CB PHE A 29 4.334 -8.911 6.443 1.00 0.00 C ATOM 434 CG PHE A 29 4.994 -9.637 5.306 1.00 0.00 C ATOM 435 CD1 PHE A 29 5.251 -10.996 5.390 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.356 -8.960 4.152 1.00 0.00 C ATOM 437 CE1 PHE A 29 5.859 -11.666 4.346 1.00 0.00 C ATOM 438 CE2 PHE A 29 5.964 -9.625 3.104 1.00 0.00 C ATOM 439 CZ PHE A 29 6.215 -10.980 3.200 1.00 0.00 C ATOM 0 H PHE A 29 4.584 -10.310 8.675 1.00 0.00 H new ATOM 0 HA PHE A 29 6.248 -8.335 7.234 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.486 -9.499 6.796 1.00 0.00 H new ATOM 0 HB3 PHE A 29 3.936 -7.965 6.077 1.00 0.00 H new ATOM 0 HD1 PHE A 29 4.973 -11.538 6.282 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.161 -7.901 4.071 1.00 0.00 H new ATOM 0 HE1 PHE A 29 6.056 -12.725 4.425 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.243 -9.086 2.211 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.688 -11.502 2.382 1.00 0.00 H new ATOM 449 N VAL A 30 5.143 -6.275 8.162 1.00 0.00 N ATOM 450 CA VAL A 30 4.689 -5.101 8.898 1.00 0.00 C ATOM 451 C VAL A 30 4.389 -3.942 7.954 1.00 0.00 C ATOM 452 O VAL A 30 5.300 -3.309 7.420 1.00 0.00 O ATOM 453 CB VAL A 30 5.738 -4.647 9.932 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.294 -3.362 10.614 1.00 0.00 C ATOM 455 CG2 VAL A 30 5.987 -5.745 10.955 1.00 0.00 C ATOM 0 H VAL A 30 5.799 -6.073 7.408 1.00 0.00 H new ATOM 0 HA VAL A 30 3.775 -5.388 9.419 1.00 0.00 H new ATOM 0 HB VAL A 30 6.675 -4.448 9.411 1.00 0.00 H new ATOM 0 HG11 VAL A 30 6.047 -3.057 11.341 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.171 -2.577 9.867 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.345 -3.530 11.124 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.730 -5.408 11.677 1.00 0.00 H new ATOM 0 HG22 VAL A 30 5.057 -5.977 11.473 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.353 -6.638 10.448 1.00 0.00 H new ATOM 465 N LEU A 31 3.104 -3.670 7.751 1.00 0.00 N ATOM 466 CA LEU A 31 2.682 -2.587 6.870 1.00 0.00 C ATOM 467 C LEU A 31 2.912 -1.230 7.527 1.00 0.00 C ATOM 468 O LEU A 31 2.847 -1.102 8.749 1.00 0.00 O ATOM 469 CB LEU A 31 1.204 -2.746 6.506 1.00 0.00 C ATOM 470 CG LEU A 31 0.593 -1.617 5.675 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.043 -1.717 4.226 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.926 -1.650 5.767 1.00 0.00 C ATOM 0 H LEU A 31 2.337 -4.184 8.184 1.00 0.00 H new ATOM 0 HA LEU A 31 3.281 -2.636 5.961 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.084 -3.680 5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.631 -2.842 7.428 1.00 0.00 H new ATOM 0 HG LEU A 31 0.941 -0.666 6.077 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.598 -0.905 3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.129 -1.644 4.177 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.724 -2.673 3.811 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.344 -0.840 5.170 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.293 -2.605 5.391 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.230 -1.529 6.807 1.00 0.00 H new ATOM 484 N ASN A 32 3.179 -0.218 6.707 1.00 0.00 N ATOM 485 CA ASN A 32 3.417 1.130 7.209 1.00 0.00 C ATOM 486 C ASN A 32 2.426 2.119 6.603 1.00 0.00 C ATOM 487 O ASN A 32 2.685 2.710 5.556 1.00 0.00 O ATOM 488 CB ASN A 32 4.849 1.569 6.894 1.00 0.00 C ATOM 489 CG ASN A 32 5.831 1.153 7.972 1.00 0.00 C ATOM 490 OD1 ASN A 32 5.440 0.628 9.015 1.00 0.00 O ATOM 491 ND2 ASN A 32 7.114 1.385 7.724 1.00 0.00 N ATOM 0 H ASN A 32 3.236 -0.306 5.692 1.00 0.00 H new ATOM 0 HA ASN A 32 3.277 1.118 8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.157 1.139 5.941 1.00 0.00 H new ATOM 0 HB3 ASN A 32 4.877 2.653 6.779 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.821 1.126 8.412 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.393 1.822 6.846 1.00 0.00 H new ATOM 498 N ASN A 33 1.289 2.293 7.270 1.00 0.00 N ATOM 499 CA ASN A 33 0.258 3.210 6.797 1.00 0.00 C ATOM 500 C ASN A 33 0.743 4.655 6.864 1.00 0.00 C ATOM 501 O ASN A 33 0.315 5.501 6.080 1.00 0.00 O ATOM 502 CB ASN A 33 -1.017 3.049 7.628 1.00 0.00 C ATOM 503 CG ASN A 33 -1.197 1.634 8.141 1.00 0.00 C ATOM 504 OD1 ASN A 33 -0.558 0.700 7.657 1.00 0.00 O ATOM 505 ND2 ASN A 33 -2.071 1.470 9.127 1.00 0.00 N ATOM 0 H ASN A 33 1.059 1.811 8.139 1.00 0.00 H new ATOM 0 HA ASN A 33 0.039 2.967 5.757 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.987 3.738 8.472 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -1.880 3.326 7.022 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.235 0.541 9.514 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -2.578 2.273 9.498 1.00 0.00 H new ATOM 512 N GLU A 34 1.640 4.929 7.807 1.00 0.00 N ATOM 513 CA GLU A 34 2.183 6.272 7.976 1.00 0.00 C ATOM 514 C GLU A 34 3.146 6.616 6.844 1.00 0.00 C ATOM 515 O GLU A 34 3.067 7.693 6.254 1.00 0.00 O ATOM 516 CB GLU A 34 2.898 6.391 9.324 1.00 0.00 C ATOM 517 CG GLU A 34 3.504 7.762 9.573 1.00 0.00 C ATOM 518 CD GLU A 34 2.493 8.758 10.107 1.00 0.00 C ATOM 519 OE1 GLU A 34 1.943 8.516 11.202 1.00 0.00 O ATOM 520 OE2 GLU A 34 2.251 9.779 9.430 1.00 0.00 O ATOM 0 H GLU A 34 2.005 4.240 8.464 1.00 0.00 H new ATOM 0 HA GLU A 34 1.353 6.978 7.950 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.191 6.165 10.122 1.00 0.00 H new ATOM 0 HB3 GLU A 34 3.686 5.640 9.375 1.00 0.00 H new ATOM 0 HG2 GLU A 34 4.326 7.668 10.283 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.927 8.142 8.643 1.00 0.00 H new ATOM 527 N ALA A 35 4.056 5.693 6.548 1.00 0.00 N ATOM 528 CA ALA A 35 5.033 5.898 5.486 1.00 0.00 C ATOM 529 C ALA A 35 4.511 5.379 4.151 1.00 0.00 C ATOM 530 O ALA A 35 4.464 6.112 3.165 1.00 0.00 O ATOM 531 CB ALA A 35 6.347 5.217 5.841 1.00 0.00 C ATOM 0 H ALA A 35 4.137 4.797 7.029 1.00 0.00 H new ATOM 0 HA ALA A 35 5.205 6.970 5.387 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.068 5.378 5.040 1.00 0.00 H new ATOM 0 HB2 ALA A 35 6.736 5.637 6.769 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.180 4.148 5.969 1.00 0.00 H new ATOM 537 N GLY A 36 4.119 4.109 4.128 1.00 0.00 N ATOM 538 CA GLY A 36 3.605 3.513 2.908 1.00 0.00 C ATOM 539 C GLY A 36 4.555 2.490 2.317 1.00 0.00 C ATOM 540 O GLY A 36 4.542 2.244 1.110 1.00 0.00 O ATOM 0 H GLY A 36 4.148 3.482 4.932 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.647 3.037 3.116 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.419 4.298 2.175 1.00 0.00 H new ATOM 544 N LEU A 37 5.383 1.894 3.168 1.00 0.00 N ATOM 545 CA LEU A 37 6.346 0.892 2.724 1.00 0.00 C ATOM 546 C LEU A 37 6.074 -0.455 3.385 1.00 0.00 C ATOM 547 O LEU A 37 5.915 -0.540 4.603 1.00 0.00 O ATOM 548 CB LEU A 37 7.770 1.350 3.040 1.00 0.00 C ATOM 549 CG LEU A 37 8.406 2.310 2.033 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.456 3.177 2.710 1.00 0.00 C ATOM 551 CD2 LEU A 37 9.017 1.538 0.872 1.00 0.00 C ATOM 0 H LEU A 37 5.407 2.087 4.169 1.00 0.00 H new ATOM 0 HA LEU A 37 6.240 0.774 1.646 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.767 1.831 4.018 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.405 0.467 3.121 1.00 0.00 H new ATOM 0 HG LEU A 37 7.626 2.962 1.640 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.897 3.853 1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.990 3.758 3.506 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.235 2.542 3.133 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.465 2.237 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.784 0.861 1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.240 0.962 0.369 1.00 0.00 H new ATOM 563 N LEU A 38 6.025 -1.507 2.575 1.00 0.00 N ATOM 564 CA LEU A 38 5.775 -2.852 3.081 1.00 0.00 C ATOM 565 C LEU A 38 7.083 -3.615 3.268 1.00 0.00 C ATOM 566 O LEU A 38 7.751 -3.967 2.296 1.00 0.00 O ATOM 567 CB LEU A 38 4.858 -3.616 2.125 1.00 0.00 C ATOM 568 CG LEU A 38 4.463 -5.028 2.559 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.293 -4.981 3.530 1.00 0.00 C ATOM 570 CD2 LEU A 38 4.118 -5.881 1.347 1.00 0.00 C ATOM 0 H LEU A 38 6.155 -1.454 1.565 1.00 0.00 H new ATOM 0 HA LEU A 38 5.285 -2.763 4.051 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.948 -3.033 1.983 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.350 -3.680 1.155 1.00 0.00 H new ATOM 0 HG LEU A 38 5.313 -5.482 3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.026 -5.995 3.828 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.575 -4.406 4.412 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.438 -4.508 3.047 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.839 -6.883 1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.284 -5.430 0.810 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.983 -5.943 0.687 1.00 0.00 H new ATOM 582 N GLU A 39 7.440 -3.869 4.523 1.00 0.00 N ATOM 583 CA GLU A 39 8.667 -4.591 4.836 1.00 0.00 C ATOM 584 C GLU A 39 8.356 -5.982 5.383 1.00 0.00 C ATOM 585 O GLU A 39 7.196 -6.321 5.622 1.00 0.00 O ATOM 586 CB GLU A 39 9.503 -3.808 5.850 1.00 0.00 C ATOM 587 CG GLU A 39 9.410 -2.301 5.680 1.00 0.00 C ATOM 588 CD GLU A 39 10.669 -1.585 6.129 1.00 0.00 C ATOM 589 OE1 GLU A 39 11.622 -2.270 6.556 1.00 0.00 O ATOM 590 OE2 GLU A 39 10.701 -0.338 6.054 1.00 0.00 O ATOM 0 H GLU A 39 6.897 -3.586 5.339 1.00 0.00 H new ATOM 0 HA GLU A 39 9.238 -4.701 3.914 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.179 -4.072 6.857 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.546 -4.112 5.760 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.218 -2.068 4.633 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.560 -1.926 6.251 1.00 0.00 H new ATOM 597 N TYR A 40 9.398 -6.781 5.577 1.00 0.00 N ATOM 598 CA TYR A 40 9.236 -8.136 6.093 1.00 0.00 C ATOM 599 C TYR A 40 10.527 -8.631 6.738 1.00 0.00 C ATOM 600 O TYR A 40 11.625 -8.315 6.279 1.00 0.00 O ATOM 601 CB TYR A 40 8.818 -9.085 4.969 1.00 0.00 C ATOM 602 CG TYR A 40 9.973 -9.568 4.122 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.708 -10.690 4.488 1.00 0.00 C ATOM 604 CD2 TYR A 40 10.331 -8.903 2.956 1.00 0.00 C ATOM 605 CE1 TYR A 40 11.765 -11.133 3.717 1.00 0.00 C ATOM 606 CE2 TYR A 40 11.385 -9.340 2.178 1.00 0.00 C ATOM 607 CZ TYR A 40 12.099 -10.456 2.564 1.00 0.00 C ATOM 608 OH TYR A 40 13.151 -10.896 1.793 1.00 0.00 O ATOM 0 H TYR A 40 10.364 -6.515 5.385 1.00 0.00 H new ATOM 0 HA TYR A 40 8.455 -8.117 6.853 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.311 -9.947 5.403 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.095 -8.580 4.328 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.448 -11.224 5.390 1.00 0.00 H new ATOM 0 HD2 TYR A 40 9.775 -8.028 2.652 1.00 0.00 H new ATOM 0 HE1 TYR A 40 12.327 -12.005 4.016 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.649 -8.812 1.274 1.00 0.00 H new ATOM 0 HH TYR A 40 13.254 -10.309 1.015 1.00 0.00 H new ATOM 618 N PHE A 41 10.387 -9.410 7.805 1.00 0.00 N ATOM 619 CA PHE A 41 11.541 -9.950 8.515 1.00 0.00 C ATOM 620 C PHE A 41 11.297 -11.398 8.928 1.00 0.00 C ATOM 621 O PHE A 41 10.158 -11.866 8.951 1.00 0.00 O ATOM 622 CB PHE A 41 11.850 -9.101 9.750 1.00 0.00 C ATOM 623 CG PHE A 41 11.697 -7.625 9.517 1.00 0.00 C ATOM 624 CD1 PHE A 41 10.449 -7.074 9.274 1.00 0.00 C ATOM 625 CD2 PHE A 41 12.801 -6.789 9.540 1.00 0.00 C ATOM 626 CE1 PHE A 41 10.306 -5.716 9.058 1.00 0.00 C ATOM 627 CE2 PHE A 41 12.665 -5.430 9.325 1.00 0.00 C ATOM 628 CZ PHE A 41 11.415 -4.893 9.085 1.00 0.00 C ATOM 0 H PHE A 41 9.486 -9.682 8.197 1.00 0.00 H new ATOM 0 HA PHE A 41 12.396 -9.922 7.840 1.00 0.00 H new ATOM 0 HB2 PHE A 41 11.189 -9.403 10.563 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.870 -9.305 10.076 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.578 -7.713 9.253 1.00 0.00 H new ATOM 0 HD2 PHE A 41 13.780 -7.204 9.728 1.00 0.00 H new ATOM 0 HE1 PHE A 41 9.328 -5.299 8.868 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.534 -4.789 9.345 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.305 -3.832 8.919 1.00 0.00 H new ATOM 638 N VAL A 42 12.375 -12.105 9.252 1.00 0.00 N ATOM 639 CA VAL A 42 12.279 -13.500 9.665 1.00 0.00 C ATOM 640 C VAL A 42 11.314 -13.663 10.834 1.00 0.00 C ATOM 641 O VAL A 42 10.469 -14.556 10.834 1.00 0.00 O ATOM 642 CB VAL A 42 13.656 -14.062 10.067 1.00 0.00 C ATOM 643 CG1 VAL A 42 13.536 -15.518 10.488 1.00 0.00 C ATOM 644 CG2 VAL A 42 14.648 -13.908 8.925 1.00 0.00 C ATOM 0 H VAL A 42 13.325 -11.734 9.236 1.00 0.00 H new ATOM 0 HA VAL A 42 11.903 -14.059 8.808 1.00 0.00 H new ATOM 0 HB VAL A 42 14.027 -13.492 10.919 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.518 -15.898 10.768 1.00 0.00 H new ATOM 0 HG12 VAL A 42 12.860 -15.596 11.340 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.143 -16.106 9.658 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.615 -14.310 9.226 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.285 -14.451 8.052 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.756 -12.852 8.676 1.00 0.00 H new ATOM 654 N ASN A 43 11.447 -12.792 11.829 1.00 0.00 N ATOM 655 CA ASN A 43 10.587 -12.839 13.006 1.00 0.00 C ATOM 656 C ASN A 43 10.387 -11.443 13.589 1.00 0.00 C ATOM 657 O ASN A 43 11.086 -10.500 13.221 1.00 0.00 O ATOM 658 CB ASN A 43 11.186 -13.766 14.065 1.00 0.00 C ATOM 659 CG ASN A 43 10.746 -15.206 13.888 1.00 0.00 C ATOM 660 OD1 ASN A 43 9.639 -15.476 13.424 1.00 0.00 O ATOM 661 ND2 ASN A 43 11.614 -16.140 14.260 1.00 0.00 N ATOM 0 H ASN A 43 12.142 -12.045 11.844 1.00 0.00 H new ATOM 0 HA ASN A 43 9.616 -13.228 12.701 1.00 0.00 H new ATOM 0 HB2 ASN A 43 12.274 -13.713 14.017 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.893 -13.419 15.056 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.373 -17.127 14.166 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.521 -15.871 14.640 1.00 0.00 H new ATOM 668 N GLU A 44 9.427 -11.321 14.502 1.00 0.00 N ATOM 669 CA GLU A 44 9.136 -10.041 15.136 1.00 0.00 C ATOM 670 C GLU A 44 10.352 -9.522 15.898 1.00 0.00 C ATOM 671 O GLU A 44 10.531 -8.314 16.050 1.00 0.00 O ATOM 672 CB GLU A 44 7.945 -10.177 16.086 1.00 0.00 C ATOM 673 CG GLU A 44 7.440 -8.849 16.624 1.00 0.00 C ATOM 674 CD GLU A 44 6.489 -9.016 17.793 1.00 0.00 C ATOM 675 OE1 GLU A 44 6.659 -9.984 18.563 1.00 0.00 O ATOM 676 OE2 GLU A 44 5.575 -8.177 17.939 1.00 0.00 O ATOM 0 H GLU A 44 8.839 -12.092 14.818 1.00 0.00 H new ATOM 0 HA GLU A 44 8.887 -9.325 14.353 1.00 0.00 H new ATOM 0 HB2 GLU A 44 7.131 -10.681 15.565 1.00 0.00 H new ATOM 0 HB3 GLU A 44 8.230 -10.814 16.923 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.289 -8.241 16.936 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.935 -8.306 15.825 1.00 0.00 H new ATOM 683 N GLN A 45 11.183 -10.444 16.373 1.00 0.00 N ATOM 684 CA GLN A 45 12.381 -10.079 17.120 1.00 0.00 C ATOM 685 C GLN A 45 13.434 -9.474 16.198 1.00 0.00 C ATOM 686 O GLN A 45 14.357 -8.799 16.653 1.00 0.00 O ATOM 687 CB GLN A 45 12.954 -11.304 17.835 1.00 0.00 C ATOM 688 CG GLN A 45 12.047 -11.853 18.924 1.00 0.00 C ATOM 689 CD GLN A 45 12.800 -12.676 19.951 1.00 0.00 C ATOM 690 OE1 GLN A 45 13.697 -13.447 19.609 1.00 0.00 O ATOM 691 NE2 GLN A 45 12.437 -12.516 21.218 1.00 0.00 N ATOM 0 H GLN A 45 11.049 -11.448 16.254 1.00 0.00 H new ATOM 0 HA GLN A 45 12.103 -9.331 17.862 1.00 0.00 H new ATOM 0 HB2 GLN A 45 13.142 -12.088 17.101 1.00 0.00 H new ATOM 0 HB3 GLN A 45 13.916 -11.041 18.274 1.00 0.00 H new ATOM 0 HG2 GLN A 45 11.545 -11.025 19.425 1.00 0.00 H new ATOM 0 HG3 GLN A 45 11.271 -12.468 18.469 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.688 -11.866 21.456 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.907 -13.043 21.954 1.00 0.00 H new ATOM 700 N SER A 46 13.289 -9.721 14.900 1.00 0.00 N ATOM 701 CA SER A 46 14.231 -9.204 13.914 1.00 0.00 C ATOM 702 C SER A 46 13.617 -8.048 13.130 1.00 0.00 C ATOM 703 O SER A 46 13.810 -7.933 11.919 1.00 0.00 O ATOM 704 CB SER A 46 14.659 -10.316 12.954 1.00 0.00 C ATOM 705 OG SER A 46 13.650 -10.576 11.993 1.00 0.00 O ATOM 0 H SER A 46 12.529 -10.276 14.507 1.00 0.00 H new ATOM 0 HA SER A 46 15.108 -8.835 14.445 1.00 0.00 H new ATOM 0 HB2 SER A 46 15.582 -10.030 12.449 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.872 -11.225 13.517 1.00 0.00 H new ATOM 0 HG SER A 46 12.770 -10.409 12.390 1.00 0.00 H new ATOM 711 N ARG A 47 12.876 -7.195 13.829 1.00 0.00 N ATOM 712 CA ARG A 47 12.232 -6.049 13.199 1.00 0.00 C ATOM 713 C ARG A 47 13.075 -4.789 13.372 1.00 0.00 C ATOM 714 O ARG A 47 12.851 -3.783 12.700 1.00 0.00 O ATOM 715 CB ARG A 47 10.839 -5.829 13.794 1.00 0.00 C ATOM 716 CG ARG A 47 10.832 -4.906 15.002 1.00 0.00 C ATOM 717 CD ARG A 47 9.419 -4.667 15.511 1.00 0.00 C ATOM 718 NE ARG A 47 9.407 -3.900 16.754 1.00 0.00 N ATOM 719 CZ ARG A 47 8.310 -3.364 17.276 1.00 0.00 C ATOM 720 NH1 ARG A 47 7.141 -3.511 16.667 1.00 0.00 N ATOM 721 NH2 ARG A 47 8.380 -2.680 18.411 1.00 0.00 N ATOM 0 H ARG A 47 12.707 -7.276 14.832 1.00 0.00 H new ATOM 0 HA ARG A 47 12.136 -6.258 12.134 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.187 -5.414 13.026 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.419 -6.793 14.081 1.00 0.00 H new ATOM 0 HG2 ARG A 47 11.438 -5.341 15.797 1.00 0.00 H new ATOM 0 HG3 ARG A 47 11.290 -3.953 14.736 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.845 -4.136 14.752 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.925 -5.625 15.672 1.00 0.00 H new ATOM 0 HE ARG A 47 10.290 -3.769 17.248 1.00 0.00 H new ATOM 0 HH11 ARG A 47 7.083 -4.037 15.795 1.00 0.00 H new ATOM 0 HH12 ARG A 47 6.300 -3.098 17.071 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.277 -2.566 18.883 1.00 0.00 H new ATOM 0 HH22 ARG A 47 7.537 -2.269 18.811 1.00 0.00 H new ATOM 735 N ASN A 48 14.045 -4.851 14.279 1.00 0.00 N ATOM 736 CA ASN A 48 14.921 -3.715 14.541 1.00 0.00 C ATOM 737 C ASN A 48 16.242 -3.863 13.793 1.00 0.00 C ATOM 738 O ASN A 48 16.753 -2.901 13.220 1.00 0.00 O ATOM 739 CB ASN A 48 15.183 -3.583 16.042 1.00 0.00 C ATOM 740 CG ASN A 48 15.646 -2.191 16.428 1.00 0.00 C ATOM 741 OD1 ASN A 48 15.775 -1.310 15.577 1.00 0.00 O ATOM 742 ND2 ASN A 48 15.899 -1.987 17.715 1.00 0.00 N ATOM 0 H ASN A 48 14.244 -5.676 14.845 1.00 0.00 H new ATOM 0 HA ASN A 48 14.422 -2.813 14.185 1.00 0.00 H new ATOM 0 HB2 ASN A 48 14.272 -3.825 16.590 1.00 0.00 H new ATOM 0 HB3 ASN A 48 15.938 -4.310 16.342 1.00 0.00 H new ATOM 0 HD21 ASN A 48 16.214 -1.071 18.034 1.00 0.00 H new ATOM 0 HD22 ASN A 48 15.778 -2.746 18.385 1.00 0.00 H new ATOM 749 N GLN A 49 16.789 -5.075 13.803 1.00 0.00 N ATOM 750 CA GLN A 49 18.051 -5.348 13.126 1.00 0.00 C ATOM 751 C GLN A 49 18.072 -4.717 11.738 1.00 0.00 C ATOM 752 O GLN A 49 18.719 -3.692 11.520 1.00 0.00 O ATOM 753 CB GLN A 49 18.278 -6.857 13.016 1.00 0.00 C ATOM 754 CG GLN A 49 19.578 -7.227 12.320 1.00 0.00 C ATOM 755 CD GLN A 49 19.648 -8.698 11.958 1.00 0.00 C ATOM 756 OE1 GLN A 49 19.868 -9.551 12.818 1.00 0.00 O ATOM 757 NE2 GLN A 49 19.460 -9.003 10.679 1.00 0.00 N ATOM 0 H GLN A 49 16.378 -5.882 14.272 1.00 0.00 H new ATOM 0 HA GLN A 49 18.854 -4.908 13.717 1.00 0.00 H new ATOM 0 HB2 GLN A 49 18.275 -7.290 14.016 1.00 0.00 H new ATOM 0 HB3 GLN A 49 17.445 -7.303 12.473 1.00 0.00 H new ATOM 0 HG2 GLN A 49 19.684 -6.629 11.415 1.00 0.00 H new ATOM 0 HG3 GLN A 49 20.417 -6.976 12.969 1.00 0.00 H new ATOM 0 HE21 GLN A 49 19.280 -8.264 10.000 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.495 -9.976 10.376 1.00 0.00 H new ATOM 766 N LYS A 50 17.360 -5.334 10.801 1.00 0.00 N ATOM 767 CA LYS A 50 17.296 -4.833 9.433 1.00 0.00 C ATOM 768 C LYS A 50 16.320 -5.655 8.598 1.00 0.00 C ATOM 769 O LYS A 50 16.300 -6.885 8.654 1.00 0.00 O ATOM 770 CB LYS A 50 18.685 -4.863 8.791 1.00 0.00 C ATOM 771 CG LYS A 50 18.754 -4.138 7.458 1.00 0.00 C ATOM 772 CD LYS A 50 18.849 -2.633 7.646 1.00 0.00 C ATOM 773 CE LYS A 50 20.271 -2.200 7.967 1.00 0.00 C ATOM 774 NZ LYS A 50 20.355 -0.743 8.259 1.00 0.00 N ATOM 0 H LYS A 50 16.819 -6.183 10.964 1.00 0.00 H new ATOM 0 HA LYS A 50 16.941 -3.803 9.466 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.403 -4.414 9.477 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.987 -5.900 8.647 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.618 -4.491 6.895 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.870 -4.377 6.867 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.510 -2.130 6.740 1.00 0.00 H new ATOM 0 HD3 LYS A 50 18.183 -2.323 8.451 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.637 -2.764 8.825 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.922 -2.440 7.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.340 -0.488 8.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 20.030 -0.204 7.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 19.754 -0.518 9.077 1.00 0.00 H new ATOM 788 N PRO A 51 15.491 -4.963 7.802 1.00 0.00 N ATOM 789 CA PRO A 51 14.499 -5.609 6.938 1.00 0.00 C ATOM 790 C PRO A 51 15.142 -6.361 5.778 1.00 0.00 C ATOM 791 O PRO A 51 16.068 -5.861 5.139 1.00 0.00 O ATOM 792 CB PRO A 51 13.664 -4.437 6.418 1.00 0.00 C ATOM 793 CG PRO A 51 14.575 -3.261 6.491 1.00 0.00 C ATOM 794 CD PRO A 51 15.460 -3.495 7.684 1.00 0.00 C ATOM 0 HA PRO A 51 13.918 -6.359 7.475 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.327 -4.614 5.397 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.772 -4.285 7.026 1.00 0.00 H new ATOM 0 HG2 PRO A 51 15.166 -3.168 5.580 1.00 0.00 H new ATOM 0 HG3 PRO A 51 14.009 -2.336 6.600 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.457 -3.083 7.532 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.056 -3.028 8.582 1.00 0.00 H new ATOM 802 N ARG A 52 14.646 -7.565 5.511 1.00 0.00 N ATOM 803 CA ARG A 52 15.174 -8.385 4.428 1.00 0.00 C ATOM 804 C ARG A 52 14.842 -7.772 3.070 1.00 0.00 C ATOM 805 O ARG A 52 15.577 -7.953 2.101 1.00 0.00 O ATOM 806 CB ARG A 52 14.606 -9.804 4.511 1.00 0.00 C ATOM 807 CG ARG A 52 14.966 -10.529 5.797 1.00 0.00 C ATOM 808 CD ARG A 52 16.337 -11.181 5.704 1.00 0.00 C ATOM 809 NE ARG A 52 16.383 -12.213 4.671 1.00 0.00 N ATOM 810 CZ ARG A 52 17.373 -13.091 4.553 1.00 0.00 C ATOM 811 NH1 ARG A 52 18.392 -13.063 5.400 1.00 0.00 N ATOM 812 NH2 ARG A 52 17.343 -14.000 3.587 1.00 0.00 N ATOM 0 H ARG A 52 13.880 -7.994 6.030 1.00 0.00 H new ATOM 0 HA ARG A 52 16.258 -8.427 4.533 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.521 -9.758 4.421 1.00 0.00 H new ATOM 0 HB3 ARG A 52 14.971 -10.383 3.663 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.952 -9.825 6.629 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.214 -11.289 6.010 1.00 0.00 H new ATOM 0 HD2 ARG A 52 17.087 -10.420 5.489 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.596 -11.620 6.667 1.00 0.00 H new ATOM 0 HE ARG A 52 15.613 -12.262 4.004 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.417 -12.366 6.145 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.151 -13.738 5.307 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.560 -14.025 2.934 1.00 0.00 H new ATOM 0 HH22 ARG A 52 18.103 -14.674 3.497 1.00 0.00 H new ATOM 826 N GLY A 53 13.730 -7.047 3.010 1.00 0.00 N ATOM 827 CA GLY A 53 13.320 -6.419 1.767 1.00 0.00 C ATOM 828 C GLY A 53 12.155 -5.469 1.954 1.00 0.00 C ATOM 829 O GLY A 53 11.370 -5.613 2.892 1.00 0.00 O ATOM 0 H GLY A 53 13.105 -6.883 3.799 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.164 -5.875 1.343 1.00 0.00 H new ATOM 0 HA3 GLY A 53 13.044 -7.190 1.048 1.00 0.00 H new ATOM 833 N THR A 54 12.040 -4.491 1.060 1.00 0.00 N ATOM 834 CA THR A 54 10.964 -3.511 1.133 1.00 0.00 C ATOM 835 C THR A 54 10.314 -3.307 -0.231 1.00 0.00 C ATOM 836 O THR A 54 10.996 -3.270 -1.256 1.00 0.00 O ATOM 837 CB THR A 54 11.475 -2.154 1.654 1.00 0.00 C ATOM 838 OG1 THR A 54 12.495 -1.648 0.786 1.00 0.00 O ATOM 839 CG2 THR A 54 12.024 -2.289 3.066 1.00 0.00 C ATOM 0 H THR A 54 12.680 -4.357 0.277 1.00 0.00 H new ATOM 0 HA THR A 54 10.224 -3.904 1.830 1.00 0.00 H new ATOM 0 HB THR A 54 10.637 -1.458 1.672 1.00 0.00 H new ATOM 0 HG1 THR A 54 12.813 -0.785 1.123 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.379 -1.318 3.413 1.00 0.00 H new ATOM 0 HG22 THR A 54 11.237 -2.646 3.730 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.851 -3.000 3.069 1.00 0.00 H new ATOM 847 N LEU A 55 8.992 -3.174 -0.236 1.00 0.00 N ATOM 848 CA LEU A 55 8.249 -2.972 -1.475 1.00 0.00 C ATOM 849 C LEU A 55 7.285 -1.796 -1.347 1.00 0.00 C ATOM 850 O LEU A 55 6.385 -1.809 -0.508 1.00 0.00 O ATOM 851 CB LEU A 55 7.477 -4.241 -1.842 1.00 0.00 C ATOM 852 CG LEU A 55 6.654 -4.177 -3.129 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.528 -4.480 -4.337 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.482 -5.144 -3.061 1.00 0.00 C ATOM 0 H LEU A 55 8.413 -3.202 0.603 1.00 0.00 H new ATOM 0 HA LEU A 55 8.964 -2.747 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU A 55 8.188 -5.062 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.807 -4.486 -1.018 1.00 0.00 H new ATOM 0 HG LEU A 55 6.260 -3.166 -3.236 1.00 0.00 H new ATOM 0 HD11 LEU A 55 6.925 -4.430 -5.244 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.334 -3.748 -4.396 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.952 -5.479 -4.238 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.907 -5.085 -3.985 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.855 -6.160 -2.930 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.842 -4.881 -2.219 1.00 0.00 H new ATOM 866 N GLN A 56 7.481 -0.784 -2.185 1.00 0.00 N ATOM 867 CA GLN A 56 6.628 0.399 -2.166 1.00 0.00 C ATOM 868 C GLN A 56 5.190 0.039 -2.524 1.00 0.00 C ATOM 869 O GLN A 56 4.945 -0.888 -3.298 1.00 0.00 O ATOM 870 CB GLN A 56 7.160 1.453 -3.138 1.00 0.00 C ATOM 871 CG GLN A 56 8.154 2.415 -2.508 1.00 0.00 C ATOM 872 CD GLN A 56 9.115 3.007 -3.520 1.00 0.00 C ATOM 873 OE1 GLN A 56 8.699 3.603 -4.513 1.00 0.00 O ATOM 874 NE2 GLN A 56 10.410 2.846 -3.272 1.00 0.00 N ATOM 0 H GLN A 56 8.222 -0.759 -2.885 1.00 0.00 H new ATOM 0 HA GLN A 56 6.640 0.808 -1.156 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.637 0.951 -3.980 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.321 2.022 -3.539 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.611 3.221 -2.014 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.720 1.893 -1.737 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.711 2.345 -2.436 1.00 0.00 H new ATOM 0 HE22 GLN A 56 11.104 3.224 -3.917 1.00 0.00 H new ATOM 883 N LEU A 57 4.242 0.776 -1.957 1.00 0.00 N ATOM 884 CA LEU A 57 2.827 0.534 -2.217 1.00 0.00 C ATOM 885 C LEU A 57 2.222 1.669 -3.037 1.00 0.00 C ATOM 886 O LEU A 57 1.380 1.441 -3.905 1.00 0.00 O ATOM 887 CB LEU A 57 2.065 0.380 -0.899 1.00 0.00 C ATOM 888 CG LEU A 57 2.343 -0.899 -0.109 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.903 -0.739 1.338 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.643 -2.087 -0.753 1.00 0.00 C ATOM 0 H LEU A 57 4.427 1.546 -1.314 1.00 0.00 H new ATOM 0 HA LEU A 57 2.741 -0.389 -2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.301 1.234 -0.264 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.997 0.427 -1.112 1.00 0.00 H new ATOM 0 HG LEU A 57 3.417 -1.085 -0.122 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.109 -1.659 1.885 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.450 0.085 1.796 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.834 -0.528 1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.852 -2.989 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.568 -1.910 -0.771 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.007 -2.215 -1.772 1.00 0.00 H new ATOM 902 N ALA A 58 2.658 2.893 -2.757 1.00 0.00 N ATOM 903 CA ALA A 58 2.164 4.063 -3.471 1.00 0.00 C ATOM 904 C ALA A 58 2.063 3.790 -4.968 1.00 0.00 C ATOM 905 O ALA A 58 3.038 3.939 -5.703 1.00 0.00 O ATOM 906 CB ALA A 58 3.065 5.261 -3.211 1.00 0.00 C ATOM 0 H ALA A 58 3.353 3.100 -2.040 1.00 0.00 H new ATOM 0 HA ALA A 58 1.164 4.288 -3.100 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.683 6.127 -3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.083 5.478 -2.143 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.076 5.037 -3.552 1.00 0.00 H new ATOM 912 N GLY A 59 0.876 3.389 -5.414 1.00 0.00 N ATOM 913 CA GLY A 59 0.670 3.100 -6.821 1.00 0.00 C ATOM 914 C GLY A 59 0.754 1.618 -7.128 1.00 0.00 C ATOM 915 O GLY A 59 1.211 1.224 -8.200 1.00 0.00 O ATOM 0 H GLY A 59 0.053 3.259 -4.825 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.306 3.476 -7.127 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.416 3.633 -7.411 1.00 0.00 H new ATOM 919 N ALA A 60 0.311 0.794 -6.183 1.00 0.00 N ATOM 920 CA ALA A 60 0.338 -0.652 -6.358 1.00 0.00 C ATOM 921 C ALA A 60 -1.066 -1.204 -6.583 1.00 0.00 C ATOM 922 O ALA A 60 -2.060 -0.539 -6.289 1.00 0.00 O ATOM 923 CB ALA A 60 0.981 -1.318 -5.150 1.00 0.00 C ATOM 0 H ALA A 60 -0.070 1.104 -5.289 1.00 0.00 H new ATOM 0 HA ALA A 60 0.934 -0.875 -7.243 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.994 -2.398 -5.294 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.002 -0.955 -5.035 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.408 -1.079 -4.254 1.00 0.00 H new ATOM 929 N VAL A 61 -1.141 -2.423 -7.107 1.00 0.00 N ATOM 930 CA VAL A 61 -2.424 -3.064 -7.372 1.00 0.00 C ATOM 931 C VAL A 61 -2.528 -4.403 -6.650 1.00 0.00 C ATOM 932 O VAL A 61 -1.591 -5.201 -6.663 1.00 0.00 O ATOM 933 CB VAL A 61 -2.638 -3.288 -8.880 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.745 -4.305 -9.117 1.00 0.00 C ATOM 935 CG2 VAL A 61 -2.955 -1.972 -9.574 1.00 0.00 C ATOM 0 H VAL A 61 -0.328 -2.987 -7.357 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.197 -2.392 -6.999 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.716 -3.684 -9.305 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.882 -4.450 -10.189 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.473 -5.253 -8.654 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.674 -3.940 -8.679 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.103 -2.149 -10.639 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.863 -1.545 -9.147 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.127 -1.278 -9.433 1.00 0.00 H new ATOM 945 N ILE A 62 -3.674 -4.642 -6.021 1.00 0.00 N ATOM 946 CA ILE A 62 -3.901 -5.885 -5.295 1.00 0.00 C ATOM 947 C ILE A 62 -4.854 -6.800 -6.057 1.00 0.00 C ATOM 948 O ILE A 62 -6.052 -6.530 -6.147 1.00 0.00 O ATOM 949 CB ILE A 62 -4.475 -5.620 -3.891 1.00 0.00 C ATOM 950 CG1 ILE A 62 -3.442 -4.900 -3.021 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.906 -6.926 -3.239 1.00 0.00 C ATOM 952 CD1 ILE A 62 -3.275 -3.437 -3.368 1.00 0.00 C ATOM 0 H ILE A 62 -4.459 -3.991 -6.000 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.932 -6.374 -5.196 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.351 -4.979 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.737 -4.986 -1.975 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.480 -5.402 -3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.309 -6.722 -2.247 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.672 -7.403 -3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.046 -7.590 -3.151 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.528 -2.990 -2.712 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.950 -3.344 -4.404 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.227 -2.921 -3.238 1.00 0.00 H new ATOM 964 N SER A 63 -4.314 -7.885 -6.603 1.00 0.00 N ATOM 965 CA SER A 63 -5.115 -8.840 -7.359 1.00 0.00 C ATOM 966 C SER A 63 -5.184 -10.183 -6.638 1.00 0.00 C ATOM 967 O SER A 63 -4.309 -11.038 -6.780 1.00 0.00 O ATOM 968 CB SER A 63 -4.533 -9.030 -8.761 1.00 0.00 C ATOM 969 OG SER A 63 -5.354 -9.879 -9.544 1.00 0.00 O ATOM 0 H SER A 63 -3.325 -8.124 -6.536 1.00 0.00 H new ATOM 0 HA SER A 63 -6.126 -8.441 -7.444 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.434 -8.062 -9.251 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.531 -9.454 -8.688 1.00 0.00 H new ATOM 0 HG SER A 63 -4.961 -9.983 -10.436 1.00 0.00 H new ATOM 975 N PRO A 64 -6.249 -10.375 -5.846 1.00 0.00 N ATOM 976 CA PRO A 64 -6.458 -11.611 -5.087 1.00 0.00 C ATOM 977 C PRO A 64 -6.793 -12.795 -5.988 1.00 0.00 C ATOM 978 O PRO A 64 -7.829 -12.809 -6.652 1.00 0.00 O ATOM 979 CB PRO A 64 -7.647 -11.275 -4.182 1.00 0.00 C ATOM 980 CG PRO A 64 -8.378 -10.196 -4.904 1.00 0.00 C ATOM 981 CD PRO A 64 -7.331 -9.399 -5.630 1.00 0.00 C ATOM 0 HA PRO A 64 -5.562 -11.912 -4.543 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.283 -12.146 -4.023 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.315 -10.939 -3.200 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -9.102 -10.615 -5.602 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -8.933 -9.568 -4.208 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.709 -9.003 -6.572 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.992 -8.548 -5.039 1.00 0.00 H new ATOM 989 N SER A 65 -5.909 -13.787 -6.006 1.00 0.00 N ATOM 990 CA SER A 65 -6.109 -14.975 -6.829 1.00 0.00 C ATOM 991 C SER A 65 -7.459 -15.621 -6.530 1.00 0.00 C ATOM 992 O SER A 65 -8.157 -15.223 -5.598 1.00 0.00 O ATOM 993 CB SER A 65 -4.984 -15.983 -6.590 1.00 0.00 C ATOM 994 OG SER A 65 -3.715 -15.355 -6.653 1.00 0.00 O ATOM 0 H SER A 65 -5.047 -13.792 -5.460 1.00 0.00 H new ATOM 0 HA SER A 65 -6.095 -14.669 -7.875 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.113 -16.452 -5.615 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.038 -16.777 -7.335 1.00 0.00 H new ATOM 0 HG SER A 65 -3.013 -16.020 -6.495 1.00 0.00 H new ATOM 1000 N ASP A 66 -7.818 -16.621 -7.328 1.00 0.00 N ATOM 1001 CA ASP A 66 -9.083 -17.325 -7.149 1.00 0.00 C ATOM 1002 C ASP A 66 -8.855 -18.827 -7.021 1.00 0.00 C ATOM 1003 O ASP A 66 -9.756 -19.570 -6.631 1.00 0.00 O ATOM 1004 CB ASP A 66 -10.021 -17.037 -8.323 1.00 0.00 C ATOM 1005 CG ASP A 66 -10.316 -15.558 -8.478 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -9.371 -14.750 -8.372 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -11.494 -15.209 -8.706 1.00 0.00 O ATOM 0 H ASP A 66 -7.251 -16.962 -8.105 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.544 -16.966 -6.229 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -9.574 -17.414 -9.243 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -10.956 -17.578 -8.178 1.00 0.00 H new ATOM 1012 N GLU A 67 -7.645 -19.268 -7.352 1.00 0.00 N ATOM 1013 CA GLU A 67 -7.301 -20.683 -7.276 1.00 0.00 C ATOM 1014 C GLU A 67 -7.573 -21.234 -5.879 1.00 0.00 C ATOM 1015 O GLU A 67 -8.530 -21.979 -5.669 1.00 0.00 O ATOM 1016 CB GLU A 67 -5.830 -20.893 -7.642 1.00 0.00 C ATOM 1017 CG GLU A 67 -5.551 -20.780 -9.131 1.00 0.00 C ATOM 1018 CD GLU A 67 -4.069 -20.716 -9.444 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -3.311 -20.174 -8.612 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -3.667 -21.207 -10.519 1.00 0.00 O ATOM 0 H GLU A 67 -6.887 -18.666 -7.675 1.00 0.00 H new ATOM 0 HA GLU A 67 -7.926 -21.222 -7.988 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.224 -20.159 -7.111 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.515 -21.877 -7.296 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.990 -21.635 -9.645 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.040 -19.888 -9.522 1.00 0.00 H new ATOM 1027 N ASP A 68 -6.723 -20.862 -4.927 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.871 -21.318 -3.550 1.00 0.00 C ATOM 1029 C ASP A 68 -7.663 -20.308 -2.725 1.00 0.00 C ATOM 1030 O ASP A 68 -7.935 -19.197 -3.181 1.00 0.00 O ATOM 1031 CB ASP A 68 -5.498 -21.547 -2.916 1.00 0.00 C ATOM 1032 CG ASP A 68 -4.551 -22.289 -3.839 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -4.403 -21.863 -5.004 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -3.958 -23.296 -3.397 1.00 0.00 O ATOM 0 H ASP A 68 -5.925 -20.246 -5.084 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.419 -22.260 -3.562 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -5.060 -20.586 -2.647 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -5.617 -22.112 -1.992 1.00 0.00 H new ATOM 1039 N SER A 69 -8.031 -20.702 -1.510 1.00 0.00 N ATOM 1040 CA SER A 69 -8.796 -19.834 -0.624 1.00 0.00 C ATOM 1041 C SER A 69 -7.963 -18.631 -0.190 1.00 0.00 C ATOM 1042 O SER A 69 -8.299 -17.486 -0.495 1.00 0.00 O ATOM 1043 CB SER A 69 -9.267 -20.612 0.606 1.00 0.00 C ATOM 1044 OG SER A 69 -9.799 -21.873 0.238 1.00 0.00 O ATOM 0 H SER A 69 -7.811 -21.617 -1.117 1.00 0.00 H new ATOM 0 HA SER A 69 -9.666 -19.473 -1.172 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.433 -20.752 1.293 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.024 -20.035 1.137 1.00 0.00 H new ATOM 0 HG SER A 69 -10.091 -22.352 1.042 1.00 0.00 H new ATOM 1050 N HIS A 70 -6.875 -18.899 0.525 1.00 0.00 N ATOM 1051 CA HIS A 70 -5.993 -17.840 1.001 1.00 0.00 C ATOM 1052 C HIS A 70 -4.886 -17.558 -0.011 1.00 0.00 C ATOM 1053 O HIS A 70 -3.941 -18.336 -0.147 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.382 -18.224 2.349 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.267 -19.101 3.180 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -5.791 -20.155 3.930 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -7.606 -19.073 3.378 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -6.799 -20.740 4.552 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -7.912 -20.102 4.235 1.00 0.00 N ATOM 0 H HIS A 70 -6.583 -19.841 0.787 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.587 -16.934 1.124 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.435 -18.736 2.177 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.156 -17.316 2.908 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.303 -18.372 2.943 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.726 -21.595 5.208 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -8.846 -20.336 4.572 1.00 0.00 H new ATOM 1068 N THR A 71 -5.010 -16.441 -0.721 1.00 0.00 N ATOM 1069 CA THR A 71 -4.023 -16.058 -1.722 1.00 0.00 C ATOM 1070 C THR A 71 -4.215 -14.610 -2.158 1.00 0.00 C ATOM 1071 O THR A 71 -5.337 -14.102 -2.181 1.00 0.00 O ATOM 1072 CB THR A 71 -4.096 -16.970 -2.961 1.00 0.00 C ATOM 1073 OG1 THR A 71 -4.350 -18.321 -2.561 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.801 -16.906 -3.757 1.00 0.00 C ATOM 0 H THR A 71 -5.785 -15.786 -0.621 1.00 0.00 H new ATOM 0 HA THR A 71 -3.043 -16.167 -1.257 1.00 0.00 H new ATOM 0 HB THR A 71 -4.911 -16.620 -3.595 1.00 0.00 H new ATOM 0 HG1 THR A 71 -3.712 -18.581 -1.864 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.876 -17.558 -4.627 1.00 0.00 H new ATOM 0 HG22 THR A 71 -2.626 -15.881 -4.085 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.972 -17.233 -3.130 1.00 0.00 H new ATOM 1082 N PHE A 72 -3.115 -13.950 -2.504 1.00 0.00 N ATOM 1083 CA PHE A 72 -3.163 -12.559 -2.940 1.00 0.00 C ATOM 1084 C PHE A 72 -1.785 -12.082 -3.388 1.00 0.00 C ATOM 1085 O PHE A 72 -0.761 -12.527 -2.869 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.682 -11.667 -1.811 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.783 -11.637 -0.608 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -2.802 -12.672 0.313 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -1.918 -10.575 -0.400 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -1.976 -12.647 1.421 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -1.089 -10.545 0.706 1.00 0.00 C ATOM 1092 CZ PHE A 72 -1.117 -11.582 1.617 1.00 0.00 C ATOM 0 H PHE A 72 -2.179 -14.356 -2.491 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.844 -12.493 -3.788 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.805 -10.652 -2.188 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.669 -12.016 -1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.470 -13.508 0.163 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -1.891 -9.761 -1.110 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.002 -13.459 2.133 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -0.420 -9.711 0.857 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.469 -11.561 2.481 1.00 0.00 H new ATOM 1102 N THR A 73 -1.767 -11.173 -4.359 1.00 0.00 N ATOM 1103 CA THR A 73 -0.516 -10.636 -4.879 1.00 0.00 C ATOM 1104 C THR A 73 -0.478 -9.116 -4.759 1.00 0.00 C ATOM 1105 O THR A 73 -1.457 -8.435 -5.064 1.00 0.00 O ATOM 1106 CB THR A 73 -0.307 -11.028 -6.354 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.492 -10.747 -7.108 1.00 0.00 O ATOM 1108 CG2 THR A 73 0.041 -12.504 -6.477 1.00 0.00 C ATOM 0 H THR A 73 -2.605 -10.794 -4.800 1.00 0.00 H new ATOM 0 HA THR A 73 0.286 -11.066 -4.279 1.00 0.00 H new ATOM 0 HB THR A 73 0.522 -10.441 -6.750 1.00 0.00 H new ATOM 0 HG1 THR A 73 -1.351 -10.997 -8.045 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.184 -12.758 -7.527 1.00 0.00 H new ATOM 0 HG22 THR A 73 0.959 -12.709 -5.926 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.770 -13.105 -6.066 1.00 0.00 H new ATOM 1116 N VAL A 74 0.658 -8.591 -4.313 1.00 0.00 N ATOM 1117 CA VAL A 74 0.825 -7.151 -4.154 1.00 0.00 C ATOM 1118 C VAL A 74 1.737 -6.581 -5.234 1.00 0.00 C ATOM 1119 O VAL A 74 2.950 -6.487 -5.050 1.00 0.00 O ATOM 1120 CB VAL A 74 1.405 -6.803 -2.771 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.625 -5.303 -2.646 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.490 -7.309 -1.666 1.00 0.00 C ATOM 0 H VAL A 74 1.477 -9.141 -4.055 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.165 -6.705 -4.247 1.00 0.00 H new ATOM 0 HB VAL A 74 2.371 -7.298 -2.667 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.035 -5.076 -1.662 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.323 -4.972 -3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.675 -4.784 -2.771 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.916 -7.054 -0.696 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.491 -6.845 -1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.389 -8.391 -1.745 1.00 0.00 H new ATOM 1132 N ASN A 75 1.144 -6.202 -6.362 1.00 0.00 N ATOM 1133 CA ASN A 75 1.904 -5.640 -7.473 1.00 0.00 C ATOM 1134 C ASN A 75 2.660 -4.388 -7.037 1.00 0.00 C ATOM 1135 O ASN A 75 2.644 -4.018 -5.864 1.00 0.00 O ATOM 1136 CB ASN A 75 0.971 -5.306 -8.638 1.00 0.00 C ATOM 1137 CG ASN A 75 0.765 -6.484 -9.570 1.00 0.00 C ATOM 1138 OD1 ASN A 75 1.556 -6.711 -10.486 1.00 0.00 O ATOM 1139 ND2 ASN A 75 -0.302 -7.241 -9.340 1.00 0.00 N ATOM 0 H ASN A 75 0.141 -6.274 -6.531 1.00 0.00 H new ATOM 0 HA ASN A 75 2.629 -6.386 -7.799 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.006 -4.983 -8.246 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.383 -4.468 -9.201 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.493 -8.048 -9.934 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -0.931 -7.015 -8.569 1.00 0.00 H new ATOM 1146 N ALA A 76 3.321 -3.741 -7.991 1.00 0.00 N ATOM 1147 CA ALA A 76 4.081 -2.530 -7.707 1.00 0.00 C ATOM 1148 C ALA A 76 4.239 -1.675 -8.960 1.00 0.00 C ATOM 1149 O ALA A 76 4.490 -2.192 -10.048 1.00 0.00 O ATOM 1150 CB ALA A 76 5.444 -2.885 -7.133 1.00 0.00 C ATOM 0 H ALA A 76 3.346 -4.035 -8.967 1.00 0.00 H new ATOM 0 HA ALA A 76 3.529 -1.948 -6.969 1.00 0.00 H new ATOM 0 HB1 ALA A 76 6.001 -1.971 -6.926 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.314 -3.448 -6.209 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.995 -3.490 -7.852 1.00 0.00 H new ATOM 1156 N ALA A 77 4.090 -0.364 -8.798 1.00 0.00 N ATOM 1157 CA ALA A 77 4.217 0.563 -9.916 1.00 0.00 C ATOM 1158 C ALA A 77 5.504 0.310 -10.695 1.00 0.00 C ATOM 1159 O ALA A 77 5.468 -0.045 -11.873 1.00 0.00 O ATOM 1160 CB ALA A 77 4.174 2.000 -9.418 1.00 0.00 C ATOM 0 H ALA A 77 3.881 0.080 -7.904 1.00 0.00 H new ATOM 0 HA ALA A 77 3.376 0.398 -10.590 1.00 0.00 H new ATOM 0 HB1 ALA A 77 4.270 2.681 -10.264 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.226 2.181 -8.912 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.995 2.168 -8.721 1.00 0.00 H new ATOM 1166 N SER A 78 6.639 0.495 -10.030 1.00 0.00 N ATOM 1167 CA SER A 78 7.938 0.291 -10.662 1.00 0.00 C ATOM 1168 C SER A 78 7.899 -0.905 -11.608 1.00 0.00 C ATOM 1169 O SER A 78 8.376 -0.831 -12.740 1.00 0.00 O ATOM 1170 CB SER A 78 9.018 0.079 -9.599 1.00 0.00 C ATOM 1171 OG SER A 78 10.309 0.056 -10.182 1.00 0.00 O ATOM 0 H SER A 78 6.686 0.786 -9.053 1.00 0.00 H new ATOM 0 HA SER A 78 8.177 1.183 -11.241 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.964 0.876 -8.858 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.836 -0.858 -9.073 1.00 0.00 H new ATOM 0 HG SER A 78 10.982 -0.079 -9.482 1.00 0.00 H new ATOM 1177 N GLY A 79 7.327 -2.008 -11.136 1.00 0.00 N ATOM 1178 CA GLY A 79 7.236 -3.205 -11.952 1.00 0.00 C ATOM 1179 C GLY A 79 7.652 -4.453 -11.199 1.00 0.00 C ATOM 1180 O GLY A 79 8.511 -5.205 -11.660 1.00 0.00 O ATOM 0 H GLY A 79 6.925 -2.094 -10.203 1.00 0.00 H new ATOM 0 HA2 GLY A 79 6.212 -3.323 -12.306 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.867 -3.089 -12.833 1.00 0.00 H new ATOM 1184 N GLU A 80 7.044 -4.673 -10.038 1.00 0.00 N ATOM 1185 CA GLU A 80 7.360 -5.837 -9.219 1.00 0.00 C ATOM 1186 C GLU A 80 6.085 -6.537 -8.754 1.00 0.00 C ATOM 1187 O GLU A 80 4.992 -5.977 -8.840 1.00 0.00 O ATOM 1188 CB GLU A 80 8.199 -5.425 -8.008 1.00 0.00 C ATOM 1189 CG GLU A 80 8.966 -6.576 -7.379 1.00 0.00 C ATOM 1190 CD GLU A 80 10.209 -6.115 -6.643 1.00 0.00 C ATOM 1191 OE1 GLU A 80 10.068 -5.400 -5.629 1.00 0.00 O ATOM 1192 OE2 GLU A 80 11.324 -6.470 -7.081 1.00 0.00 O ATOM 0 H GLU A 80 6.330 -4.061 -9.643 1.00 0.00 H new ATOM 0 HA GLU A 80 7.935 -6.533 -9.830 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.905 -4.652 -8.312 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.545 -4.982 -7.257 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.314 -7.107 -6.686 1.00 0.00 H new ATOM 0 HG3 GLU A 80 9.250 -7.286 -8.156 1.00 0.00 H new ATOM 1199 N GLN A 81 6.236 -7.762 -8.263 1.00 0.00 N ATOM 1200 CA GLN A 81 5.097 -8.539 -7.786 1.00 0.00 C ATOM 1201 C GLN A 81 5.479 -9.373 -6.568 1.00 0.00 C ATOM 1202 O GLN A 81 6.546 -9.988 -6.534 1.00 0.00 O ATOM 1203 CB GLN A 81 4.571 -9.448 -8.898 1.00 0.00 C ATOM 1204 CG GLN A 81 3.332 -10.236 -8.504 1.00 0.00 C ATOM 1205 CD GLN A 81 2.873 -11.184 -9.594 1.00 0.00 C ATOM 1206 OE1 GLN A 81 3.012 -10.896 -10.783 1.00 0.00 O ATOM 1207 NE2 GLN A 81 2.321 -12.324 -9.194 1.00 0.00 N ATOM 0 H GLN A 81 7.135 -8.238 -8.185 1.00 0.00 H new ATOM 0 HA GLN A 81 4.311 -7.843 -7.494 1.00 0.00 H new ATOM 0 HB2 GLN A 81 4.342 -8.841 -9.774 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.357 -10.145 -9.189 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.540 -10.804 -7.597 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.525 -9.543 -8.267 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.225 -12.522 -8.198 1.00 0.00 H new ATOM 0 HE22 GLN A 81 1.993 -13.001 -9.883 1.00 0.00 H new ATOM 1216 N TYR A 82 4.603 -9.390 -5.570 1.00 0.00 N ATOM 1217 CA TYR A 82 4.850 -10.147 -4.349 1.00 0.00 C ATOM 1218 C TYR A 82 3.825 -11.265 -4.184 1.00 0.00 C ATOM 1219 O TYR A 82 2.622 -11.048 -4.331 1.00 0.00 O ATOM 1220 CB TYR A 82 4.810 -9.220 -3.133 1.00 0.00 C ATOM 1221 CG TYR A 82 6.153 -8.619 -2.785 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.988 -8.116 -3.776 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.587 -8.554 -1.467 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.216 -7.566 -3.464 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.813 -8.004 -1.146 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.624 -7.512 -2.147 1.00 0.00 C ATOM 1227 OH TYR A 82 9.846 -6.965 -1.831 1.00 0.00 O ATOM 0 H TYR A 82 3.715 -8.888 -5.583 1.00 0.00 H new ATOM 0 HA TYR A 82 5.841 -10.595 -4.424 1.00 0.00 H new ATOM 0 HB2 TYR A 82 4.100 -8.415 -3.323 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.437 -9.778 -2.274 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.671 -8.156 -4.808 1.00 0.00 H new ATOM 0 HD2 TYR A 82 5.956 -8.940 -0.680 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.853 -7.180 -4.246 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.135 -7.960 -0.116 1.00 0.00 H new ATOM 0 HH TYR A 82 9.980 -7.003 -0.861 1.00 0.00 H new ATOM 1237 N LYS A 83 4.310 -12.463 -3.877 1.00 0.00 N ATOM 1238 CA LYS A 83 3.439 -13.617 -3.690 1.00 0.00 C ATOM 1239 C LYS A 83 3.318 -13.974 -2.211 1.00 0.00 C ATOM 1240 O LYS A 83 4.235 -14.551 -1.625 1.00 0.00 O ATOM 1241 CB LYS A 83 3.974 -14.819 -4.473 1.00 0.00 C ATOM 1242 CG LYS A 83 2.889 -15.775 -4.936 1.00 0.00 C ATOM 1243 CD LYS A 83 3.405 -16.735 -5.994 1.00 0.00 C ATOM 1244 CE LYS A 83 2.293 -17.187 -6.928 1.00 0.00 C ATOM 1245 NZ LYS A 83 2.676 -18.401 -7.700 1.00 0.00 N ATOM 0 H LYS A 83 5.303 -12.660 -3.752 1.00 0.00 H new ATOM 0 HA LYS A 83 2.449 -13.358 -4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.525 -14.460 -5.342 1.00 0.00 H new ATOM 0 HB3 LYS A 83 4.683 -15.362 -3.848 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.513 -16.340 -4.083 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.050 -15.207 -5.337 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.193 -16.252 -6.572 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.852 -17.604 -5.511 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.394 -17.394 -6.348 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.048 -16.380 -7.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.892 -18.677 -8.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.519 -18.196 -8.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.885 -19.179 -7.042 1.00 0.00 H new ATOM 1259 N LEU A 84 2.183 -13.629 -1.615 1.00 0.00 N ATOM 1260 CA LEU A 84 1.941 -13.914 -0.205 1.00 0.00 C ATOM 1261 C LEU A 84 0.698 -14.780 -0.030 1.00 0.00 C ATOM 1262 O LEU A 84 -0.051 -15.008 -0.980 1.00 0.00 O ATOM 1263 CB LEU A 84 1.783 -12.610 0.579 1.00 0.00 C ATOM 1264 CG LEU A 84 2.830 -11.530 0.305 1.00 0.00 C ATOM 1265 CD1 LEU A 84 2.502 -10.260 1.075 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.221 -12.031 0.667 1.00 0.00 C ATOM 0 H LEU A 84 1.415 -13.151 -2.086 1.00 0.00 H new ATOM 0 HA LEU A 84 2.800 -14.462 0.182 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.798 -12.196 0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.803 -12.845 1.643 1.00 0.00 H new ATOM 0 HG LEU A 84 2.815 -11.299 -0.760 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.258 -9.503 0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.524 -9.890 0.767 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.488 -10.476 2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.953 -11.249 0.465 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.250 -12.291 1.725 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.457 -12.912 0.070 1.00 0.00 H new ATOM 1278 N ARG A 85 0.485 -15.259 1.192 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.668 -16.100 1.492 1.00 0.00 C ATOM 1280 C ARG A 85 -1.116 -15.912 2.938 1.00 0.00 C ATOM 1281 O ARG A 85 -0.356 -16.169 3.872 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.333 -17.571 1.237 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.342 -18.537 1.836 1.00 0.00 C ATOM 1284 CD ARG A 85 -0.800 -19.957 1.872 1.00 0.00 C ATOM 1285 NE ARG A 85 -1.570 -20.815 2.768 1.00 0.00 N ATOM 1286 CZ ARG A 85 -2.704 -21.413 2.419 1.00 0.00 C ATOM 1287 NH1 ARG A 85 -3.196 -21.248 1.199 1.00 0.00 N ATOM 1288 NH2 ARG A 85 -3.347 -22.179 3.291 1.00 0.00 N ATOM 0 H ARG A 85 1.095 -15.079 1.989 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.485 -15.802 0.835 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.274 -17.741 0.162 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.653 -17.787 1.648 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.597 -18.218 2.847 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.262 -18.512 1.252 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -0.816 -20.377 0.866 1.00 0.00 H new ATOM 0 HD3 ARG A 85 0.241 -19.939 2.193 1.00 0.00 H new ATOM 0 HE ARG A 85 -1.218 -20.963 3.714 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -2.704 -20.661 0.526 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -4.067 -21.708 0.934 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -2.971 -22.309 4.230 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -4.218 -22.638 3.022 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.353 -15.461 3.115 1.00 0.00 N ATOM 1303 CA ALA A 86 -2.903 -15.240 4.447 1.00 0.00 C ATOM 1304 C ALA A 86 -3.116 -16.560 5.179 1.00 0.00 C ATOM 1305 O ALA A 86 -3.256 -17.613 4.556 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.210 -14.467 4.357 1.00 0.00 C ATOM 0 H ALA A 86 -2.994 -15.241 2.352 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.184 -14.651 5.017 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.609 -14.309 5.359 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.030 -13.503 3.882 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.928 -15.035 3.765 1.00 0.00 H new ATOM 1312 N THR A 87 -3.139 -16.499 6.507 1.00 0.00 N ATOM 1313 CA THR A 87 -3.333 -17.690 7.324 1.00 0.00 C ATOM 1314 C THR A 87 -4.691 -18.327 7.054 1.00 0.00 C ATOM 1315 O THR A 87 -4.807 -19.550 6.968 1.00 0.00 O ATOM 1316 CB THR A 87 -3.221 -17.365 8.826 1.00 0.00 C ATOM 1317 OG1 THR A 87 -3.249 -18.575 9.592 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.354 -16.452 9.268 1.00 0.00 C ATOM 0 H THR A 87 -3.026 -15.636 7.040 1.00 0.00 H new ATOM 0 HA THR A 87 -2.545 -18.392 7.051 1.00 0.00 H new ATOM 0 HB THR A 87 -2.275 -16.851 8.995 1.00 0.00 H new ATOM 0 HG1 THR A 87 -3.176 -18.360 10.545 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.254 -16.237 10.332 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.312 -15.520 8.704 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.310 -16.944 9.086 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.715 -17.491 6.920 1.00 0.00 N ATOM 1327 CA ASP A 88 -7.066 -17.974 6.657 1.00 0.00 C ATOM 1328 C ASP A 88 -7.844 -16.973 5.809 1.00 0.00 C ATOM 1329 O ASP A 88 -7.527 -15.784 5.787 1.00 0.00 O ATOM 1330 CB ASP A 88 -7.804 -18.230 7.971 1.00 0.00 C ATOM 1331 CG ASP A 88 -8.449 -16.976 8.527 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -7.736 -15.963 8.690 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -9.667 -17.007 8.799 1.00 0.00 O ATOM 0 H ASP A 88 -5.636 -16.476 6.989 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.990 -18.910 6.104 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -8.570 -18.989 7.812 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -7.105 -18.631 8.705 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.864 -17.463 5.111 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.688 -16.611 4.262 1.00 0.00 C ATOM 1340 C ALA A 89 -9.967 -15.271 4.935 1.00 0.00 C ATOM 1341 O ALA A 89 -9.924 -14.222 4.292 1.00 0.00 O ATOM 1342 CB ALA A 89 -10.994 -17.314 3.920 1.00 0.00 C ATOM 0 H ALA A 89 -9.139 -18.445 5.117 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.139 -16.418 3.340 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.600 -16.667 3.286 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.780 -18.243 3.392 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.539 -17.536 4.838 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.254 -15.313 6.231 1.00 0.00 N ATOM 1349 CA LYS A 90 -10.539 -14.103 6.992 1.00 0.00 C ATOM 1350 C LYS A 90 -9.344 -13.155 6.975 1.00 0.00 C ATOM 1351 O LYS A 90 -9.490 -11.964 6.705 1.00 0.00 O ATOM 1352 CB LYS A 90 -10.903 -14.457 8.436 1.00 0.00 C ATOM 1353 CG LYS A 90 -11.517 -13.302 9.209 1.00 0.00 C ATOM 1354 CD LYS A 90 -10.452 -12.461 9.892 1.00 0.00 C ATOM 1355 CE LYS A 90 -11.048 -11.593 10.991 1.00 0.00 C ATOM 1356 NZ LYS A 90 -11.812 -10.442 10.436 1.00 0.00 N ATOM 0 H LYS A 90 -10.295 -16.173 6.777 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.385 -13.601 6.524 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.603 -15.293 8.431 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.006 -14.795 8.955 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.097 -12.676 8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.210 -13.690 9.956 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.688 -13.113 10.316 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.958 -11.828 9.155 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.706 -12.198 11.615 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -10.250 -11.223 11.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -12.202 -9.875 11.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -11.179 -9.850 9.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.590 -10.795 9.843 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.164 -13.693 7.265 1.00 0.00 N ATOM 1371 CA GLU A 91 -6.944 -12.894 7.283 1.00 0.00 C ATOM 1372 C GLU A 91 -6.664 -12.300 5.906 1.00 0.00 C ATOM 1373 O GLU A 91 -6.072 -11.226 5.790 1.00 0.00 O ATOM 1374 CB GLU A 91 -5.756 -13.747 7.734 1.00 0.00 C ATOM 1375 CG GLU A 91 -4.439 -12.989 7.761 1.00 0.00 C ATOM 1376 CD GLU A 91 -3.468 -13.544 8.784 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -3.841 -13.628 9.973 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -2.334 -13.895 8.396 1.00 0.00 O ATOM 0 H GLU A 91 -8.027 -14.678 7.491 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.085 -12.077 7.991 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.959 -14.141 8.730 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.659 -14.603 7.066 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.981 -13.028 6.773 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.633 -11.939 7.981 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.092 -13.006 4.864 1.00 0.00 N ATOM 1386 CA ARG A 92 -6.886 -12.550 3.495 1.00 0.00 C ATOM 1387 C ARG A 92 -7.637 -11.246 3.237 1.00 0.00 C ATOM 1388 O ARG A 92 -7.026 -10.197 3.038 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.345 -13.620 2.504 1.00 0.00 C ATOM 1390 CG ARG A 92 -7.248 -13.186 1.050 1.00 0.00 C ATOM 1391 CD ARG A 92 -8.006 -14.134 0.134 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.446 -14.093 0.375 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.242 -13.137 -0.091 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -9.741 -12.149 -0.819 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.543 -13.170 0.171 1.00 0.00 N ATOM 0 H ARG A 92 -7.584 -13.896 4.942 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.820 -12.369 3.356 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.744 -14.518 2.647 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.378 -13.889 2.726 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.648 -12.178 0.943 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.201 -13.148 0.750 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -7.805 -13.873 -0.905 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.642 -15.151 0.283 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.863 -14.839 0.931 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.742 -12.121 -1.023 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -10.355 -11.416 -1.176 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.932 -13.929 0.730 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.154 -12.436 -0.187 1.00 0.00 H new ATOM 1409 N GLN A 93 -8.964 -11.323 3.243 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.797 -10.150 3.008 1.00 0.00 C ATOM 1411 C GLN A 93 -9.248 -8.935 3.750 1.00 0.00 C ATOM 1412 O GLN A 93 -9.178 -7.837 3.197 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.236 -10.424 3.448 1.00 0.00 C ATOM 1414 CG GLN A 93 -11.343 -11.005 4.849 1.00 0.00 C ATOM 1415 CD GLN A 93 -12.776 -11.294 5.253 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -13.650 -11.467 4.403 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -13.024 -11.348 6.556 1.00 0.00 N ATOM 0 H GLN A 93 -9.485 -12.185 3.408 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.786 -9.936 1.939 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.804 -9.495 3.405 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.698 -11.113 2.741 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.762 -11.926 4.902 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.902 -10.308 5.562 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.269 -11.198 7.225 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -13.969 -11.539 6.888 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.861 -9.140 5.005 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.318 -8.061 5.823 1.00 0.00 C ATOM 1428 C HIS A 94 -7.095 -7.437 5.157 1.00 0.00 C ATOM 1429 O HIS A 94 -7.008 -6.217 5.016 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.946 -8.582 7.211 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.386 -7.529 8.116 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -8.163 -6.563 8.719 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -6.116 -7.294 8.521 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.396 -5.779 9.455 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -6.149 -6.202 9.352 1.00 0.00 N ATOM 0 H HIS A 94 -8.913 -10.042 5.477 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.086 -7.294 5.925 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.831 -9.016 7.676 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.216 -9.384 7.105 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -9.173 -6.468 8.613 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.240 -7.860 8.242 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.731 -4.936 10.041 1.00 0.00 H new ATOM 1444 N TRP A 95 -6.154 -8.281 4.750 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.935 -7.812 4.100 1.00 0.00 C ATOM 1446 C TRP A 95 -5.253 -7.146 2.766 1.00 0.00 C ATOM 1447 O TRP A 95 -5.025 -5.949 2.589 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.967 -8.976 3.885 1.00 0.00 C ATOM 1449 CG TRP A 95 -3.063 -9.220 5.056 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.050 -10.320 5.865 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -2.043 -8.345 5.549 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -2.083 -10.181 6.832 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.451 -8.978 6.659 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.571 -7.089 5.159 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.413 -8.396 7.382 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.541 -6.512 5.878 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.029 -7.166 6.978 1.00 0.00 C ATOM 0 H TRP A 95 -6.211 -9.294 4.858 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.466 -7.074 4.751 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.538 -9.882 3.681 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.360 -8.776 3.002 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.703 -11.174 5.760 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.871 -10.863 7.560 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -2.003 -6.578 4.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.027 -8.898 8.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -0.169 -5.541 5.587 1.00 0.00 H new ATOM 0 HH2 TRP A 95 0.834 -6.689 7.518 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.779 -7.928 1.829 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.129 -7.413 0.510 1.00 0.00 C ATOM 1470 C VAL A 96 -6.668 -5.990 0.602 1.00 0.00 C ATOM 1471 O VAL A 96 -6.186 -5.087 -0.082 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.178 -8.304 -0.181 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.665 -7.656 -1.468 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.605 -9.687 -0.453 1.00 0.00 C ATOM 0 H VAL A 96 -5.972 -8.921 1.959 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.215 -7.415 -0.084 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.032 -8.415 0.487 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.406 -8.300 -1.942 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.116 -6.690 -1.241 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.823 -7.513 -2.145 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.359 -10.304 -0.942 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.733 -9.599 -1.101 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.311 -10.151 0.489 1.00 0.00 H new ATOM 1484 N SER A 97 -7.671 -5.796 1.452 1.00 0.00 N ATOM 1485 CA SER A 97 -8.279 -4.483 1.632 1.00 0.00 C ATOM 1486 C SER A 97 -7.305 -3.521 2.305 1.00 0.00 C ATOM 1487 O SER A 97 -6.849 -2.554 1.695 1.00 0.00 O ATOM 1488 CB SER A 97 -9.557 -4.598 2.464 1.00 0.00 C ATOM 1489 OG SER A 97 -10.422 -3.501 2.226 1.00 0.00 O ATOM 0 H SER A 97 -8.080 -6.532 2.027 1.00 0.00 H new ATOM 0 HA SER A 97 -8.530 -4.089 0.647 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.070 -5.529 2.221 1.00 0.00 H new ATOM 0 HB3 SER A 97 -9.302 -4.641 3.523 1.00 0.00 H new ATOM 0 HG SER A 97 -11.232 -3.600 2.769 1.00 0.00 H new ATOM 1495 N ARG A 98 -6.991 -3.794 3.567 1.00 0.00 N ATOM 1496 CA ARG A 98 -6.072 -2.953 4.325 1.00 0.00 C ATOM 1497 C ARG A 98 -4.956 -2.422 3.429 1.00 0.00 C ATOM 1498 O ARG A 98 -4.445 -1.322 3.642 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.473 -3.739 5.493 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.373 -3.791 6.717 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.790 -2.398 7.161 1.00 0.00 C ATOM 1502 NE ARG A 98 -7.225 -2.376 8.555 1.00 0.00 N ATOM 1503 CZ ARG A 98 -8.458 -2.680 8.945 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -9.373 -3.029 8.050 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -8.779 -2.637 10.232 1.00 0.00 N ATOM 0 H ARG A 98 -7.359 -4.591 4.086 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.634 -2.105 4.717 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -5.261 -4.757 5.165 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.520 -3.289 5.772 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.260 -4.383 6.493 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.852 -4.293 7.532 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.954 -1.711 7.031 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.599 -2.041 6.523 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.545 -2.113 9.268 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -9.130 -3.064 7.060 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.319 -3.262 8.352 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -8.078 -2.370 10.924 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.726 -2.871 10.529 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.583 -3.212 2.428 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.527 -2.822 1.500 1.00 0.00 C ATOM 1521 C LEU A 99 -4.061 -1.868 0.436 1.00 0.00 C ATOM 1522 O LEU A 99 -3.429 -0.862 0.118 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.924 -4.060 0.834 1.00 0.00 C ATOM 1524 CG LEU A 99 -2.202 -5.037 1.763 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -2.046 -6.394 1.093 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.845 -4.482 2.171 1.00 0.00 C ATOM 0 H LEU A 99 -4.996 -4.125 2.238 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.751 -2.307 2.067 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.722 -4.598 0.323 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.221 -3.730 0.069 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.804 -5.166 2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.530 -7.076 1.769 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.030 -6.796 0.853 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.466 -6.283 0.177 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.346 -5.191 2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.235 -4.323 1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.981 -3.534 2.692 1.00 0.00 H new ATOM 1538 N GLN A 100 -5.230 -2.192 -0.108 1.00 0.00 N ATOM 1539 CA GLN A 100 -5.850 -1.362 -1.134 1.00 0.00 C ATOM 1540 C GLN A 100 -5.953 0.088 -0.674 1.00 0.00 C ATOM 1541 O GLN A 100 -5.822 1.014 -1.474 1.00 0.00 O ATOM 1542 CB GLN A 100 -7.239 -1.899 -1.483 1.00 0.00 C ATOM 1543 CG GLN A 100 -7.212 -3.096 -2.420 1.00 0.00 C ATOM 1544 CD GLN A 100 -8.454 -3.191 -3.283 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -9.332 -2.329 -3.224 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -8.536 -4.241 -4.091 1.00 0.00 N ATOM 0 H GLN A 100 -5.766 -3.022 0.144 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.220 -1.397 -2.023 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.752 -2.180 -0.563 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.823 -1.101 -1.943 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.333 -3.030 -3.061 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -7.111 -4.009 -1.833 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.785 -4.931 -4.108 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.350 -4.357 -4.695 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.188 0.277 0.620 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.308 1.615 1.187 1.00 0.00 C ATOM 1557 C ILE A 101 -4.943 2.283 1.311 1.00 0.00 C ATOM 1558 O ILE A 101 -4.755 3.420 0.875 1.00 0.00 O ATOM 1559 CB ILE A 101 -6.978 1.581 2.573 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.337 0.883 2.489 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.134 2.992 3.120 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -8.269 -0.605 2.754 1.00 0.00 C ATOM 0 H ILE A 101 -6.299 -0.479 1.296 1.00 0.00 H new ATOM 0 HA ILE A 101 -6.932 2.192 0.505 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.342 1.016 3.255 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.017 1.341 3.207 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.761 1.049 1.499 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.609 2.952 4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.153 3.457 3.211 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.752 3.579 2.441 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.268 -1.034 2.678 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -7.615 -1.076 2.020 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.875 -0.779 3.755 1.00 0.00 H new ATOM 1574 N CYS A 102 -3.993 1.570 1.906 1.00 0.00 N ATOM 1575 CA CYS A 102 -2.644 2.094 2.087 1.00 0.00 C ATOM 1576 C CYS A 102 -2.005 2.427 0.742 1.00 0.00 C ATOM 1577 O CYS A 102 -1.266 3.404 0.618 1.00 0.00 O ATOM 1578 CB CYS A 102 -1.778 1.083 2.840 1.00 0.00 C ATOM 1579 SG CYS A 102 -0.134 1.697 3.276 1.00 0.00 S ATOM 0 H CYS A 102 -4.132 0.628 2.271 1.00 0.00 H new ATOM 0 HA CYS A 102 -2.713 3.010 2.673 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.296 0.785 3.752 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.669 0.188 2.228 1.00 0.00 H new ATOM 0 HG CYS A 102 0.195 1.257 4.454 1.00 0.00 H new ATOM 1585 N THR A 103 -2.293 1.606 -0.263 1.00 0.00 N ATOM 1586 CA THR A 103 -1.745 1.811 -1.598 1.00 0.00 C ATOM 1587 C THR A 103 -2.452 2.957 -2.313 1.00 0.00 C ATOM 1588 O THR A 103 -1.825 3.728 -3.038 1.00 0.00 O ATOM 1589 CB THR A 103 -1.863 0.536 -2.455 1.00 0.00 C ATOM 1590 OG1 THR A 103 -1.064 0.665 -3.636 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.311 0.276 -2.842 1.00 0.00 C ATOM 0 H THR A 103 -2.903 0.793 -0.178 1.00 0.00 H new ATOM 0 HA THR A 103 -0.691 2.060 -1.472 1.00 0.00 H new ATOM 0 HB THR A 103 -1.505 -0.307 -1.864 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.247 1.164 -3.425 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.369 -0.629 -3.447 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.911 0.150 -1.941 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.691 1.121 -3.416 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.760 3.062 -2.103 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.552 4.115 -2.728 1.00 0.00 C ATOM 1601 C GLN A 104 -4.413 5.427 -1.963 1.00 0.00 C ATOM 1602 O GLN A 104 -3.882 6.409 -2.485 1.00 0.00 O ATOM 1603 CB GLN A 104 -6.024 3.704 -2.796 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.862 4.591 -3.702 1.00 0.00 C ATOM 1605 CD GLN A 104 -8.346 4.301 -3.592 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -8.749 3.192 -3.242 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -9.168 5.300 -3.891 1.00 0.00 N ATOM 0 H GLN A 104 -4.294 2.431 -1.505 1.00 0.00 H new ATOM 0 HA GLN A 104 -4.177 4.264 -3.741 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.089 2.674 -3.148 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.445 3.724 -1.791 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -6.680 5.636 -3.450 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.544 4.452 -4.735 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -8.790 6.203 -4.177 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -10.177 5.164 -3.835 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.894 5.438 -0.724 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.823 6.630 0.113 1.00 0.00 C ATOM 1618 C HIS A 105 -3.516 7.382 -0.121 1.00 0.00 C ATOM 1619 O HIS A 105 -3.454 8.602 0.029 1.00 0.00 O ATOM 1620 CB HIS A 105 -4.949 6.251 1.589 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.515 7.345 2.442 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -6.785 7.855 2.267 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -4.978 8.025 3.481 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -7.003 8.802 3.161 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -5.922 8.925 3.911 1.00 0.00 N ATOM 0 H HIS A 105 -5.337 4.635 -0.278 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.652 7.284 -0.159 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.583 5.369 1.676 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -3.966 5.976 1.970 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.990 7.886 3.895 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -7.911 9.378 3.262 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -5.807 9.581 4.683 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.473 6.645 -0.489 1.00 0.00 N ATOM 1635 CA HIS A 106 -1.166 7.241 -0.744 1.00 0.00 C ATOM 1636 C HIS A 106 -1.059 7.717 -2.190 1.00 0.00 C ATOM 1637 O HIS A 106 -0.959 8.915 -2.455 1.00 0.00 O ATOM 1638 CB HIS A 106 -0.055 6.236 -0.442 1.00 0.00 C ATOM 1639 CG HIS A 106 0.193 6.039 1.022 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.423 5.688 1.537 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.640 6.148 2.084 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.336 5.588 2.851 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.094 5.862 3.208 1.00 0.00 N ATOM 0 H HIS A 106 -2.507 5.634 -0.617 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.053 8.103 -0.087 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.312 5.277 -0.891 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.867 6.573 -0.916 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.687 6.411 2.052 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.143 5.327 3.520 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -0.262 5.861 4.164 1.00 0.00 H new ATOM 1652 N THR A 107 -1.080 6.770 -3.122 1.00 0.00 N ATOM 1653 CA THR A 107 -0.983 7.091 -4.541 1.00 0.00 C ATOM 1654 C THR A 107 -1.855 8.291 -4.893 1.00 0.00 C ATOM 1655 O THR A 107 -1.529 9.063 -5.795 1.00 0.00 O ATOM 1656 CB THR A 107 -1.397 5.895 -5.418 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.785 5.998 -6.708 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.909 5.834 -5.571 1.00 0.00 C ATOM 0 H THR A 107 -1.163 5.774 -2.920 1.00 0.00 H new ATOM 0 HA THR A 107 0.061 7.332 -4.740 1.00 0.00 H new ATOM 0 HB THR A 107 -1.060 4.981 -4.929 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.749 6.939 -6.979 1.00 0.00 H new ATOM 0 HG21 THR A 107 -3.178 4.981 -6.194 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.370 5.725 -4.589 1.00 0.00 H new ATOM 0 HG23 THR A 107 -3.265 6.752 -6.039 1.00 0.00 H new ATOM 1666 N GLU A 108 -2.964 8.442 -4.176 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.882 9.549 -4.415 1.00 0.00 C ATOM 1668 C GLU A 108 -3.203 10.888 -4.142 1.00 0.00 C ATOM 1669 O GLU A 108 -3.311 11.823 -4.934 1.00 0.00 O ATOM 1670 CB GLU A 108 -5.127 9.407 -3.535 1.00 0.00 C ATOM 1671 CG GLU A 108 -6.378 10.013 -4.149 1.00 0.00 C ATOM 1672 CD GLU A 108 -7.460 10.281 -3.121 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -7.156 10.917 -2.091 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -8.612 9.853 -3.347 1.00 0.00 O ATOM 0 H GLU A 108 -3.248 7.812 -3.426 1.00 0.00 H new ATOM 0 HA GLU A 108 -4.181 9.520 -5.463 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.304 8.350 -3.339 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.938 9.883 -2.573 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -6.118 10.946 -4.649 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.766 9.339 -4.913 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.504 10.971 -3.015 1.00 0.00 N ATOM 1682 CA ALA A 109 -1.806 12.194 -2.637 1.00 0.00 C ATOM 1683 C ALA A 109 -0.875 12.660 -3.751 1.00 0.00 C ATOM 1684 O ALA A 109 -0.715 13.860 -3.978 1.00 0.00 O ATOM 1685 CB ALA A 109 -1.026 11.980 -1.349 1.00 0.00 C ATOM 0 H ALA A 109 -2.406 10.206 -2.348 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.551 12.973 -2.472 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.510 12.901 -1.079 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.713 11.701 -0.550 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.296 11.184 -1.494 1.00 0.00 H new ATOM 1691 N ILE A 110 -0.261 11.705 -4.441 1.00 0.00 N ATOM 1692 CA ILE A 110 0.654 12.019 -5.531 1.00 0.00 C ATOM 1693 C ILE A 110 0.041 13.034 -6.490 1.00 0.00 C ATOM 1694 O ILE A 110 -0.942 12.744 -7.171 1.00 0.00 O ATOM 1695 CB ILE A 110 1.045 10.755 -6.320 1.00 0.00 C ATOM 1696 CG1 ILE A 110 1.664 9.715 -5.384 1.00 0.00 C ATOM 1697 CG2 ILE A 110 2.011 11.108 -7.441 1.00 0.00 C ATOM 1698 CD1 ILE A 110 2.947 10.177 -4.730 1.00 0.00 C ATOM 0 H ILE A 110 -0.381 10.708 -4.265 1.00 0.00 H new ATOM 0 HA ILE A 110 1.549 12.446 -5.078 1.00 0.00 H new ATOM 0 HB ILE A 110 0.145 10.328 -6.763 1.00 0.00 H new ATOM 0 HG12 ILE A 110 0.942 9.461 -4.608 1.00 0.00 H new ATOM 0 HG13 ILE A 110 1.861 8.803 -5.947 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.278 10.205 -7.989 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.537 11.818 -8.119 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.911 11.555 -7.019 1.00 0.00 H new ATOM 0 HD11 ILE A 110 3.329 9.389 -4.081 1.00 0.00 H new ATOM 0 HD12 ILE A 110 3.686 10.404 -5.499 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.752 11.072 -4.139 1.00 0.00 H new ATOM 1710 N GLY A 111 0.629 14.225 -6.539 1.00 0.00 N ATOM 1711 CA GLY A 111 0.127 15.264 -7.419 1.00 0.00 C ATOM 1712 C GLY A 111 0.443 14.992 -8.876 1.00 0.00 C ATOM 1713 O GLY A 111 0.823 13.879 -9.240 1.00 0.00 O ATOM 0 H GLY A 111 1.444 14.489 -5.985 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -0.952 15.351 -7.295 1.00 0.00 H new ATOM 0 HA3 GLY A 111 0.560 16.222 -7.129 1.00 0.00 H new ATOM 1717 N LYS A 112 0.284 16.011 -9.715 1.00 0.00 N ATOM 1718 CA LYS A 112 0.554 15.877 -11.141 1.00 0.00 C ATOM 1719 C LYS A 112 1.974 16.325 -11.471 1.00 0.00 C ATOM 1720 O LYS A 112 2.690 16.833 -10.609 1.00 0.00 O ATOM 1721 CB LYS A 112 -0.452 16.700 -11.951 1.00 0.00 C ATOM 1722 CG LYS A 112 -0.213 18.198 -11.876 1.00 0.00 C ATOM 1723 CD LYS A 112 -1.226 18.966 -12.708 1.00 0.00 C ATOM 1724 CE LYS A 112 -2.562 19.084 -11.992 1.00 0.00 C ATOM 1725 NZ LYS A 112 -3.431 20.126 -12.606 1.00 0.00 N ATOM 0 H LYS A 112 -0.031 16.939 -9.431 1.00 0.00 H new ATOM 0 HA LYS A 112 0.453 14.825 -11.407 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -0.410 16.386 -12.994 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -1.458 16.483 -11.593 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -0.271 18.525 -10.838 1.00 0.00 H new ATOM 0 HG3 LYS A 112 0.794 18.425 -12.226 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -0.840 19.962 -12.925 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -1.368 18.463 -13.665 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -3.074 18.122 -12.019 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -2.392 19.325 -10.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -4.332 20.175 -12.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -2.953 21.049 -12.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -3.615 19.883 -13.600 1.00 0.00 H new ATOM 1739 N ASN A 113 2.375 16.134 -12.723 1.00 0.00 N ATOM 1740 CA ASN A 113 3.710 16.519 -13.166 1.00 0.00 C ATOM 1741 C ASN A 113 4.760 16.127 -12.132 1.00 0.00 C ATOM 1742 O ASN A 113 5.685 16.889 -11.852 1.00 0.00 O ATOM 1743 CB ASN A 113 3.769 18.026 -13.424 1.00 0.00 C ATOM 1744 CG ASN A 113 5.093 18.459 -14.023 1.00 0.00 C ATOM 1745 OD1 ASN A 113 5.814 19.272 -13.444 1.00 0.00 O ATOM 1746 ND2 ASN A 113 5.420 17.915 -15.190 1.00 0.00 N ATOM 0 H ASN A 113 1.794 15.715 -13.449 1.00 0.00 H new ATOM 0 HA ASN A 113 3.925 15.990 -14.094 1.00 0.00 H new ATOM 0 HB2 ASN A 113 2.959 18.309 -14.097 1.00 0.00 H new ATOM 0 HB3 ASN A 113 3.606 18.559 -12.487 1.00 0.00 H new ATOM 0 HD21 ASN A 113 6.299 18.167 -15.642 1.00 0.00 H new ATOM 0 HD22 ASN A 113 4.792 17.245 -15.634 1.00 0.00 H new ATOM 1753 N ASN A 114 4.611 14.933 -11.568 1.00 0.00 N ATOM 1754 CA ASN A 114 5.546 14.438 -10.565 1.00 0.00 C ATOM 1755 C ASN A 114 6.989 14.660 -11.010 1.00 0.00 C ATOM 1756 O ASN A 114 7.762 15.336 -10.331 1.00 0.00 O ATOM 1757 CB ASN A 114 5.306 12.951 -10.301 1.00 0.00 C ATOM 1758 CG ASN A 114 5.310 12.130 -11.576 1.00 0.00 C ATOM 1759 OD1 ASN A 114 4.447 12.296 -12.438 1.00 0.00 O ATOM 1760 ND2 ASN A 114 6.285 11.237 -11.701 1.00 0.00 N ATOM 0 H ASN A 114 3.851 14.290 -11.789 1.00 0.00 H new ATOM 0 HA ASN A 114 5.378 14.995 -9.643 1.00 0.00 H new ATOM 0 HB2 ASN A 114 6.076 12.575 -9.628 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.350 12.824 -9.793 1.00 0.00 H new ATOM 0 HD21 ASN A 114 6.339 10.655 -12.537 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.979 11.133 -10.961 1.00 0.00 H new ATOM 1767 N SER A 115 7.344 14.087 -12.155 1.00 0.00 N ATOM 1768 CA SER A 115 8.694 14.219 -12.690 1.00 0.00 C ATOM 1769 C SER A 115 9.214 15.642 -12.506 1.00 0.00 C ATOM 1770 O SER A 115 10.259 15.859 -11.895 1.00 0.00 O ATOM 1771 CB SER A 115 8.717 13.843 -14.173 1.00 0.00 C ATOM 1772 OG SER A 115 10.047 13.714 -14.645 1.00 0.00 O ATOM 0 H SER A 115 6.715 13.527 -12.730 1.00 0.00 H new ATOM 0 HA SER A 115 9.345 13.539 -12.140 1.00 0.00 H new ATOM 0 HB2 SER A 115 8.182 12.905 -14.322 1.00 0.00 H new ATOM 0 HB3 SER A 115 8.194 14.604 -14.753 1.00 0.00 H new ATOM 0 HG SER A 115 10.035 13.472 -15.594 1.00 0.00 H new ATOM 1778 N GLY A 116 8.475 16.609 -13.042 1.00 0.00 N ATOM 1779 CA GLY A 116 8.877 17.999 -12.927 1.00 0.00 C ATOM 1780 C GLY A 116 10.186 18.285 -13.636 1.00 0.00 C ATOM 1781 O GLY A 116 10.766 17.416 -14.288 1.00 0.00 O ATOM 0 H GLY A 116 7.606 16.455 -13.553 1.00 0.00 H new ATOM 0 HA2 GLY A 116 8.096 18.635 -13.343 1.00 0.00 H new ATOM 0 HA3 GLY A 116 8.974 18.260 -11.873 1.00 0.00 H new ATOM 1785 N PRO A 117 10.670 19.530 -13.513 1.00 0.00 N ATOM 1786 CA PRO A 117 11.924 19.957 -14.142 1.00 0.00 C ATOM 1787 C PRO A 117 13.145 19.313 -13.495 1.00 0.00 C ATOM 1788 O PRO A 117 14.191 19.168 -14.129 1.00 0.00 O ATOM 1789 CB PRO A 117 11.936 21.471 -13.917 1.00 0.00 C ATOM 1790 CG PRO A 117 11.093 21.681 -12.707 1.00 0.00 C ATOM 1791 CD PRO A 117 10.032 20.616 -12.752 1.00 0.00 C ATOM 0 HA PRO A 117 11.973 19.668 -15.192 1.00 0.00 H new ATOM 0 HB2 PRO A 117 12.950 21.840 -13.762 1.00 0.00 H new ATOM 0 HB3 PRO A 117 11.531 22.002 -14.778 1.00 0.00 H new ATOM 0 HG2 PRO A 117 11.689 21.600 -11.798 1.00 0.00 H new ATOM 0 HG3 PRO A 117 10.648 22.676 -12.709 1.00 0.00 H new ATOM 0 HD2 PRO A 117 9.746 20.291 -11.752 1.00 0.00 H new ATOM 0 HD3 PRO A 117 9.126 20.972 -13.243 1.00 0.00 H new ATOM 1799 N SER A 118 13.006 18.928 -12.231 1.00 0.00 N ATOM 1800 CA SER A 118 14.100 18.302 -11.497 1.00 0.00 C ATOM 1801 C SER A 118 13.746 16.868 -11.113 1.00 0.00 C ATOM 1802 O SER A 118 13.059 16.632 -10.119 1.00 0.00 O ATOM 1803 CB SER A 118 14.430 19.112 -10.242 1.00 0.00 C ATOM 1804 OG SER A 118 14.836 20.428 -10.577 1.00 0.00 O ATOM 0 H SER A 118 12.146 19.038 -11.693 1.00 0.00 H new ATOM 0 HA SER A 118 14.975 18.280 -12.147 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.557 19.152 -9.591 1.00 0.00 H new ATOM 0 HB3 SER A 118 15.222 18.615 -9.682 1.00 0.00 H new ATOM 0 HG SER A 118 15.040 20.926 -9.758 1.00 0.00 H new ATOM 1810 N SER A 119 14.221 15.915 -11.908 1.00 0.00 N ATOM 1811 CA SER A 119 13.952 14.504 -11.654 1.00 0.00 C ATOM 1812 C SER A 119 14.398 14.110 -10.249 1.00 0.00 C ATOM 1813 O SER A 119 15.531 14.372 -9.849 1.00 0.00 O ATOM 1814 CB SER A 119 14.665 13.633 -12.690 1.00 0.00 C ATOM 1815 OG SER A 119 16.067 13.829 -12.644 1.00 0.00 O ATOM 0 H SER A 119 14.794 16.094 -12.733 1.00 0.00 H new ATOM 0 HA SER A 119 12.877 14.345 -11.733 1.00 0.00 H new ATOM 0 HB2 SER A 119 14.435 12.583 -12.507 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.294 13.871 -13.687 1.00 0.00 H new ATOM 0 HG SER A 119 16.336 14.051 -11.728 1.00 0.00 H new ATOM 1821 N GLY A 120 13.495 13.479 -9.504 1.00 0.00 N ATOM 1822 CA GLY A 120 13.813 13.059 -8.152 1.00 0.00 C ATOM 1823 C GLY A 120 14.456 11.687 -8.107 1.00 0.00 C ATOM 1824 O GLY A 120 15.361 11.444 -7.309 1.00 0.00 O ATOM 0 H GLY A 120 12.550 13.252 -9.813 1.00 0.00 H new ATOM 0 HA2 GLY A 120 14.485 13.787 -7.697 1.00 0.00 H new ATOM 0 HA3 GLY A 120 12.902 13.050 -7.554 1.00 0.00 H new TER 1828 GLY A 120