USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 994 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 120 LYS NZ :NH3+ -149:sc= 1.17 (180deg=0) USER MOD Set 1.2: A 122 HIS : no HE2:sc= 1.14 K(o=2.3,f=-10!) USER MOD Set 2.1: A 74 SER OG : rot -31:sc= 0.0531 USER MOD Set 2.2: A 83 SER OG : rot -59:sc= 1.26 USER MOD Set 3.1: A 73 HIS : no HE2:sc= 0.653 K(o=1.4,f=-0.77) USER MOD Set 3.2: A 85 SER OG : rot -132:sc= 0.767 USER MOD Set 4.1: A 29 ASN : amide:sc= -0.758 K(o=-0.76,f=-2.9!) USER MOD Set 4.2: A 33 LYS NZ :NH3+ 168:sc= 0 (180deg=0) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 160:sc= -0.461 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0928 K(o=-0.093,f=-3.6!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 170:sc=-0.00911 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 161:sc= -2.47! (180deg=-3.34!) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 60:sc= -3.65! USER MOD Single : A 55 LYS NZ :NH3+ -173:sc= 0.467 (180deg=0.452) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 145:sc= 0.7 USER MOD Single : A 69 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.104) USER MOD Single : A 70 HIS : no HD1:sc= -1.41 X(o=-1.4,f=-1.1) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN :FLIP amide:sc= -0.044 F(o=-0.88,f=-0.044) USER MOD Single : A 80 HIS : no HE2:sc= -2.14 X(o=-2.1,f=-2.3!) USER MOD Single : A 81 THR OG1 : rot 58:sc= 0.671 USER MOD Single : A 82 TYR OH : rot 170:sc= -3.16! USER MOD Single : A 84 TYR OH : rot 111:sc= 0.82 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 98 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.121) USER MOD Single : A 101 TYR OH : rot 30:sc= -0.0303 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.0199 X(o=-0.02,f=-0.02) USER MOD Single : A 113 THR OG1 : rot 124:sc= 0.185 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -169:sc= 0.0716 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot -83:sc= 1.28 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.062 X(o=-0.062,f=-0.0016) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 150:sc=-0.00527 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -8.156 -1.164 17.472 1.00 0.00 N ATOM 9 CA VAL A 3 -6.706 -1.483 17.348 1.00 0.00 C ATOM 10 C VAL A 3 -5.993 -0.345 16.617 1.00 0.00 C ATOM 11 O VAL A 3 -6.507 0.214 15.669 1.00 0.00 O ATOM 12 CB VAL A 3 -6.536 -2.783 16.558 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.030 -2.577 15.125 1.00 0.00 C ATOM 14 CG2 VAL A 3 -5.057 -3.176 16.536 1.00 0.00 C ATOM 0 HA VAL A 3 -6.274 -1.602 18.342 1.00 0.00 H new ATOM 0 HB VAL A 3 -7.116 -3.575 17.032 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -6.909 -3.502 14.562 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.083 -2.296 15.140 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -6.450 -1.785 14.651 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.935 -4.102 15.974 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.477 -2.384 16.062 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.704 -3.322 17.557 1.00 0.00 H new ATOM 24 N TYR A 4 -4.813 0.004 17.050 1.00 0.00 N ATOM 25 CA TYR A 4 -4.068 1.106 16.379 1.00 0.00 C ATOM 26 C TYR A 4 -3.162 0.523 15.293 1.00 0.00 C ATOM 27 O TYR A 4 -2.571 -0.525 15.460 1.00 0.00 O ATOM 28 CB TYR A 4 -3.215 1.847 17.411 1.00 0.00 C ATOM 29 CG TYR A 4 -2.537 3.024 16.754 1.00 0.00 C ATOM 30 CD1 TYR A 4 -3.203 4.252 16.657 1.00 0.00 C ATOM 31 CD2 TYR A 4 -1.242 2.888 16.240 1.00 0.00 C ATOM 32 CE1 TYR A 4 -2.575 5.344 16.047 1.00 0.00 C ATOM 33 CE2 TYR A 4 -0.613 3.981 15.629 1.00 0.00 C ATOM 34 CZ TYR A 4 -1.279 5.208 15.533 1.00 0.00 C ATOM 35 OH TYR A 4 -0.660 6.284 14.931 1.00 0.00 O ATOM 0 H TYR A 4 -4.332 -0.427 17.840 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.776 1.800 15.927 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -3.839 2.188 18.237 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.469 1.173 17.833 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -4.202 4.357 17.053 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -0.728 1.941 16.314 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -3.089 6.291 15.973 1.00 0.00 H new ATOM 0 HE2 TYR A 4 0.386 3.876 15.232 1.00 0.00 H new ATOM 0 HH TYR A 4 0.235 6.020 14.630 1.00 0.00 H new ATOM 45 N THR A 5 -3.049 1.195 14.179 1.00 0.00 N ATOM 46 CA THR A 5 -2.180 0.679 13.083 1.00 0.00 C ATOM 47 C THR A 5 -0.786 1.297 13.206 1.00 0.00 C ATOM 48 O THR A 5 -0.637 2.450 13.557 1.00 0.00 O ATOM 49 CB THR A 5 -2.789 1.057 11.730 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.133 0.601 11.674 1.00 0.00 O ATOM 51 CG2 THR A 5 -1.980 0.410 10.606 1.00 0.00 C ATOM 0 H THR A 5 -3.520 2.078 13.981 1.00 0.00 H new ATOM 0 HA THR A 5 -2.104 -0.406 13.157 1.00 0.00 H new ATOM 0 HB THR A 5 -2.768 2.140 11.611 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.618 1.097 10.982 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.414 0.680 9.643 1.00 0.00 H new ATOM 0 HG22 THR A 5 -0.949 0.762 10.650 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.999 -0.674 10.722 1.00 0.00 H new ATOM 59 N TYR A 6 0.237 0.538 12.921 1.00 0.00 N ATOM 60 CA TYR A 6 1.619 1.085 13.026 1.00 0.00 C ATOM 61 C TYR A 6 2.302 1.016 11.658 1.00 0.00 C ATOM 62 O TYR A 6 2.097 0.093 10.896 1.00 0.00 O ATOM 63 CB TYR A 6 2.419 0.260 14.036 1.00 0.00 C ATOM 64 CG TYR A 6 3.780 0.885 14.232 1.00 0.00 C ATOM 65 CD1 TYR A 6 3.946 1.926 15.153 1.00 0.00 C ATOM 66 CD2 TYR A 6 4.876 0.423 13.494 1.00 0.00 C ATOM 67 CE1 TYR A 6 5.208 2.505 15.336 1.00 0.00 C ATOM 68 CE2 TYR A 6 6.137 1.002 13.676 1.00 0.00 C ATOM 69 CZ TYR A 6 6.303 2.043 14.597 1.00 0.00 C ATOM 70 OH TYR A 6 7.547 2.614 14.777 1.00 0.00 O ATOM 0 H TYR A 6 0.176 -0.435 12.621 1.00 0.00 H new ATOM 0 HA TYR A 6 1.574 2.122 13.358 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.888 0.215 14.987 1.00 0.00 H new ATOM 0 HB3 TYR A 6 2.526 -0.765 13.681 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.101 2.283 15.723 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.748 -0.381 12.784 1.00 0.00 H new ATOM 0 HE1 TYR A 6 5.336 3.308 16.047 1.00 0.00 H new ATOM 0 HE2 TYR A 6 6.982 0.646 13.106 1.00 0.00 H new ATOM 0 HH TYR A 6 8.196 2.176 14.188 1.00 0.00 H new ATOM 80 N GLU A 7 3.115 1.988 11.343 1.00 0.00 N ATOM 81 CA GLU A 7 3.812 1.980 10.026 1.00 0.00 C ATOM 82 C GLU A 7 5.313 1.788 10.247 1.00 0.00 C ATOM 83 O GLU A 7 5.885 2.317 11.180 1.00 0.00 O ATOM 84 CB GLU A 7 3.567 3.311 9.312 1.00 0.00 C ATOM 85 CG GLU A 7 4.218 3.274 7.928 1.00 0.00 C ATOM 86 CD GLU A 7 4.050 4.635 7.249 1.00 0.00 C ATOM 87 OE1 GLU A 7 3.499 5.524 7.877 1.00 0.00 O ATOM 88 OE2 GLU A 7 4.472 4.765 6.112 1.00 0.00 O ATOM 0 H GLU A 7 3.326 2.787 11.941 1.00 0.00 H new ATOM 0 HA GLU A 7 3.427 1.164 9.415 1.00 0.00 H new ATOM 0 HB2 GLU A 7 2.497 3.494 9.217 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.980 4.132 9.898 1.00 0.00 H new ATOM 0 HG2 GLU A 7 5.276 3.029 8.019 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.761 2.493 7.320 1.00 0.00 H new ATOM 95 N ASN A 8 5.958 1.034 9.399 1.00 0.00 N ATOM 96 CA ASN A 8 7.422 0.810 9.565 1.00 0.00 C ATOM 97 C ASN A 8 8.172 1.402 8.370 1.00 0.00 C ATOM 98 O ASN A 8 7.713 1.345 7.247 1.00 0.00 O ATOM 99 CB ASN A 8 7.700 -0.693 9.648 1.00 0.00 C ATOM 100 CG ASN A 8 9.125 -0.921 10.156 1.00 0.00 C ATOM 101 OD1 ASN A 8 9.772 -0.002 10.617 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.645 -2.116 10.092 1.00 0.00 N ATOM 0 H ASN A 8 5.535 0.564 8.599 1.00 0.00 H new ATOM 0 HA ASN A 8 7.761 1.295 10.480 1.00 0.00 H new ATOM 0 HB2 ASN A 8 6.983 -1.170 10.317 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.574 -1.152 8.667 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.594 -2.278 10.429 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.102 -2.888 9.705 1.00 0.00 H new ATOM 109 N GLU A 9 9.322 1.970 8.605 1.00 0.00 N ATOM 110 CA GLU A 9 10.103 2.566 7.484 1.00 0.00 C ATOM 111 C GLU A 9 11.475 1.891 7.407 1.00 0.00 C ATOM 112 O GLU A 9 12.105 1.631 8.413 1.00 0.00 O ATOM 113 CB GLU A 9 10.286 4.065 7.728 1.00 0.00 C ATOM 114 CG GLU A 9 8.915 4.739 7.815 1.00 0.00 C ATOM 115 CD GLU A 9 9.099 6.246 8.001 1.00 0.00 C ATOM 116 OE1 GLU A 9 10.221 6.661 8.242 1.00 0.00 O ATOM 117 OE2 GLU A 9 8.115 6.961 7.899 1.00 0.00 O ATOM 0 H GLU A 9 9.755 2.048 9.525 1.00 0.00 H new ATOM 0 HA GLU A 9 9.568 2.415 6.547 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.843 4.229 8.651 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.870 4.507 6.921 1.00 0.00 H new ATOM 0 HG2 GLU A 9 8.342 4.541 6.909 1.00 0.00 H new ATOM 0 HG3 GLU A 9 8.347 4.326 8.648 1.00 0.00 H new ATOM 124 N PHE A 10 11.942 1.605 6.223 1.00 0.00 N ATOM 125 CA PHE A 10 13.273 0.948 6.089 1.00 0.00 C ATOM 126 C PHE A 10 13.854 1.242 4.704 1.00 0.00 C ATOM 127 O PHE A 10 13.139 1.335 3.727 1.00 0.00 O ATOM 128 CB PHE A 10 13.115 -0.564 6.262 1.00 0.00 C ATOM 129 CG PHE A 10 14.460 -1.233 6.109 1.00 0.00 C ATOM 130 CD1 PHE A 10 15.301 -1.377 7.219 1.00 0.00 C ATOM 131 CD2 PHE A 10 14.865 -1.711 4.857 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.548 -1.996 7.076 1.00 0.00 C ATOM 133 CE2 PHE A 10 16.113 -2.332 4.714 1.00 0.00 C ATOM 134 CZ PHE A 10 16.954 -2.474 5.824 1.00 0.00 C ATOM 0 H PHE A 10 11.461 1.797 5.344 1.00 0.00 H new ATOM 0 HA PHE A 10 13.945 1.335 6.854 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.696 -0.786 7.243 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.417 -0.954 5.522 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.988 -1.011 8.185 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.215 -1.601 4.001 1.00 0.00 H new ATOM 0 HE1 PHE A 10 17.198 -2.105 7.932 1.00 0.00 H new ATOM 0 HE2 PHE A 10 16.426 -2.701 3.748 1.00 0.00 H new ATOM 0 HZ PHE A 10 17.916 -2.952 5.715 1.00 0.00 H new ATOM 144 N THR A 11 15.148 1.389 4.614 1.00 0.00 N ATOM 145 CA THR A 11 15.778 1.675 3.295 1.00 0.00 C ATOM 146 C THR A 11 16.622 0.474 2.866 1.00 0.00 C ATOM 147 O THR A 11 17.185 -0.224 3.686 1.00 0.00 O ATOM 148 CB THR A 11 16.670 2.912 3.413 1.00 0.00 C ATOM 149 OG1 THR A 11 17.864 2.567 4.100 1.00 0.00 O ATOM 150 CG2 THR A 11 15.931 4.005 4.186 1.00 0.00 C ATOM 0 H THR A 11 15.796 1.323 5.399 1.00 0.00 H new ATOM 0 HA THR A 11 15.002 1.859 2.552 1.00 0.00 H new ATOM 0 HB THR A 11 16.916 3.280 2.417 1.00 0.00 H new ATOM 0 HG1 THR A 11 18.438 3.358 4.175 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.568 4.886 4.269 1.00 0.00 H new ATOM 0 HG22 THR A 11 15.015 4.268 3.657 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.683 3.641 5.183 1.00 0.00 H new ATOM 158 N SER A 12 16.714 0.223 1.589 1.00 0.00 N ATOM 159 CA SER A 12 17.522 -0.936 1.115 1.00 0.00 C ATOM 160 C SER A 12 18.086 -0.638 -0.275 1.00 0.00 C ATOM 161 O SER A 12 17.737 0.343 -0.900 1.00 0.00 O ATOM 162 CB SER A 12 16.633 -2.179 1.048 1.00 0.00 C ATOM 163 OG SER A 12 15.741 -2.063 -0.052 1.00 0.00 O ATOM 0 H SER A 12 16.265 0.770 0.854 1.00 0.00 H new ATOM 0 HA SER A 12 18.345 -1.111 1.808 1.00 0.00 H new ATOM 0 HB2 SER A 12 17.247 -3.073 0.940 1.00 0.00 H new ATOM 0 HB3 SER A 12 16.071 -2.288 1.976 1.00 0.00 H new ATOM 0 HG SER A 12 15.285 -2.919 -0.195 1.00 0.00 H new ATOM 169 N ASP A 13 18.954 -1.481 -0.764 1.00 0.00 N ATOM 170 CA ASP A 13 19.538 -1.251 -2.115 1.00 0.00 C ATOM 171 C ASP A 13 18.530 -1.682 -3.183 1.00 0.00 C ATOM 172 O ASP A 13 17.447 -2.137 -2.876 1.00 0.00 O ATOM 173 CB ASP A 13 20.821 -2.073 -2.261 1.00 0.00 C ATOM 174 CG ASP A 13 21.684 -1.481 -3.377 1.00 0.00 C ATOM 175 OD1 ASP A 13 22.310 -0.461 -3.138 1.00 0.00 O ATOM 176 OD2 ASP A 13 21.705 -2.058 -4.452 1.00 0.00 O ATOM 0 H ASP A 13 19.284 -2.319 -0.286 1.00 0.00 H new ATOM 0 HA ASP A 13 19.769 -0.193 -2.239 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.374 -2.074 -1.321 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.577 -3.111 -2.488 1.00 0.00 H new ATOM 181 N ILE A 14 18.874 -1.541 -4.434 1.00 0.00 N ATOM 182 CA ILE A 14 17.928 -1.945 -5.513 1.00 0.00 C ATOM 183 C ILE A 14 16.752 -0.965 -5.543 1.00 0.00 C ATOM 184 O ILE A 14 16.289 -0.510 -4.516 1.00 0.00 O ATOM 185 CB ILE A 14 17.413 -3.358 -5.231 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.554 -4.220 -4.687 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.881 -3.976 -6.527 1.00 0.00 C ATOM 188 CD1 ILE A 14 18.224 -4.661 -3.260 1.00 0.00 C ATOM 0 H ILE A 14 19.766 -1.165 -4.755 1.00 0.00 H new ATOM 0 HA ILE A 14 18.438 -1.932 -6.476 1.00 0.00 H new ATOM 0 HB ILE A 14 16.611 -3.310 -4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.701 -5.092 -5.324 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.487 -3.657 -4.698 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.514 -4.983 -6.326 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.067 -3.364 -6.915 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.683 -4.022 -7.264 1.00 0.00 H new ATOM 0 HD11 ILE A 14 19.037 -5.275 -2.872 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.099 -3.782 -2.627 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.301 -5.240 -3.263 1.00 0.00 H new ATOM 200 N PRO A 15 16.264 -0.631 -6.747 1.00 0.00 N ATOM 201 CA PRO A 15 15.142 0.300 -6.914 1.00 0.00 C ATOM 202 C PRO A 15 13.820 -0.290 -6.405 1.00 0.00 C ATOM 203 O PRO A 15 13.579 -1.477 -6.492 1.00 0.00 O ATOM 204 CB PRO A 15 15.082 0.526 -8.424 1.00 0.00 C ATOM 205 CG PRO A 15 15.707 -0.692 -9.012 1.00 0.00 C ATOM 206 CD PRO A 15 16.764 -1.134 -8.039 1.00 0.00 C ATOM 0 HA PRO A 15 15.285 1.217 -6.343 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.054 0.648 -8.766 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.623 1.427 -8.712 1.00 0.00 H new ATOM 0 HG2 PRO A 15 14.965 -1.476 -9.163 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.143 -0.474 -9.987 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.877 -2.218 -8.032 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.739 -0.713 -8.285 1.00 0.00 H new ATOM 214 N ALA A 16 12.972 0.542 -5.866 1.00 0.00 N ATOM 215 CA ALA A 16 11.664 0.065 -5.330 1.00 0.00 C ATOM 216 C ALA A 16 10.965 -0.889 -6.313 1.00 0.00 C ATOM 217 O ALA A 16 10.480 -1.931 -5.919 1.00 0.00 O ATOM 218 CB ALA A 16 10.758 1.270 -5.074 1.00 0.00 C ATOM 0 H ALA A 16 13.131 1.545 -5.773 1.00 0.00 H new ATOM 0 HA ALA A 16 11.854 -0.478 -4.404 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.800 0.928 -4.682 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.231 1.933 -4.350 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.597 1.809 -6.008 1.00 0.00 H new ATOM 224 N PRO A 17 10.881 -0.527 -7.608 1.00 0.00 N ATOM 225 CA PRO A 17 10.201 -1.364 -8.612 1.00 0.00 C ATOM 226 C PRO A 17 10.887 -2.718 -8.827 1.00 0.00 C ATOM 227 O PRO A 17 10.231 -3.722 -9.025 1.00 0.00 O ATOM 228 CB PRO A 17 10.267 -0.520 -9.886 1.00 0.00 C ATOM 229 CG PRO A 17 11.433 0.380 -9.674 1.00 0.00 C ATOM 230 CD PRO A 17 11.431 0.704 -8.207 1.00 0.00 C ATOM 0 HA PRO A 17 9.187 -1.616 -8.301 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.402 -1.144 -10.769 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.349 0.048 -10.034 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.363 -0.108 -9.967 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.344 1.285 -10.275 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.433 0.922 -7.838 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.814 1.574 -7.985 1.00 0.00 H new ATOM 238 N LYS A 18 12.189 -2.766 -8.790 1.00 0.00 N ATOM 239 CA LYS A 18 12.879 -4.072 -8.995 1.00 0.00 C ATOM 240 C LYS A 18 12.662 -4.964 -7.770 1.00 0.00 C ATOM 241 O LYS A 18 12.588 -6.172 -7.875 1.00 0.00 O ATOM 242 CB LYS A 18 14.377 -3.841 -9.199 1.00 0.00 C ATOM 243 CG LYS A 18 14.614 -3.252 -10.591 1.00 0.00 C ATOM 244 CD LYS A 18 16.118 -3.180 -10.863 1.00 0.00 C ATOM 245 CE LYS A 18 16.367 -2.348 -12.123 1.00 0.00 C ATOM 246 NZ LYS A 18 17.790 -1.905 -12.152 1.00 0.00 N ATOM 0 H LYS A 18 12.801 -1.966 -8.628 1.00 0.00 H new ATOM 0 HA LYS A 18 12.467 -4.560 -9.878 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.759 -3.164 -8.435 1.00 0.00 H new ATOM 0 HB3 LYS A 18 14.919 -4.781 -9.092 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.126 -3.868 -11.346 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.173 -2.257 -10.657 1.00 0.00 H new ATOM 0 HD2 LYS A 18 16.632 -2.734 -10.012 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.524 -4.183 -10.990 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.140 -2.937 -13.012 1.00 0.00 H new ATOM 0 HE3 LYS A 18 15.705 -1.482 -12.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.960 -1.339 -13.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.991 -1.328 -11.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.413 -2.738 -12.158 1.00 0.00 H new ATOM 260 N LEU A 19 12.562 -4.378 -6.608 1.00 0.00 N ATOM 261 CA LEU A 19 12.352 -5.194 -5.378 1.00 0.00 C ATOM 262 C LEU A 19 10.871 -5.565 -5.255 1.00 0.00 C ATOM 263 O LEU A 19 10.523 -6.598 -4.719 1.00 0.00 O ATOM 264 CB LEU A 19 12.778 -4.383 -4.153 1.00 0.00 C ATOM 265 CG LEU A 19 12.616 -5.237 -2.894 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.290 -6.594 -3.107 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.271 -4.525 -1.707 1.00 0.00 C ATOM 0 H LEU A 19 12.617 -3.371 -6.457 1.00 0.00 H new ATOM 0 HA LEU A 19 12.949 -6.104 -5.439 1.00 0.00 H new ATOM 0 HB2 LEU A 19 13.815 -4.064 -4.258 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.173 -3.480 -4.073 1.00 0.00 H new ATOM 0 HG LEU A 19 11.556 -5.385 -2.690 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.175 -7.202 -2.210 1.00 0.00 H new ATOM 0 HD12 LEU A 19 12.826 -7.102 -3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.350 -6.446 -3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.156 -5.133 -0.810 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.331 -4.377 -1.912 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.793 -3.558 -1.554 1.00 0.00 H new ATOM 279 N PHE A 20 9.999 -4.728 -5.745 1.00 0.00 N ATOM 280 CA PHE A 20 8.541 -5.030 -5.653 1.00 0.00 C ATOM 281 C PHE A 20 8.237 -6.328 -6.406 1.00 0.00 C ATOM 282 O PHE A 20 7.466 -7.151 -5.954 1.00 0.00 O ATOM 283 CB PHE A 20 7.743 -3.882 -6.273 1.00 0.00 C ATOM 284 CG PHE A 20 6.269 -4.200 -6.209 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.530 -3.866 -5.068 1.00 0.00 C ATOM 286 CD2 PHE A 20 5.641 -4.831 -7.290 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.163 -4.160 -5.007 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.274 -5.127 -7.229 1.00 0.00 C ATOM 289 CZ PHE A 20 3.534 -4.791 -6.089 1.00 0.00 C ATOM 0 H PHE A 20 10.232 -3.848 -6.205 1.00 0.00 H new ATOM 0 HA PHE A 20 8.260 -5.145 -4.606 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.949 -2.953 -5.741 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.048 -3.731 -7.308 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.015 -3.381 -4.234 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.211 -5.089 -8.170 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.593 -3.901 -4.127 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.790 -5.615 -8.062 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.479 -5.018 -6.043 1.00 0.00 H new ATOM 299 N LYS A 21 8.831 -6.515 -7.552 1.00 0.00 N ATOM 300 CA LYS A 21 8.570 -7.758 -8.333 1.00 0.00 C ATOM 301 C LYS A 21 9.093 -8.970 -7.560 1.00 0.00 C ATOM 302 O LYS A 21 8.380 -9.929 -7.336 1.00 0.00 O ATOM 303 CB LYS A 21 9.284 -7.670 -9.684 1.00 0.00 C ATOM 304 CG LYS A 21 8.860 -8.851 -10.560 1.00 0.00 C ATOM 305 CD LYS A 21 9.634 -8.812 -11.879 1.00 0.00 C ATOM 306 CE LYS A 21 9.065 -9.863 -12.835 1.00 0.00 C ATOM 307 NZ LYS A 21 9.864 -11.117 -12.727 1.00 0.00 N ATOM 0 H LYS A 21 9.486 -5.862 -7.982 1.00 0.00 H new ATOM 0 HA LYS A 21 7.497 -7.866 -8.493 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.038 -6.730 -10.178 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.364 -7.680 -9.538 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.052 -9.790 -10.041 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.788 -8.808 -10.754 1.00 0.00 H new ATOM 0 HD2 LYS A 21 9.562 -7.821 -12.326 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.692 -9.004 -11.698 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.021 -10.062 -12.594 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.090 -9.490 -13.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 9.314 -11.913 -13.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.746 -11.014 -13.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.090 -11.300 -11.728 1.00 0.00 H new ATOM 321 N ALA A 22 10.332 -8.940 -7.154 1.00 0.00 N ATOM 322 CA ALA A 22 10.899 -10.094 -6.402 1.00 0.00 C ATOM 323 C ALA A 22 10.305 -10.137 -4.993 1.00 0.00 C ATOM 324 O ALA A 22 10.513 -11.075 -4.251 1.00 0.00 O ATOM 325 CB ALA A 22 12.419 -9.945 -6.308 1.00 0.00 C ATOM 0 H ALA A 22 10.977 -8.165 -7.311 1.00 0.00 H new ATOM 0 HA ALA A 22 10.653 -11.018 -6.925 1.00 0.00 H new ATOM 0 HB1 ALA A 22 12.834 -10.789 -5.758 1.00 0.00 H new ATOM 0 HB2 ALA A 22 12.845 -9.921 -7.311 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.662 -9.018 -5.788 1.00 0.00 H new ATOM 331 N PHE A 23 9.568 -9.128 -4.616 1.00 0.00 N ATOM 332 CA PHE A 23 8.967 -9.118 -3.252 1.00 0.00 C ATOM 333 C PHE A 23 7.640 -9.879 -3.271 1.00 0.00 C ATOM 334 O PHE A 23 7.276 -10.535 -2.316 1.00 0.00 O ATOM 335 CB PHE A 23 8.720 -7.673 -2.812 1.00 0.00 C ATOM 336 CG PHE A 23 8.207 -7.663 -1.392 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.086 -7.907 -0.329 1.00 0.00 C ATOM 338 CD2 PHE A 23 6.854 -7.411 -1.138 1.00 0.00 C ATOM 339 CE1 PHE A 23 8.610 -7.898 0.988 1.00 0.00 C ATOM 340 CE2 PHE A 23 6.378 -7.403 0.179 1.00 0.00 C ATOM 341 CZ PHE A 23 7.256 -7.647 1.242 1.00 0.00 C ATOM 0 H PHE A 23 9.357 -8.313 -5.191 1.00 0.00 H new ATOM 0 HA PHE A 23 9.651 -9.599 -2.552 1.00 0.00 H new ATOM 0 HB2 PHE A 23 9.643 -7.097 -2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 23 7.997 -7.198 -3.475 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.130 -8.102 -0.525 1.00 0.00 H new ATOM 0 HD2 PHE A 23 6.177 -7.223 -1.958 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.287 -8.085 1.808 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.334 -7.209 0.375 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.889 -7.642 2.258 1.00 0.00 H new ATOM 351 N VAL A 24 6.912 -9.796 -4.352 1.00 0.00 N ATOM 352 CA VAL A 24 5.609 -10.516 -4.427 1.00 0.00 C ATOM 353 C VAL A 24 5.687 -11.607 -5.498 1.00 0.00 C ATOM 354 O VAL A 24 5.137 -12.679 -5.345 1.00 0.00 O ATOM 355 CB VAL A 24 4.501 -9.524 -4.787 1.00 0.00 C ATOM 356 CG1 VAL A 24 4.422 -8.436 -3.715 1.00 0.00 C ATOM 357 CG2 VAL A 24 4.807 -8.884 -6.142 1.00 0.00 C ATOM 0 H VAL A 24 7.163 -9.262 -5.184 1.00 0.00 H new ATOM 0 HA VAL A 24 5.390 -10.973 -3.462 1.00 0.00 H new ATOM 0 HB VAL A 24 3.548 -10.050 -4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.633 -7.729 -3.971 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.202 -8.892 -2.750 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.375 -7.911 -3.659 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.017 -8.178 -6.397 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.761 -8.359 -6.089 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.862 -9.659 -6.906 1.00 0.00 H new ATOM 367 N LEU A 25 6.363 -11.341 -6.582 1.00 0.00 N ATOM 368 CA LEU A 25 6.472 -12.364 -7.659 1.00 0.00 C ATOM 369 C LEU A 25 7.381 -13.504 -7.196 1.00 0.00 C ATOM 370 O LEU A 25 7.132 -14.660 -7.472 1.00 0.00 O ATOM 371 CB LEU A 25 7.062 -11.720 -8.916 1.00 0.00 C ATOM 372 CG LEU A 25 6.946 -12.694 -10.091 1.00 0.00 C ATOM 373 CD1 LEU A 25 5.509 -13.212 -10.181 1.00 0.00 C ATOM 374 CD2 LEU A 25 7.311 -11.974 -11.389 1.00 0.00 C ATOM 0 H LEU A 25 6.844 -10.461 -6.768 1.00 0.00 H new ATOM 0 HA LEU A 25 5.481 -12.760 -7.883 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.535 -10.794 -9.144 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.107 -11.459 -8.748 1.00 0.00 H new ATOM 0 HG LEU A 25 7.626 -13.532 -9.938 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.424 -13.906 -11.017 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.249 -13.726 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.829 -12.374 -10.334 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.228 -12.668 -12.226 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.631 -11.136 -11.544 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.334 -11.604 -11.324 1.00 0.00 H new ATOM 386 N ASP A 26 8.434 -13.189 -6.491 1.00 0.00 N ATOM 387 CA ASP A 26 9.355 -14.258 -6.011 1.00 0.00 C ATOM 388 C ASP A 26 9.193 -14.432 -4.500 1.00 0.00 C ATOM 389 O ASP A 26 10.008 -15.050 -3.847 1.00 0.00 O ATOM 390 CB ASP A 26 10.799 -13.866 -6.326 1.00 0.00 C ATOM 391 CG ASP A 26 11.004 -13.849 -7.842 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.140 -14.350 -8.543 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.023 -13.337 -8.277 1.00 0.00 O ATOM 0 H ASP A 26 8.696 -12.239 -6.227 1.00 0.00 H new ATOM 0 HA ASP A 26 9.115 -15.196 -6.512 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.020 -12.884 -5.907 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.488 -14.572 -5.863 1.00 0.00 H new ATOM 398 N ALA A 27 8.148 -13.890 -3.938 1.00 0.00 N ATOM 399 CA ALA A 27 7.938 -14.026 -2.469 1.00 0.00 C ATOM 400 C ALA A 27 7.582 -15.477 -2.135 1.00 0.00 C ATOM 401 O ALA A 27 8.023 -16.020 -1.142 1.00 0.00 O ATOM 402 CB ALA A 27 6.796 -13.107 -2.030 1.00 0.00 C ATOM 0 H ALA A 27 7.431 -13.359 -4.432 1.00 0.00 H new ATOM 0 HA ALA A 27 8.852 -13.747 -1.945 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.642 -13.206 -0.956 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.049 -12.074 -2.267 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.882 -13.386 -2.555 1.00 0.00 H new ATOM 408 N ASP A 28 6.785 -16.105 -2.954 1.00 0.00 N ATOM 409 CA ASP A 28 6.398 -17.519 -2.681 1.00 0.00 C ATOM 410 C ASP A 28 7.654 -18.391 -2.609 1.00 0.00 C ATOM 411 O ASP A 28 7.710 -19.352 -1.869 1.00 0.00 O ATOM 412 CB ASP A 28 5.490 -18.024 -3.804 1.00 0.00 C ATOM 413 CG ASP A 28 4.168 -17.255 -3.776 1.00 0.00 C ATOM 414 OD1 ASP A 28 3.911 -16.593 -2.784 1.00 0.00 O ATOM 415 OD2 ASP A 28 3.435 -17.340 -4.748 1.00 0.00 O ATOM 0 H ASP A 28 6.385 -15.701 -3.801 1.00 0.00 H new ATOM 0 HA ASP A 28 5.867 -17.572 -1.731 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.979 -17.892 -4.769 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.305 -19.091 -3.684 1.00 0.00 H new ATOM 420 N ASN A 29 8.660 -18.065 -3.372 1.00 0.00 N ATOM 421 CA ASN A 29 9.909 -18.879 -3.347 1.00 0.00 C ATOM 422 C ASN A 29 10.968 -18.165 -2.504 1.00 0.00 C ATOM 423 O ASN A 29 11.748 -18.787 -1.811 1.00 0.00 O ATOM 424 CB ASN A 29 10.430 -19.056 -4.774 1.00 0.00 C ATOM 425 CG ASN A 29 11.402 -20.236 -4.820 1.00 0.00 C ATOM 426 OD1 ASN A 29 11.422 -21.058 -3.926 1.00 0.00 O ATOM 427 ND2 ASN A 29 12.216 -20.356 -5.834 1.00 0.00 N ATOM 0 H ASN A 29 8.672 -17.271 -4.012 1.00 0.00 H new ATOM 0 HA ASN A 29 9.697 -19.856 -2.912 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.598 -19.229 -5.457 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.930 -18.146 -5.105 1.00 0.00 H new ATOM 0 HD21 ASN A 29 12.868 -21.139 -5.875 1.00 0.00 H new ATOM 0 HD22 ASN A 29 12.200 -19.666 -6.585 1.00 0.00 H new ATOM 434 N LEU A 30 11.003 -16.863 -2.560 1.00 0.00 N ATOM 435 CA LEU A 30 12.013 -16.108 -1.766 1.00 0.00 C ATOM 436 C LEU A 30 11.635 -16.154 -0.284 1.00 0.00 C ATOM 437 O LEU A 30 12.484 -16.247 0.580 1.00 0.00 O ATOM 438 CB LEU A 30 12.049 -14.653 -2.238 1.00 0.00 C ATOM 439 CG LEU A 30 13.324 -13.979 -1.729 1.00 0.00 C ATOM 440 CD1 LEU A 30 13.262 -13.853 -0.205 1.00 0.00 C ATOM 441 CD2 LEU A 30 14.538 -14.823 -2.122 1.00 0.00 C ATOM 0 H LEU A 30 10.375 -16.288 -3.122 1.00 0.00 H new ATOM 0 HA LEU A 30 12.995 -16.559 -1.905 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.014 -14.612 -3.327 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.172 -14.119 -1.871 1.00 0.00 H new ATOM 0 HG LEU A 30 13.412 -12.987 -2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 30 14.171 -13.373 0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 30 12.397 -13.252 0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 30 13.174 -14.845 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 30 15.447 -14.343 -1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 30 14.450 -15.815 -1.679 1.00 0.00 H new ATOM 0 HD23 LEU A 30 14.583 -14.913 -3.207 1.00 0.00 H new ATOM 453 N ILE A 31 10.367 -16.087 0.018 1.00 0.00 N ATOM 454 CA ILE A 31 9.937 -16.125 1.443 1.00 0.00 C ATOM 455 C ILE A 31 10.588 -17.321 2.149 1.00 0.00 C ATOM 456 O ILE A 31 11.260 -17.165 3.149 1.00 0.00 O ATOM 457 CB ILE A 31 8.411 -16.242 1.512 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.782 -14.891 1.164 1.00 0.00 C ATOM 459 CG2 ILE A 31 7.985 -16.651 2.924 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.356 -15.106 0.657 1.00 0.00 C ATOM 0 H ILE A 31 9.610 -16.008 -0.662 1.00 0.00 H new ATOM 0 HA ILE A 31 10.249 -15.208 1.942 1.00 0.00 H new ATOM 0 HB ILE A 31 8.076 -16.998 0.802 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.773 -14.245 2.042 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.377 -14.386 0.403 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.899 -16.733 2.967 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.431 -17.613 3.174 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.321 -15.899 3.638 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.909 -14.143 0.409 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.377 -15.736 -0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.764 -15.593 1.432 1.00 0.00 H new ATOM 472 N PRO A 32 10.389 -18.538 1.616 1.00 0.00 N ATOM 473 CA PRO A 32 10.964 -19.759 2.201 1.00 0.00 C ATOM 474 C PRO A 32 12.488 -19.796 2.057 1.00 0.00 C ATOM 475 O PRO A 32 13.169 -20.523 2.751 1.00 0.00 O ATOM 476 CB PRO A 32 10.332 -20.881 1.380 1.00 0.00 C ATOM 477 CG PRO A 32 9.981 -20.240 0.080 1.00 0.00 C ATOM 478 CD PRO A 32 9.594 -18.827 0.409 1.00 0.00 C ATOM 0 HA PRO A 32 10.766 -19.833 3.270 1.00 0.00 H new ATOM 0 HB2 PRO A 32 11.026 -21.709 1.239 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.449 -21.286 1.874 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.826 -20.263 -0.608 1.00 0.00 H new ATOM 0 HG3 PRO A 32 9.160 -20.767 -0.406 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.833 -18.143 -0.405 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.525 -18.735 0.599 1.00 0.00 H new ATOM 486 N LYS A 33 13.028 -19.017 1.160 1.00 0.00 N ATOM 487 CA LYS A 33 14.507 -19.008 0.972 1.00 0.00 C ATOM 488 C LYS A 33 15.167 -18.334 2.176 1.00 0.00 C ATOM 489 O LYS A 33 16.230 -18.727 2.615 1.00 0.00 O ATOM 490 CB LYS A 33 14.856 -18.235 -0.300 1.00 0.00 C ATOM 491 CG LYS A 33 14.766 -19.170 -1.508 1.00 0.00 C ATOM 492 CD LYS A 33 15.143 -18.402 -2.776 1.00 0.00 C ATOM 493 CE LYS A 33 14.622 -19.155 -4.001 1.00 0.00 C ATOM 494 NZ LYS A 33 14.309 -18.183 -5.087 1.00 0.00 N ATOM 0 H LYS A 33 12.509 -18.386 0.549 1.00 0.00 H new ATOM 0 HA LYS A 33 14.869 -20.032 0.883 1.00 0.00 H new ATOM 0 HB2 LYS A 33 14.174 -17.394 -0.426 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.861 -17.821 -0.222 1.00 0.00 H new ATOM 0 HG2 LYS A 33 15.434 -20.021 -1.373 1.00 0.00 H new ATOM 0 HG3 LYS A 33 13.756 -19.569 -1.598 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.720 -17.398 -2.746 1.00 0.00 H new ATOM 0 HD3 LYS A 33 16.225 -18.290 -2.838 1.00 0.00 H new ATOM 0 HE2 LYS A 33 15.368 -19.872 -4.344 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.730 -19.724 -3.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 14.151 -18.696 -5.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 13.452 -17.649 -4.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 15.105 -17.524 -5.203 1.00 0.00 H new ATOM 508 N ILE A 34 14.547 -17.318 2.712 1.00 0.00 N ATOM 509 CA ILE A 34 15.140 -16.618 3.886 1.00 0.00 C ATOM 510 C ILE A 34 15.145 -17.561 5.092 1.00 0.00 C ATOM 511 O ILE A 34 15.990 -17.468 5.960 1.00 0.00 O ATOM 512 CB ILE A 34 14.308 -15.377 4.212 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.281 -14.448 2.997 1.00 0.00 C ATOM 514 CG2 ILE A 34 14.930 -14.643 5.401 1.00 0.00 C ATOM 515 CD1 ILE A 34 13.240 -13.348 3.217 1.00 0.00 C ATOM 0 H ILE A 34 13.656 -16.943 2.387 1.00 0.00 H new ATOM 0 HA ILE A 34 16.162 -16.319 3.654 1.00 0.00 H new ATOM 0 HB ILE A 34 13.291 -15.678 4.463 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.265 -14.006 2.842 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.041 -15.015 2.098 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.337 -13.758 5.633 1.00 0.00 H new ATOM 0 HG22 ILE A 34 14.950 -15.304 6.267 1.00 0.00 H new ATOM 0 HG23 ILE A 34 15.947 -14.342 5.151 1.00 0.00 H new ATOM 0 HD11 ILE A 34 13.221 -12.686 2.351 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.257 -13.799 3.350 1.00 0.00 H new ATOM 0 HD13 ILE A 34 13.500 -12.774 4.107 1.00 0.00 H new ATOM 527 N ALA A 35 14.209 -18.468 5.152 1.00 0.00 N ATOM 528 CA ALA A 35 14.162 -19.416 6.300 1.00 0.00 C ATOM 529 C ALA A 35 13.424 -20.689 5.880 1.00 0.00 C ATOM 530 O ALA A 35 12.308 -20.933 6.291 1.00 0.00 O ATOM 531 CB ALA A 35 13.424 -18.763 7.471 1.00 0.00 C ATOM 0 H ALA A 35 13.475 -18.593 4.455 1.00 0.00 H new ATOM 0 HA ALA A 35 15.178 -19.668 6.605 1.00 0.00 H new ATOM 0 HB1 ALA A 35 13.389 -19.456 8.311 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.948 -17.855 7.771 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.408 -18.511 7.166 1.00 0.00 H new ATOM 537 N PRO A 36 14.068 -21.513 5.040 1.00 0.00 N ATOM 538 CA PRO A 36 13.480 -22.769 4.555 1.00 0.00 C ATOM 539 C PRO A 36 13.376 -23.814 5.668 1.00 0.00 C ATOM 540 O PRO A 36 12.472 -24.627 5.688 1.00 0.00 O ATOM 541 CB PRO A 36 14.468 -23.238 3.488 1.00 0.00 C ATOM 542 CG PRO A 36 15.765 -22.608 3.874 1.00 0.00 C ATOM 543 CD PRO A 36 15.419 -21.286 4.499 1.00 0.00 C ATOM 0 HA PRO A 36 12.465 -22.629 4.183 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.545 -24.325 3.469 1.00 0.00 H new ATOM 0 HB3 PRO A 36 14.155 -22.924 2.492 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.311 -23.239 4.575 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.406 -22.471 3.003 1.00 0.00 H new ATOM 0 HD2 PRO A 36 16.126 -21.014 5.283 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.429 -20.479 3.766 1.00 0.00 H new ATOM 551 N GLN A 37 14.294 -23.800 6.595 1.00 0.00 N ATOM 552 CA GLN A 37 14.248 -24.793 7.705 1.00 0.00 C ATOM 553 C GLN A 37 13.151 -24.399 8.696 1.00 0.00 C ATOM 554 O GLN A 37 12.606 -25.228 9.397 1.00 0.00 O ATOM 555 CB GLN A 37 15.598 -24.817 8.424 1.00 0.00 C ATOM 556 CG GLN A 37 16.677 -25.325 7.466 1.00 0.00 C ATOM 557 CD GLN A 37 18.034 -25.306 8.172 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.200 -24.645 9.178 1.00 0.00 O ATOM 559 NE2 GLN A 37 19.020 -26.008 7.684 1.00 0.00 N ATOM 0 H GLN A 37 15.074 -23.144 6.632 1.00 0.00 H new ATOM 0 HA GLN A 37 14.034 -25.782 7.299 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.852 -23.818 8.777 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.543 -25.461 9.302 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.440 -26.337 7.137 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.710 -24.700 6.574 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.882 -26.563 6.840 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.929 -26.001 8.147 1.00 0.00 H new ATOM 568 N ALA A 38 12.823 -23.137 8.761 1.00 0.00 N ATOM 569 CA ALA A 38 11.763 -22.691 9.708 1.00 0.00 C ATOM 570 C ALA A 38 10.392 -23.120 9.180 1.00 0.00 C ATOM 571 O ALA A 38 9.528 -23.532 9.929 1.00 0.00 O ATOM 572 CB ALA A 38 11.806 -21.168 9.840 1.00 0.00 C ATOM 0 H ALA A 38 13.243 -22.396 8.199 1.00 0.00 H new ATOM 0 HA ALA A 38 11.933 -23.145 10.684 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.031 -20.841 10.533 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.782 -20.863 10.217 1.00 0.00 H new ATOM 0 HB3 ALA A 38 11.636 -20.713 8.864 1.00 0.00 H new ATOM 578 N VAL A 39 10.184 -23.025 7.895 1.00 0.00 N ATOM 579 CA VAL A 39 8.869 -23.427 7.321 1.00 0.00 C ATOM 580 C VAL A 39 9.071 -24.589 6.346 1.00 0.00 C ATOM 581 O VAL A 39 10.112 -24.725 5.735 1.00 0.00 O ATOM 582 CB VAL A 39 8.254 -22.240 6.578 1.00 0.00 C ATOM 583 CG1 VAL A 39 9.271 -21.679 5.582 1.00 0.00 C ATOM 584 CG2 VAL A 39 7.005 -22.703 5.825 1.00 0.00 C ATOM 0 H VAL A 39 10.868 -22.686 7.218 1.00 0.00 H new ATOM 0 HA VAL A 39 8.202 -23.739 8.125 1.00 0.00 H new ATOM 0 HB VAL A 39 7.981 -21.465 7.294 1.00 0.00 H new ATOM 0 HG11 VAL A 39 8.833 -20.833 5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.162 -21.350 6.118 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.544 -22.454 4.866 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.566 -21.858 5.295 1.00 0.00 H new ATOM 0 HG22 VAL A 39 7.278 -23.478 5.109 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.280 -23.103 6.534 1.00 0.00 H new ATOM 594 N LYS A 40 8.082 -25.427 6.195 1.00 0.00 N ATOM 595 CA LYS A 40 8.217 -26.580 5.259 1.00 0.00 C ATOM 596 C LYS A 40 8.041 -26.091 3.820 1.00 0.00 C ATOM 597 O LYS A 40 8.822 -26.411 2.946 1.00 0.00 O ATOM 598 CB LYS A 40 7.147 -27.626 5.578 1.00 0.00 C ATOM 599 CG LYS A 40 7.374 -28.867 4.712 1.00 0.00 C ATOM 600 CD LYS A 40 6.282 -29.899 5.001 1.00 0.00 C ATOM 601 CE LYS A 40 6.571 -31.181 4.215 1.00 0.00 C ATOM 602 NZ LYS A 40 5.286 -31.866 3.893 1.00 0.00 N ATOM 0 H LYS A 40 7.186 -25.363 6.679 1.00 0.00 H new ATOM 0 HA LYS A 40 9.205 -27.027 5.373 1.00 0.00 H new ATOM 0 HB2 LYS A 40 7.188 -27.894 6.634 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.155 -27.216 5.391 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.361 -28.594 3.657 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.356 -29.293 4.919 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.244 -30.115 6.069 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.307 -29.500 4.722 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.109 -30.944 3.297 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.212 -31.842 4.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 5.481 -32.737 3.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.789 -32.105 4.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.690 -31.235 3.320 1.00 0.00 H new ATOM 616 N CYS A 41 7.021 -25.319 3.566 1.00 0.00 N ATOM 617 CA CYS A 41 6.798 -24.812 2.182 1.00 0.00 C ATOM 618 C CYS A 41 5.516 -23.978 2.142 1.00 0.00 C ATOM 619 O CYS A 41 4.473 -24.400 2.600 1.00 0.00 O ATOM 620 CB CYS A 41 6.666 -25.997 1.223 1.00 0.00 C ATOM 621 SG CYS A 41 7.831 -25.798 -0.147 1.00 0.00 S ATOM 0 H CYS A 41 6.333 -25.017 4.256 1.00 0.00 H new ATOM 0 HA CYS A 41 7.642 -24.191 1.882 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.865 -26.930 1.751 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.647 -26.058 0.842 1.00 0.00 H new ATOM 0 HG CYS A 41 7.720 -26.806 -0.961 1.00 0.00 H new ATOM 627 N ALA A 42 5.585 -22.794 1.596 1.00 0.00 N ATOM 628 CA ALA A 42 4.371 -21.934 1.525 1.00 0.00 C ATOM 629 C ALA A 42 3.577 -22.280 0.264 1.00 0.00 C ATOM 630 O ALA A 42 4.108 -22.303 -0.828 1.00 0.00 O ATOM 631 CB ALA A 42 4.789 -20.462 1.476 1.00 0.00 C ATOM 0 H ALA A 42 6.430 -22.386 1.196 1.00 0.00 H new ATOM 0 HA ALA A 42 3.752 -22.106 2.405 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.900 -19.833 1.424 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.357 -20.215 2.373 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.408 -20.289 0.596 1.00 0.00 H new ATOM 637 N GLU A 43 2.307 -22.549 0.406 1.00 0.00 N ATOM 638 CA GLU A 43 1.483 -22.895 -0.786 1.00 0.00 C ATOM 639 C GLU A 43 0.311 -21.918 -0.897 1.00 0.00 C ATOM 640 O GLU A 43 -0.198 -21.428 0.091 1.00 0.00 O ATOM 641 CB GLU A 43 0.946 -24.320 -0.639 1.00 0.00 C ATOM 642 CG GLU A 43 2.116 -25.291 -0.475 1.00 0.00 C ATOM 643 CD GLU A 43 1.583 -26.722 -0.370 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.381 -26.875 -0.225 1.00 0.00 O ATOM 645 OE2 GLU A 43 2.385 -27.638 -0.435 1.00 0.00 O ATOM 0 H GLU A 43 1.806 -22.544 1.294 1.00 0.00 H new ATOM 0 HA GLU A 43 2.098 -22.829 -1.684 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.283 -24.383 0.224 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.356 -24.590 -1.515 1.00 0.00 H new ATOM 0 HG2 GLU A 43 2.794 -25.206 -1.324 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.689 -25.039 0.417 1.00 0.00 H new ATOM 652 N ILE A 44 -0.124 -21.634 -2.095 1.00 0.00 N ATOM 653 CA ILE A 44 -1.263 -20.689 -2.269 1.00 0.00 C ATOM 654 C ILE A 44 -2.519 -21.472 -2.662 1.00 0.00 C ATOM 655 O ILE A 44 -2.564 -22.116 -3.691 1.00 0.00 O ATOM 656 CB ILE A 44 -0.927 -19.681 -3.370 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.383 -18.969 -3.027 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.052 -18.651 -3.479 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.780 -18.047 -4.181 1.00 0.00 C ATOM 0 H ILE A 44 0.260 -22.015 -2.960 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.441 -20.159 -1.333 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.819 -20.204 -4.320 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.266 -18.392 -2.110 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.170 -19.701 -2.845 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.813 -17.933 -4.263 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.986 -19.157 -3.723 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.160 -18.128 -2.529 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.713 -17.540 -3.937 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.914 -18.636 -5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.004 -17.307 -4.342 1.00 0.00 H new ATOM 671 N LEU A 45 -3.538 -21.423 -1.849 1.00 0.00 N ATOM 672 CA LEU A 45 -4.789 -22.164 -2.176 1.00 0.00 C ATOM 673 C LEU A 45 -5.373 -21.625 -3.483 1.00 0.00 C ATOM 674 O LEU A 45 -5.772 -22.376 -4.351 1.00 0.00 O ATOM 675 CB LEU A 45 -5.803 -21.973 -1.047 1.00 0.00 C ATOM 676 CG LEU A 45 -5.352 -22.761 0.185 1.00 0.00 C ATOM 677 CD1 LEU A 45 -4.252 -21.985 0.914 1.00 0.00 C ATOM 678 CD2 LEU A 45 -6.542 -22.963 1.125 1.00 0.00 C ATOM 0 H LEU A 45 -3.559 -20.902 -0.972 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.565 -23.225 -2.288 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.894 -20.915 -0.801 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.788 -22.312 -1.368 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.966 -23.732 -0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -3.931 -22.546 1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.404 -21.841 0.245 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.637 -21.014 1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.221 -23.524 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -6.929 -21.993 1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.325 -23.516 0.607 1.00 0.00 H new ATOM 690 N GLU A 46 -5.429 -20.329 -3.631 1.00 0.00 N ATOM 691 CA GLU A 46 -5.988 -19.744 -4.882 1.00 0.00 C ATOM 692 C GLU A 46 -5.460 -18.319 -5.061 1.00 0.00 C ATOM 693 O GLU A 46 -5.080 -17.664 -4.111 1.00 0.00 O ATOM 694 CB GLU A 46 -7.515 -19.711 -4.791 1.00 0.00 C ATOM 695 CG GLU A 46 -8.063 -21.139 -4.843 1.00 0.00 C ATOM 696 CD GLU A 46 -7.565 -21.829 -6.115 1.00 0.00 C ATOM 697 OE1 GLU A 46 -7.159 -21.128 -7.026 1.00 0.00 O ATOM 698 OE2 GLU A 46 -7.599 -23.049 -6.156 1.00 0.00 O ATOM 0 H GLU A 46 -5.111 -19.650 -2.939 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.686 -20.354 -5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.824 -19.226 -3.865 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.926 -19.123 -5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.740 -21.696 -3.964 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.153 -21.123 -4.828 1.00 0.00 H new ATOM 705 N GLY A 47 -5.436 -17.834 -6.272 1.00 0.00 N ATOM 706 CA GLY A 47 -4.934 -16.452 -6.510 1.00 0.00 C ATOM 707 C GLY A 47 -3.520 -16.514 -7.090 1.00 0.00 C ATOM 708 O GLY A 47 -3.172 -15.773 -7.986 1.00 0.00 O ATOM 0 H GLY A 47 -5.742 -18.335 -7.106 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.597 -15.926 -7.197 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -4.931 -15.889 -5.577 1.00 0.00 H new ATOM 712 N ASP A 48 -2.701 -17.396 -6.584 1.00 0.00 N ATOM 713 CA ASP A 48 -1.311 -17.508 -7.104 1.00 0.00 C ATOM 714 C ASP A 48 -0.591 -16.169 -6.929 1.00 0.00 C ATOM 715 O ASP A 48 0.197 -15.764 -7.762 1.00 0.00 O ATOM 716 CB ASP A 48 -1.349 -17.876 -8.589 1.00 0.00 C ATOM 717 CG ASP A 48 -1.893 -19.297 -8.747 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.034 -19.972 -7.741 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.160 -19.686 -9.873 1.00 0.00 O ATOM 0 H ASP A 48 -2.936 -18.044 -5.832 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.778 -18.282 -6.551 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.978 -17.172 -9.133 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.349 -17.808 -9.017 1.00 0.00 H new ATOM 724 N GLY A 49 -0.854 -15.480 -5.853 1.00 0.00 N ATOM 725 CA GLY A 49 -0.183 -14.169 -5.625 1.00 0.00 C ATOM 726 C GLY A 49 -1.004 -13.054 -6.278 1.00 0.00 C ATOM 727 O GLY A 49 -0.467 -12.075 -6.759 1.00 0.00 O ATOM 0 H GLY A 49 -1.504 -15.768 -5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.081 -13.982 -4.556 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.824 -14.186 -6.043 1.00 0.00 H new ATOM 731 N GLY A 50 -2.301 -13.194 -6.299 1.00 0.00 N ATOM 732 CA GLY A 50 -3.154 -12.142 -6.922 1.00 0.00 C ATOM 733 C GLY A 50 -4.114 -11.576 -5.873 1.00 0.00 C ATOM 734 O GLY A 50 -3.939 -11.776 -4.687 1.00 0.00 O ATOM 0 H GLY A 50 -2.807 -13.991 -5.912 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.530 -11.345 -7.327 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.716 -12.562 -7.756 1.00 0.00 H new ATOM 738 N PRO A 51 -5.149 -10.853 -6.325 1.00 0.00 N ATOM 739 CA PRO A 51 -6.147 -10.251 -5.432 1.00 0.00 C ATOM 740 C PRO A 51 -7.034 -11.314 -4.777 1.00 0.00 C ATOM 741 O PRO A 51 -7.564 -12.186 -5.435 1.00 0.00 O ATOM 742 CB PRO A 51 -6.982 -9.376 -6.367 1.00 0.00 C ATOM 743 CG PRO A 51 -6.819 -10.001 -7.712 1.00 0.00 C ATOM 744 CD PRO A 51 -5.427 -10.567 -7.744 1.00 0.00 C ATOM 0 HA PRO A 51 -5.686 -9.701 -4.612 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.029 -9.357 -6.063 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.630 -8.344 -6.364 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.561 -10.783 -7.871 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.958 -9.264 -8.503 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.372 -11.468 -8.355 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.712 -9.856 -8.159 1.00 0.00 H new ATOM 752 N GLY A 52 -7.198 -11.248 -3.484 1.00 0.00 N ATOM 753 CA GLY A 52 -8.047 -12.256 -2.789 1.00 0.00 C ATOM 754 C GLY A 52 -7.346 -13.615 -2.818 1.00 0.00 C ATOM 755 O GLY A 52 -7.980 -14.651 -2.845 1.00 0.00 O ATOM 0 H GLY A 52 -6.781 -10.540 -2.879 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.226 -11.949 -1.759 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.020 -12.326 -3.275 1.00 0.00 H new ATOM 759 N THR A 53 -6.041 -13.619 -2.812 1.00 0.00 N ATOM 760 CA THR A 53 -5.300 -14.911 -2.841 1.00 0.00 C ATOM 761 C THR A 53 -5.132 -15.436 -1.413 1.00 0.00 C ATOM 762 O THR A 53 -4.906 -14.683 -0.488 1.00 0.00 O ATOM 763 CB THR A 53 -3.920 -14.693 -3.467 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.074 -14.158 -4.774 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.175 -16.027 -3.543 1.00 0.00 C ATOM 0 H THR A 53 -5.456 -12.784 -2.788 1.00 0.00 H new ATOM 0 HA THR A 53 -5.859 -15.636 -3.432 1.00 0.00 H new ATOM 0 HB THR A 53 -3.349 -13.996 -2.854 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.546 -13.301 -4.723 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.193 -15.870 -3.989 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.057 -16.436 -2.539 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.744 -16.727 -4.155 1.00 0.00 H new ATOM 773 N ILE A 54 -5.239 -16.724 -1.229 1.00 0.00 N ATOM 774 CA ILE A 54 -5.084 -17.296 0.138 1.00 0.00 C ATOM 775 C ILE A 54 -3.770 -18.075 0.215 1.00 0.00 C ATOM 776 O ILE A 54 -3.478 -18.903 -0.624 1.00 0.00 O ATOM 777 CB ILE A 54 -6.253 -18.235 0.435 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.572 -17.481 0.258 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.147 -18.744 1.874 1.00 0.00 C ATOM 780 CD1 ILE A 54 -8.743 -18.442 0.472 1.00 0.00 C ATOM 0 H ILE A 54 -5.427 -17.404 -1.966 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.073 -16.490 0.871 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.222 -19.080 -0.253 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.630 -16.657 0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.623 -17.046 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -6.981 -19.414 2.085 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.208 -19.283 2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.177 -17.899 2.562 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -9.683 -17.904 0.346 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.687 -19.251 -0.256 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.694 -18.856 1.479 1.00 0.00 H new ATOM 792 N LYS A 55 -2.972 -17.816 1.215 1.00 0.00 N ATOM 793 CA LYS A 55 -1.677 -18.543 1.341 1.00 0.00 C ATOM 794 C LYS A 55 -1.683 -19.385 2.618 1.00 0.00 C ATOM 795 O LYS A 55 -2.264 -19.013 3.618 1.00 0.00 O ATOM 796 CB LYS A 55 -0.530 -17.532 1.403 1.00 0.00 C ATOM 797 CG LYS A 55 -0.531 -16.682 0.131 1.00 0.00 C ATOM 798 CD LYS A 55 0.679 -15.745 0.143 1.00 0.00 C ATOM 799 CE LYS A 55 0.639 -14.844 -1.093 1.00 0.00 C ATOM 800 NZ LYS A 55 2.026 -14.620 -1.589 1.00 0.00 N ATOM 0 H LYS A 55 -3.161 -17.133 1.949 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.543 -19.195 0.478 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.640 -16.894 2.280 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.422 -18.052 1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.498 -17.325 -0.749 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.452 -16.103 0.068 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.674 -15.138 1.049 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.602 -16.325 0.153 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.032 -15.305 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.171 -13.891 -0.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.012 -13.915 -2.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.622 -14.273 -0.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.414 -15.515 -1.950 1.00 0.00 H new ATOM 814 N LYS A 56 -1.037 -20.518 2.593 1.00 0.00 N ATOM 815 CA LYS A 56 -1.001 -21.385 3.804 1.00 0.00 C ATOM 816 C LYS A 56 0.444 -21.805 4.084 1.00 0.00 C ATOM 817 O LYS A 56 1.100 -22.396 3.250 1.00 0.00 O ATOM 818 CB LYS A 56 -1.856 -22.632 3.565 1.00 0.00 C ATOM 819 CG LYS A 56 -1.928 -23.456 4.853 1.00 0.00 C ATOM 820 CD LYS A 56 -2.690 -24.755 4.585 1.00 0.00 C ATOM 821 CE LYS A 56 -2.882 -25.515 5.900 1.00 0.00 C ATOM 822 NZ LYS A 56 -2.039 -26.744 5.891 1.00 0.00 N ATOM 0 H LYS A 56 -0.532 -20.881 1.785 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.394 -20.834 4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.858 -22.344 3.249 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.428 -23.231 2.761 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.923 -23.679 5.212 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.426 -22.884 5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.658 -24.535 4.135 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.141 -25.371 3.873 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.609 -24.880 6.743 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.931 -25.782 6.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.169 -27.261 6.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.320 -27.352 5.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.039 -26.478 5.787 1.00 0.00 H new ATOM 836 N ILE A 57 0.945 -21.502 5.250 1.00 0.00 N ATOM 837 CA ILE A 57 2.348 -21.883 5.577 1.00 0.00 C ATOM 838 C ILE A 57 2.351 -22.903 6.718 1.00 0.00 C ATOM 839 O ILE A 57 1.613 -22.778 7.676 1.00 0.00 O ATOM 840 CB ILE A 57 3.128 -20.638 6.005 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.969 -19.547 4.943 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.608 -20.991 6.156 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.328 -18.188 5.550 1.00 0.00 C ATOM 0 H ILE A 57 0.445 -21.008 5.989 1.00 0.00 H new ATOM 0 HA ILE A 57 2.817 -22.323 4.697 1.00 0.00 H new ATOM 0 HB ILE A 57 2.742 -20.276 6.958 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.614 -19.758 4.090 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.944 -19.532 4.572 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.164 -20.105 6.461 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.721 -21.768 6.912 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.995 -21.352 5.203 1.00 0.00 H new ATOM 0 HD11 ILE A 57 3.215 -17.411 4.794 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.665 -17.978 6.389 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.360 -18.207 5.900 1.00 0.00 H new ATOM 855 N THR A 58 3.174 -23.910 6.622 1.00 0.00 N ATOM 856 CA THR A 58 3.226 -24.936 7.701 1.00 0.00 C ATOM 857 C THR A 58 4.625 -24.955 8.319 1.00 0.00 C ATOM 858 O THR A 58 5.620 -25.004 7.624 1.00 0.00 O ATOM 859 CB THR A 58 2.911 -26.313 7.109 1.00 0.00 C ATOM 860 OG1 THR A 58 1.630 -26.281 6.498 1.00 0.00 O ATOM 861 CG2 THR A 58 2.923 -27.364 8.219 1.00 0.00 C ATOM 0 H THR A 58 3.813 -24.067 5.843 1.00 0.00 H new ATOM 0 HA THR A 58 2.493 -24.694 8.470 1.00 0.00 H new ATOM 0 HB THR A 58 3.664 -26.569 6.363 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.427 -27.161 6.117 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.699 -28.343 7.796 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.907 -27.388 8.687 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.172 -27.112 8.967 1.00 0.00 H new ATOM 869 N PHE A 59 4.711 -24.914 9.621 1.00 0.00 N ATOM 870 CA PHE A 59 6.047 -24.928 10.280 1.00 0.00 C ATOM 871 C PHE A 59 6.314 -26.315 10.867 1.00 0.00 C ATOM 872 O PHE A 59 5.456 -26.914 11.485 1.00 0.00 O ATOM 873 CB PHE A 59 6.076 -23.885 11.400 1.00 0.00 C ATOM 874 CG PHE A 59 5.828 -22.515 10.817 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.894 -21.777 10.288 1.00 0.00 C ATOM 876 CD2 PHE A 59 4.535 -21.982 10.805 1.00 0.00 C ATOM 877 CE1 PHE A 59 6.665 -20.506 9.747 1.00 0.00 C ATOM 878 CE2 PHE A 59 4.305 -20.711 10.264 1.00 0.00 C ATOM 879 CZ PHE A 59 5.370 -19.973 9.735 1.00 0.00 C ATOM 0 H PHE A 59 3.914 -24.871 10.256 1.00 0.00 H new ATOM 0 HA PHE A 59 6.816 -24.692 9.544 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.317 -24.117 12.147 1.00 0.00 H new ATOM 0 HB3 PHE A 59 7.040 -23.907 11.907 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.893 -22.188 10.297 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.713 -22.551 11.213 1.00 0.00 H new ATOM 0 HE1 PHE A 59 7.487 -19.937 9.339 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.306 -20.300 10.255 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.193 -18.993 9.318 1.00 0.00 H new ATOM 974 N TYR A 67 0.635 -23.372 12.014 1.00 0.00 N ATOM 975 CA TYR A 67 0.627 -22.928 10.591 1.00 0.00 C ATOM 976 C TYR A 67 -0.048 -21.559 10.484 1.00 0.00 C ATOM 977 O TYR A 67 -0.991 -21.264 11.191 1.00 0.00 O ATOM 978 CB TYR A 67 -0.141 -23.945 9.742 1.00 0.00 C ATOM 979 CG TYR A 67 -1.616 -23.851 10.053 1.00 0.00 C ATOM 980 CD1 TYR A 67 -2.156 -24.587 11.115 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.443 -23.028 9.279 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.524 -24.499 11.402 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.811 -22.942 9.566 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.351 -23.677 10.627 1.00 0.00 C ATOM 985 OH TYR A 67 -5.699 -23.591 10.912 1.00 0.00 O ATOM 0 HA TYR A 67 1.653 -22.854 10.230 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.031 -23.754 8.683 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.221 -24.953 9.947 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.518 -25.222 11.712 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.026 -22.460 8.461 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.941 -25.065 12.221 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.449 -22.308 8.968 1.00 0.00 H new ATOM 0 HH TYR A 67 -6.014 -22.680 10.733 1.00 0.00 H new ATOM 995 N VAL A 68 0.428 -20.722 9.604 1.00 0.00 N ATOM 996 CA VAL A 68 -0.185 -19.373 9.449 1.00 0.00 C ATOM 997 C VAL A 68 -0.653 -19.190 8.003 1.00 0.00 C ATOM 998 O VAL A 68 -0.048 -19.695 7.077 1.00 0.00 O ATOM 999 CB VAL A 68 0.853 -18.300 9.788 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.206 -16.917 9.696 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.375 -18.525 11.209 1.00 0.00 C ATOM 0 H VAL A 68 1.216 -20.914 8.985 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.037 -19.281 10.122 1.00 0.00 H new ATOM 0 HB VAL A 68 1.682 -18.361 9.083 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.945 -16.153 9.937 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.166 -16.756 8.684 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.623 -16.856 10.401 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.114 -17.761 11.450 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.547 -18.464 11.915 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.837 -19.510 11.275 1.00 0.00 H new ATOM 1011 N LYS A 69 -1.725 -18.475 7.801 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.228 -18.263 6.414 1.00 0.00 C ATOM 1013 C LYS A 69 -2.237 -16.768 6.096 1.00 0.00 C ATOM 1014 O LYS A 69 -2.589 -15.949 6.922 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.649 -18.819 6.298 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.629 -20.328 6.549 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.028 -20.902 6.317 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.038 -22.387 6.686 1.00 0.00 C ATOM 1019 NZ LYS A 69 -5.553 -23.181 5.535 1.00 0.00 N ATOM 0 H LYS A 69 -2.274 -18.029 8.535 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.577 -18.779 5.708 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.303 -18.328 7.019 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.053 -18.610 5.307 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -2.912 -20.809 5.883 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.304 -20.534 7.569 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.759 -20.362 6.919 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.317 -20.774 5.274 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.032 -22.715 6.947 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.664 -22.551 7.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.434 -24.195 5.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.562 -22.972 5.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -5.023 -22.931 4.676 1.00 0.00 H new ATOM 1033 N HIS A 70 -1.852 -16.403 4.904 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.840 -14.959 4.533 1.00 0.00 C ATOM 1035 C HIS A 70 -2.777 -14.730 3.345 1.00 0.00 C ATOM 1036 O HIS A 70 -2.766 -15.470 2.381 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.418 -14.543 4.147 1.00 0.00 C ATOM 1038 CG HIS A 70 0.472 -14.623 5.356 1.00 0.00 C ATOM 1039 ND1 HIS A 70 1.202 -15.761 5.664 1.00 0.00 N ATOM 1040 CD2 HIS A 70 0.762 -13.714 6.343 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.888 -15.509 6.794 1.00 0.00 C ATOM 1042 NE2 HIS A 70 1.657 -14.275 7.249 1.00 0.00 N ATOM 0 H HIS A 70 -1.545 -17.042 4.171 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.176 -14.363 5.382 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.038 -15.193 3.359 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.420 -13.528 3.750 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.357 -12.715 6.407 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.545 -16.219 7.274 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.052 -13.838 8.082 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.589 -13.710 3.406 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.525 -13.435 2.279 1.00 0.00 C ATOM 1052 C LYS A 71 -4.123 -12.132 1.586 1.00 0.00 C ATOM 1053 O LYS A 71 -3.730 -11.175 2.224 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.950 -13.306 2.820 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.934 -13.223 1.651 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.347 -12.989 2.190 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.355 -13.106 1.045 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.153 -11.851 0.957 1.00 0.00 N ATOM 0 H LYS A 71 -3.645 -13.056 4.187 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.480 -14.255 1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.190 -14.162 3.451 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.034 -12.416 3.444 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.650 -12.412 0.980 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.903 -14.144 1.069 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.577 -13.718 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.414 -12.002 2.649 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.834 -13.285 0.104 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.014 -13.958 1.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.839 -11.929 0.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.661 -11.699 1.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.517 -11.047 0.779 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.218 -12.087 0.285 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.841 -10.845 -0.447 1.00 0.00 C ATOM 1074 C ILE A 72 -5.105 -10.054 -0.789 1.00 0.00 C ATOM 1075 O ILE A 72 -6.086 -10.602 -1.252 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.105 -11.216 -1.735 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.885 -12.074 -1.398 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.649 -9.940 -2.448 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.201 -12.520 -2.692 1.00 0.00 C ATOM 0 H ILE A 72 -4.540 -12.856 -0.302 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.189 -10.236 0.179 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.775 -11.777 -2.386 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.187 -11.507 -0.782 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.189 -12.944 -0.816 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.124 -10.204 -3.366 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.518 -9.328 -2.690 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.980 -9.378 -1.796 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.331 -13.132 -2.452 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.900 -13.103 -3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.883 -11.643 -3.256 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.090 -8.768 -0.566 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.293 -7.944 -0.878 1.00 0.00 C ATOM 1093 C HIS A 73 -6.184 -7.401 -2.304 1.00 0.00 C ATOM 1094 O HIS A 73 -7.105 -7.504 -3.089 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.381 -6.777 0.107 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.803 -7.291 1.455 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -8.098 -7.716 1.711 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -6.115 -7.457 2.632 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -8.147 -8.113 2.996 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.965 -7.975 3.603 1.00 0.00 N ATOM 0 H HIS A 73 -4.298 -8.253 -0.182 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.188 -8.560 -0.792 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.415 -6.277 0.182 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.096 -6.037 -0.252 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.872 -7.726 1.047 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -5.072 -7.221 2.781 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -9.034 -8.497 3.478 1.00 0.00 H new ATOM 1108 N SER A 74 -5.065 -6.823 -2.646 1.00 0.00 N ATOM 1109 CA SER A 74 -4.900 -6.275 -4.021 1.00 0.00 C ATOM 1110 C SER A 74 -3.427 -5.938 -4.264 1.00 0.00 C ATOM 1111 O SER A 74 -2.677 -5.682 -3.341 1.00 0.00 O ATOM 1112 CB SER A 74 -5.744 -5.007 -4.168 1.00 0.00 C ATOM 1113 OG SER A 74 -5.179 -3.968 -3.384 1.00 0.00 O ATOM 0 H SER A 74 -4.258 -6.707 -2.032 1.00 0.00 H new ATOM 0 HA SER A 74 -5.227 -7.017 -4.749 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.786 -4.705 -5.215 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.769 -5.201 -3.850 1.00 0.00 H new ATOM 0 HG SER A 74 -4.748 -4.353 -2.593 1.00 0.00 H new ATOM 1119 N ILE A 75 -3.007 -5.936 -5.499 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.584 -5.616 -5.803 1.00 0.00 C ATOM 1121 C ILE A 75 -1.526 -4.541 -6.890 1.00 0.00 C ATOM 1122 O ILE A 75 -2.341 -4.512 -7.791 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.871 -6.877 -6.296 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.464 -7.307 -7.638 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.054 -8.000 -5.273 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.646 -8.467 -8.208 1.00 0.00 C ATOM 0 H ILE A 75 -3.588 -6.142 -6.311 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.093 -5.250 -4.901 1.00 0.00 H new ATOM 0 HB ILE A 75 0.192 -6.668 -6.419 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.503 -7.610 -7.508 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.461 -6.469 -8.335 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.546 -8.898 -5.624 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.630 -7.694 -4.317 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.116 -8.209 -5.148 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.068 -8.774 -9.165 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.386 -8.148 -8.352 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.672 -9.307 -7.513 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.570 -3.656 -6.814 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.464 -2.585 -7.845 1.00 0.00 C ATOM 1140 C ASP A 76 0.963 -2.549 -8.399 1.00 0.00 C ATOM 1141 O ASP A 76 1.823 -1.866 -7.880 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.799 -1.233 -7.212 1.00 0.00 C ATOM 1143 CG ASP A 76 -2.243 -1.252 -6.707 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.973 -2.151 -7.090 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.594 -0.365 -5.946 1.00 0.00 O ATOM 0 H ASP A 76 0.141 -3.628 -6.084 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.163 -2.790 -8.655 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.117 -1.026 -6.388 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.668 -0.435 -7.942 1.00 0.00 H new ATOM 1150 N LYS A 77 1.219 -3.276 -9.451 1.00 0.00 N ATOM 1151 CA LYS A 77 2.589 -3.280 -10.037 1.00 0.00 C ATOM 1152 C LYS A 77 2.925 -1.879 -10.552 1.00 0.00 C ATOM 1153 O LYS A 77 4.056 -1.439 -10.492 1.00 0.00 O ATOM 1154 CB LYS A 77 2.646 -4.278 -11.195 1.00 0.00 C ATOM 1155 CG LYS A 77 2.425 -5.695 -10.661 1.00 0.00 C ATOM 1156 CD LYS A 77 2.610 -6.703 -11.798 1.00 0.00 C ATOM 1157 CE LYS A 77 2.231 -8.101 -11.306 1.00 0.00 C ATOM 1158 NZ LYS A 77 1.125 -8.641 -12.146 1.00 0.00 N ATOM 0 H LYS A 77 0.540 -3.867 -9.930 1.00 0.00 H new ATOM 0 HA LYS A 77 3.311 -3.570 -9.274 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.885 -4.035 -11.936 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.611 -4.214 -11.697 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.129 -5.906 -9.856 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.423 -5.785 -10.240 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.989 -6.425 -12.650 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.645 -6.695 -12.141 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.096 -8.762 -11.356 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.922 -8.059 -10.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.867 -9.591 -11.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.298 -8.014 -12.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.436 -8.695 -13.137 1.00 0.00 H new ATOM 1172 N VAL A 78 1.950 -1.174 -11.058 1.00 0.00 N ATOM 1173 CA VAL A 78 2.214 0.198 -11.576 1.00 0.00 C ATOM 1174 C VAL A 78 2.431 1.153 -10.400 1.00 0.00 C ATOM 1175 O VAL A 78 3.276 2.026 -10.443 1.00 0.00 O ATOM 1176 CB VAL A 78 1.016 0.671 -12.402 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.193 2.149 -12.758 1.00 0.00 C ATOM 1178 CG2 VAL A 78 0.925 -0.154 -13.687 1.00 0.00 C ATOM 0 H VAL A 78 0.983 -1.489 -11.135 1.00 0.00 H new ATOM 0 HA VAL A 78 3.105 0.184 -12.204 1.00 0.00 H new ATOM 0 HB VAL A 78 0.102 0.543 -11.822 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.340 2.486 -13.346 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.259 2.738 -11.843 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.107 2.277 -13.338 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.072 0.183 -14.276 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.839 -0.026 -14.267 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.799 -1.207 -13.435 1.00 0.00 H new ATOM 1188 N ASN A 79 1.674 0.994 -9.348 1.00 0.00 N ATOM 1189 CA ASN A 79 1.837 1.892 -8.169 1.00 0.00 C ATOM 1190 C ASN A 79 2.901 1.318 -7.231 1.00 0.00 C ATOM 1191 O ASN A 79 3.141 1.837 -6.159 1.00 0.00 O ATOM 1192 CB ASN A 79 0.506 2.000 -7.423 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.566 2.546 -8.367 1.00 0.00 C ATOM 1194 OD1 ASN A 79 -1.676 1.879 -8.528 1.00 0.00 O flip ATOM 1195 ND2 ASN A 79 -0.393 3.591 -8.964 1.00 0.00 N flip ATOM 0 H ASN A 79 0.950 0.281 -9.254 1.00 0.00 H new ATOM 0 HA ASN A 79 2.147 2.881 -8.507 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.209 1.022 -7.045 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.613 2.656 -6.559 1.00 0.00 H new ATOM 0 HD21 ASN A 79 0.475 4.113 -8.838 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.115 3.946 -9.590 1.00 0.00 H new ATOM 1202 N HIS A 80 3.541 0.250 -7.624 1.00 0.00 N ATOM 1203 CA HIS A 80 4.588 -0.354 -6.751 1.00 0.00 C ATOM 1204 C HIS A 80 4.046 -0.494 -5.327 1.00 0.00 C ATOM 1205 O HIS A 80 4.706 -0.157 -4.365 1.00 0.00 O ATOM 1206 CB HIS A 80 5.824 0.549 -6.739 1.00 0.00 C ATOM 1207 CG HIS A 80 6.252 0.832 -8.153 1.00 0.00 C ATOM 1208 ND1 HIS A 80 5.885 1.991 -8.818 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.016 0.116 -9.040 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.424 1.939 -10.050 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.124 0.817 -10.237 1.00 0.00 N ATOM 0 H HIS A 80 3.384 -0.230 -8.510 1.00 0.00 H new ATOM 0 HA HIS A 80 4.859 -1.337 -7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 80 5.601 1.482 -6.222 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.634 0.067 -6.192 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.311 2.746 -8.442 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.465 -0.845 -8.839 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.305 2.710 -10.796 1.00 0.00 H new ATOM 1219 N THR A 81 2.847 -0.991 -5.184 1.00 0.00 N ATOM 1220 CA THR A 81 2.266 -1.151 -3.821 1.00 0.00 C ATOM 1221 C THR A 81 1.700 -2.565 -3.670 1.00 0.00 C ATOM 1222 O THR A 81 0.981 -3.052 -4.520 1.00 0.00 O ATOM 1223 CB THR A 81 1.143 -0.129 -3.623 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.638 1.174 -3.894 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.637 -0.196 -2.181 1.00 0.00 C ATOM 0 H THR A 81 2.246 -1.293 -5.951 1.00 0.00 H new ATOM 0 HA THR A 81 3.043 -0.989 -3.074 1.00 0.00 H new ATOM 0 HB THR A 81 0.322 -0.355 -4.303 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.994 1.205 -4.807 1.00 0.00 H new ATOM 0 HG21 THR A 81 -0.162 0.532 -2.042 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.257 -1.196 -1.975 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.456 0.029 -1.497 1.00 0.00 H new ATOM 1233 N TYR A 82 2.018 -3.228 -2.592 1.00 0.00 N ATOM 1234 CA TYR A 82 1.498 -4.610 -2.383 1.00 0.00 C ATOM 1235 C TYR A 82 0.770 -4.680 -1.039 1.00 0.00 C ATOM 1236 O TYR A 82 1.338 -4.411 0.000 1.00 0.00 O ATOM 1237 CB TYR A 82 2.664 -5.600 -2.385 1.00 0.00 C ATOM 1238 CG TYR A 82 2.139 -7.000 -2.169 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.683 -7.752 -3.259 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.106 -7.545 -0.879 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.196 -9.049 -3.058 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.620 -8.842 -0.680 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.165 -9.594 -1.769 1.00 0.00 C ATOM 1244 OH TYR A 82 0.686 -10.873 -1.572 1.00 0.00 O ATOM 0 H TYR A 82 2.616 -2.872 -1.846 1.00 0.00 H new ATOM 0 HA TYR A 82 0.806 -4.865 -3.186 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.201 -5.544 -3.332 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.375 -5.342 -1.600 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.707 -7.332 -4.254 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.456 -6.964 -0.038 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.844 -9.629 -3.898 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.596 -9.263 0.314 1.00 0.00 H new ATOM 0 HH TYR A 82 0.880 -11.157 -0.655 1.00 0.00 H new ATOM 1254 N SER A 83 -0.486 -5.037 -1.051 1.00 0.00 N ATOM 1255 CA SER A 83 -1.247 -5.119 0.228 1.00 0.00 C ATOM 1256 C SER A 83 -1.583 -6.581 0.532 1.00 0.00 C ATOM 1257 O SER A 83 -1.931 -7.344 -0.348 1.00 0.00 O ATOM 1258 CB SER A 83 -2.541 -4.314 0.103 1.00 0.00 C ATOM 1259 OG SER A 83 -3.373 -4.906 -0.884 1.00 0.00 O ATOM 0 H SER A 83 -1.017 -5.275 -1.889 1.00 0.00 H new ATOM 0 HA SER A 83 -0.641 -4.711 1.037 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.059 -4.287 1.062 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.316 -3.282 -0.167 1.00 0.00 H new ATOM 0 HG SER A 83 -2.900 -4.924 -1.742 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.486 -6.976 1.772 1.00 0.00 N ATOM 1266 CA TYR A 84 -1.803 -8.386 2.133 1.00 0.00 C ATOM 1267 C TYR A 84 -2.206 -8.455 3.609 1.00 0.00 C ATOM 1268 O TYR A 84 -2.029 -7.512 4.353 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.573 -9.265 1.889 1.00 0.00 C ATOM 1270 CG TYR A 84 0.463 -9.002 2.957 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.380 -7.957 2.802 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.506 -9.806 4.103 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.340 -7.715 3.792 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.466 -9.565 5.092 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.384 -8.519 4.936 1.00 0.00 C ATOM 1276 OH TYR A 84 3.330 -8.281 5.912 1.00 0.00 O ATOM 0 H TYR A 84 -1.201 -6.382 2.551 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.628 -8.745 1.517 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.859 -10.317 1.898 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.155 -9.056 0.904 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.347 -7.337 1.918 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.202 -10.612 4.223 1.00 0.00 H new ATOM 0 HE1 TYR A 84 3.047 -6.907 3.672 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.499 -10.185 5.975 1.00 0.00 H new ATOM 0 HH TYR A 84 2.890 -7.937 6.717 1.00 0.00 H new ATOM 1286 N SER A 85 -2.746 -9.563 4.037 1.00 0.00 N ATOM 1287 CA SER A 85 -3.160 -9.686 5.463 1.00 0.00 C ATOM 1288 C SER A 85 -2.959 -11.127 5.934 1.00 0.00 C ATOM 1289 O SER A 85 -2.908 -12.048 5.142 1.00 0.00 O ATOM 1290 CB SER A 85 -4.637 -9.308 5.599 1.00 0.00 C ATOM 1291 OG SER A 85 -5.428 -10.218 4.847 1.00 0.00 O ATOM 0 H SER A 85 -2.918 -10.387 3.462 1.00 0.00 H new ATOM 0 HA SER A 85 -2.554 -9.017 6.074 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.935 -9.331 6.647 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.797 -8.290 5.244 1.00 0.00 H new ATOM 0 HG SER A 85 -6.072 -9.719 4.303 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.849 -11.330 7.219 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.655 -12.712 7.741 1.00 0.00 C ATOM 1299 C LEU A 86 -4.007 -13.287 8.167 1.00 0.00 C ATOM 1300 O LEU A 86 -4.693 -12.730 9.001 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.714 -12.676 8.947 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.178 -14.083 9.218 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.040 -14.009 10.239 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -2.303 -14.959 9.773 1.00 0.00 C ATOM 0 H LEU A 86 -2.885 -10.599 7.929 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.221 -13.338 6.961 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.888 -11.991 8.757 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.243 -12.302 9.823 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.805 -14.514 8.289 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.342 -15.012 10.432 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.762 -13.385 9.845 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.412 -13.578 11.168 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.922 -15.962 9.966 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.676 -14.527 10.702 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.114 -15.013 9.047 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.397 -14.394 7.599 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.707 -15.000 7.972 1.00 0.00 C ATOM 1318 C ILE A 87 -5.580 -15.703 9.325 1.00 0.00 C ATOM 1319 O ILE A 87 -6.215 -15.330 10.290 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.120 -16.015 6.905 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.382 -15.288 5.584 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.395 -16.734 7.352 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -6.623 -16.314 4.475 1.00 0.00 C ATOM 0 H ILE A 87 -3.867 -14.905 6.894 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.462 -14.217 8.041 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.321 -16.743 6.767 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.248 -14.633 5.683 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.531 -14.655 5.330 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.690 -17.458 6.592 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.210 -17.251 8.293 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.194 -16.006 7.489 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.810 -15.796 3.534 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.744 -16.950 4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.487 -16.928 4.729 1.00 0.00 H new ATOM 1335 N GLU A 88 -4.763 -16.718 9.404 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.601 -17.442 10.697 1.00 0.00 C ATOM 1337 C GLU A 88 -3.113 -17.655 10.980 1.00 0.00 C ATOM 1338 O GLU A 88 -2.288 -17.601 10.091 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.304 -18.797 10.614 1.00 0.00 C ATOM 1340 CG GLU A 88 -6.810 -18.581 10.451 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.525 -19.933 10.480 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -6.842 -20.943 10.491 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -8.746 -19.935 10.493 1.00 0.00 O ATOM 0 H GLU A 88 -4.202 -17.076 8.631 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.042 -16.853 11.501 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.915 -19.370 9.772 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.104 -19.378 11.514 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.185 -17.942 11.250 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.015 -18.069 9.511 1.00 0.00 H new ATOM 1350 N GLY A 89 -2.766 -17.898 12.214 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.333 -18.115 12.557 1.00 0.00 C ATOM 1352 C GLY A 89 -1.218 -18.516 14.029 1.00 0.00 C ATOM 1353 O GLY A 89 -2.127 -18.315 14.811 1.00 0.00 O ATOM 0 H GLY A 89 -3.414 -17.956 13.000 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.910 -18.894 11.922 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.761 -17.206 12.371 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.108 -19.083 14.414 1.00 0.00 N ATOM 1358 CA ASP A 90 0.065 -19.499 15.835 1.00 0.00 C ATOM 1359 C ASP A 90 0.069 -18.262 16.736 1.00 0.00 C ATOM 1360 O ASP A 90 -0.327 -18.318 17.883 1.00 0.00 O ATOM 1361 CB ASP A 90 1.391 -20.245 15.988 1.00 0.00 C ATOM 1362 CG ASP A 90 1.438 -21.410 14.998 1.00 0.00 C ATOM 1363 OD1 ASP A 90 0.381 -21.827 14.554 1.00 0.00 O ATOM 1364 OD2 ASP A 90 2.530 -21.865 14.699 1.00 0.00 O ATOM 0 H ASP A 90 0.688 -19.277 13.806 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.758 -20.153 16.124 1.00 0.00 H new ATOM 0 HB2 ASP A 90 2.225 -19.567 15.808 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.496 -20.616 17.008 1.00 0.00 H new ATOM 1369 N ALA A 91 0.515 -17.147 16.227 1.00 0.00 N ATOM 1370 CA ALA A 91 0.547 -15.910 17.058 1.00 0.00 C ATOM 1371 C ALA A 91 -0.856 -15.305 17.131 1.00 0.00 C ATOM 1372 O ALA A 91 -1.171 -14.552 18.031 1.00 0.00 O ATOM 1373 CB ALA A 91 1.507 -14.898 16.431 1.00 0.00 C ATOM 0 H ALA A 91 0.858 -17.039 15.273 1.00 0.00 H new ATOM 0 HA ALA A 91 0.887 -16.159 18.063 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.530 -13.994 17.039 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.507 -15.328 16.382 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.168 -14.650 15.425 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.704 -15.627 16.193 1.00 0.00 N ATOM 1380 CA LEU A 92 -3.086 -15.067 16.213 1.00 0.00 C ATOM 1381 C LEU A 92 -3.920 -15.840 17.228 1.00 0.00 C ATOM 1382 O LEU A 92 -4.836 -15.317 17.831 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.718 -15.209 14.825 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.690 -14.854 13.747 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -3.412 -14.591 12.422 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -1.920 -13.601 14.163 1.00 0.00 C ATOM 0 H LEU A 92 -1.500 -16.253 15.414 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.050 -14.013 16.487 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.073 -16.229 14.680 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.586 -14.555 14.742 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.993 -15.683 13.626 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.682 -14.338 11.654 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.959 -15.485 12.122 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -4.110 -13.763 12.546 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.189 -13.351 13.394 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.615 -12.771 14.286 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.405 -13.786 15.106 1.00 0.00 H new ATOM 1398 N SER A 93 -3.604 -17.085 17.416 1.00 0.00 N ATOM 1399 CA SER A 93 -4.369 -17.914 18.391 1.00 0.00 C ATOM 1400 C SER A 93 -5.869 -17.696 18.177 1.00 0.00 C ATOM 1401 O SER A 93 -6.285 -17.079 17.217 1.00 0.00 O ATOM 1402 CB SER A 93 -3.992 -17.505 19.816 1.00 0.00 C ATOM 1403 OG SER A 93 -2.617 -17.779 20.040 1.00 0.00 O ATOM 0 H SER A 93 -2.846 -17.570 16.936 1.00 0.00 H new ATOM 0 HA SER A 93 -4.129 -18.967 18.241 1.00 0.00 H new ATOM 0 HB2 SER A 93 -4.191 -16.444 19.966 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.604 -18.049 20.536 1.00 0.00 H new ATOM 0 HG SER A 93 -2.375 -17.515 20.952 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.684 -18.197 19.064 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.155 -18.017 18.909 1.00 0.00 C ATOM 1411 C GLU A 94 -8.588 -16.727 19.611 1.00 0.00 C ATOM 1412 O GLU A 94 -9.763 -16.462 19.772 1.00 0.00 O ATOM 1413 CB GLU A 94 -8.884 -19.207 19.538 1.00 0.00 C ATOM 1414 CG GLU A 94 -8.471 -20.495 18.822 1.00 0.00 C ATOM 1415 CD GLU A 94 -9.221 -21.679 19.434 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -9.866 -21.486 20.451 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -9.140 -22.760 18.873 1.00 0.00 O ATOM 0 H GLU A 94 -6.395 -18.723 19.889 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.403 -17.956 17.849 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.643 -19.275 20.599 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.962 -19.067 19.464 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.694 -20.420 17.758 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.395 -20.646 18.913 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.649 -15.924 20.030 1.00 0.00 N ATOM 1425 CA ASN A 95 -8.009 -14.655 20.722 1.00 0.00 C ATOM 1426 C ASN A 95 -7.671 -13.466 19.822 1.00 0.00 C ATOM 1427 O ASN A 95 -8.120 -12.359 20.046 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.218 -14.545 22.027 1.00 0.00 C ATOM 1429 CG ASN A 95 -7.494 -15.774 22.896 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -8.628 -16.177 23.057 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.495 -16.390 23.467 1.00 0.00 N ATOM 0 H ASN A 95 -6.649 -16.092 19.923 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.077 -14.652 20.940 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.152 -14.470 21.813 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.501 -13.638 22.561 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -6.667 -17.210 24.049 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.542 -16.051 23.332 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.880 -13.682 18.807 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.514 -12.559 17.899 1.00 0.00 C ATOM 1440 C ILE A 96 -7.196 -12.744 16.542 1.00 0.00 C ATOM 1441 O ILE A 96 -7.238 -13.830 15.999 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.996 -12.534 17.706 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.305 -12.657 19.066 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.587 -11.219 17.041 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.788 -12.622 18.872 1.00 0.00 C ATOM 0 H ILE A 96 -6.472 -14.586 18.568 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.843 -11.619 18.341 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.697 -13.369 17.072 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.618 -11.843 19.720 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.599 -13.587 19.552 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.506 -11.202 16.904 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.077 -11.134 16.071 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.886 -10.383 17.673 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.295 -12.710 19.840 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.484 -13.451 18.234 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.503 -11.680 18.404 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.728 -11.688 15.989 1.00 0.00 N ATOM 1458 CA GLU A 97 -8.403 -11.795 14.664 1.00 0.00 C ATOM 1459 C GLU A 97 -7.357 -11.682 13.553 1.00 0.00 C ATOM 1460 O GLU A 97 -6.178 -11.542 13.812 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.429 -10.669 14.518 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.573 -10.890 15.511 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.565 -9.728 15.411 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -11.291 -8.804 14.664 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.580 -9.785 16.085 1.00 0.00 O ATOM 0 H GLU A 97 -7.724 -10.754 16.399 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.911 -12.756 14.591 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.955 -9.705 14.701 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.817 -10.645 13.500 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -11.077 -11.832 15.298 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.180 -10.961 16.525 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.776 -11.743 12.320 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.800 -11.643 11.199 1.00 0.00 C ATOM 1474 C LYS A 98 -6.020 -10.331 11.317 1.00 0.00 C ATOM 1475 O LYS A 98 -6.404 -9.432 12.039 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.549 -11.671 9.865 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.341 -12.975 9.751 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.929 -13.092 8.343 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.954 -11.977 8.123 1.00 0.00 C ATOM 1480 NZ LYS A 98 -11.204 -12.297 8.869 1.00 0.00 N ATOM 0 H LYS A 98 -8.750 -11.858 12.040 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.108 -12.484 11.245 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.223 -10.817 9.796 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.844 -11.588 9.038 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.693 -13.826 9.958 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.139 -12.994 10.493 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -8.135 -13.023 7.599 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.402 -14.066 8.215 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -9.549 -11.024 8.463 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.169 -11.871 7.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.964 -11.656 8.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.482 -13.280 8.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.040 -12.178 9.889 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.925 -10.220 10.615 1.00 0.00 N ATOM 1495 CA ILE A 99 -4.116 -8.972 10.687 1.00 0.00 C ATOM 1496 C ILE A 99 -3.985 -8.366 9.288 1.00 0.00 C ATOM 1497 O ILE A 99 -3.661 -9.046 8.334 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.723 -9.299 11.230 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.854 -10.063 12.550 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.949 -8.002 11.467 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.463 -10.451 13.054 1.00 0.00 C ATOM 0 H ILE A 99 -4.556 -10.941 9.995 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.608 -8.259 11.348 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.188 -9.914 10.506 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.362 -9.446 13.291 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.463 -10.956 12.407 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.957 -8.236 11.854 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.853 -7.459 10.527 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.484 -7.386 12.189 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.555 -10.995 13.994 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.972 -11.084 12.315 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.869 -9.551 13.213 1.00 0.00 H new ATOM 1513 N ASP A 100 -4.230 -7.092 9.158 1.00 0.00 N ATOM 1514 CA ASP A 100 -4.116 -6.443 7.821 1.00 0.00 C ATOM 1515 C ASP A 100 -2.694 -5.913 7.636 1.00 0.00 C ATOM 1516 O ASP A 100 -2.185 -5.173 8.456 1.00 0.00 O ATOM 1517 CB ASP A 100 -5.109 -5.281 7.731 1.00 0.00 C ATOM 1518 CG ASP A 100 -6.537 -5.830 7.726 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -6.688 -7.033 7.589 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -7.455 -5.038 7.860 1.00 0.00 O ATOM 0 H ASP A 100 -4.504 -6.472 9.920 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.339 -7.171 7.041 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.971 -4.604 8.574 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.927 -4.702 6.825 1.00 0.00 H new ATOM 1525 N TYR A 101 -2.044 -6.285 6.567 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.654 -5.801 6.337 1.00 0.00 C ATOM 1527 C TYR A 101 -0.610 -4.952 5.065 1.00 0.00 C ATOM 1528 O TYR A 101 -1.269 -5.247 4.087 1.00 0.00 O ATOM 1529 CB TYR A 101 0.284 -6.999 6.183 1.00 0.00 C ATOM 1530 CG TYR A 101 0.527 -7.627 7.534 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.525 -7.119 8.373 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.246 -8.719 7.947 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.750 -7.701 9.627 1.00 0.00 C ATOM 1534 CE2 TYR A 101 -0.021 -9.302 9.201 1.00 0.00 C ATOM 1535 CZ TYR A 101 0.977 -8.793 10.040 1.00 0.00 C ATOM 1536 OH TYR A 101 1.199 -9.367 11.275 1.00 0.00 O ATOM 0 H TYR A 101 -2.415 -6.902 5.844 1.00 0.00 H new ATOM 0 HA TYR A 101 -0.336 -5.197 7.187 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.153 -7.731 5.503 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.229 -6.680 5.743 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.122 -6.278 8.053 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -1.016 -9.112 7.299 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.519 -7.308 10.275 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.617 -10.144 9.520 1.00 0.00 H new ATOM 0 HH TYR A 101 1.530 -8.686 11.897 1.00 0.00 H new ATOM 1546 N GLU A 102 0.163 -3.901 5.070 1.00 0.00 N ATOM 1547 CA GLU A 102 0.253 -3.035 3.862 1.00 0.00 C ATOM 1548 C GLU A 102 1.724 -2.820 3.501 1.00 0.00 C ATOM 1549 O GLU A 102 2.552 -2.574 4.354 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.405 -1.684 4.154 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.883 -1.899 4.485 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.579 -0.543 4.618 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.886 0.460 4.602 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.794 -0.532 4.733 1.00 0.00 O ATOM 0 H GLU A 102 0.737 -3.605 5.860 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.260 -3.515 3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.098 -1.195 4.988 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.306 -1.025 3.291 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.360 -2.489 3.702 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.981 -2.462 5.413 1.00 0.00 H new ATOM 1561 N THR A 103 2.057 -2.914 2.242 1.00 0.00 N ATOM 1562 CA THR A 103 3.475 -2.717 1.832 1.00 0.00 C ATOM 1563 C THR A 103 3.552 -1.642 0.745 1.00 0.00 C ATOM 1564 O THR A 103 2.848 -1.693 -0.243 1.00 0.00 O ATOM 1565 CB THR A 103 4.035 -4.034 1.288 1.00 0.00 C ATOM 1566 OG1 THR A 103 3.809 -5.070 2.234 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.537 -3.889 1.037 1.00 0.00 C ATOM 0 H THR A 103 1.409 -3.118 1.481 1.00 0.00 H new ATOM 0 HA THR A 103 4.061 -2.400 2.695 1.00 0.00 H new ATOM 0 HB THR A 103 3.535 -4.281 0.351 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.165 -5.914 1.886 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.933 -4.828 0.650 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.709 -3.095 0.310 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.040 -3.641 1.972 1.00 0.00 H new ATOM 1575 N LYS A 104 4.405 -0.670 0.921 1.00 0.00 N ATOM 1576 CA LYS A 104 4.531 0.406 -0.100 1.00 0.00 C ATOM 1577 C LYS A 104 6.009 0.598 -0.448 1.00 0.00 C ATOM 1578 O LYS A 104 6.844 0.764 0.419 1.00 0.00 O ATOM 1579 CB LYS A 104 3.964 1.713 0.460 1.00 0.00 C ATOM 1580 CG LYS A 104 4.022 2.797 -0.617 1.00 0.00 C ATOM 1581 CD LYS A 104 3.479 4.110 -0.049 1.00 0.00 C ATOM 1582 CE LYS A 104 3.352 5.139 -1.174 1.00 0.00 C ATOM 1583 NZ LYS A 104 2.658 6.353 -0.661 1.00 0.00 N ATOM 0 H LYS A 104 5.020 -0.575 1.729 1.00 0.00 H new ATOM 0 HA LYS A 104 3.976 0.127 -0.996 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.935 1.565 0.787 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.535 2.024 1.335 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.049 2.932 -0.957 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.436 2.494 -1.485 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.508 3.943 0.417 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.145 4.485 0.728 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.339 5.404 -1.552 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.795 4.714 -2.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.572 7.053 -1.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.710 6.093 -0.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.207 6.762 0.122 1.00 0.00 H new ATOM 1597 N LEU A 105 6.340 0.569 -1.709 1.00 0.00 N ATOM 1598 CA LEU A 105 7.765 0.742 -2.107 1.00 0.00 C ATOM 1599 C LEU A 105 8.004 2.185 -2.556 1.00 0.00 C ATOM 1600 O LEU A 105 7.356 2.682 -3.456 1.00 0.00 O ATOM 1601 CB LEU A 105 8.091 -0.213 -3.256 1.00 0.00 C ATOM 1602 CG LEU A 105 8.009 -1.656 -2.753 1.00 0.00 C ATOM 1603 CD1 LEU A 105 8.865 -1.807 -1.495 1.00 0.00 C ATOM 1604 CD2 LEU A 105 6.555 -2.000 -2.424 1.00 0.00 C ATOM 0 H LEU A 105 5.686 0.433 -2.480 1.00 0.00 H new ATOM 0 HA LEU A 105 8.408 0.520 -1.255 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.392 -0.062 -4.079 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.089 -0.007 -3.643 1.00 0.00 H new ATOM 0 HG LEU A 105 8.376 -2.331 -3.526 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.807 -2.835 -1.136 1.00 0.00 H new ATOM 0 HD12 LEU A 105 9.901 -1.562 -1.728 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.498 -1.132 -0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.496 -3.028 -2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.187 -1.325 -1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 105 5.944 -1.893 -3.320 1.00 0.00 H new ATOM 1616 N VAL A 106 8.933 2.860 -1.936 1.00 0.00 N ATOM 1617 CA VAL A 106 9.220 4.269 -2.324 1.00 0.00 C ATOM 1618 C VAL A 106 10.727 4.443 -2.519 1.00 0.00 C ATOM 1619 O VAL A 106 11.523 3.786 -1.880 1.00 0.00 O ATOM 1620 CB VAL A 106 8.737 5.212 -1.220 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.933 6.662 -1.665 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.253 4.958 -0.946 1.00 0.00 C ATOM 0 H VAL A 106 9.507 2.495 -1.176 1.00 0.00 H new ATOM 0 HA VAL A 106 8.701 4.504 -3.253 1.00 0.00 H new ATOM 0 HB VAL A 106 9.311 5.031 -0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.589 7.334 -0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.990 6.843 -1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.360 6.844 -2.574 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.908 5.629 -0.160 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.679 5.139 -1.855 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.113 3.925 -0.628 1.00 0.00 H new ATOM 1632 N SER A 107 11.126 5.319 -3.398 1.00 0.00 N ATOM 1633 CA SER A 107 12.583 5.529 -3.628 1.00 0.00 C ATOM 1634 C SER A 107 12.976 6.937 -3.173 1.00 0.00 C ATOM 1635 O SER A 107 12.166 7.843 -3.159 1.00 0.00 O ATOM 1636 CB SER A 107 12.890 5.370 -5.118 1.00 0.00 C ATOM 1637 OG SER A 107 12.668 4.022 -5.507 1.00 0.00 O ATOM 0 H SER A 107 10.508 5.898 -3.966 1.00 0.00 H new ATOM 0 HA SER A 107 13.151 4.793 -3.058 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.258 6.037 -5.704 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.923 5.652 -5.319 1.00 0.00 H new ATOM 0 HG SER A 107 12.863 3.921 -6.462 1.00 0.00 H new ATOM 1643 N ALA A 108 14.211 7.125 -2.799 1.00 0.00 N ATOM 1644 CA ALA A 108 14.655 8.473 -2.344 1.00 0.00 C ATOM 1645 C ALA A 108 15.610 9.072 -3.379 1.00 0.00 C ATOM 1646 O ALA A 108 16.153 8.375 -4.213 1.00 0.00 O ATOM 1647 CB ALA A 108 15.374 8.344 -1.001 1.00 0.00 C ATOM 0 H ALA A 108 14.932 6.404 -2.789 1.00 0.00 H new ATOM 0 HA ALA A 108 13.788 9.124 -2.232 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.700 9.329 -0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.694 7.917 -0.264 1.00 0.00 H new ATOM 0 HB3 ALA A 108 16.242 7.694 -1.114 1.00 0.00 H new ATOM 1653 N PRO A 109 15.817 10.397 -3.318 1.00 0.00 N ATOM 1654 CA PRO A 109 16.708 11.102 -4.247 1.00 0.00 C ATOM 1655 C PRO A 109 18.177 10.751 -3.999 1.00 0.00 C ATOM 1656 O PRO A 109 19.024 10.948 -4.847 1.00 0.00 O ATOM 1657 CB PRO A 109 16.461 12.577 -3.929 1.00 0.00 C ATOM 1658 CG PRO A 109 15.977 12.580 -2.518 1.00 0.00 C ATOM 1659 CD PRO A 109 15.199 11.307 -2.338 1.00 0.00 C ATOM 0 HA PRO A 109 16.510 10.838 -5.286 1.00 0.00 H new ATOM 0 HB2 PRO A 109 17.373 13.164 -4.037 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.722 13.010 -4.603 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.813 12.627 -1.820 1.00 0.00 H new ATOM 0 HG3 PRO A 109 15.350 13.450 -2.324 1.00 0.00 H new ATOM 0 HD2 PRO A 109 15.284 10.923 -1.322 1.00 0.00 H new ATOM 0 HD3 PRO A 109 14.137 11.452 -2.536 1.00 0.00 H new ATOM 1667 N HIS A 110 18.484 10.230 -2.842 1.00 0.00 N ATOM 1668 CA HIS A 110 19.897 9.866 -2.541 1.00 0.00 C ATOM 1669 C HIS A 110 20.323 8.701 -3.437 1.00 0.00 C ATOM 1670 O HIS A 110 21.494 8.407 -3.577 1.00 0.00 O ATOM 1671 CB HIS A 110 20.017 9.448 -1.074 1.00 0.00 C ATOM 1672 CG HIS A 110 19.534 10.564 -0.191 1.00 0.00 C ATOM 1673 ND1 HIS A 110 20.295 11.698 0.049 1.00 0.00 N ATOM 1674 CD2 HIS A 110 18.371 10.736 0.519 1.00 0.00 C ATOM 1675 CE1 HIS A 110 19.587 12.494 0.872 1.00 0.00 C ATOM 1676 NE2 HIS A 110 18.407 11.955 1.189 1.00 0.00 N ATOM 0 H HIS A 110 17.818 10.041 -2.093 1.00 0.00 H new ATOM 0 HA HIS A 110 20.541 10.726 -2.727 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.430 8.547 -0.893 1.00 0.00 H new ATOM 0 HB3 HIS A 110 21.053 9.206 -0.838 1.00 0.00 H new ATOM 0 HD2 HIS A 110 17.553 10.032 0.552 1.00 0.00 H new ATOM 0 HE1 HIS A 110 19.931 13.452 1.232 1.00 0.00 H new ATOM 0 HE2 HIS A 110 17.687 12.352 1.793 1.00 0.00 H new ATOM 1684 N GLY A 111 19.380 8.033 -4.045 1.00 0.00 N ATOM 1685 CA GLY A 111 19.732 6.887 -4.930 1.00 0.00 C ATOM 1686 C GLY A 111 19.319 5.578 -4.255 1.00 0.00 C ATOM 1687 O GLY A 111 19.287 4.531 -4.872 1.00 0.00 O ATOM 0 H GLY A 111 18.383 8.231 -3.967 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.229 6.988 -5.891 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.803 6.884 -5.130 1.00 0.00 H new ATOM 1691 N GLY A 112 18.999 5.628 -2.990 1.00 0.00 N ATOM 1692 CA GLY A 112 18.588 4.386 -2.276 1.00 0.00 C ATOM 1693 C GLY A 112 17.076 4.192 -2.421 1.00 0.00 C ATOM 1694 O GLY A 112 16.387 5.018 -2.987 1.00 0.00 O ATOM 0 H GLY A 112 19.005 6.475 -2.421 1.00 0.00 H new ATOM 0 HA2 GLY A 112 19.117 3.526 -2.686 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.858 4.453 -1.222 1.00 0.00 H new ATOM 1698 N THR A 113 16.556 3.108 -1.914 1.00 0.00 N ATOM 1699 CA THR A 113 15.090 2.864 -2.025 1.00 0.00 C ATOM 1700 C THR A 113 14.473 2.806 -0.626 1.00 0.00 C ATOM 1701 O THR A 113 14.941 2.092 0.239 1.00 0.00 O ATOM 1702 CB THR A 113 14.847 1.536 -2.746 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.399 1.601 -4.053 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.343 1.270 -2.836 1.00 0.00 C ATOM 0 H THR A 113 17.082 2.382 -1.428 1.00 0.00 H new ATOM 0 HA THR A 113 14.629 3.674 -2.590 1.00 0.00 H new ATOM 0 HB THR A 113 15.323 0.728 -2.191 1.00 0.00 H new ATOM 0 HG1 THR A 113 16.036 0.867 -4.176 1.00 0.00 H new ATOM 0 HG21 THR A 113 13.171 0.324 -3.350 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.922 1.220 -1.832 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.863 2.077 -3.391 1.00 0.00 H new ATOM 1712 N ILE A 114 13.426 3.549 -0.398 1.00 0.00 N ATOM 1713 CA ILE A 114 12.778 3.534 0.944 1.00 0.00 C ATOM 1714 C ILE A 114 11.557 2.612 0.911 1.00 0.00 C ATOM 1715 O ILE A 114 10.736 2.688 0.019 1.00 0.00 O ATOM 1716 CB ILE A 114 12.338 4.952 1.316 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.540 5.897 1.246 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.770 4.953 2.737 1.00 0.00 C ATOM 1719 CD1 ILE A 114 13.067 7.338 1.443 1.00 0.00 C ATOM 0 H ILE A 114 12.990 4.166 -1.083 1.00 0.00 H new ATOM 0 HA ILE A 114 13.489 3.169 1.686 1.00 0.00 H new ATOM 0 HB ILE A 114 11.572 5.289 0.617 1.00 0.00 H new ATOM 0 HG12 ILE A 114 14.268 5.634 2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 114 14.040 5.796 0.283 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.456 5.963 3.003 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.913 4.282 2.787 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.536 4.615 3.435 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.922 8.012 1.393 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.355 7.597 0.660 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.586 7.433 2.417 1.00 0.00 H new ATOM 1731 N ILE A 115 11.431 1.740 1.875 1.00 0.00 N ATOM 1732 CA ILE A 115 10.262 0.816 1.892 1.00 0.00 C ATOM 1733 C ILE A 115 9.420 1.076 3.142 1.00 0.00 C ATOM 1734 O ILE A 115 9.933 1.172 4.240 1.00 0.00 O ATOM 1735 CB ILE A 115 10.758 -0.632 1.904 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.701 -0.860 0.722 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.562 -1.580 1.793 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.543 -2.111 0.974 1.00 0.00 C ATOM 0 H ILE A 115 12.085 1.628 2.649 1.00 0.00 H new ATOM 0 HA ILE A 115 9.653 0.986 1.004 1.00 0.00 H new ATOM 0 HB ILE A 115 11.291 -0.825 2.835 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.127 -0.974 -0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 115 12.349 0.006 0.588 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.914 -2.612 1.801 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.890 -1.419 2.636 1.00 0.00 H new ATOM 0 HG23 ILE A 115 9.029 -1.386 0.862 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.215 -2.273 0.131 1.00 0.00 H new ATOM 0 HD12 ILE A 115 13.128 -1.979 1.884 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.887 -2.974 1.086 1.00 0.00 H new ATOM 1750 N LYS A 116 8.129 1.187 2.986 1.00 0.00 N ATOM 1751 CA LYS A 116 7.252 1.437 4.165 1.00 0.00 C ATOM 1752 C LYS A 116 6.287 0.262 4.336 1.00 0.00 C ATOM 1753 O LYS A 116 5.663 -0.182 3.394 1.00 0.00 O ATOM 1754 CB LYS A 116 6.455 2.723 3.944 1.00 0.00 C ATOM 1755 CG LYS A 116 7.411 3.916 3.900 1.00 0.00 C ATOM 1756 CD LYS A 116 6.605 5.213 3.816 1.00 0.00 C ATOM 1757 CE LYS A 116 7.561 6.402 3.713 1.00 0.00 C ATOM 1758 NZ LYS A 116 6.832 7.581 3.165 1.00 0.00 N ATOM 0 H LYS A 116 7.643 1.115 2.092 1.00 0.00 H new ATOM 0 HA LYS A 116 7.865 1.540 5.061 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.893 2.659 3.012 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.729 2.855 4.746 1.00 0.00 H new ATOM 0 HG2 LYS A 116 8.041 3.924 4.790 1.00 0.00 H new ATOM 0 HG3 LYS A 116 8.075 3.832 3.040 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.945 5.188 2.949 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.971 5.318 4.697 1.00 0.00 H new ATOM 0 HE2 LYS A 116 7.971 6.639 4.695 1.00 0.00 H new ATOM 0 HE3 LYS A 116 8.403 6.150 3.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 7.482 8.390 3.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 6.462 7.352 2.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.043 7.825 3.797 1.00 0.00 H new ATOM 1772 N THR A 117 6.161 -0.247 5.531 1.00 0.00 N ATOM 1773 CA THR A 117 5.237 -1.394 5.755 1.00 0.00 C ATOM 1774 C THR A 117 4.334 -1.102 6.956 1.00 0.00 C ATOM 1775 O THR A 117 4.798 -0.785 8.033 1.00 0.00 O ATOM 1776 CB THR A 117 6.053 -2.661 6.027 1.00 0.00 C ATOM 1777 OG1 THR A 117 6.939 -2.893 4.941 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.110 -3.854 6.183 1.00 0.00 C ATOM 0 H THR A 117 6.657 0.081 6.360 1.00 0.00 H new ATOM 0 HA THR A 117 4.621 -1.540 4.867 1.00 0.00 H new ATOM 0 HB THR A 117 6.628 -2.534 6.944 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.337 -3.784 5.028 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.692 -4.755 6.377 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.431 -3.675 7.017 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.533 -3.984 5.267 1.00 0.00 H new ATOM 1786 N THR A 118 3.046 -1.213 6.778 1.00 0.00 N ATOM 1787 CA THR A 118 2.110 -0.947 7.907 1.00 0.00 C ATOM 1788 C THR A 118 1.497 -2.269 8.375 1.00 0.00 C ATOM 1789 O THR A 118 1.262 -3.166 7.589 1.00 0.00 O ATOM 1790 CB THR A 118 0.999 -0.006 7.439 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.577 1.154 6.858 1.00 0.00 O ATOM 1792 CG2 THR A 118 0.130 0.397 8.632 1.00 0.00 C ATOM 0 H THR A 118 2.601 -1.477 5.899 1.00 0.00 H new ATOM 0 HA THR A 118 2.652 -0.483 8.731 1.00 0.00 H new ATOM 0 HB THR A 118 0.381 -0.514 6.699 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.866 1.757 6.556 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.661 1.068 8.296 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.314 -0.494 9.076 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.745 0.905 9.375 1.00 0.00 H new ATOM 1800 N SER A 119 1.240 -2.402 9.647 1.00 0.00 N ATOM 1801 CA SER A 119 0.646 -3.670 10.156 1.00 0.00 C ATOM 1802 C SER A 119 -0.558 -3.358 11.048 1.00 0.00 C ATOM 1803 O SER A 119 -0.523 -2.458 11.863 1.00 0.00 O ATOM 1804 CB SER A 119 1.695 -4.434 10.967 1.00 0.00 C ATOM 1805 OG SER A 119 2.797 -4.757 10.130 1.00 0.00 O ATOM 0 H SER A 119 1.415 -1.689 10.355 1.00 0.00 H new ATOM 0 HA SER A 119 0.320 -4.278 9.312 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.030 -3.830 11.810 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.259 -5.344 11.380 1.00 0.00 H new ATOM 0 HG SER A 119 2.597 -5.574 9.627 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.622 -4.099 10.899 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.830 -3.854 11.736 1.00 0.00 C ATOM 1813 C LYS A 120 -3.460 -5.197 12.114 1.00 0.00 C ATOM 1814 O LYS A 120 -3.656 -6.056 11.278 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.839 -3.020 10.945 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.886 -2.444 11.901 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.951 -1.693 11.099 1.00 0.00 C ATOM 1818 CE LYS A 120 -6.949 -1.044 12.059 1.00 0.00 C ATOM 1819 NZ LYS A 120 -8.337 -1.330 11.600 1.00 0.00 N ATOM 0 H LYS A 120 -1.707 -4.866 10.232 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.547 -3.315 12.640 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.328 -2.213 10.420 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.323 -3.637 10.188 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -5.348 -3.246 12.477 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.411 -1.771 12.615 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.482 -0.932 10.475 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.468 -2.380 10.429 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -6.802 -1.428 13.068 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.783 0.032 12.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -8.960 -0.540 11.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.344 -1.445 10.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.677 -2.205 12.048 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.774 -5.390 13.365 1.00 0.00 N ATOM 1834 CA TYR A 121 -4.384 -6.684 13.785 1.00 0.00 C ATOM 1835 C TYR A 121 -5.654 -6.420 14.595 1.00 0.00 C ATOM 1836 O TYR A 121 -5.762 -5.435 15.299 1.00 0.00 O ATOM 1837 CB TYR A 121 -3.387 -7.460 14.646 1.00 0.00 C ATOM 1838 CG TYR A 121 -3.209 -6.751 15.967 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -2.292 -5.700 16.077 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -3.962 -7.145 17.078 1.00 0.00 C ATOM 1841 CE1 TYR A 121 -2.128 -5.041 17.301 1.00 0.00 C ATOM 1842 CE2 TYR A 121 -3.798 -6.486 18.303 1.00 0.00 C ATOM 1843 CZ TYR A 121 -2.880 -5.434 18.414 1.00 0.00 C ATOM 1844 OH TYR A 121 -2.719 -4.784 19.621 1.00 0.00 O ATOM 0 H TYR A 121 -3.635 -4.711 14.113 1.00 0.00 H new ATOM 0 HA TYR A 121 -4.636 -7.266 12.899 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.746 -8.476 14.811 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.430 -7.540 14.131 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.711 -5.397 15.218 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -4.669 -7.957 16.991 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -1.421 -4.229 17.387 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -4.379 -6.789 19.161 1.00 0.00 H new ATOM 0 HH TYR A 121 -3.317 -5.180 20.288 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.617 -7.297 14.504 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.879 -7.102 15.272 1.00 0.00 C ATOM 1856 C HIS A 122 -8.039 -8.241 16.281 1.00 0.00 C ATOM 1857 O HIS A 122 -7.353 -9.241 16.216 1.00 0.00 O ATOM 1858 CB HIS A 122 -9.066 -7.103 14.307 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.995 -5.888 13.423 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -8.362 -5.907 12.190 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -9.471 -4.610 13.579 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -8.473 -4.676 11.658 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -9.141 -3.847 12.465 1.00 0.00 N ATOM 0 H HIS A 122 -6.584 -8.140 13.931 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.842 -6.150 15.801 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -9.054 -8.008 13.700 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -10.002 -7.105 14.865 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -7.897 -6.708 11.764 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -10.019 -4.251 14.438 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -8.071 -4.393 10.696 1.00 0.00 H new ATOM 1871 N THR A 123 -8.939 -8.098 17.215 1.00 0.00 N ATOM 1872 CA THR A 123 -9.138 -9.175 18.226 1.00 0.00 C ATOM 1873 C THR A 123 -10.627 -9.518 18.322 1.00 0.00 C ATOM 1874 O THR A 123 -11.480 -8.723 17.985 1.00 0.00 O ATOM 1875 CB THR A 123 -8.638 -8.695 19.591 1.00 0.00 C ATOM 1876 OG1 THR A 123 -9.493 -7.665 20.069 1.00 0.00 O ATOM 1877 CG2 THR A 123 -7.214 -8.157 19.455 1.00 0.00 C ATOM 0 H THR A 123 -9.544 -7.284 17.322 1.00 0.00 H new ATOM 0 HA THR A 123 -8.579 -10.061 17.925 1.00 0.00 H new ATOM 0 HB THR A 123 -8.642 -9.528 20.294 1.00 0.00 H new ATOM 0 HG1 THR A 123 -9.176 -7.357 20.944 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.860 -7.816 20.428 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.560 -8.948 19.087 1.00 0.00 H new ATOM 0 HG23 THR A 123 -7.206 -7.323 18.753 1.00 0.00 H new ATOM 2169 N ALA A 142 11.222 -6.378 9.585 1.00 0.00 N ATOM 2170 CA ALA A 142 12.417 -5.624 9.111 1.00 0.00 C ATOM 2171 C ALA A 142 13.562 -6.603 8.844 1.00 0.00 C ATOM 2172 O ALA A 142 14.296 -6.469 7.884 1.00 0.00 O ATOM 2173 CB ALA A 142 12.845 -4.619 10.182 1.00 0.00 C ATOM 0 HA ALA A 142 12.171 -5.092 8.192 1.00 0.00 H new ATOM 0 HB1 ALA A 142 13.719 -4.068 9.835 1.00 0.00 H new ATOM 0 HB2 ALA A 142 12.029 -3.922 10.374 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.092 -5.150 11.101 1.00 0.00 H new ATOM 2179 N HIS A 143 13.720 -7.589 9.685 1.00 0.00 N ATOM 2180 CA HIS A 143 14.817 -8.575 9.479 1.00 0.00 C ATOM 2181 C HIS A 143 14.647 -9.250 8.116 1.00 0.00 C ATOM 2182 O HIS A 143 15.584 -9.379 7.354 1.00 0.00 O ATOM 2183 CB HIS A 143 14.766 -9.634 10.582 1.00 0.00 C ATOM 2184 CG HIS A 143 15.154 -9.010 11.895 1.00 0.00 C ATOM 2185 ND1 HIS A 143 14.739 -9.529 13.110 1.00 0.00 N ATOM 2186 CD2 HIS A 143 15.920 -7.911 12.197 1.00 0.00 C ATOM 2187 CE1 HIS A 143 15.252 -8.750 14.081 1.00 0.00 C ATOM 2188 NE2 HIS A 143 15.980 -7.749 13.579 1.00 0.00 N ATOM 0 H HIS A 143 13.137 -7.754 10.505 1.00 0.00 H new ATOM 0 HA HIS A 143 15.778 -8.061 9.513 1.00 0.00 H new ATOM 0 HB2 HIS A 143 13.763 -10.056 10.650 1.00 0.00 H new ATOM 0 HB3 HIS A 143 15.442 -10.455 10.344 1.00 0.00 H new ATOM 0 HD2 HIS A 143 16.402 -7.270 11.474 1.00 0.00 H new ATOM 0 HE1 HIS A 143 15.094 -8.914 15.137 1.00 0.00 H new ATOM 0 HE2 HIS A 143 16.474 -7.022 14.097 1.00 0.00 H new ATOM 2196 N LEU A 144 13.456 -9.684 7.803 1.00 0.00 N ATOM 2197 CA LEU A 144 13.227 -10.350 6.491 1.00 0.00 C ATOM 2198 C LEU A 144 13.681 -9.420 5.363 1.00 0.00 C ATOM 2199 O LEU A 144 14.433 -9.807 4.491 1.00 0.00 O ATOM 2200 CB LEU A 144 11.738 -10.661 6.329 1.00 0.00 C ATOM 2201 CG LEU A 144 11.299 -11.638 7.421 1.00 0.00 C ATOM 2202 CD1 LEU A 144 9.850 -12.061 7.176 1.00 0.00 C ATOM 2203 CD2 LEU A 144 12.202 -12.874 7.393 1.00 0.00 C ATOM 0 H LEU A 144 12.633 -9.606 8.400 1.00 0.00 H new ATOM 0 HA LEU A 144 13.797 -11.278 6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.155 -9.742 6.392 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.550 -11.091 5.345 1.00 0.00 H new ATOM 0 HG LEU A 144 11.376 -11.153 8.394 1.00 0.00 H new ATOM 0 HD11 LEU A 144 9.538 -12.757 7.954 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.206 -11.182 7.196 1.00 0.00 H new ATOM 0 HD13 LEU A 144 9.772 -12.546 6.203 1.00 0.00 H new ATOM 0 HD21 LEU A 144 11.890 -13.571 8.171 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.125 -13.359 6.420 1.00 0.00 H new ATOM 0 HD23 LEU A 144 13.235 -12.574 7.568 1.00 0.00 H new ATOM 2215 N PHE A 145 13.230 -8.196 5.374 1.00 0.00 N ATOM 2216 CA PHE A 145 13.636 -7.243 4.303 1.00 0.00 C ATOM 2217 C PHE A 145 15.163 -7.201 4.210 1.00 0.00 C ATOM 2218 O PHE A 145 15.728 -7.115 3.138 1.00 0.00 O ATOM 2219 CB PHE A 145 13.109 -5.846 4.636 1.00 0.00 C ATOM 2220 CG PHE A 145 11.602 -5.841 4.534 1.00 0.00 C ATOM 2221 CD1 PHE A 145 10.986 -5.914 3.280 1.00 0.00 C ATOM 2222 CD2 PHE A 145 10.821 -5.766 5.694 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.589 -5.910 3.184 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.424 -5.761 5.598 1.00 0.00 C ATOM 2225 CZ PHE A 145 8.807 -5.834 4.344 1.00 0.00 C ATOM 0 H PHE A 145 12.598 -7.815 6.078 1.00 0.00 H new ATOM 0 HA PHE A 145 13.221 -7.571 3.350 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.417 -5.559 5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.533 -5.112 3.951 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.588 -5.973 2.385 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.296 -5.712 6.662 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.114 -5.966 2.216 1.00 0.00 H new ATOM 0 HE2 PHE A 145 8.822 -5.701 6.493 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.730 -5.832 4.271 1.00 0.00 H new ATOM 2235 N LYS A 146 15.837 -7.264 5.327 1.00 0.00 N ATOM 2236 CA LYS A 146 17.325 -7.230 5.304 1.00 0.00 C ATOM 2237 C LYS A 146 17.850 -8.441 4.532 1.00 0.00 C ATOM 2238 O LYS A 146 18.770 -8.337 3.744 1.00 0.00 O ATOM 2239 CB LYS A 146 17.857 -7.269 6.738 1.00 0.00 C ATOM 2240 CG LYS A 146 19.380 -7.128 6.724 1.00 0.00 C ATOM 2241 CD LYS A 146 19.755 -5.676 6.423 1.00 0.00 C ATOM 2242 CE LYS A 146 21.275 -5.518 6.490 1.00 0.00 C ATOM 2243 NZ LYS A 146 21.612 -4.241 7.179 1.00 0.00 N ATOM 0 H LYS A 146 15.419 -7.338 6.255 1.00 0.00 H new ATOM 0 HA LYS A 146 17.661 -6.315 4.816 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.413 -6.464 7.324 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.573 -8.206 7.217 1.00 0.00 H new ATOM 0 HG2 LYS A 146 19.793 -7.429 7.687 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.810 -7.789 5.972 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.392 -5.393 5.435 1.00 0.00 H new ATOM 0 HD3 LYS A 146 19.277 -5.009 7.141 1.00 0.00 H new ATOM 0 HE2 LYS A 146 21.715 -6.359 7.025 1.00 0.00 H new ATOM 0 HE3 LYS A 146 21.696 -5.523 5.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 22.645 -4.133 7.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 21.204 -3.443 6.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 21.222 -4.253 8.143 1.00 0.00 H new ATOM 2257 N LEU A 147 17.274 -9.591 4.750 1.00 0.00 N ATOM 2258 CA LEU A 147 17.741 -10.808 4.028 1.00 0.00 C ATOM 2259 C LEU A 147 17.495 -10.635 2.529 1.00 0.00 C ATOM 2260 O LEU A 147 18.346 -10.927 1.713 1.00 0.00 O ATOM 2261 CB LEU A 147 16.970 -12.028 4.535 1.00 0.00 C ATOM 2262 CG LEU A 147 17.628 -12.552 5.814 1.00 0.00 C ATOM 2263 CD1 LEU A 147 19.106 -12.841 5.546 1.00 0.00 C ATOM 2264 CD2 LEU A 147 17.506 -11.498 6.916 1.00 0.00 C ATOM 0 H LEU A 147 16.500 -9.741 5.397 1.00 0.00 H new ATOM 0 HA LEU A 147 18.806 -10.952 4.207 1.00 0.00 H new ATOM 0 HB2 LEU A 147 15.932 -11.760 4.731 1.00 0.00 H new ATOM 0 HB3 LEU A 147 16.960 -12.807 3.773 1.00 0.00 H new ATOM 0 HG LEU A 147 17.131 -13.469 6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 147 19.575 -13.214 6.457 1.00 0.00 H new ATOM 0 HD12 LEU A 147 19.193 -13.591 4.760 1.00 0.00 H new ATOM 0 HD13 LEU A 147 19.605 -11.924 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 147 17.974 -11.869 7.828 1.00 0.00 H new ATOM 0 HD22 LEU A 147 18.004 -10.581 6.600 1.00 0.00 H new ATOM 0 HD23 LEU A 147 16.453 -11.291 7.107 1.00 0.00 H new ATOM 2276 N ILE A 148 16.337 -10.160 2.158 1.00 0.00 N ATOM 2277 CA ILE A 148 16.043 -9.969 0.711 1.00 0.00 C ATOM 2278 C ILE A 148 17.119 -9.079 0.088 1.00 0.00 C ATOM 2279 O ILE A 148 17.749 -9.438 -0.887 1.00 0.00 O ATOM 2280 CB ILE A 148 14.674 -9.305 0.549 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.604 -10.162 1.229 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.347 -9.169 -0.939 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.260 -9.433 1.181 1.00 0.00 C ATOM 0 H ILE A 148 15.584 -9.897 2.794 1.00 0.00 H new ATOM 0 HA ILE A 148 16.036 -10.937 0.211 1.00 0.00 H new ATOM 0 HB ILE A 148 14.694 -8.318 1.010 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.524 -11.127 0.729 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.885 -10.361 2.263 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.372 -8.696 -1.055 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.107 -8.557 -1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.328 -10.157 -1.399 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.498 -10.043 1.665 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.345 -8.479 1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.978 -9.257 0.143 1.00 0.00 H new ATOM 2295 N GLU A 149 17.336 -7.918 0.644 1.00 0.00 N ATOM 2296 CA GLU A 149 18.372 -7.004 0.084 1.00 0.00 C ATOM 2297 C GLU A 149 19.711 -7.738 0.001 1.00 0.00 C ATOM 2298 O GLU A 149 20.530 -7.461 -0.853 1.00 0.00 O ATOM 2299 CB GLU A 149 18.516 -5.781 0.991 1.00 0.00 C ATOM 2300 CG GLU A 149 19.528 -4.810 0.379 1.00 0.00 C ATOM 2301 CD GLU A 149 19.947 -3.781 1.429 1.00 0.00 C ATOM 2302 OE1 GLU A 149 19.501 -3.901 2.559 1.00 0.00 O ATOM 2303 OE2 GLU A 149 20.706 -2.890 1.087 1.00 0.00 O ATOM 0 H GLU A 149 16.841 -7.563 1.462 1.00 0.00 H new ATOM 0 HA GLU A 149 18.072 -6.684 -0.914 1.00 0.00 H new ATOM 0 HB2 GLU A 149 17.551 -5.289 1.112 1.00 0.00 H new ATOM 0 HB3 GLU A 149 18.844 -6.088 1.984 1.00 0.00 H new ATOM 0 HG2 GLU A 149 20.401 -5.356 0.021 1.00 0.00 H new ATOM 0 HG3 GLU A 149 19.090 -4.308 -0.484 1.00 0.00 H new ATOM 2310 N GLY A 150 19.944 -8.673 0.882 1.00 0.00 N ATOM 2311 CA GLY A 150 21.232 -9.421 0.850 1.00 0.00 C ATOM 2312 C GLY A 150 21.221 -10.401 -0.324 1.00 0.00 C ATOM 2313 O GLY A 150 22.243 -10.686 -0.918 1.00 0.00 O ATOM 0 H GLY A 150 19.299 -8.950 1.621 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.066 -8.727 0.751 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.376 -9.960 1.787 1.00 0.00 H new ATOM 2317 N TYR A 151 20.073 -10.918 -0.665 1.00 0.00 N ATOM 2318 CA TYR A 151 19.997 -11.880 -1.801 1.00 0.00 C ATOM 2319 C TYR A 151 20.174 -11.127 -3.121 1.00 0.00 C ATOM 2320 O TYR A 151 20.879 -11.567 -4.007 1.00 0.00 O ATOM 2321 CB TYR A 151 18.632 -12.571 -1.790 1.00 0.00 C ATOM 2322 CG TYR A 151 18.580 -13.556 -0.649 1.00 0.00 C ATOM 2323 CD1 TYR A 151 19.366 -14.714 -0.687 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.747 -13.311 0.449 1.00 0.00 C ATOM 2325 CE1 TYR A 151 19.320 -15.627 0.372 1.00 0.00 C ATOM 2326 CE2 TYR A 151 17.701 -14.225 1.509 1.00 0.00 C ATOM 2327 CZ TYR A 151 18.488 -15.383 1.471 1.00 0.00 C ATOM 2328 OH TYR A 151 18.442 -16.283 2.515 1.00 0.00 O ATOM 0 H TYR A 151 19.184 -10.716 -0.207 1.00 0.00 H new ATOM 0 HA TYR A 151 20.786 -12.626 -1.699 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.838 -11.832 -1.683 1.00 0.00 H new ATOM 0 HB3 TYR A 151 18.464 -13.085 -2.737 1.00 0.00 H new ATOM 0 HD1 TYR A 151 20.008 -14.903 -1.535 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.140 -12.418 0.479 1.00 0.00 H new ATOM 0 HE1 TYR A 151 19.926 -16.520 0.342 1.00 0.00 H new ATOM 0 HE2 TYR A 151 17.058 -14.037 2.356 1.00 0.00 H new ATOM 0 HH TYR A 151 18.241 -15.808 3.348 1.00 0.00 H new ATOM 2338 N LEU A 152 19.540 -9.995 -3.259 1.00 0.00 N ATOM 2339 CA LEU A 152 19.674 -9.218 -4.522 1.00 0.00 C ATOM 2340 C LEU A 152 21.042 -8.535 -4.553 1.00 0.00 C ATOM 2341 O LEU A 152 21.740 -8.570 -5.547 1.00 0.00 O ATOM 2342 CB LEU A 152 18.570 -8.161 -4.591 1.00 0.00 C ATOM 2343 CG LEU A 152 17.215 -8.855 -4.747 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.757 -9.386 -3.388 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.186 -7.854 -5.276 1.00 0.00 C ATOM 0 H LEU A 152 18.936 -9.575 -2.552 1.00 0.00 H new ATOM 0 HA LEU A 152 19.584 -9.889 -5.376 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.577 -7.551 -3.688 1.00 0.00 H new ATOM 0 HB3 LEU A 152 18.746 -7.489 -5.431 1.00 0.00 H new ATOM 0 HG LEU A 152 17.309 -9.683 -5.449 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.792 -9.881 -3.497 1.00 0.00 H new ATOM 0 HD12 LEU A 152 17.490 -10.099 -3.010 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.663 -8.557 -2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.221 -8.349 -5.387 1.00 0.00 H new ATOM 0 HD22 LEU A 152 16.090 -7.025 -4.574 1.00 0.00 H new ATOM 0 HD23 LEU A 152 16.512 -7.474 -6.244 1.00 0.00 H new