USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1077 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 120 SER OG : rot 180:sc= 0.995 USER MOD Set 1.2: B 123 THR OG1 : rot 81:sc= 1.17 USER MOD Set 2.1: A 54 THR OG1 : rot 180:sc= -0.21 USER MOD Set 2.2: A 57 THR OG1 : rot -170:sc= 0.203 USER MOD Set 3.1: A 15 CYS SG : rot 178:sc= -9.17! USER MOD Set 3.2: A 17 SER OG : rot -29:sc= 0.793 USER MOD Set 3.3: A 18 CYS SG : rot 99:sc= 1.79 USER MOD Set 3.4: A 21 THR OG1 : rot -61:sc= 1.23 USER MOD Set 3.5: B 85 CYS SG : rot -105:sc= -9.47! USER MOD Set 3.6: B 88 CYS SG : rot 140:sc= 0.332 USER MOD Set 3.7: B 133 LYS NZ :NH3+ -163:sc= 1.97 (180deg=-0.462) USER MOD Set 4.1: A 7 THR OG1 : rot 180:sc= 0.574 USER MOD Set 4.2: A 73 ASN : amide:sc= 0.634 X(o=1.2,f=0.89) USER MOD Set 5.1: A 4 ASN : amide:sc= -0.0104 K(o=-0.01,f=-2.3!) USER MOD Set 5.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -121:sc= -0.104 (180deg=-0.525) USER MOD Single : A 14 THR OG1 : rot 50:sc= 1.2 USER MOD Single : A 16 ASN : amide:sc= -0.0331 K(o=-0.033,f=-1.2) USER MOD Single : A 24 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.13) USER MOD Single : A 25 GLN : amide:sc= 0.637 K(o=0.64,f=-0.022) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 174:sc= 0.962 (180deg=0.931) USER MOD Single : A 43 ASN : amide:sc= -1.21 K(o=-1.2,f=-5.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0345 USER MOD Single : A 51 LYS NZ :NH3+ -127:sc= 1.05 (180deg=-0.341) USER MOD Single : A 53 GLN : amide:sc= -0.563 K(o=-0.56,f=-4.3) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc=-0.00192 K(o=-0.0019,f=-1.8!) USER MOD Single : A 65 MET CE :methyl -179:sc= -0.183 (180deg=-0.186) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 172:sc= -0.0958 (180deg=-0.215) USER MOD Single : B 76 LYS NZ :NH3+ -157:sc= 1.3 (180deg=1.27) USER MOD Single : B 77 HIS : no HE2:sc= -0.102 X(o=-0.1,f=-0.38) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 THR OG1 : rot 180:sc= -0.2 USER MOD Single : B 93 SER OG : rot 71:sc= 1.22 USER MOD Single : B 97 ASN : amide:sc=-0.00653 X(o=-0.0065,f=-0.081) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 LYS NZ :NH3+ 171:sc= 0.991 (180deg=0.753) USER MOD Single : B 104 TYR OH : rot 40:sc= 0.151 USER MOD Single : B 110 ASN : amide:sc= 0.741 K(o=0.74,f=0) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 LYS NZ :NH3+ -147:sc= 0.872 (180deg=0.275) USER MOD Single : B 114 CYS SG : rot 180:sc= -1.31 USER MOD Single : B 117 SER OG : rot -126:sc= 1.92 USER MOD Single : B 119 HIS : no HD1:sc= -0.0843 X(o=-0.084,f=0) USER MOD Single : B 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 127 THR OG1 : rot 85:sc= 1.21 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 161:sc= 0.717 (180deg=0.247) USER MOD Single : B 131 THR OG1 : rot -72:sc= 1.24 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -7.427 -7.896 27.519 1.00 0.00 N ATOM 21 CA GLY A 2 -6.001 -7.952 27.173 1.00 0.00 C ATOM 22 C GLY A 2 -5.746 -7.672 25.694 1.00 0.00 C ATOM 23 O GLY A 2 -5.621 -6.509 25.308 1.00 0.00 O ATOM 0 HA2 GLY A 2 -5.456 -7.226 27.776 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -5.608 -8.937 27.426 1.00 0.00 H new ATOM 27 N VAL A 3 -5.663 -8.732 24.891 1.00 0.00 N ATOM 28 CA VAL A 3 -5.311 -8.714 23.458 1.00 0.00 C ATOM 29 C VAL A 3 -6.291 -9.546 22.620 1.00 0.00 C ATOM 30 O VAL A 3 -7.033 -10.373 23.150 1.00 0.00 O ATOM 31 CB VAL A 3 -3.873 -9.240 23.214 1.00 0.00 C ATOM 32 CG1 VAL A 3 -2.818 -8.222 23.668 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.604 -10.618 23.843 1.00 0.00 C ATOM 0 H VAL A 3 -5.847 -9.676 25.231 1.00 0.00 H new ATOM 0 HA VAL A 3 -5.370 -7.671 23.146 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.791 -9.374 22.135 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -1.822 -8.623 23.482 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.945 -7.294 23.111 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -2.937 -8.025 24.733 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -2.579 -10.921 23.631 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -3.750 -10.560 24.922 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.293 -11.351 23.423 1.00 0.00 H new ATOM 43 N ASN A 4 -6.267 -9.352 21.299 1.00 0.00 N ATOM 44 CA ASN A 4 -6.967 -10.188 20.321 1.00 0.00 C ATOM 45 C ASN A 4 -6.113 -10.360 19.048 1.00 0.00 C ATOM 46 O ASN A 4 -5.581 -9.396 18.504 1.00 0.00 O ATOM 47 CB ASN A 4 -8.343 -9.560 20.039 1.00 0.00 C ATOM 48 CG ASN A 4 -9.273 -10.438 19.209 1.00 0.00 C ATOM 49 OD1 ASN A 4 -8.933 -11.530 18.772 1.00 0.00 O ATOM 50 ND2 ASN A 4 -10.495 -10.000 18.985 1.00 0.00 N ATOM 0 H ASN A 4 -5.746 -8.588 20.869 1.00 0.00 H new ATOM 0 HA ASN A 4 -7.126 -11.192 20.715 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.828 -9.333 20.989 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.198 -8.612 19.521 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.151 -10.570 18.451 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -10.785 -9.091 19.346 1.00 0.00 H new ATOM 57 N SER A 5 -5.942 -11.597 18.585 1.00 0.00 N ATOM 58 CA SER A 5 -5.187 -11.958 17.379 1.00 0.00 C ATOM 59 C SER A 5 -6.111 -12.171 16.168 1.00 0.00 C ATOM 60 O SER A 5 -7.188 -12.766 16.302 1.00 0.00 O ATOM 61 CB SER A 5 -4.397 -13.250 17.644 1.00 0.00 C ATOM 62 OG SER A 5 -3.644 -13.631 16.508 1.00 0.00 O ATOM 0 H SER A 5 -6.340 -12.410 19.056 1.00 0.00 H new ATOM 0 HA SER A 5 -4.512 -11.135 17.147 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.730 -13.104 18.494 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.085 -14.051 17.913 1.00 0.00 H new ATOM 0 HG SER A 5 -3.150 -14.454 16.704 1.00 0.00 H new ATOM 68 N VAL A 6 -5.675 -11.765 14.970 1.00 0.00 N ATOM 69 CA VAL A 6 -6.280 -12.197 13.696 1.00 0.00 C ATOM 70 C VAL A 6 -5.196 -12.558 12.675 1.00 0.00 C ATOM 71 O VAL A 6 -4.123 -11.953 12.651 1.00 0.00 O ATOM 72 CB VAL A 6 -7.293 -11.163 13.141 1.00 0.00 C ATOM 73 CG1 VAL A 6 -6.647 -9.884 12.591 1.00 0.00 C ATOM 74 CG2 VAL A 6 -8.205 -11.780 12.066 1.00 0.00 C ATOM 0 H VAL A 6 -4.890 -11.125 14.852 1.00 0.00 H new ATOM 0 HA VAL A 6 -6.858 -13.099 13.896 1.00 0.00 H new ATOM 0 HB VAL A 6 -7.889 -10.873 14.006 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -7.423 -9.214 12.223 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -6.087 -9.389 13.384 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -5.971 -10.140 11.775 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -8.901 -11.024 11.702 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -7.597 -12.143 11.237 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -8.764 -12.611 12.496 1.00 0.00 H new ATOM 84 N THR A 7 -5.508 -13.546 11.833 1.00 0.00 N ATOM 85 CA THR A 7 -4.676 -14.032 10.728 1.00 0.00 C ATOM 86 C THR A 7 -5.437 -13.811 9.433 1.00 0.00 C ATOM 87 O THR A 7 -6.625 -14.120 9.351 1.00 0.00 O ATOM 88 CB THR A 7 -4.331 -15.516 10.898 1.00 0.00 C ATOM 89 OG1 THR A 7 -3.918 -15.739 12.228 1.00 0.00 O ATOM 90 CG2 THR A 7 -3.212 -15.928 9.942 1.00 0.00 C ATOM 0 H THR A 7 -6.390 -14.054 11.906 1.00 0.00 H new ATOM 0 HA THR A 7 -3.734 -13.484 10.715 1.00 0.00 H new ATOM 0 HB THR A 7 -5.214 -16.113 10.670 1.00 0.00 H new ATOM 0 HG1 THR A 7 -3.697 -16.686 12.347 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.985 -16.985 10.081 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.531 -15.758 8.914 1.00 0.00 H new ATOM 0 HG23 THR A 7 -2.321 -15.335 10.148 1.00 0.00 H new ATOM 98 N ILE A 8 -4.778 -13.243 8.430 1.00 0.00 N ATOM 99 CA ILE A 8 -5.369 -12.792 7.170 1.00 0.00 C ATOM 100 C ILE A 8 -4.462 -13.209 6.002 1.00 0.00 C ATOM 101 O ILE A 8 -3.280 -12.886 5.966 1.00 0.00 O ATOM 102 CB ILE A 8 -5.609 -11.255 7.238 1.00 0.00 C ATOM 103 CG1 ILE A 8 -6.521 -10.898 8.442 1.00 0.00 C ATOM 104 CG2 ILE A 8 -6.211 -10.719 5.928 1.00 0.00 C ATOM 105 CD1 ILE A 8 -7.012 -9.448 8.529 1.00 0.00 C ATOM 0 H ILE A 8 -3.773 -13.076 8.472 1.00 0.00 H new ATOM 0 HA ILE A 8 -6.338 -13.262 7.003 1.00 0.00 H new ATOM 0 HB ILE A 8 -4.640 -10.775 7.378 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.393 -11.551 8.413 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.979 -11.129 9.359 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.365 -9.643 6.012 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -5.529 -10.925 5.103 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.166 -11.209 5.740 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.639 -9.329 9.413 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.156 -8.777 8.598 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.591 -9.206 7.638 1.00 0.00 H new ATOM 117 N SER A 9 -5.005 -13.905 5.011 1.00 0.00 N ATOM 118 CA SER A 9 -4.376 -14.044 3.697 1.00 0.00 C ATOM 119 C SER A 9 -4.501 -12.690 2.976 1.00 0.00 C ATOM 120 O SER A 9 -5.629 -12.260 2.717 1.00 0.00 O ATOM 121 CB SER A 9 -5.076 -15.146 2.876 1.00 0.00 C ATOM 122 OG SER A 9 -5.408 -16.294 3.647 1.00 0.00 O ATOM 0 H SER A 9 -5.897 -14.392 5.093 1.00 0.00 H new ATOM 0 HA SER A 9 -3.329 -14.326 3.809 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.985 -14.738 2.433 1.00 0.00 H new ATOM 0 HB3 SER A 9 -4.427 -15.445 2.053 1.00 0.00 H new ATOM 0 HG SER A 9 -5.850 -16.956 3.075 1.00 0.00 H new ATOM 128 N VAL A 10 -3.395 -12.004 2.669 1.00 0.00 N ATOM 129 CA VAL A 10 -3.375 -10.732 1.926 1.00 0.00 C ATOM 130 C VAL A 10 -2.929 -11.056 0.503 1.00 0.00 C ATOM 131 O VAL A 10 -1.751 -11.021 0.156 1.00 0.00 O ATOM 132 CB VAL A 10 -2.508 -9.636 2.583 1.00 0.00 C ATOM 133 CG1 VAL A 10 -2.479 -8.353 1.728 1.00 0.00 C ATOM 134 CG2 VAL A 10 -3.126 -9.255 3.936 1.00 0.00 C ATOM 0 H VAL A 10 -2.464 -12.323 2.935 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.374 -10.297 1.929 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.498 -10.032 2.689 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.860 -7.602 2.219 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.064 -8.580 0.746 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.493 -7.969 1.613 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.520 -8.481 4.408 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.138 -8.880 3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.159 -10.133 4.581 1.00 0.00 H new ATOM 144 N GLU A 11 -3.923 -11.427 -0.294 1.00 0.00 N ATOM 145 CA GLU A 11 -3.791 -12.103 -1.591 1.00 0.00 C ATOM 146 C GLU A 11 -2.959 -11.333 -2.637 1.00 0.00 C ATOM 147 O GLU A 11 -2.408 -11.948 -3.556 1.00 0.00 O ATOM 148 CB GLU A 11 -5.203 -12.404 -2.141 1.00 0.00 C ATOM 149 CG GLU A 11 -6.046 -13.267 -1.179 1.00 0.00 C ATOM 150 CD GLU A 11 -7.053 -14.138 -1.927 1.00 0.00 C ATOM 151 OE1 GLU A 11 -8.197 -13.710 -2.189 1.00 0.00 O ATOM 152 OE2 GLU A 11 -6.684 -15.278 -2.307 1.00 0.00 O ATOM 0 H GLU A 11 -4.898 -11.258 -0.045 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.233 -13.022 -1.410 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.723 -11.465 -2.330 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.114 -12.917 -3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.386 -13.902 -0.588 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.575 -12.619 -0.480 1.00 0.00 H new ATOM 159 N GLY A 12 -2.830 -10.007 -2.500 1.00 0.00 N ATOM 160 CA GLY A 12 -2.060 -9.146 -3.409 1.00 0.00 C ATOM 161 C GLY A 12 -0.631 -8.803 -2.962 1.00 0.00 C ATOM 162 O GLY A 12 0.124 -8.251 -3.763 1.00 0.00 O ATOM 0 H GLY A 12 -3.268 -9.491 -1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.008 -9.634 -4.382 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.609 -8.215 -3.548 1.00 0.00 H new ATOM 166 N MET A 13 -0.244 -9.109 -1.718 1.00 0.00 N ATOM 167 CA MET A 13 1.054 -8.753 -1.115 1.00 0.00 C ATOM 168 C MET A 13 2.051 -9.916 -1.219 1.00 0.00 C ATOM 169 O MET A 13 1.759 -11.008 -0.732 1.00 0.00 O ATOM 170 CB MET A 13 0.809 -8.371 0.350 1.00 0.00 C ATOM 171 CG MET A 13 2.079 -7.984 1.121 1.00 0.00 C ATOM 172 SD MET A 13 1.918 -8.141 2.913 1.00 0.00 S ATOM 173 CE MET A 13 1.918 -9.949 3.004 1.00 0.00 C ATOM 0 H MET A 13 -0.844 -9.629 -1.078 1.00 0.00 H new ATOM 0 HA MET A 13 1.492 -7.912 -1.652 1.00 0.00 H new ATOM 0 HB2 MET A 13 0.109 -7.536 0.384 1.00 0.00 H new ATOM 0 HB3 MET A 13 0.331 -9.209 0.857 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.904 -8.611 0.783 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.341 -6.954 0.878 1.00 0.00 H new ATOM 0 HE1 MET A 13 0.993 -10.290 3.469 1.00 0.00 H new ATOM 0 HE2 MET A 13 1.993 -10.364 1.999 1.00 0.00 H new ATOM 0 HE3 MET A 13 2.768 -10.283 3.599 1.00 0.00 H new ATOM 183 N THR A 14 3.243 -9.679 -1.793 1.00 0.00 N ATOM 184 CA THR A 14 4.276 -10.718 -2.002 1.00 0.00 C ATOM 185 C THR A 14 5.709 -10.176 -2.172 1.00 0.00 C ATOM 186 O THR A 14 6.586 -10.896 -2.653 1.00 0.00 O ATOM 187 CB THR A 14 3.806 -11.728 -3.061 1.00 0.00 C ATOM 188 OG1 THR A 14 4.539 -12.933 -2.985 1.00 0.00 O ATOM 189 CG2 THR A 14 3.898 -11.141 -4.454 1.00 0.00 C ATOM 0 H THR A 14 3.522 -8.757 -2.128 1.00 0.00 H new ATOM 0 HA THR A 14 4.381 -11.278 -1.073 1.00 0.00 H new ATOM 0 HB THR A 14 2.760 -11.954 -2.852 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.554 -13.249 -2.057 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.559 -11.878 -5.182 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.269 -10.253 -4.517 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.932 -10.869 -4.667 1.00 0.00 H new ATOM 197 N CYS A 15 5.966 -8.926 -1.767 1.00 0.00 N ATOM 198 CA CYS A 15 7.262 -8.261 -1.877 1.00 0.00 C ATOM 199 C CYS A 15 7.782 -7.596 -0.575 1.00 0.00 C ATOM 200 O CYS A 15 7.054 -7.378 0.401 1.00 0.00 O ATOM 201 CB CYS A 15 7.133 -7.243 -3.019 1.00 0.00 C ATOM 202 SG CYS A 15 6.380 -5.693 -2.436 1.00 0.00 S ATOM 0 H CYS A 15 5.253 -8.335 -1.341 1.00 0.00 H new ATOM 0 HA CYS A 15 8.019 -9.018 -2.080 1.00 0.00 H new ATOM 0 HB2 CYS A 15 8.118 -7.037 -3.439 1.00 0.00 H new ATOM 0 HB3 CYS A 15 6.527 -7.666 -3.820 1.00 0.00 H new ATOM 0 HG CYS A 15 6.332 -4.839 -3.415 1.00 0.00 H new ATOM 207 N ASN A 16 9.058 -7.198 -0.630 1.00 0.00 N ATOM 208 CA ASN A 16 9.811 -6.537 0.442 1.00 0.00 C ATOM 209 C ASN A 16 9.363 -5.109 0.826 1.00 0.00 C ATOM 210 O ASN A 16 9.789 -4.624 1.876 1.00 0.00 O ATOM 211 CB ASN A 16 11.309 -6.544 0.083 1.00 0.00 C ATOM 212 CG ASN A 16 11.705 -5.769 -1.174 1.00 0.00 C ATOM 213 OD1 ASN A 16 10.897 -5.175 -1.883 1.00 0.00 O ATOM 214 ND2 ASN A 16 12.986 -5.758 -1.484 1.00 0.00 N ATOM 0 H ASN A 16 9.623 -7.336 -1.468 1.00 0.00 H new ATOM 0 HA ASN A 16 9.599 -7.124 1.336 1.00 0.00 H new ATOM 0 HB2 ASN A 16 11.866 -6.136 0.927 1.00 0.00 H new ATOM 0 HB3 ASN A 16 11.628 -7.579 -0.038 1.00 0.00 H new ATOM 0 HD21 ASN A 16 13.306 -5.256 -2.312 1.00 0.00 H new ATOM 0 HD22 ASN A 16 13.657 -6.251 -0.895 1.00 0.00 H new ATOM 221 N SER A 17 8.522 -4.426 0.040 1.00 0.00 N ATOM 222 CA SER A 17 8.034 -3.077 0.391 1.00 0.00 C ATOM 223 C SER A 17 6.560 -3.066 0.807 1.00 0.00 C ATOM 224 O SER A 17 6.172 -2.270 1.658 1.00 0.00 O ATOM 225 CB SER A 17 8.292 -2.065 -0.737 1.00 0.00 C ATOM 226 OG SER A 17 7.465 -2.259 -1.868 1.00 0.00 O ATOM 0 H SER A 17 8.162 -4.782 -0.846 1.00 0.00 H new ATOM 0 HA SER A 17 8.612 -2.768 1.262 1.00 0.00 H new ATOM 0 HB2 SER A 17 8.138 -1.057 -0.352 1.00 0.00 H new ATOM 0 HB3 SER A 17 9.336 -2.133 -1.044 1.00 0.00 H new ATOM 0 HG SER A 17 7.226 -3.207 -1.940 1.00 0.00 H new ATOM 232 N CYS A 18 5.715 -3.951 0.270 1.00 0.00 N ATOM 233 CA CYS A 18 4.328 -4.071 0.687 1.00 0.00 C ATOM 234 C CYS A 18 4.234 -4.590 2.149 1.00 0.00 C ATOM 235 O CYS A 18 3.421 -4.092 2.926 1.00 0.00 O ATOM 236 CB CYS A 18 3.647 -4.935 -0.385 1.00 0.00 C ATOM 237 SG CYS A 18 3.755 -4.141 -2.015 1.00 0.00 S ATOM 0 H CYS A 18 5.981 -4.603 -0.468 1.00 0.00 H new ATOM 0 HA CYS A 18 3.801 -3.118 0.739 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.119 -5.917 -0.421 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.601 -5.094 -0.121 1.00 0.00 H new ATOM 0 HG CYS A 18 4.734 -4.667 -2.690 1.00 0.00 H new ATOM 242 N VAL A 19 5.138 -5.490 2.556 1.00 0.00 N ATOM 243 CA VAL A 19 5.296 -5.892 3.972 1.00 0.00 C ATOM 244 C VAL A 19 5.631 -4.703 4.895 1.00 0.00 C ATOM 245 O VAL A 19 5.069 -4.584 5.985 1.00 0.00 O ATOM 246 CB VAL A 19 6.346 -7.014 4.169 1.00 0.00 C ATOM 247 CG1 VAL A 19 5.854 -8.332 3.545 1.00 0.00 C ATOM 248 CG2 VAL A 19 7.743 -6.656 3.638 1.00 0.00 C ATOM 0 H VAL A 19 5.781 -5.962 1.921 1.00 0.00 H new ATOM 0 HA VAL A 19 4.321 -6.286 4.258 1.00 0.00 H new ATOM 0 HB VAL A 19 6.454 -7.138 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.605 -9.108 3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.921 -8.634 4.021 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.687 -8.189 2.477 1.00 0.00 H new ATOM 0 HG21 VAL A 19 8.423 -7.490 3.812 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.685 -6.452 2.569 1.00 0.00 H new ATOM 0 HG23 VAL A 19 8.114 -5.772 4.156 1.00 0.00 H new ATOM 258 N TRP A 20 6.481 -3.775 4.435 1.00 0.00 N ATOM 259 CA TRP A 20 6.838 -2.556 5.166 1.00 0.00 C ATOM 260 C TRP A 20 5.645 -1.588 5.245 1.00 0.00 C ATOM 261 O TRP A 20 5.375 -1.044 6.318 1.00 0.00 O ATOM 262 CB TRP A 20 8.066 -1.938 4.484 1.00 0.00 C ATOM 263 CG TRP A 20 8.652 -0.699 5.094 1.00 0.00 C ATOM 264 CD1 TRP A 20 9.774 -0.656 5.847 1.00 0.00 C ATOM 265 CD2 TRP A 20 8.240 0.695 4.922 1.00 0.00 C ATOM 266 NE1 TRP A 20 10.085 0.654 6.152 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.175 1.531 5.603 1.00 0.00 C ATOM 268 CE3 TRP A 20 7.192 1.342 4.230 1.00 0.00 C ATOM 269 CZ2 TRP A 20 9.073 2.931 5.604 1.00 0.00 C ATOM 270 CZ3 TRP A 20 7.079 2.745 4.221 1.00 0.00 C ATOM 271 CH2 TRP A 20 8.014 3.540 4.910 1.00 0.00 C ATOM 0 H TRP A 20 6.946 -3.853 3.530 1.00 0.00 H new ATOM 0 HA TRP A 20 7.092 -2.788 6.200 1.00 0.00 H new ATOM 0 HB2 TRP A 20 8.848 -2.697 4.449 1.00 0.00 H new ATOM 0 HB3 TRP A 20 7.797 -1.709 3.453 1.00 0.00 H new ATOM 0 HD1 TRP A 20 10.342 -1.518 6.163 1.00 0.00 H new ATOM 0 HE1 TRP A 20 10.888 0.937 6.714 1.00 0.00 H new ATOM 0 HE3 TRP A 20 6.463 0.749 3.698 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 9.799 3.532 6.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 6.270 3.215 3.682 1.00 0.00 H new ATOM 0 HH2 TRP A 20 7.918 4.616 4.905 1.00 0.00 H new ATOM 282 N THR A 21 4.873 -1.454 4.153 1.00 0.00 N ATOM 283 CA THR A 21 3.599 -0.714 4.115 1.00 0.00 C ATOM 284 C THR A 21 2.628 -1.217 5.182 1.00 0.00 C ATOM 285 O THR A 21 2.081 -0.393 5.910 1.00 0.00 O ATOM 286 CB THR A 21 2.990 -0.755 2.705 1.00 0.00 C ATOM 287 OG1 THR A 21 3.850 -0.070 1.822 1.00 0.00 O ATOM 288 CG2 THR A 21 1.617 -0.086 2.630 1.00 0.00 C ATOM 0 H THR A 21 5.122 -1.865 3.253 1.00 0.00 H new ATOM 0 HA THR A 21 3.803 0.331 4.351 1.00 0.00 H new ATOM 0 HB THR A 21 2.870 -1.805 2.437 1.00 0.00 H new ATOM 0 HG1 THR A 21 3.936 0.864 2.107 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.238 -0.147 1.610 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.927 -0.594 3.304 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.706 0.960 2.923 1.00 0.00 H new ATOM 296 N ILE A 22 2.477 -2.537 5.367 1.00 0.00 N ATOM 297 CA ILE A 22 1.664 -3.085 6.476 1.00 0.00 C ATOM 298 C ILE A 22 2.175 -2.588 7.840 1.00 0.00 C ATOM 299 O ILE A 22 1.390 -2.036 8.605 1.00 0.00 O ATOM 300 CB ILE A 22 1.573 -4.635 6.439 1.00 0.00 C ATOM 301 CG1 ILE A 22 1.000 -5.225 5.128 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.738 -5.143 7.633 1.00 0.00 C ATOM 303 CD1 ILE A 22 -0.495 -5.000 4.869 1.00 0.00 C ATOM 0 H ILE A 22 2.902 -3.246 4.769 1.00 0.00 H new ATOM 0 HA ILE A 22 0.650 -2.709 6.336 1.00 0.00 H new ATOM 0 HB ILE A 22 2.604 -4.983 6.499 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.558 -4.803 4.292 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.188 -6.299 5.127 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.679 -6.231 7.599 1.00 0.00 H new ATOM 0 HG22 ILE A 22 1.211 -4.834 8.565 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.267 -4.724 7.579 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.773 -5.460 3.921 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.076 -5.449 5.675 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.700 -3.930 4.827 1.00 0.00 H new ATOM 315 N GLU A 23 3.469 -2.734 8.150 1.00 0.00 N ATOM 316 CA GLU A 23 4.039 -2.332 9.452 1.00 0.00 C ATOM 317 C GLU A 23 3.887 -0.823 9.734 1.00 0.00 C ATOM 318 O GLU A 23 3.740 -0.412 10.887 1.00 0.00 O ATOM 319 CB GLU A 23 5.524 -2.735 9.502 1.00 0.00 C ATOM 320 CG GLU A 23 6.082 -2.709 10.935 1.00 0.00 C ATOM 321 CD GLU A 23 7.528 -3.193 11.024 1.00 0.00 C ATOM 322 OE1 GLU A 23 8.442 -2.423 10.646 1.00 0.00 O ATOM 323 OE2 GLU A 23 7.773 -4.312 11.535 1.00 0.00 O ATOM 0 H GLU A 23 4.154 -3.134 7.509 1.00 0.00 H new ATOM 0 HA GLU A 23 3.478 -2.851 10.230 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.642 -3.735 9.085 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.104 -2.058 8.875 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.021 -1.693 11.324 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.456 -3.333 11.573 1.00 0.00 H new ATOM 330 N GLN A 24 3.943 0.012 8.695 1.00 0.00 N ATOM 331 CA GLN A 24 3.720 1.457 8.792 1.00 0.00 C ATOM 332 C GLN A 24 2.240 1.833 8.965 1.00 0.00 C ATOM 333 O GLN A 24 1.937 2.704 9.784 1.00 0.00 O ATOM 334 CB GLN A 24 4.360 2.165 7.585 1.00 0.00 C ATOM 335 CG GLN A 24 5.901 2.110 7.609 1.00 0.00 C ATOM 336 CD GLN A 24 6.503 2.792 8.835 1.00 0.00 C ATOM 337 OE1 GLN A 24 6.279 3.968 9.094 1.00 0.00 O ATOM 338 NE2 GLN A 24 7.252 2.080 9.649 1.00 0.00 N ATOM 0 H GLN A 24 4.148 -0.301 7.746 1.00 0.00 H new ATOM 0 HA GLN A 24 4.207 1.804 9.703 1.00 0.00 H new ATOM 0 HB2 GLN A 24 3.999 1.704 6.666 1.00 0.00 H new ATOM 0 HB3 GLN A 24 4.038 3.206 7.568 1.00 0.00 H new ATOM 0 HG2 GLN A 24 6.222 1.069 7.585 1.00 0.00 H new ATOM 0 HG3 GLN A 24 6.290 2.585 6.708 1.00 0.00 H new ATOM 0 HE21 GLN A 24 7.443 1.100 9.440 1.00 0.00 H new ATOM 0 HE22 GLN A 24 7.642 2.508 10.489 1.00 0.00 H new ATOM 347 N GLN A 25 1.325 1.204 8.216 1.00 0.00 N ATOM 348 CA GLN A 25 -0.116 1.477 8.298 1.00 0.00 C ATOM 349 C GLN A 25 -0.732 0.947 9.599 1.00 0.00 C ATOM 350 O GLN A 25 -1.537 1.635 10.230 1.00 0.00 O ATOM 351 CB GLN A 25 -0.835 0.845 7.088 1.00 0.00 C ATOM 352 CG GLN A 25 -2.277 1.354 6.927 1.00 0.00 C ATOM 353 CD GLN A 25 -2.344 2.799 6.426 1.00 0.00 C ATOM 354 OE1 GLN A 25 -2.511 3.748 7.190 1.00 0.00 O ATOM 355 NE2 GLN A 25 -2.176 3.027 5.145 1.00 0.00 N ATOM 0 H GLN A 25 1.565 0.487 7.532 1.00 0.00 H new ATOM 0 HA GLN A 25 -0.246 2.559 8.289 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -0.273 1.064 6.180 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -0.847 -0.239 7.202 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -2.810 0.708 6.230 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -2.792 1.282 7.885 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.037 2.247 4.502 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.185 3.984 4.792 1.00 0.00 H new ATOM 364 N ILE A 26 -0.373 -0.279 9.996 1.00 0.00 N ATOM 365 CA ILE A 26 -0.872 -0.938 11.210 1.00 0.00 C ATOM 366 C ILE A 26 -0.301 -0.252 12.450 1.00 0.00 C ATOM 367 O ILE A 26 -1.071 0.142 13.323 1.00 0.00 O ATOM 368 CB ILE A 26 -0.566 -2.455 11.133 1.00 0.00 C ATOM 369 CG1 ILE A 26 -1.342 -3.149 9.984 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.822 -3.206 12.449 1.00 0.00 C ATOM 371 CD1 ILE A 26 -2.871 -3.003 10.015 1.00 0.00 C ATOM 0 H ILE A 26 0.287 -0.854 9.472 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.955 -0.841 11.287 1.00 0.00 H new ATOM 0 HB ILE A 26 0.503 -2.508 10.929 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -0.979 -2.752 9.036 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -1.099 -4.211 9.999 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.586 -4.262 12.317 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.192 -2.788 13.235 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.870 -3.101 12.730 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.304 -3.529 9.164 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.259 -3.429 10.940 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.137 -1.947 9.963 1.00 0.00 H new ATOM 383 N GLY A 27 1.008 0.018 12.486 1.00 0.00 N ATOM 384 CA GLY A 27 1.663 0.779 13.562 1.00 0.00 C ATOM 385 C GLY A 27 1.205 2.235 13.724 1.00 0.00 C ATOM 386 O GLY A 27 1.671 2.902 14.647 1.00 0.00 O ATOM 0 H GLY A 27 1.654 -0.289 11.759 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.495 0.258 14.504 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.738 0.774 13.383 1.00 0.00 H new ATOM 390 N LYS A 28 0.303 2.729 12.867 1.00 0.00 N ATOM 391 CA LYS A 28 -0.429 4.002 13.004 1.00 0.00 C ATOM 392 C LYS A 28 -1.825 3.820 13.637 1.00 0.00 C ATOM 393 O LYS A 28 -2.438 4.805 14.057 1.00 0.00 O ATOM 394 CB LYS A 28 -0.459 4.646 11.600 1.00 0.00 C ATOM 395 CG LYS A 28 -1.113 6.034 11.507 1.00 0.00 C ATOM 396 CD LYS A 28 -1.042 6.611 10.082 1.00 0.00 C ATOM 397 CE LYS A 28 0.372 7.072 9.708 1.00 0.00 C ATOM 398 NZ LYS A 28 0.414 7.688 8.359 1.00 0.00 N ATOM 0 H LYS A 28 0.048 2.229 12.015 1.00 0.00 H new ATOM 0 HA LYS A 28 0.076 4.669 13.703 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.566 4.724 11.236 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.986 3.972 10.925 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.155 5.965 11.819 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.618 6.715 12.199 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.375 5.856 9.370 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.730 7.453 9.999 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.727 7.791 10.447 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.052 6.221 9.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.387 7.986 8.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.100 6.994 7.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.215 8.516 8.336 1.00 0.00 H new ATOM 412 N VAL A 29 -2.316 2.584 13.777 1.00 0.00 N ATOM 413 CA VAL A 29 -3.543 2.281 14.524 1.00 0.00 C ATOM 414 C VAL A 29 -3.188 2.111 16.006 1.00 0.00 C ATOM 415 O VAL A 29 -2.629 1.102 16.427 1.00 0.00 O ATOM 416 CB VAL A 29 -4.307 1.055 13.984 1.00 0.00 C ATOM 417 CG1 VAL A 29 -5.678 0.962 14.674 1.00 0.00 C ATOM 418 CG2 VAL A 29 -4.530 1.124 12.462 1.00 0.00 C ATOM 0 H VAL A 29 -1.871 1.760 13.373 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.228 3.119 14.395 1.00 0.00 H new ATOM 0 HB VAL A 29 -3.697 0.177 14.198 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.219 0.096 14.293 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.538 0.858 15.750 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -6.251 1.866 14.469 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.072 0.237 12.133 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -5.110 2.015 12.219 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.566 1.169 11.955 1.00 0.00 H new ATOM 428 N ASN A 30 -3.530 3.139 16.776 1.00 0.00 N ATOM 429 CA ASN A 30 -3.244 3.365 18.205 1.00 0.00 C ATOM 430 C ASN A 30 -3.265 2.139 19.153 1.00 0.00 C ATOM 431 O ASN A 30 -2.559 2.141 20.163 1.00 0.00 O ATOM 432 CB ASN A 30 -4.279 4.385 18.704 1.00 0.00 C ATOM 433 CG ASN A 30 -3.942 4.950 20.077 1.00 0.00 C ATOM 434 OD1 ASN A 30 -4.600 4.643 21.068 1.00 0.00 O ATOM 435 ND2 ASN A 30 -2.932 5.794 20.167 1.00 0.00 N ATOM 0 H ASN A 30 -4.066 3.914 16.386 1.00 0.00 H new ATOM 0 HA ASN A 30 -2.206 3.695 18.243 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -4.349 5.203 17.988 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -5.259 3.910 18.743 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -2.687 6.202 21.069 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -2.396 6.038 19.334 1.00 0.00 H new ATOM 442 N GLY A 31 -4.079 1.114 18.863 1.00 0.00 N ATOM 443 CA GLY A 31 -4.277 -0.056 19.727 1.00 0.00 C ATOM 444 C GLY A 31 -3.300 -1.219 19.511 1.00 0.00 C ATOM 445 O GLY A 31 -3.229 -2.087 20.379 1.00 0.00 O ATOM 0 H GLY A 31 -4.628 1.075 18.004 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.204 0.267 20.766 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.291 -0.426 19.578 1.00 0.00 H new ATOM 449 N VAL A 32 -2.570 -1.276 18.394 1.00 0.00 N ATOM 450 CA VAL A 32 -1.818 -2.485 17.987 1.00 0.00 C ATOM 451 C VAL A 32 -0.739 -2.916 18.993 1.00 0.00 C ATOM 452 O VAL A 32 -0.038 -2.088 19.577 1.00 0.00 O ATOM 453 CB VAL A 32 -1.237 -2.394 16.563 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.384 -2.189 15.562 1.00 0.00 C ATOM 455 CG2 VAL A 32 -0.142 -1.329 16.398 1.00 0.00 C ATOM 0 H VAL A 32 -2.478 -0.495 17.744 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.573 -3.271 17.980 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.731 -3.338 16.360 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.978 -2.124 14.552 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.074 -3.030 15.622 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.914 -1.267 15.800 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.214 -1.330 15.368 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.549 -0.348 16.641 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.688 -1.553 17.068 1.00 0.00 H new ATOM 465 N HIS A 33 -0.606 -4.233 19.179 1.00 0.00 N ATOM 466 CA HIS A 33 0.365 -4.855 20.085 1.00 0.00 C ATOM 467 C HIS A 33 1.479 -5.615 19.336 1.00 0.00 C ATOM 468 O HIS A 33 2.630 -5.593 19.775 1.00 0.00 O ATOM 469 CB HIS A 33 -0.391 -5.796 21.037 1.00 0.00 C ATOM 470 CG HIS A 33 0.488 -6.364 22.125 1.00 0.00 C ATOM 471 ND1 HIS A 33 0.932 -5.681 23.233 1.00 0.00 N ATOM 472 CD2 HIS A 33 1.041 -7.616 22.182 1.00 0.00 C ATOM 473 CE1 HIS A 33 1.738 -6.486 23.939 1.00 0.00 C ATOM 474 NE2 HIS A 33 1.852 -7.680 23.326 1.00 0.00 N ATOM 0 H HIS A 33 -1.187 -4.914 18.690 1.00 0.00 H new ATOM 0 HA HIS A 33 0.866 -4.066 20.646 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -1.220 -5.254 21.493 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -0.823 -6.615 20.462 1.00 0.00 H new ATOM 0 HD2 HIS A 33 0.881 -8.414 21.472 1.00 0.00 H new ATOM 0 HE1 HIS A 33 2.225 -6.217 24.865 1.00 0.00 H new ATOM 0 HE2 HIS A 33 2.416 -8.473 23.632 1.00 0.00 H new ATOM 482 N HIS A 34 1.194 -6.278 18.208 1.00 0.00 N ATOM 483 CA HIS A 34 2.217 -6.941 17.384 1.00 0.00 C ATOM 484 C HIS A 34 1.768 -7.129 15.921 1.00 0.00 C ATOM 485 O HIS A 34 0.626 -7.507 15.669 1.00 0.00 O ATOM 486 CB HIS A 34 2.599 -8.296 18.010 1.00 0.00 C ATOM 487 CG HIS A 34 3.784 -8.945 17.338 1.00 0.00 C ATOM 488 ND1 HIS A 34 3.742 -9.859 16.312 1.00 0.00 N ATOM 489 CD2 HIS A 34 5.105 -8.719 17.614 1.00 0.00 C ATOM 490 CE1 HIS A 34 5.002 -10.168 15.974 1.00 0.00 C ATOM 491 NE2 HIS A 34 5.880 -9.496 16.740 1.00 0.00 N ATOM 0 H HIS A 34 0.248 -6.371 17.839 1.00 0.00 H new ATOM 0 HA HIS A 34 3.091 -6.289 17.363 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.823 -8.151 19.067 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.744 -8.969 17.954 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.486 -8.055 18.376 1.00 0.00 H new ATOM 0 HE1 HIS A 34 5.275 -10.862 15.193 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.898 -9.542 16.695 1.00 0.00 H new ATOM 499 N ILE A 35 2.669 -6.924 14.956 1.00 0.00 N ATOM 500 CA ILE A 35 2.476 -7.226 13.530 1.00 0.00 C ATOM 501 C ILE A 35 3.570 -8.176 13.004 1.00 0.00 C ATOM 502 O ILE A 35 4.763 -8.003 13.278 1.00 0.00 O ATOM 503 CB ILE A 35 2.351 -5.898 12.727 1.00 0.00 C ATOM 504 CG1 ILE A 35 2.036 -6.118 11.227 1.00 0.00 C ATOM 505 CG2 ILE A 35 3.525 -4.925 12.930 1.00 0.00 C ATOM 506 CD1 ILE A 35 3.235 -6.281 10.277 1.00 0.00 C ATOM 0 H ILE A 35 3.589 -6.528 15.151 1.00 0.00 H new ATOM 0 HA ILE A 35 1.541 -7.769 13.391 1.00 0.00 H new ATOM 0 HB ILE A 35 1.482 -5.406 13.163 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.411 -7.007 11.139 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.440 -5.274 10.879 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.360 -4.026 12.336 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.596 -4.655 13.984 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.452 -5.403 12.614 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.875 -6.428 9.259 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.855 -5.386 10.317 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.825 -7.145 10.581 1.00 0.00 H new ATOM 518 N LYS A 36 3.149 -9.169 12.218 1.00 0.00 N ATOM 519 CA LYS A 36 3.988 -10.053 11.394 1.00 0.00 C ATOM 520 C LYS A 36 3.342 -10.256 10.007 1.00 0.00 C ATOM 521 O LYS A 36 2.129 -10.428 9.910 1.00 0.00 O ATOM 522 CB LYS A 36 4.164 -11.400 12.131 1.00 0.00 C ATOM 523 CG LYS A 36 4.796 -12.548 11.318 1.00 0.00 C ATOM 524 CD LYS A 36 6.266 -12.325 10.927 1.00 0.00 C ATOM 525 CE LYS A 36 6.717 -13.308 9.835 1.00 0.00 C ATOM 526 NZ LYS A 36 6.726 -14.718 10.290 1.00 0.00 N ATOM 0 H LYS A 36 2.158 -9.394 12.132 1.00 0.00 H new ATOM 0 HA LYS A 36 4.968 -9.602 11.239 1.00 0.00 H new ATOM 0 HB2 LYS A 36 4.779 -11.228 13.015 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.186 -11.728 12.482 1.00 0.00 H new ATOM 0 HG2 LYS A 36 4.724 -13.468 11.898 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.211 -12.697 10.410 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.398 -11.302 10.574 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.899 -12.442 11.807 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.055 -13.214 8.974 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.717 -13.035 9.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 7.038 -15.332 9.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 7.378 -14.819 11.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 5.768 -14.994 10.585 1.00 0.00 H new ATOM 540 N VAL A 37 4.136 -10.285 8.939 1.00 0.00 N ATOM 541 CA VAL A 37 3.690 -10.598 7.569 1.00 0.00 C ATOM 542 C VAL A 37 4.706 -11.501 6.865 1.00 0.00 C ATOM 543 O VAL A 37 5.912 -11.309 7.023 1.00 0.00 O ATOM 544 CB VAL A 37 3.432 -9.314 6.736 1.00 0.00 C ATOM 545 CG1 VAL A 37 2.075 -8.697 7.080 1.00 0.00 C ATOM 546 CG2 VAL A 37 4.507 -8.235 6.928 1.00 0.00 C ATOM 0 H VAL A 37 5.135 -10.087 8.996 1.00 0.00 H new ATOM 0 HA VAL A 37 2.742 -11.131 7.649 1.00 0.00 H new ATOM 0 HB VAL A 37 3.456 -9.641 5.696 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.921 -7.799 6.481 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.284 -9.416 6.866 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.052 -8.436 8.138 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.264 -7.366 6.317 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.545 -7.942 7.977 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.477 -8.630 6.627 1.00 0.00 H new ATOM 556 N SER A 38 4.228 -12.485 6.099 1.00 0.00 N ATOM 557 CA SER A 38 5.083 -13.379 5.293 1.00 0.00 C ATOM 558 C SER A 38 4.780 -13.275 3.793 1.00 0.00 C ATOM 559 O SER A 38 3.684 -13.602 3.329 1.00 0.00 O ATOM 560 CB SER A 38 4.975 -14.850 5.717 1.00 0.00 C ATOM 561 OG SER A 38 5.379 -15.070 7.058 1.00 0.00 O ATOM 0 H SER A 38 3.232 -12.690 6.016 1.00 0.00 H new ATOM 0 HA SER A 38 6.101 -13.036 5.480 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.944 -15.183 5.594 1.00 0.00 H new ATOM 0 HB3 SER A 38 5.588 -15.460 5.054 1.00 0.00 H new ATOM 0 HG SER A 38 5.288 -16.021 7.275 1.00 0.00 H new ATOM 567 N LEU A 39 5.780 -12.844 3.016 1.00 0.00 N ATOM 568 CA LEU A 39 5.633 -12.483 1.604 1.00 0.00 C ATOM 569 C LEU A 39 5.523 -13.681 0.653 1.00 0.00 C ATOM 570 O LEU A 39 4.848 -13.571 -0.368 1.00 0.00 O ATOM 571 CB LEU A 39 6.796 -11.542 1.229 1.00 0.00 C ATOM 572 CG LEU A 39 8.190 -12.214 1.216 1.00 0.00 C ATOM 573 CD1 LEU A 39 8.654 -12.523 -0.216 1.00 0.00 C ATOM 574 CD2 LEU A 39 9.220 -11.317 1.910 1.00 0.00 C ATOM 0 H LEU A 39 6.734 -12.735 3.360 1.00 0.00 H new ATOM 0 HA LEU A 39 4.677 -11.973 1.481 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.601 -11.120 0.243 1.00 0.00 H new ATOM 0 HB3 LEU A 39 6.815 -10.710 1.933 1.00 0.00 H new ATOM 0 HG LEU A 39 8.105 -13.156 1.757 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.636 -12.994 -0.186 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.942 -13.198 -0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.713 -11.597 -0.787 1.00 0.00 H new ATOM 0 HD21 LEU A 39 10.196 -11.803 1.893 1.00 0.00 H new ATOM 0 HD22 LEU A 39 9.281 -10.362 1.388 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.917 -11.147 2.943 1.00 0.00 H new ATOM 586 N GLU A 40 6.153 -14.820 0.960 1.00 0.00 N ATOM 587 CA GLU A 40 6.141 -15.982 0.064 1.00 0.00 C ATOM 588 C GLU A 40 4.832 -16.782 0.171 1.00 0.00 C ATOM 589 O GLU A 40 4.389 -17.359 -0.823 1.00 0.00 O ATOM 590 CB GLU A 40 7.392 -16.865 0.249 1.00 0.00 C ATOM 591 CG GLU A 40 7.538 -17.607 1.583 1.00 0.00 C ATOM 592 CD GLU A 40 8.152 -16.739 2.672 1.00 0.00 C ATOM 593 OE1 GLU A 40 7.447 -15.880 3.250 1.00 0.00 O ATOM 594 OE2 GLU A 40 9.346 -16.925 2.992 1.00 0.00 O ATOM 0 H GLU A 40 6.678 -14.962 1.823 1.00 0.00 H new ATOM 0 HA GLU A 40 6.182 -15.599 -0.956 1.00 0.00 H new ATOM 0 HB2 GLU A 40 7.404 -17.605 -0.552 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.272 -16.236 0.115 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.558 -17.955 1.910 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.158 -18.492 1.436 1.00 0.00 H new ATOM 601 N GLU A 41 4.188 -16.769 1.345 1.00 0.00 N ATOM 602 CA GLU A 41 2.847 -17.328 1.563 1.00 0.00 C ATOM 603 C GLU A 41 1.716 -16.312 1.327 1.00 0.00 C ATOM 604 O GLU A 41 0.563 -16.726 1.208 1.00 0.00 O ATOM 605 CB GLU A 41 2.725 -17.889 2.991 1.00 0.00 C ATOM 606 CG GLU A 41 3.542 -19.170 3.177 1.00 0.00 C ATOM 607 CD GLU A 41 3.223 -19.838 4.513 1.00 0.00 C ATOM 608 OE1 GLU A 41 2.247 -20.627 4.582 1.00 0.00 O ATOM 609 OE2 GLU A 41 3.965 -19.576 5.491 1.00 0.00 O ATOM 0 H GLU A 41 4.593 -16.361 2.188 1.00 0.00 H new ATOM 0 HA GLU A 41 2.731 -18.123 0.827 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.062 -17.138 3.705 1.00 0.00 H new ATOM 0 HB3 GLU A 41 1.677 -18.092 3.212 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.330 -19.862 2.362 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.606 -18.937 3.129 1.00 0.00 H new ATOM 616 N LYS A 42 2.015 -15.010 1.262 1.00 0.00 N ATOM 617 CA LYS A 42 1.065 -13.897 1.083 1.00 0.00 C ATOM 618 C LYS A 42 0.144 -13.681 2.307 1.00 0.00 C ATOM 619 O LYS A 42 -0.997 -13.237 2.175 1.00 0.00 O ATOM 620 CB LYS A 42 0.293 -14.031 -0.241 1.00 0.00 C ATOM 621 CG LYS A 42 1.225 -14.205 -1.452 1.00 0.00 C ATOM 622 CD LYS A 42 0.503 -13.903 -2.767 1.00 0.00 C ATOM 623 CE LYS A 42 -0.696 -14.838 -2.939 1.00 0.00 C ATOM 624 NZ LYS A 42 -1.429 -14.568 -4.195 1.00 0.00 N ATOM 0 H LYS A 42 2.978 -14.682 1.337 1.00 0.00 H new ATOM 0 HA LYS A 42 1.654 -12.983 1.015 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.381 -14.885 -0.180 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -0.326 -13.146 -0.388 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.085 -13.543 -1.348 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.609 -15.225 -1.473 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.169 -12.866 -2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.191 -14.024 -3.604 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.353 -15.873 -2.934 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.372 -14.722 -2.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.171 -15.285 -4.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.864 -13.625 -4.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.768 -14.604 -4.997 1.00 0.00 H new ATOM 638 N ASN A 43 0.593 -14.032 3.515 1.00 0.00 N ATOM 639 CA ASN A 43 -0.214 -13.983 4.736 1.00 0.00 C ATOM 640 C ASN A 43 0.260 -12.902 5.724 1.00 0.00 C ATOM 641 O ASN A 43 1.357 -12.348 5.614 1.00 0.00 O ATOM 642 CB ASN A 43 -0.316 -15.388 5.357 1.00 0.00 C ATOM 643 CG ASN A 43 0.967 -15.913 5.994 1.00 0.00 C ATOM 644 OD1 ASN A 43 1.794 -15.159 6.479 1.00 0.00 O ATOM 645 ND2 ASN A 43 1.173 -17.216 6.026 1.00 0.00 N ATOM 0 H ASN A 43 1.544 -14.364 3.674 1.00 0.00 H new ATOM 0 HA ASN A 43 -1.224 -13.673 4.467 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -1.100 -15.377 6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -0.631 -16.088 4.583 1.00 0.00 H new ATOM 0 HD21 ASN A 43 2.020 -17.588 6.455 1.00 0.00 H new ATOM 0 HD22 ASN A 43 0.485 -17.851 5.622 1.00 0.00 H new ATOM 652 N ALA A 44 -0.603 -12.610 6.690 1.00 0.00 N ATOM 653 CA ALA A 44 -0.496 -11.492 7.614 1.00 0.00 C ATOM 654 C ALA A 44 -1.106 -11.868 8.983 1.00 0.00 C ATOM 655 O ALA A 44 -2.287 -12.207 9.047 1.00 0.00 O ATOM 656 CB ALA A 44 -1.245 -10.322 6.935 1.00 0.00 C ATOM 0 H ALA A 44 -1.436 -13.175 6.856 1.00 0.00 H new ATOM 0 HA ALA A 44 0.538 -11.215 7.819 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.205 -9.443 7.578 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -0.774 -10.094 5.979 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -2.285 -10.603 6.769 1.00 0.00 H new ATOM 662 N THR A 45 -0.335 -11.807 10.078 1.00 0.00 N ATOM 663 CA THR A 45 -0.780 -12.155 11.444 1.00 0.00 C ATOM 664 C THR A 45 -0.543 -10.978 12.372 1.00 0.00 C ATOM 665 O THR A 45 0.555 -10.428 12.421 1.00 0.00 O ATOM 666 CB THR A 45 -0.049 -13.387 11.986 1.00 0.00 C ATOM 667 OG1 THR A 45 -0.155 -14.430 11.051 1.00 0.00 O ATOM 668 CG2 THR A 45 -0.681 -13.884 13.289 1.00 0.00 C ATOM 0 H THR A 45 0.639 -11.508 10.042 1.00 0.00 H new ATOM 0 HA THR A 45 -1.843 -12.390 11.397 1.00 0.00 H new ATOM 0 HB THR A 45 0.988 -13.105 12.167 1.00 0.00 H new ATOM 0 HG1 THR A 45 0.312 -15.222 11.390 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.138 -14.759 13.646 1.00 0.00 H new ATOM 0 HG22 THR A 45 -0.633 -13.096 14.040 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.722 -14.152 13.109 1.00 0.00 H new ATOM 676 N ILE A 46 -1.555 -10.580 13.136 1.00 0.00 N ATOM 677 CA ILE A 46 -1.557 -9.293 13.844 1.00 0.00 C ATOM 678 C ILE A 46 -2.371 -9.379 15.142 1.00 0.00 C ATOM 679 O ILE A 46 -3.460 -9.965 15.178 1.00 0.00 O ATOM 680 CB ILE A 46 -2.000 -8.199 12.834 1.00 0.00 C ATOM 681 CG1 ILE A 46 -1.668 -6.735 13.190 1.00 0.00 C ATOM 682 CG2 ILE A 46 -3.471 -8.341 12.415 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.312 -6.124 14.437 1.00 0.00 C ATOM 0 H ILE A 46 -2.398 -11.135 13.285 1.00 0.00 H new ATOM 0 HA ILE A 46 -0.563 -9.015 14.194 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.358 -8.413 11.980 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.587 -6.658 13.304 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.944 -6.115 12.337 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.726 -7.551 11.709 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.623 -9.312 11.944 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.109 -8.261 13.295 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.979 -5.092 14.550 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.397 -6.147 14.334 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.019 -6.698 15.316 1.00 0.00 H new ATOM 695 N ILE A 47 -1.812 -8.817 16.216 1.00 0.00 N ATOM 696 CA ILE A 47 -2.440 -8.685 17.539 1.00 0.00 C ATOM 697 C ILE A 47 -2.741 -7.215 17.849 1.00 0.00 C ATOM 698 O ILE A 47 -1.838 -6.376 17.861 1.00 0.00 O ATOM 699 CB ILE A 47 -1.561 -9.302 18.654 1.00 0.00 C ATOM 700 CG1 ILE A 47 -1.240 -10.785 18.356 1.00 0.00 C ATOM 701 CG2 ILE A 47 -2.284 -9.172 20.007 1.00 0.00 C ATOM 702 CD1 ILE A 47 -0.573 -11.527 19.523 1.00 0.00 C ATOM 0 H ILE A 47 -0.871 -8.424 16.190 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.378 -9.239 17.512 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.616 -8.760 18.693 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -2.164 -11.300 18.092 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -0.586 -10.837 17.485 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.666 -9.606 20.793 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.461 -8.119 20.225 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.237 -9.699 19.962 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.380 -12.560 19.235 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.369 -11.039 19.774 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.233 -11.509 20.390 1.00 0.00 H new ATOM 714 N TYR A 48 -4.004 -6.938 18.166 1.00 0.00 N ATOM 715 CA TYR A 48 -4.563 -5.621 18.475 1.00 0.00 C ATOM 716 C TYR A 48 -5.235 -5.563 19.857 1.00 0.00 C ATOM 717 O TYR A 48 -5.654 -6.581 20.408 1.00 0.00 O ATOM 718 CB TYR A 48 -5.578 -5.248 17.382 1.00 0.00 C ATOM 719 CG TYR A 48 -6.685 -6.262 17.120 1.00 0.00 C ATOM 720 CD1 TYR A 48 -6.465 -7.340 16.236 1.00 0.00 C ATOM 721 CD2 TYR A 48 -7.952 -6.107 17.719 1.00 0.00 C ATOM 722 CE1 TYR A 48 -7.501 -8.246 15.947 1.00 0.00 C ATOM 723 CE2 TYR A 48 -9.007 -6.977 17.389 1.00 0.00 C ATOM 724 CZ TYR A 48 -8.783 -8.052 16.502 1.00 0.00 C ATOM 725 OH TYR A 48 -9.801 -8.901 16.199 1.00 0.00 O ATOM 0 H TYR A 48 -4.710 -7.673 18.218 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.739 -4.908 18.502 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -6.040 -4.298 17.652 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -5.035 -5.085 16.451 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -5.495 -7.470 15.779 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.114 -5.315 18.436 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -7.315 -9.090 15.300 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -9.988 -6.823 17.814 1.00 0.00 H new ATOM 0 HH TYR A 48 -10.613 -8.619 16.670 1.00 0.00 H new ATOM 735 N ASP A 49 -5.383 -4.348 20.393 1.00 0.00 N ATOM 736 CA ASP A 49 -6.217 -4.057 21.562 1.00 0.00 C ATOM 737 C ASP A 49 -7.718 -4.154 21.195 1.00 0.00 C ATOM 738 O ASP A 49 -8.187 -3.357 20.367 1.00 0.00 O ATOM 739 CB ASP A 49 -5.855 -2.658 22.081 1.00 0.00 C ATOM 740 CG ASP A 49 -6.697 -2.169 23.259 1.00 0.00 C ATOM 741 OD1 ASP A 49 -7.372 -2.978 23.935 1.00 0.00 O ATOM 742 OD2 ASP A 49 -6.648 -0.951 23.532 1.00 0.00 O ATOM 0 H ASP A 49 -4.916 -3.522 20.018 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.032 -4.790 22.348 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.806 -2.657 22.378 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.955 -1.946 21.262 1.00 0.00 H new ATOM 747 N PRO A 50 -8.480 -5.094 21.798 1.00 0.00 N ATOM 748 CA PRO A 50 -9.887 -5.312 21.476 1.00 0.00 C ATOM 749 C PRO A 50 -10.810 -4.190 21.965 1.00 0.00 C ATOM 750 O PRO A 50 -11.954 -4.135 21.516 1.00 0.00 O ATOM 751 CB PRO A 50 -10.253 -6.654 22.120 1.00 0.00 C ATOM 752 CG PRO A 50 -9.295 -6.763 23.302 1.00 0.00 C ATOM 753 CD PRO A 50 -8.037 -6.077 22.780 1.00 0.00 C ATOM 0 HA PRO A 50 -10.026 -5.319 20.395 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.293 -6.671 22.445 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.123 -7.481 21.422 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.688 -6.266 24.189 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.106 -7.801 23.575 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.492 -5.596 23.592 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -7.360 -6.801 22.326 1.00 0.00 H new ATOM 761 N LYS A 51 -10.349 -3.281 22.838 1.00 0.00 N ATOM 762 CA LYS A 51 -11.128 -2.090 23.205 1.00 0.00 C ATOM 763 C LYS A 51 -11.350 -1.184 21.981 1.00 0.00 C ATOM 764 O LYS A 51 -12.474 -0.762 21.704 1.00 0.00 O ATOM 765 CB LYS A 51 -10.422 -1.314 24.336 1.00 0.00 C ATOM 766 CG LYS A 51 -10.238 -2.149 25.615 1.00 0.00 C ATOM 767 CD LYS A 51 -9.812 -1.324 26.842 1.00 0.00 C ATOM 768 CE LYS A 51 -8.654 -0.341 26.611 1.00 0.00 C ATOM 769 NZ LYS A 51 -7.379 -1.007 26.258 1.00 0.00 N ATOM 0 H LYS A 51 -9.443 -3.348 23.301 1.00 0.00 H new ATOM 0 HA LYS A 51 -12.104 -2.415 23.566 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.446 -0.978 23.985 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -11.000 -0.421 24.572 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -11.173 -2.661 25.841 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.490 -2.919 25.430 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -10.676 -0.763 27.198 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.528 -2.011 27.639 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.927 0.350 25.814 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -8.507 0.254 27.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.628 -0.680 26.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.488 -2.037 26.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.125 -0.772 25.277 1.00 0.00 H new ATOM 783 N LEU A 52 -10.279 -0.899 21.228 1.00 0.00 N ATOM 784 CA LEU A 52 -10.297 -0.008 20.068 1.00 0.00 C ATOM 785 C LEU A 52 -10.732 -0.751 18.802 1.00 0.00 C ATOM 786 O LEU A 52 -11.743 -0.392 18.195 1.00 0.00 O ATOM 787 CB LEU A 52 -8.901 0.629 19.906 1.00 0.00 C ATOM 788 CG LEU A 52 -8.676 1.898 20.755 1.00 0.00 C ATOM 789 CD1 LEU A 52 -8.954 1.703 22.253 1.00 0.00 C ATOM 790 CD2 LEU A 52 -7.231 2.373 20.557 1.00 0.00 C ATOM 0 H LEU A 52 -9.357 -1.292 21.416 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.031 0.782 20.229 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.145 -0.110 20.172 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.748 0.878 18.856 1.00 0.00 H new ATOM 0 HG LEU A 52 -9.393 2.643 20.410 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.773 2.639 22.781 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.992 1.401 22.394 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.294 0.930 22.648 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -7.058 3.270 21.152 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.544 1.589 20.874 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.063 2.598 19.504 1.00 0.00 H new ATOM 802 N GLN A 53 -9.980 -1.771 18.389 1.00 0.00 N ATOM 803 CA GLN A 53 -10.014 -2.282 17.015 1.00 0.00 C ATOM 804 C GLN A 53 -10.994 -3.456 16.842 1.00 0.00 C ATOM 805 O GLN A 53 -11.481 -4.034 17.818 1.00 0.00 O ATOM 806 CB GLN A 53 -8.589 -2.681 16.579 1.00 0.00 C ATOM 807 CG GLN A 53 -7.552 -1.559 16.757 1.00 0.00 C ATOM 808 CD GLN A 53 -6.134 -1.955 16.364 1.00 0.00 C ATOM 809 OE1 GLN A 53 -5.206 -1.794 17.137 1.00 0.00 O ATOM 810 NE2 GLN A 53 -5.891 -2.484 15.184 1.00 0.00 N ATOM 0 H GLN A 53 -9.329 -2.268 18.997 1.00 0.00 H new ATOM 0 HA GLN A 53 -10.382 -1.483 16.371 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -8.273 -3.551 17.154 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.610 -2.982 15.532 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -7.856 -0.699 16.160 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -7.553 -1.240 17.799 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -6.654 -2.627 14.522 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.940 -2.751 14.931 1.00 0.00 H new ATOM 819 N THR A 54 -11.248 -3.817 15.579 1.00 0.00 N ATOM 820 CA THR A 54 -11.930 -5.045 15.136 1.00 0.00 C ATOM 821 C THR A 54 -11.216 -5.582 13.883 1.00 0.00 C ATOM 822 O THR A 54 -10.419 -4.844 13.298 1.00 0.00 O ATOM 823 CB THR A 54 -13.410 -4.778 14.822 1.00 0.00 C ATOM 824 OG1 THR A 54 -13.506 -3.807 13.815 1.00 0.00 O ATOM 825 CG2 THR A 54 -14.226 -4.333 16.032 1.00 0.00 C ATOM 0 H THR A 54 -10.969 -3.230 14.793 1.00 0.00 H new ATOM 0 HA THR A 54 -11.889 -5.781 15.939 1.00 0.00 H new ATOM 0 HB THR A 54 -13.832 -5.728 14.495 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.450 -3.637 13.613 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.260 -4.164 15.731 1.00 0.00 H new ATOM 0 HG22 THR A 54 -14.193 -5.108 16.798 1.00 0.00 H new ATOM 0 HG23 THR A 54 -13.809 -3.409 16.432 1.00 0.00 H new ATOM 833 N PRO A 55 -11.487 -6.816 13.409 1.00 0.00 N ATOM 834 CA PRO A 55 -10.934 -7.313 12.144 1.00 0.00 C ATOM 835 C PRO A 55 -11.255 -6.410 10.942 1.00 0.00 C ATOM 836 O PRO A 55 -10.437 -6.304 10.029 1.00 0.00 O ATOM 837 CB PRO A 55 -11.513 -8.717 11.958 1.00 0.00 C ATOM 838 CG PRO A 55 -11.916 -9.150 13.365 1.00 0.00 C ATOM 839 CD PRO A 55 -12.289 -7.843 14.056 1.00 0.00 C ATOM 0 HA PRO A 55 -9.845 -7.323 12.191 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -12.370 -8.708 11.284 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -10.777 -9.397 11.528 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -12.755 -9.845 13.344 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -11.097 -9.654 13.878 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -13.353 -7.634 13.950 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -12.078 -7.890 15.124 1.00 0.00 H new ATOM 847 N LYS A 56 -12.388 -5.692 10.976 1.00 0.00 N ATOM 848 CA LYS A 56 -12.734 -4.633 10.011 1.00 0.00 C ATOM 849 C LYS A 56 -11.602 -3.591 9.864 1.00 0.00 C ATOM 850 O LYS A 56 -11.246 -3.232 8.736 1.00 0.00 O ATOM 851 CB LYS A 56 -14.057 -3.980 10.462 1.00 0.00 C ATOM 852 CG LYS A 56 -14.602 -2.909 9.502 1.00 0.00 C ATOM 853 CD LYS A 56 -15.695 -2.055 10.164 1.00 0.00 C ATOM 854 CE LYS A 56 -15.948 -0.783 9.344 1.00 0.00 C ATOM 855 NZ LYS A 56 -16.862 0.156 10.035 1.00 0.00 N ATOM 0 H LYS A 56 -13.104 -5.833 11.688 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.861 -5.073 9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.810 -4.759 10.581 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -13.908 -3.528 11.443 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.786 -2.265 9.174 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -15.006 -3.390 8.611 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.616 -2.632 10.246 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.394 -1.789 11.177 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -14.999 -0.285 9.147 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.372 -1.054 8.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -17.004 1.000 9.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -17.778 -0.309 10.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.447 0.437 10.946 1.00 0.00 H new ATOM 869 N THR A 57 -10.994 -3.168 10.986 1.00 0.00 N ATOM 870 CA THR A 57 -9.850 -2.234 11.064 1.00 0.00 C ATOM 871 C THR A 57 -8.602 -2.816 10.401 1.00 0.00 C ATOM 872 O THR A 57 -7.850 -2.084 9.764 1.00 0.00 O ATOM 873 CB THR A 57 -9.516 -1.910 12.532 1.00 0.00 C ATOM 874 OG1 THR A 57 -10.684 -1.713 13.290 1.00 0.00 O ATOM 875 CG2 THR A 57 -8.642 -0.667 12.686 1.00 0.00 C ATOM 0 H THR A 57 -11.299 -3.481 11.908 1.00 0.00 H new ATOM 0 HA THR A 57 -10.144 -1.327 10.536 1.00 0.00 H new ATOM 0 HB THR A 57 -8.963 -2.775 12.897 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.446 -1.357 14.171 1.00 0.00 H new ATOM 0 HG21 THR A 57 -8.442 -0.492 13.743 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.700 -0.817 12.158 1.00 0.00 H new ATOM 0 HG23 THR A 57 -9.160 0.196 12.267 1.00 0.00 H new ATOM 883 N LEU A 58 -8.365 -4.123 10.546 1.00 0.00 N ATOM 884 CA LEU A 58 -7.217 -4.808 9.942 1.00 0.00 C ATOM 885 C LEU A 58 -7.385 -4.981 8.425 1.00 0.00 C ATOM 886 O LEU A 58 -6.448 -4.711 7.676 1.00 0.00 O ATOM 887 CB LEU A 58 -6.948 -6.141 10.677 1.00 0.00 C ATOM 888 CG LEU A 58 -6.381 -6.048 12.117 1.00 0.00 C ATOM 889 CD1 LEU A 58 -5.187 -5.094 12.216 1.00 0.00 C ATOM 890 CD2 LEU A 58 -7.394 -5.648 13.194 1.00 0.00 C ATOM 0 H LEU A 58 -8.968 -4.740 11.090 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.333 -4.182 10.066 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.882 -6.701 10.716 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.251 -6.725 10.076 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.073 -7.074 12.317 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.828 -5.066 13.245 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -4.387 -5.443 11.562 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.494 -4.094 11.911 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.898 -5.612 14.164 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.806 -4.666 12.960 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.200 -6.381 13.226 1.00 0.00 H new ATOM 902 N GLN A 59 -8.580 -5.361 7.959 1.00 0.00 N ATOM 903 CA GLN A 59 -8.926 -5.391 6.530 1.00 0.00 C ATOM 904 C GLN A 59 -8.771 -3.989 5.882 1.00 0.00 C ATOM 905 O GLN A 59 -8.312 -3.890 4.746 1.00 0.00 O ATOM 906 CB GLN A 59 -10.363 -5.940 6.366 1.00 0.00 C ATOM 907 CG GLN A 59 -10.531 -7.436 6.738 1.00 0.00 C ATOM 908 CD GLN A 59 -11.999 -7.843 6.935 1.00 0.00 C ATOM 909 OE1 GLN A 59 -12.745 -7.286 7.734 1.00 0.00 O ATOM 910 NE2 GLN A 59 -12.492 -8.825 6.218 1.00 0.00 N ATOM 0 H GLN A 59 -9.342 -5.659 8.567 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.235 -6.053 6.008 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.037 -5.348 6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.675 -5.800 5.331 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.091 -8.052 5.954 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -9.976 -7.642 7.654 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -11.901 -9.311 5.544 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.467 -9.102 6.335 1.00 0.00 H new ATOM 919 N GLU A 60 -9.072 -2.899 6.604 1.00 0.00 N ATOM 920 CA GLU A 60 -9.014 -1.509 6.119 1.00 0.00 C ATOM 921 C GLU A 60 -7.601 -0.996 5.735 1.00 0.00 C ATOM 922 O GLU A 60 -7.483 -0.012 4.993 1.00 0.00 O ATOM 923 CB GLU A 60 -9.692 -0.622 7.183 1.00 0.00 C ATOM 924 CG GLU A 60 -9.658 0.872 6.861 1.00 0.00 C ATOM 925 CD GLU A 60 -10.566 1.688 7.769 1.00 0.00 C ATOM 926 OE1 GLU A 60 -10.444 1.616 9.015 1.00 0.00 O ATOM 927 OE2 GLU A 60 -11.441 2.399 7.222 1.00 0.00 O ATOM 0 H GLU A 60 -9.373 -2.962 7.576 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.546 -1.463 5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.730 -0.936 7.295 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.204 -0.787 8.144 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.635 1.237 6.954 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.957 1.023 5.824 1.00 0.00 H new ATOM 934 N ALA A 61 -6.512 -1.639 6.179 1.00 0.00 N ATOM 935 CA ALA A 61 -5.161 -1.334 5.678 1.00 0.00 C ATOM 936 C ALA A 61 -4.949 -1.824 4.234 1.00 0.00 C ATOM 937 O ALA A 61 -4.152 -1.254 3.486 1.00 0.00 O ATOM 938 CB ALA A 61 -4.122 -1.920 6.644 1.00 0.00 C ATOM 0 H ALA A 61 -6.539 -2.375 6.885 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.038 -0.252 5.640 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.119 -1.698 6.279 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.254 -1.479 7.632 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.253 -3.000 6.708 1.00 0.00 H new ATOM 944 N ILE A 62 -5.661 -2.885 3.842 1.00 0.00 N ATOM 945 CA ILE A 62 -5.628 -3.455 2.490 1.00 0.00 C ATOM 946 C ILE A 62 -6.379 -2.561 1.503 1.00 0.00 C ATOM 947 O ILE A 62 -5.886 -2.327 0.401 1.00 0.00 O ATOM 948 CB ILE A 62 -6.160 -4.909 2.499 1.00 0.00 C ATOM 949 CG1 ILE A 62 -5.613 -5.757 3.676 1.00 0.00 C ATOM 950 CG2 ILE A 62 -5.847 -5.595 1.157 1.00 0.00 C ATOM 951 CD1 ILE A 62 -4.092 -5.700 3.890 1.00 0.00 C ATOM 0 H ILE A 62 -6.291 -3.384 4.470 1.00 0.00 H new ATOM 0 HA ILE A 62 -4.593 -3.496 2.150 1.00 0.00 H new ATOM 0 HB ILE A 62 -7.239 -4.845 2.641 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -6.103 -5.430 4.593 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.900 -6.796 3.515 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -6.225 -6.617 1.174 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -6.325 -5.044 0.347 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.769 -5.610 0.999 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.820 -6.329 4.738 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.585 -6.059 2.994 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.791 -4.672 4.090 1.00 0.00 H new ATOM 963 N ASP A 63 -7.527 -2.016 1.909 1.00 0.00 N ATOM 964 CA ASP A 63 -8.334 -1.065 1.125 1.00 0.00 C ATOM 965 C ASP A 63 -7.599 0.260 0.849 1.00 0.00 C ATOM 966 O ASP A 63 -7.856 0.906 -0.168 1.00 0.00 O ATOM 967 CB ASP A 63 -9.660 -0.824 1.867 1.00 0.00 C ATOM 968 CG ASP A 63 -10.590 0.185 1.180 1.00 0.00 C ATOM 969 OD1 ASP A 63 -10.906 0.022 -0.024 1.00 0.00 O ATOM 970 OD2 ASP A 63 -11.034 1.144 1.857 1.00 0.00 O ATOM 0 H ASP A 63 -7.937 -2.227 2.819 1.00 0.00 H new ATOM 0 HA ASP A 63 -8.525 -1.501 0.145 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.185 -1.774 1.969 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -9.441 -0.472 2.875 1.00 0.00 H new ATOM 975 N ASP A 64 -6.651 0.654 1.708 1.00 0.00 N ATOM 976 CA ASP A 64 -5.788 1.814 1.458 1.00 0.00 C ATOM 977 C ASP A 64 -4.764 1.577 0.330 1.00 0.00 C ATOM 978 O ASP A 64 -4.363 2.529 -0.341 1.00 0.00 O ATOM 979 CB ASP A 64 -5.113 2.293 2.755 1.00 0.00 C ATOM 980 CG ASP A 64 -5.515 3.743 3.016 1.00 0.00 C ATOM 981 OD1 ASP A 64 -5.047 4.643 2.284 1.00 0.00 O ATOM 982 OD2 ASP A 64 -6.396 3.978 3.875 1.00 0.00 O ATOM 0 H ASP A 64 -6.461 0.180 2.591 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.438 2.613 1.102 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -5.414 1.662 3.592 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.029 2.212 2.668 1.00 0.00 H new ATOM 987 N MET A 65 -4.407 0.316 0.063 1.00 0.00 N ATOM 988 CA MET A 65 -3.650 -0.112 -1.123 1.00 0.00 C ATOM 989 C MET A 65 -4.605 -0.462 -2.284 1.00 0.00 C ATOM 990 O MET A 65 -5.779 -0.086 -2.271 1.00 0.00 O ATOM 991 CB MET A 65 -2.725 -1.285 -0.735 1.00 0.00 C ATOM 992 CG MET A 65 -1.657 -0.871 0.286 1.00 0.00 C ATOM 993 SD MET A 65 -0.523 -2.198 0.757 1.00 0.00 S ATOM 994 CE MET A 65 -1.588 -3.114 1.894 1.00 0.00 C ATOM 0 H MET A 65 -4.643 -0.459 0.683 1.00 0.00 H new ATOM 0 HA MET A 65 -3.023 0.704 -1.482 1.00 0.00 H new ATOM 0 HB2 MET A 65 -3.324 -2.096 -0.322 1.00 0.00 H new ATOM 0 HB3 MET A 65 -2.238 -1.672 -1.630 1.00 0.00 H new ATOM 0 HG2 MET A 65 -1.079 -0.044 -0.126 1.00 0.00 H new ATOM 0 HG3 MET A 65 -2.153 -0.498 1.182 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.041 -3.965 2.299 1.00 0.00 H new ATOM 0 HE2 MET A 65 -1.897 -2.460 2.709 1.00 0.00 H new ATOM 0 HE3 MET A 65 -2.469 -3.470 1.360 1.00 0.00 H new ATOM 1004 N GLY A 66 -4.116 -1.181 -3.303 1.00 0.00 N ATOM 1005 CA GLY A 66 -4.906 -1.703 -4.428 1.00 0.00 C ATOM 1006 C GLY A 66 -4.893 -3.232 -4.473 1.00 0.00 C ATOM 1007 O GLY A 66 -4.433 -3.796 -5.465 1.00 0.00 O ATOM 0 H GLY A 66 -3.128 -1.424 -3.370 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.934 -1.351 -4.344 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.510 -1.309 -5.364 1.00 0.00 H new ATOM 1011 N PHE A 67 -5.354 -3.874 -3.394 1.00 0.00 N ATOM 1012 CA PHE A 67 -5.221 -5.312 -3.110 1.00 0.00 C ATOM 1013 C PHE A 67 -6.538 -5.903 -2.558 1.00 0.00 C ATOM 1014 O PHE A 67 -7.553 -5.216 -2.480 1.00 0.00 O ATOM 1015 CB PHE A 67 -4.046 -5.529 -2.128 1.00 0.00 C ATOM 1016 CG PHE A 67 -2.635 -5.232 -2.620 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -2.224 -5.558 -3.930 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -1.688 -4.714 -1.716 1.00 0.00 C ATOM 1019 CE1 PHE A 67 -0.890 -5.356 -4.326 1.00 0.00 C ATOM 1020 CE2 PHE A 67 -0.354 -4.511 -2.113 1.00 0.00 C ATOM 1021 CZ PHE A 67 0.047 -4.834 -3.419 1.00 0.00 C ATOM 0 H PHE A 67 -5.856 -3.381 -2.655 1.00 0.00 H new ATOM 0 HA PHE A 67 -5.008 -5.840 -4.039 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -4.229 -4.912 -1.248 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.073 -6.568 -1.800 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -2.937 -5.965 -4.632 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.989 -4.470 -0.708 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.584 -5.603 -5.332 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.362 -4.107 -1.413 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.071 -4.682 -3.725 1.00 0.00 H new ATOM 1031 N ASP A 68 -6.544 -7.186 -2.182 1.00 0.00 N ATOM 1032 CA ASP A 68 -7.688 -7.888 -1.587 1.00 0.00 C ATOM 1033 C ASP A 68 -7.181 -8.935 -0.580 1.00 0.00 C ATOM 1034 O ASP A 68 -6.038 -9.389 -0.680 1.00 0.00 O ATOM 1035 CB ASP A 68 -8.538 -8.540 -2.696 1.00 0.00 C ATOM 1036 CG ASP A 68 -9.976 -8.864 -2.266 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -10.696 -7.949 -1.789 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -10.387 -10.038 -2.415 1.00 0.00 O ATOM 0 H ASP A 68 -5.725 -7.785 -2.287 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.321 -7.178 -1.054 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.568 -7.873 -3.557 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.050 -9.459 -3.022 1.00 0.00 H new ATOM 1043 N ALA A 69 -8.010 -9.304 0.400 1.00 0.00 N ATOM 1044 CA ALA A 69 -7.609 -10.161 1.515 1.00 0.00 C ATOM 1045 C ALA A 69 -8.746 -11.052 2.045 1.00 0.00 C ATOM 1046 O ALA A 69 -9.914 -10.857 1.694 1.00 0.00 O ATOM 1047 CB ALA A 69 -7.040 -9.247 2.608 1.00 0.00 C ATOM 0 H ALA A 69 -8.987 -9.013 0.441 1.00 0.00 H new ATOM 0 HA ALA A 69 -6.855 -10.868 1.169 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -6.728 -9.850 3.461 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.182 -8.702 2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.806 -8.539 2.925 1.00 0.00 H new ATOM 1053 N VAL A 70 -8.411 -12.024 2.901 1.00 0.00 N ATOM 1054 CA VAL A 70 -9.341 -13.026 3.455 1.00 0.00 C ATOM 1055 C VAL A 70 -8.938 -13.382 4.887 1.00 0.00 C ATOM 1056 O VAL A 70 -7.775 -13.679 5.137 1.00 0.00 O ATOM 1057 CB VAL A 70 -9.332 -14.339 2.618 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -10.342 -15.377 3.135 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -9.624 -14.126 1.126 1.00 0.00 C ATOM 0 H VAL A 70 -7.456 -12.142 3.241 1.00 0.00 H new ATOM 0 HA VAL A 70 -10.338 -12.586 3.429 1.00 0.00 H new ATOM 0 HB VAL A 70 -8.312 -14.706 2.735 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -10.293 -16.272 2.515 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -10.102 -15.636 4.166 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -11.348 -14.959 3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -9.600 -15.086 0.610 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.610 -13.675 1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -8.870 -13.465 0.698 1.00 0.00 H new ATOM 1069 N ILE A 71 -9.881 -13.385 5.832 1.00 0.00 N ATOM 1070 CA ILE A 71 -9.616 -13.794 7.224 1.00 0.00 C ATOM 1071 C ILE A 71 -9.461 -15.322 7.341 1.00 0.00 C ATOM 1072 O ILE A 71 -10.302 -16.080 6.854 1.00 0.00 O ATOM 1073 CB ILE A 71 -10.697 -13.219 8.175 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -10.488 -11.691 8.308 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -10.648 -13.908 9.556 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -11.615 -10.935 9.018 1.00 0.00 C ATOM 0 H ILE A 71 -10.847 -13.106 5.661 1.00 0.00 H new ATOM 0 HA ILE A 71 -8.661 -13.371 7.537 1.00 0.00 H new ATOM 0 HB ILE A 71 -11.684 -13.413 7.756 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -9.558 -11.514 8.848 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -10.363 -11.270 7.310 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -11.417 -13.484 10.202 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -10.824 -14.977 9.436 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -9.668 -13.750 10.007 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.371 -9.873 9.059 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -12.547 -11.073 8.470 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -11.730 -11.320 10.031 1.00 0.00 H new ATOM 1088 N HIS A 72 -8.414 -15.777 8.032 1.00 0.00 N ATOM 1089 CA HIS A 72 -7.921 -17.161 8.025 1.00 0.00 C ATOM 1090 C HIS A 72 -7.293 -17.597 9.380 1.00 0.00 C ATOM 1091 O HIS A 72 -6.313 -18.350 9.421 1.00 0.00 O ATOM 1092 CB HIS A 72 -6.949 -17.302 6.833 1.00 0.00 C ATOM 1093 CG HIS A 72 -6.833 -18.716 6.326 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -5.733 -19.539 6.405 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -7.822 -19.420 5.696 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -6.056 -20.716 5.847 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -7.320 -20.693 5.384 1.00 0.00 N ATOM 0 H HIS A 72 -7.862 -15.169 8.637 1.00 0.00 H new ATOM 0 HA HIS A 72 -8.759 -17.847 7.900 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.285 -16.658 6.020 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.963 -16.948 7.133 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -8.816 -19.059 5.477 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.393 -21.566 5.779 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -7.812 -21.447 4.904 1.00 0.00 H new ATOM 1105 N ASN A 73 -7.823 -17.096 10.508 1.00 0.00 N ATOM 1106 CA ASN A 73 -7.463 -17.535 11.872 1.00 0.00 C ATOM 1107 C ASN A 73 -8.199 -18.829 12.240 1.00 0.00 C ATOM 1108 O ASN A 73 -9.438 -18.863 12.083 1.00 0.00 O ATOM 1109 CB ASN A 73 -7.758 -16.391 12.873 1.00 0.00 C ATOM 1110 CG ASN A 73 -7.142 -16.591 14.255 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -7.820 -16.893 15.233 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -5.851 -16.383 14.385 1.00 0.00 N ATOM 1113 OXT ASN A 73 -7.540 -19.811 12.643 1.00 0.00 O ATOM 0 H ASN A 73 -8.528 -16.359 10.500 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.397 -17.759 11.915 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -7.388 -15.454 12.455 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -8.838 -16.288 12.981 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -5.410 -16.472 15.300 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.290 -16.132 13.571 1.00 0.00 H new ATOM 1121 N MET B 74 -3.130 18.466 -18.841 1.00 0.00 N ATOM 1122 CA MET B 74 -2.446 17.442 -18.018 1.00 0.00 C ATOM 1123 C MET B 74 -0.933 17.512 -18.240 1.00 0.00 C ATOM 1124 O MET B 74 -0.477 17.058 -19.294 1.00 0.00 O ATOM 1125 CB MET B 74 -2.932 16.014 -18.331 1.00 0.00 C ATOM 1126 CG MET B 74 -4.418 15.790 -18.047 1.00 0.00 C ATOM 1127 SD MET B 74 -5.097 14.216 -18.642 1.00 0.00 S ATOM 1128 CE MET B 74 -4.223 13.011 -17.613 1.00 0.00 C ATOM 0 HA MET B 74 -2.689 17.660 -16.978 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.736 15.796 -19.381 1.00 0.00 H new ATOM 0 HB3 MET B 74 -2.349 15.305 -17.743 1.00 0.00 H new ATOM 0 HG2 MET B 74 -4.578 15.851 -16.971 1.00 0.00 H new ATOM 0 HG3 MET B 74 -4.984 16.604 -18.500 1.00 0.00 H new ATOM 0 HE1 MET B 74 -4.647 12.020 -17.774 1.00 0.00 H new ATOM 0 HE2 MET B 74 -3.166 13.002 -17.881 1.00 0.00 H new ATOM 0 HE3 MET B 74 -4.329 13.284 -16.563 1.00 0.00 H new ATOM 1140 N PRO B 75 -0.139 18.046 -17.292 1.00 0.00 N ATOM 1141 CA PRO B 75 1.320 17.982 -17.338 1.00 0.00 C ATOM 1142 C PRO B 75 1.825 16.567 -17.020 1.00 0.00 C ATOM 1143 O PRO B 75 1.073 15.715 -16.541 1.00 0.00 O ATOM 1144 CB PRO B 75 1.799 18.997 -16.294 1.00 0.00 C ATOM 1145 CG PRO B 75 0.693 18.938 -15.242 1.00 0.00 C ATOM 1146 CD PRO B 75 -0.563 18.754 -16.093 1.00 0.00 C ATOM 0 HA PRO B 75 1.706 18.215 -18.331 1.00 0.00 H new ATOM 0 HB2 PRO B 75 2.769 18.724 -15.878 1.00 0.00 H new ATOM 0 HB3 PRO B 75 1.903 19.996 -16.717 1.00 0.00 H new ATOM 0 HG2 PRO B 75 0.837 18.111 -14.547 1.00 0.00 H new ATOM 0 HG3 PRO B 75 0.650 19.850 -14.647 1.00 0.00 H new ATOM 0 HD2 PRO B 75 -1.320 18.186 -15.552 1.00 0.00 H new ATOM 0 HD3 PRO B 75 -1.007 19.717 -16.346 1.00 0.00 H new ATOM 1154 N LYS B 76 3.121 16.337 -17.263 1.00 0.00 N ATOM 1155 CA LYS B 76 3.816 15.089 -16.919 1.00 0.00 C ATOM 1156 C LYS B 76 4.851 15.257 -15.802 1.00 0.00 C ATOM 1157 O LYS B 76 5.470 16.314 -15.653 1.00 0.00 O ATOM 1158 CB LYS B 76 4.496 14.496 -18.163 1.00 0.00 C ATOM 1159 CG LYS B 76 3.461 14.003 -19.177 1.00 0.00 C ATOM 1160 CD LYS B 76 4.062 13.044 -20.208 1.00 0.00 C ATOM 1161 CE LYS B 76 4.371 11.659 -19.622 1.00 0.00 C ATOM 1162 NZ LYS B 76 5.060 10.819 -20.625 1.00 0.00 N ATOM 0 H LYS B 76 3.727 17.024 -17.712 1.00 0.00 H new ATOM 0 HA LYS B 76 3.050 14.409 -16.546 1.00 0.00 H new ATOM 0 HB2 LYS B 76 5.133 15.249 -18.626 1.00 0.00 H new ATOM 0 HB3 LYS B 76 5.143 13.670 -17.868 1.00 0.00 H new ATOM 0 HG2 LYS B 76 2.650 13.502 -18.649 1.00 0.00 H new ATOM 0 HG3 LYS B 76 3.025 14.859 -19.692 1.00 0.00 H new ATOM 0 HD2 LYS B 76 3.369 12.934 -21.043 1.00 0.00 H new ATOM 0 HD3 LYS B 76 4.979 13.477 -20.609 1.00 0.00 H new ATOM 0 HE2 LYS B 76 4.995 11.763 -18.735 1.00 0.00 H new ATOM 0 HE3 LYS B 76 3.446 11.176 -19.306 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 4.921 9.815 -20.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 4.668 11.013 -21.568 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 6.077 11.038 -20.621 1.00 0.00 H new ATOM 1176 N HIS B 77 5.074 14.186 -15.049 1.00 0.00 N ATOM 1177 CA HIS B 77 6.063 14.090 -13.972 1.00 0.00 C ATOM 1178 C HIS B 77 6.447 12.616 -13.708 1.00 0.00 C ATOM 1179 O HIS B 77 5.830 11.694 -14.257 1.00 0.00 O ATOM 1180 CB HIS B 77 5.575 14.861 -12.721 1.00 0.00 C ATOM 1181 CG HIS B 77 4.081 14.856 -12.460 1.00 0.00 C ATOM 1182 ND1 HIS B 77 3.309 15.940 -12.097 1.00 0.00 N ATOM 1183 CD2 HIS B 77 3.231 13.791 -12.588 1.00 0.00 C ATOM 1184 CE1 HIS B 77 2.033 15.527 -11.997 1.00 0.00 C ATOM 1185 NE2 HIS B 77 1.934 14.221 -12.289 1.00 0.00 N ATOM 0 H HIS B 77 4.549 13.320 -15.175 1.00 0.00 H new ATOM 0 HA HIS B 77 6.989 14.577 -14.276 1.00 0.00 H new ATOM 0 HB2 HIS B 77 6.075 14.443 -11.847 1.00 0.00 H new ATOM 0 HB3 HIS B 77 5.902 15.897 -12.810 1.00 0.00 H new ATOM 0 HD1 HIS B 77 3.647 16.888 -11.933 1.00 0.00 H new ATOM 0 HD2 HIS B 77 3.514 12.788 -12.872 1.00 0.00 H new ATOM 0 HE1 HIS B 77 1.202 16.159 -11.720 1.00 0.00 H new ATOM 1193 N GLU B 78 7.489 12.382 -12.910 1.00 0.00 N ATOM 1194 CA GLU B 78 8.034 11.056 -12.613 1.00 0.00 C ATOM 1195 C GLU B 78 8.092 10.818 -11.103 1.00 0.00 C ATOM 1196 O GLU B 78 8.160 11.753 -10.307 1.00 0.00 O ATOM 1197 CB GLU B 78 9.442 10.927 -13.226 1.00 0.00 C ATOM 1198 CG GLU B 78 9.419 10.341 -14.639 1.00 0.00 C ATOM 1199 CD GLU B 78 10.744 10.597 -15.351 1.00 0.00 C ATOM 1200 OE1 GLU B 78 11.773 10.004 -14.956 1.00 0.00 O ATOM 1201 OE2 GLU B 78 10.791 11.411 -16.302 1.00 0.00 O ATOM 0 H GLU B 78 7.993 13.133 -12.438 1.00 0.00 H new ATOM 0 HA GLU B 78 7.379 10.302 -13.050 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.914 11.909 -13.252 1.00 0.00 H new ATOM 0 HB3 GLU B 78 10.057 10.295 -12.585 1.00 0.00 H new ATOM 0 HG2 GLU B 78 9.228 9.269 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU B 78 8.603 10.785 -15.209 1.00 0.00 H new ATOM 1208 N PHE B 79 8.095 9.546 -10.702 1.00 0.00 N ATOM 1209 CA PHE B 79 8.293 9.143 -9.313 1.00 0.00 C ATOM 1210 C PHE B 79 9.089 7.835 -9.256 1.00 0.00 C ATOM 1211 O PHE B 79 8.847 6.912 -10.042 1.00 0.00 O ATOM 1212 CB PHE B 79 6.949 9.003 -8.565 1.00 0.00 C ATOM 1213 CG PHE B 79 6.001 10.189 -8.659 1.00 0.00 C ATOM 1214 CD1 PHE B 79 5.203 10.362 -9.808 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.916 11.128 -7.611 1.00 0.00 C ATOM 1216 CE1 PHE B 79 4.369 11.485 -9.931 1.00 0.00 C ATOM 1217 CE2 PHE B 79 5.063 12.242 -7.727 1.00 0.00 C ATOM 1218 CZ PHE B 79 4.299 12.427 -8.892 1.00 0.00 C ATOM 0 H PHE B 79 7.959 8.761 -11.339 1.00 0.00 H new ATOM 0 HA PHE B 79 8.862 9.925 -8.810 1.00 0.00 H new ATOM 0 HB2 PHE B 79 6.434 8.122 -8.948 1.00 0.00 H new ATOM 0 HB3 PHE B 79 7.161 8.816 -7.512 1.00 0.00 H new ATOM 0 HD1 PHE B 79 5.233 9.627 -10.598 1.00 0.00 H new ATOM 0 HD2 PHE B 79 6.507 10.992 -6.717 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.781 11.624 -10.826 1.00 0.00 H new ATOM 0 HE2 PHE B 79 4.996 12.956 -6.919 1.00 0.00 H new ATOM 0 HZ PHE B 79 3.659 13.292 -8.988 1.00 0.00 H new ATOM 1228 N SER B 80 10.004 7.731 -8.295 1.00 0.00 N ATOM 1229 CA SER B 80 10.529 6.443 -7.836 1.00 0.00 C ATOM 1230 C SER B 80 9.624 5.913 -6.719 1.00 0.00 C ATOM 1231 O SER B 80 9.306 6.658 -5.790 1.00 0.00 O ATOM 1232 CB SER B 80 11.964 6.571 -7.312 1.00 0.00 C ATOM 1233 OG SER B 80 12.559 5.285 -7.214 1.00 0.00 O ATOM 0 H SER B 80 10.403 8.535 -7.812 1.00 0.00 H new ATOM 0 HA SER B 80 10.544 5.755 -8.681 1.00 0.00 H new ATOM 0 HB2 SER B 80 12.550 7.202 -7.980 1.00 0.00 H new ATOM 0 HB3 SER B 80 11.962 7.056 -6.336 1.00 0.00 H new ATOM 0 HG SER B 80 13.476 5.373 -6.880 1.00 0.00 H new ATOM 1239 N VAL B 81 9.230 4.642 -6.779 1.00 0.00 N ATOM 1240 CA VAL B 81 8.383 3.985 -5.766 1.00 0.00 C ATOM 1241 C VAL B 81 9.020 2.654 -5.391 1.00 0.00 C ATOM 1242 O VAL B 81 9.581 1.987 -6.252 1.00 0.00 O ATOM 1243 CB VAL B 81 6.926 3.763 -6.244 1.00 0.00 C ATOM 1244 CG1 VAL B 81 6.110 5.057 -6.103 1.00 0.00 C ATOM 1245 CG2 VAL B 81 6.827 3.269 -7.700 1.00 0.00 C ATOM 0 H VAL B 81 9.492 4.022 -7.545 1.00 0.00 H new ATOM 0 HA VAL B 81 8.323 4.646 -4.901 1.00 0.00 H new ATOM 0 HB VAL B 81 6.520 2.980 -5.603 1.00 0.00 H new ATOM 0 HG11 VAL B 81 5.089 4.882 -6.443 1.00 0.00 H new ATOM 0 HG12 VAL B 81 6.096 5.366 -5.058 1.00 0.00 H new ATOM 0 HG13 VAL B 81 6.565 5.842 -6.708 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.779 3.135 -7.968 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.281 4.004 -8.365 1.00 0.00 H new ATOM 0 HG23 VAL B 81 7.351 2.318 -7.798 1.00 0.00 H new ATOM 1255 N ASP B 82 8.976 2.273 -4.114 1.00 0.00 N ATOM 1256 CA ASP B 82 9.783 1.158 -3.584 1.00 0.00 C ATOM 1257 C ASP B 82 9.358 -0.252 -4.061 1.00 0.00 C ATOM 1258 O ASP B 82 9.963 -1.247 -3.661 1.00 0.00 O ATOM 1259 CB ASP B 82 9.820 1.274 -2.050 1.00 0.00 C ATOM 1260 CG ASP B 82 10.985 0.516 -1.405 1.00 0.00 C ATOM 1261 OD1 ASP B 82 12.129 0.586 -1.912 1.00 0.00 O ATOM 1262 OD2 ASP B 82 10.796 -0.083 -0.326 1.00 0.00 O ATOM 0 H ASP B 82 8.384 2.722 -3.415 1.00 0.00 H new ATOM 0 HA ASP B 82 10.786 1.258 -3.998 1.00 0.00 H new ATOM 0 HB2 ASP B 82 9.886 2.327 -1.775 1.00 0.00 H new ATOM 0 HB3 ASP B 82 8.882 0.896 -1.643 1.00 0.00 H new ATOM 1267 N MET B 83 8.340 -0.353 -4.925 1.00 0.00 N ATOM 1268 CA MET B 83 7.844 -1.620 -5.476 1.00 0.00 C ATOM 1269 C MET B 83 8.860 -2.304 -6.408 1.00 0.00 C ATOM 1270 O MET B 83 9.265 -1.751 -7.432 1.00 0.00 O ATOM 1271 CB MET B 83 6.466 -1.434 -6.142 1.00 0.00 C ATOM 1272 CG MET B 83 6.468 -0.655 -7.466 1.00 0.00 C ATOM 1273 SD MET B 83 4.821 -0.238 -8.083 1.00 0.00 S ATOM 1274 CE MET B 83 5.299 0.399 -9.710 1.00 0.00 C ATOM 0 H MET B 83 7.828 0.460 -5.267 1.00 0.00 H new ATOM 0 HA MET B 83 7.712 -2.303 -4.637 1.00 0.00 H new ATOM 0 HB2 MET B 83 6.033 -2.418 -6.321 1.00 0.00 H new ATOM 0 HB3 MET B 83 5.810 -0.920 -5.440 1.00 0.00 H new ATOM 0 HG2 MET B 83 7.037 0.265 -7.332 1.00 0.00 H new ATOM 0 HG3 MET B 83 6.988 -1.245 -8.221 1.00 0.00 H new ATOM 0 HE1 MET B 83 4.408 0.713 -10.254 1.00 0.00 H new ATOM 0 HE2 MET B 83 5.967 1.251 -9.585 1.00 0.00 H new ATOM 0 HE3 MET B 83 5.810 -0.383 -10.271 1.00 0.00 H new ATOM 1284 N THR B 84 9.236 -3.541 -6.070 1.00 0.00 N ATOM 1285 CA THR B 84 9.924 -4.506 -6.952 1.00 0.00 C ATOM 1286 C THR B 84 8.943 -5.542 -7.526 1.00 0.00 C ATOM 1287 O THR B 84 9.275 -6.299 -8.440 1.00 0.00 O ATOM 1288 CB THR B 84 11.065 -5.153 -6.152 1.00 0.00 C ATOM 1289 OG1 THR B 84 12.073 -5.537 -7.046 1.00 0.00 O ATOM 1290 CG2 THR B 84 10.681 -6.372 -5.311 1.00 0.00 C ATOM 0 H THR B 84 9.065 -3.919 -5.138 1.00 0.00 H new ATOM 0 HA THR B 84 10.344 -3.993 -7.817 1.00 0.00 H new ATOM 0 HB THR B 84 11.386 -4.393 -5.439 1.00 0.00 H new ATOM 0 HG1 THR B 84 12.810 -5.951 -6.550 1.00 0.00 H new ATOM 0 HG21 THR B 84 11.562 -6.747 -4.790 1.00 0.00 H new ATOM 0 HG22 THR B 84 9.922 -6.087 -4.582 1.00 0.00 H new ATOM 0 HG23 THR B 84 10.285 -7.152 -5.961 1.00 0.00 H new ATOM 1298 N CYS B 85 7.725 -5.542 -6.988 1.00 0.00 N ATOM 1299 CA CYS B 85 6.815 -6.664 -6.840 1.00 0.00 C ATOM 1300 C CYS B 85 6.370 -7.366 -8.144 1.00 0.00 C ATOM 1301 O CYS B 85 6.004 -8.545 -8.128 1.00 0.00 O ATOM 1302 CB CYS B 85 5.593 -6.049 -6.129 1.00 0.00 C ATOM 1303 SG CYS B 85 6.008 -4.965 -4.727 1.00 0.00 S ATOM 0 H CYS B 85 7.321 -4.683 -6.615 1.00 0.00 H new ATOM 0 HA CYS B 85 7.321 -7.464 -6.300 1.00 0.00 H new ATOM 0 HB2 CYS B 85 5.014 -5.478 -6.855 1.00 0.00 H new ATOM 0 HB3 CYS B 85 4.951 -6.855 -5.772 1.00 0.00 H new ATOM 0 HG CYS B 85 5.746 -5.579 -3.611 1.00 0.00 H new ATOM 1308 N GLY B 86 6.279 -6.601 -9.235 1.00 0.00 N ATOM 1309 CA GLY B 86 5.461 -6.935 -10.403 1.00 0.00 C ATOM 1310 C GLY B 86 4.034 -6.444 -10.195 1.00 0.00 C ATOM 1311 O GLY B 86 3.716 -5.333 -10.612 1.00 0.00 O ATOM 0 H GLY B 86 6.780 -5.718 -9.333 1.00 0.00 H new ATOM 0 HA2 GLY B 86 5.885 -6.478 -11.297 1.00 0.00 H new ATOM 0 HA3 GLY B 86 5.464 -8.013 -10.564 1.00 0.00 H new ATOM 1315 N GLY B 87 3.180 -7.239 -9.539 1.00 0.00 N ATOM 1316 CA GLY B 87 1.734 -6.979 -9.416 1.00 0.00 C ATOM 1317 C GLY B 87 1.358 -5.667 -8.714 1.00 0.00 C ATOM 1318 O GLY B 87 0.339 -5.066 -9.048 1.00 0.00 O ATOM 0 H GLY B 87 3.475 -8.095 -9.070 1.00 0.00 H new ATOM 0 HA2 GLY B 87 1.297 -6.975 -10.414 1.00 0.00 H new ATOM 0 HA3 GLY B 87 1.278 -7.806 -8.871 1.00 0.00 H new ATOM 1322 N CYS B 88 2.202 -5.156 -7.809 1.00 0.00 N ATOM 1323 CA CYS B 88 2.007 -3.851 -7.155 1.00 0.00 C ATOM 1324 C CYS B 88 1.952 -2.656 -8.143 1.00 0.00 C ATOM 1325 O CYS B 88 1.321 -1.639 -7.845 1.00 0.00 O ATOM 1326 CB CYS B 88 3.081 -3.703 -6.069 1.00 0.00 C ATOM 1327 SG CYS B 88 2.634 -2.401 -4.890 1.00 0.00 S ATOM 0 H CYS B 88 3.048 -5.639 -7.506 1.00 0.00 H new ATOM 0 HA CYS B 88 1.020 -3.827 -6.693 1.00 0.00 H new ATOM 0 HB2 CYS B 88 3.204 -4.649 -5.542 1.00 0.00 H new ATOM 0 HB3 CYS B 88 4.040 -3.468 -6.530 1.00 0.00 H new ATOM 0 HG CYS B 88 2.944 -2.781 -3.686 1.00 0.00 H new ATOM 1333 N ALA B 89 2.484 -2.809 -9.363 1.00 0.00 N ATOM 1334 CA ALA B 89 2.292 -1.868 -10.475 1.00 0.00 C ATOM 1335 C ALA B 89 0.802 -1.634 -10.800 1.00 0.00 C ATOM 1336 O ALA B 89 0.364 -0.493 -10.981 1.00 0.00 O ATOM 1337 CB ALA B 89 3.047 -2.427 -11.686 1.00 0.00 C ATOM 0 H ALA B 89 3.071 -3.606 -9.610 1.00 0.00 H new ATOM 0 HA ALA B 89 2.684 -0.890 -10.196 1.00 0.00 H new ATOM 0 HB1 ALA B 89 2.926 -1.752 -12.533 1.00 0.00 H new ATOM 0 HB2 ALA B 89 4.106 -2.520 -11.444 1.00 0.00 H new ATOM 0 HB3 ALA B 89 2.647 -3.408 -11.943 1.00 0.00 H new ATOM 1343 N GLU B 90 0.003 -2.702 -10.792 1.00 0.00 N ATOM 1344 CA GLU B 90 -1.451 -2.618 -10.909 1.00 0.00 C ATOM 1345 C GLU B 90 -2.080 -2.018 -9.637 1.00 0.00 C ATOM 1346 O GLU B 90 -3.031 -1.250 -9.732 1.00 0.00 O ATOM 1347 CB GLU B 90 -2.015 -4.013 -11.219 1.00 0.00 C ATOM 1348 CG GLU B 90 -3.478 -3.982 -11.674 1.00 0.00 C ATOM 1349 CD GLU B 90 -3.710 -3.259 -12.998 1.00 0.00 C ATOM 1350 OE1 GLU B 90 -2.897 -3.415 -13.940 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -4.782 -2.623 -13.143 1.00 0.00 O ATOM 0 H GLU B 90 0.351 -3.657 -10.703 1.00 0.00 H new ATOM 0 HA GLU B 90 -1.707 -1.947 -11.729 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -1.409 -4.479 -11.996 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -1.930 -4.638 -10.330 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -3.840 -5.006 -11.765 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -4.076 -3.500 -10.901 1.00 0.00 H new ATOM 1358 N ALA B 91 -1.532 -2.287 -8.446 1.00 0.00 N ATOM 1359 CA ALA B 91 -2.015 -1.692 -7.195 1.00 0.00 C ATOM 1360 C ALA B 91 -1.839 -0.165 -7.161 1.00 0.00 C ATOM 1361 O ALA B 91 -2.817 0.547 -6.917 1.00 0.00 O ATOM 1362 CB ALA B 91 -1.360 -2.391 -6.002 1.00 0.00 C ATOM 0 H ALA B 91 -0.743 -2.922 -8.323 1.00 0.00 H new ATOM 0 HA ALA B 91 -3.091 -1.853 -7.132 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -1.722 -1.945 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -1.613 -3.451 -6.018 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -0.278 -2.275 -6.062 1.00 0.00 H new ATOM 1368 N VAL B 92 -0.647 0.361 -7.472 1.00 0.00 N ATOM 1369 CA VAL B 92 -0.468 1.820 -7.630 1.00 0.00 C ATOM 1370 C VAL B 92 -1.348 2.374 -8.763 1.00 0.00 C ATOM 1371 O VAL B 92 -1.948 3.432 -8.597 1.00 0.00 O ATOM 1372 CB VAL B 92 1.001 2.287 -7.775 1.00 0.00 C ATOM 1373 CG1 VAL B 92 1.820 1.892 -6.535 1.00 0.00 C ATOM 1374 CG2 VAL B 92 1.706 1.789 -9.044 1.00 0.00 C ATOM 0 H VAL B 92 0.200 -0.188 -7.619 1.00 0.00 H new ATOM 0 HA VAL B 92 -0.802 2.245 -6.684 1.00 0.00 H new ATOM 0 HB VAL B 92 0.948 3.372 -7.865 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.849 2.229 -6.656 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.388 2.358 -5.650 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.804 0.808 -6.419 1.00 0.00 H new ATOM 0 HG21 VAL B 92 2.729 2.164 -9.063 1.00 0.00 H new ATOM 0 HG22 VAL B 92 1.719 0.699 -9.049 1.00 0.00 H new ATOM 0 HG23 VAL B 92 1.171 2.150 -9.923 1.00 0.00 H new ATOM 1384 N SER B 93 -1.536 1.628 -9.860 1.00 0.00 N ATOM 1385 CA SER B 93 -2.461 2.014 -10.942 1.00 0.00 C ATOM 1386 C SER B 93 -3.932 2.099 -10.484 1.00 0.00 C ATOM 1387 O SER B 93 -4.670 2.953 -10.976 1.00 0.00 O ATOM 1388 CB SER B 93 -2.339 1.048 -12.133 1.00 0.00 C ATOM 1389 OG SER B 93 -1.049 1.075 -12.720 1.00 0.00 O ATOM 0 H SER B 93 -1.055 0.744 -10.025 1.00 0.00 H new ATOM 0 HA SER B 93 -2.164 3.017 -11.250 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.563 0.035 -11.800 1.00 0.00 H new ATOM 0 HB3 SER B 93 -3.083 1.308 -12.886 1.00 0.00 H new ATOM 0 HG SER B 93 -0.406 0.648 -12.116 1.00 0.00 H new ATOM 1395 N ARG B 94 -4.365 1.262 -9.529 1.00 0.00 N ATOM 1396 CA ARG B 94 -5.664 1.366 -8.839 1.00 0.00 C ATOM 1397 C ARG B 94 -5.704 2.547 -7.857 1.00 0.00 C ATOM 1398 O ARG B 94 -6.695 3.279 -7.818 1.00 0.00 O ATOM 1399 CB ARG B 94 -5.978 0.056 -8.087 1.00 0.00 C ATOM 1400 CG ARG B 94 -6.240 -1.147 -9.006 1.00 0.00 C ATOM 1401 CD ARG B 94 -6.006 -2.466 -8.255 1.00 0.00 C ATOM 1402 NE ARG B 94 -6.172 -3.624 -9.145 1.00 0.00 N ATOM 1403 CZ ARG B 94 -5.621 -4.825 -9.013 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -4.864 -5.152 -7.984 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -5.812 -5.722 -9.953 1.00 0.00 N ATOM 0 H ARG B 94 -3.807 0.472 -9.205 1.00 0.00 H new ATOM 0 HA ARG B 94 -6.420 1.541 -9.604 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -5.144 -0.180 -7.426 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -6.851 0.213 -7.454 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -7.264 -1.111 -9.377 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -5.584 -1.096 -9.875 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -5.002 -2.472 -7.830 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -6.705 -2.542 -7.422 1.00 0.00 H new ATOM 0 HE ARG B 94 -6.778 -3.490 -9.954 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -4.681 -4.470 -7.248 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -4.461 -6.087 -7.924 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -6.377 -5.492 -10.770 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -5.395 -6.649 -9.866 1.00 0.00 H new ATOM 1419 N VAL B 95 -4.645 2.736 -7.064 1.00 0.00 N ATOM 1420 CA VAL B 95 -4.568 3.757 -5.995 1.00 0.00 C ATOM 1421 C VAL B 95 -4.556 5.191 -6.548 1.00 0.00 C ATOM 1422 O VAL B 95 -5.239 6.053 -6.003 1.00 0.00 O ATOM 1423 CB VAL B 95 -3.350 3.494 -5.074 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -2.960 4.680 -4.178 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -3.632 2.279 -4.171 1.00 0.00 C ATOM 0 H VAL B 95 -3.796 2.176 -7.143 1.00 0.00 H new ATOM 0 HA VAL B 95 -5.476 3.667 -5.398 1.00 0.00 H new ATOM 0 HB VAL B 95 -2.512 3.315 -5.748 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -2.099 4.407 -3.568 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -2.707 5.538 -4.800 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -3.798 4.937 -3.529 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -2.773 2.098 -3.525 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -4.511 2.478 -3.558 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -3.812 1.400 -4.790 1.00 0.00 H new ATOM 1435 N LEU B 96 -3.840 5.472 -7.644 1.00 0.00 N ATOM 1436 CA LEU B 96 -3.905 6.789 -8.297 1.00 0.00 C ATOM 1437 C LEU B 96 -5.240 7.014 -9.016 1.00 0.00 C ATOM 1438 O LEU B 96 -5.740 8.136 -9.034 1.00 0.00 O ATOM 1439 CB LEU B 96 -2.707 6.971 -9.244 1.00 0.00 C ATOM 1440 CG LEU B 96 -1.444 7.581 -8.599 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -1.659 9.046 -8.205 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -0.939 6.800 -7.380 1.00 0.00 C ATOM 0 H LEU B 96 -3.211 4.809 -8.097 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.847 7.552 -7.521 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -2.447 6.000 -9.665 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -3.014 7.607 -10.074 1.00 0.00 H new ATOM 0 HG LEU B 96 -0.678 7.518 -9.372 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -0.748 9.439 -7.755 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -1.906 9.629 -9.092 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -2.477 9.114 -7.487 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.050 7.286 -6.979 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -1.716 6.777 -6.616 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -0.692 5.781 -7.678 1.00 0.00 H new ATOM 1454 N ASN B 97 -5.880 5.961 -9.533 1.00 0.00 N ATOM 1455 CA ASN B 97 -7.208 6.073 -10.143 1.00 0.00 C ATOM 1456 C ASN B 97 -8.329 6.426 -9.129 1.00 0.00 C ATOM 1457 O ASN B 97 -9.437 6.771 -9.542 1.00 0.00 O ATOM 1458 CB ASN B 97 -7.490 4.803 -10.959 1.00 0.00 C ATOM 1459 CG ASN B 97 -8.654 4.990 -11.924 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -8.672 5.921 -12.724 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -9.640 4.115 -11.878 1.00 0.00 N ATOM 0 H ASN B 97 -5.497 5.016 -9.541 1.00 0.00 H new ATOM 0 HA ASN B 97 -7.208 6.926 -10.822 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -6.596 4.526 -11.518 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -7.710 3.978 -10.281 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -10.433 4.206 -12.513 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -9.610 3.347 -11.207 1.00 0.00 H new ATOM 1468 N LYS B 98 -8.032 6.456 -7.815 1.00 0.00 N ATOM 1469 CA LYS B 98 -8.906 7.061 -6.794 1.00 0.00 C ATOM 1470 C LYS B 98 -9.069 8.582 -7.014 1.00 0.00 C ATOM 1471 O LYS B 98 -10.136 9.130 -6.737 1.00 0.00 O ATOM 1472 CB LYS B 98 -8.342 6.796 -5.377 1.00 0.00 C ATOM 1473 CG LYS B 98 -8.076 5.322 -5.014 1.00 0.00 C ATOM 1474 CD LYS B 98 -9.343 4.499 -4.767 1.00 0.00 C ATOM 1475 CE LYS B 98 -8.990 3.004 -4.818 1.00 0.00 C ATOM 1476 NZ LYS B 98 -10.185 2.144 -4.667 1.00 0.00 N ATOM 0 H LYS B 98 -7.174 6.059 -7.431 1.00 0.00 H new ATOM 0 HA LYS B 98 -9.888 6.597 -6.887 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -7.408 7.348 -5.271 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -9.040 7.207 -4.648 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -7.506 4.858 -5.819 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -7.453 5.286 -4.120 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -9.772 4.751 -3.797 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -10.096 4.733 -5.519 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -8.500 2.780 -5.766 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -8.276 2.773 -4.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -9.901 1.144 -4.707 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -10.639 2.338 -3.752 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -10.856 2.344 -5.436 1.00 0.00 H new ATOM 1490 N LEU B 99 -8.038 9.262 -7.539 1.00 0.00 N ATOM 1491 CA LEU B 99 -8.134 10.638 -8.047 1.00 0.00 C ATOM 1492 C LEU B 99 -8.923 10.662 -9.361 1.00 0.00 C ATOM 1493 O LEU B 99 -9.879 11.428 -9.496 1.00 0.00 O ATOM 1494 CB LEU B 99 -6.721 11.229 -8.246 1.00 0.00 C ATOM 1495 CG LEU B 99 -5.860 11.360 -6.971 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -4.425 11.724 -7.360 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -6.423 12.439 -6.041 1.00 0.00 C ATOM 0 H LEU B 99 -7.102 8.866 -7.623 1.00 0.00 H new ATOM 0 HA LEU B 99 -8.664 11.250 -7.318 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.185 10.605 -8.961 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -6.821 12.216 -8.697 1.00 0.00 H new ATOM 0 HG LEU B 99 -5.874 10.406 -6.445 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -3.817 11.817 -6.460 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.012 10.943 -7.999 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -4.423 12.672 -7.898 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -5.800 12.513 -5.150 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -6.430 13.398 -6.559 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -7.440 12.175 -5.751 1.00 0.00 H new ATOM 1509 N GLY B 100 -8.552 9.795 -10.310 1.00 0.00 N ATOM 1510 CA GLY B 100 -9.189 9.674 -11.629 1.00 0.00 C ATOM 1511 C GLY B 100 -8.689 10.734 -12.613 1.00 0.00 C ATOM 1512 O GLY B 100 -8.351 11.851 -12.222 1.00 0.00 O ATOM 0 H GLY B 100 -7.781 9.141 -10.180 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -8.992 8.682 -12.036 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -10.270 9.765 -11.518 1.00 0.00 H new ATOM 1516 N GLY B 101 -8.634 10.389 -13.902 1.00 0.00 N ATOM 1517 CA GLY B 101 -8.054 11.245 -14.944 1.00 0.00 C ATOM 1518 C GLY B 101 -6.528 11.183 -14.928 1.00 0.00 C ATOM 1519 O GLY B 101 -5.873 12.221 -14.824 1.00 0.00 O ATOM 0 H GLY B 101 -8.993 9.502 -14.256 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -8.422 10.932 -15.921 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -8.380 12.274 -14.795 1.00 0.00 H new ATOM 1523 N VAL B 102 -5.972 9.967 -14.976 1.00 0.00 N ATOM 1524 CA VAL B 102 -4.520 9.716 -14.907 1.00 0.00 C ATOM 1525 C VAL B 102 -4.056 8.667 -15.933 1.00 0.00 C ATOM 1526 O VAL B 102 -4.730 7.664 -16.171 1.00 0.00 O ATOM 1527 CB VAL B 102 -4.062 9.324 -13.477 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -4.264 10.477 -12.478 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -4.759 8.065 -12.924 1.00 0.00 C ATOM 0 H VAL B 102 -6.523 9.113 -15.065 1.00 0.00 H new ATOM 0 HA VAL B 102 -4.041 10.661 -15.164 1.00 0.00 H new ATOM 0 HB VAL B 102 -3.000 9.100 -13.581 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -3.932 10.163 -11.488 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -3.683 11.342 -12.799 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -5.320 10.743 -12.438 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -4.387 7.854 -11.921 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -5.835 8.233 -12.884 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -4.548 7.217 -13.575 1.00 0.00 H new ATOM 1539 N LYS B 103 -2.884 8.906 -16.529 1.00 0.00 N ATOM 1540 CA LYS B 103 -2.163 8.030 -17.468 1.00 0.00 C ATOM 1541 C LYS B 103 -0.772 7.666 -16.916 1.00 0.00 C ATOM 1542 O LYS B 103 -0.104 8.505 -16.311 1.00 0.00 O ATOM 1543 CB LYS B 103 -1.987 8.771 -18.808 1.00 0.00 C ATOM 1544 CG LYS B 103 -3.012 8.401 -19.891 1.00 0.00 C ATOM 1545 CD LYS B 103 -2.891 9.339 -21.105 1.00 0.00 C ATOM 1546 CE LYS B 103 -1.510 9.313 -21.780 1.00 0.00 C ATOM 1547 NZ LYS B 103 -1.334 10.442 -22.724 1.00 0.00 N ATOM 0 H LYS B 103 -2.376 9.774 -16.359 1.00 0.00 H new ATOM 0 HA LYS B 103 -2.739 7.115 -17.606 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -2.046 9.844 -18.624 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -0.987 8.568 -19.190 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -2.857 7.369 -20.207 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -4.020 8.461 -19.479 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -3.648 9.065 -21.840 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -3.109 10.358 -20.787 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -0.732 9.353 -21.017 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -1.385 8.371 -22.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -0.344 10.478 -23.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -1.957 10.308 -23.546 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -1.577 11.334 -22.248 1.00 0.00 H new ATOM 1561 N TYR B 104 -0.296 6.448 -17.181 1.00 0.00 N ATOM 1562 CA TYR B 104 1.022 5.957 -16.742 1.00 0.00 C ATOM 1563 C TYR B 104 1.861 5.335 -17.877 1.00 0.00 C ATOM 1564 O TYR B 104 1.325 4.845 -18.875 1.00 0.00 O ATOM 1565 CB TYR B 104 0.837 4.844 -15.701 1.00 0.00 C ATOM 1566 CG TYR B 104 0.615 5.185 -14.248 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -0.686 5.357 -13.737 1.00 0.00 C ATOM 1568 CD2 TYR B 104 1.713 5.098 -13.371 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -0.889 5.401 -12.343 1.00 0.00 C ATOM 1570 CE2 TYR B 104 1.515 5.134 -11.982 1.00 0.00 C ATOM 1571 CZ TYR B 104 0.211 5.256 -11.467 1.00 0.00 C ATOM 1572 OH TYR B 104 0.025 5.193 -10.126 1.00 0.00 O ATOM 0 H TYR B 104 -0.822 5.758 -17.717 1.00 0.00 H new ATOM 0 HA TYR B 104 1.541 6.832 -16.350 1.00 0.00 H new ATOM 0 HB2 TYR B 104 -0.011 4.240 -16.023 1.00 0.00 H new ATOM 0 HB3 TYR B 104 1.720 4.207 -15.751 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -1.525 5.455 -14.410 1.00 0.00 H new ATOM 0 HD2 TYR B 104 2.712 5.003 -13.769 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -1.883 5.545 -11.945 1.00 0.00 H new ATOM 0 HE2 TYR B 104 2.359 5.068 -11.312 1.00 0.00 H new ATOM 0 HH TYR B 104 -0.768 4.651 -9.931 1.00 0.00 H new ATOM 1582 N ASP B 105 3.165 5.214 -17.629 1.00 0.00 N ATOM 1583 CA ASP B 105 3.987 4.051 -17.988 1.00 0.00 C ATOM 1584 C ASP B 105 4.848 3.643 -16.765 1.00 0.00 C ATOM 1585 O ASP B 105 5.118 4.485 -15.905 1.00 0.00 O ATOM 1586 CB ASP B 105 4.833 4.384 -19.224 1.00 0.00 C ATOM 1587 CG ASP B 105 5.497 3.136 -19.800 1.00 0.00 C ATOM 1588 OD1 ASP B 105 4.766 2.231 -20.269 1.00 0.00 O ATOM 1589 OD2 ASP B 105 6.744 3.056 -19.772 1.00 0.00 O ATOM 0 H ASP B 105 3.699 5.944 -17.158 1.00 0.00 H new ATOM 0 HA ASP B 105 3.361 3.198 -18.249 1.00 0.00 H new ATOM 0 HB2 ASP B 105 4.203 4.846 -19.984 1.00 0.00 H new ATOM 0 HB3 ASP B 105 5.597 5.114 -18.957 1.00 0.00 H new ATOM 1594 N ILE B 106 5.226 2.364 -16.626 1.00 0.00 N ATOM 1595 CA ILE B 106 5.826 1.796 -15.393 1.00 0.00 C ATOM 1596 C ILE B 106 7.064 0.948 -15.733 1.00 0.00 C ATOM 1597 O ILE B 106 7.098 0.292 -16.775 1.00 0.00 O ATOM 1598 CB ILE B 106 4.753 0.973 -14.619 1.00 0.00 C ATOM 1599 CG1 ILE B 106 3.482 1.828 -14.358 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.326 0.382 -13.311 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.385 1.183 -13.501 1.00 0.00 C ATOM 0 H ILE B 106 5.125 1.678 -17.374 1.00 0.00 H new ATOM 0 HA ILE B 106 6.162 2.607 -14.747 1.00 0.00 H new ATOM 0 HB ILE B 106 4.461 0.130 -15.246 1.00 0.00 H new ATOM 0 HG12 ILE B 106 3.789 2.757 -13.877 1.00 0.00 H new ATOM 0 HG13 ILE B 106 3.048 2.097 -15.321 1.00 0.00 H new ATOM 0 HG21 ILE B 106 4.550 -0.186 -12.798 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.162 -0.277 -13.545 1.00 0.00 H new ATOM 0 HG23 ILE B 106 5.670 1.191 -12.667 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.553 1.878 -13.392 1.00 0.00 H new ATOM 0 HD12 ILE B 106 2.035 0.271 -13.984 1.00 0.00 H new ATOM 0 HD13 ILE B 106 2.787 0.941 -12.517 1.00 0.00 H new ATOM 1613 N ASP B 107 8.082 0.940 -14.866 1.00 0.00 N ATOM 1614 CA ASP B 107 9.336 0.186 -15.038 1.00 0.00 C ATOM 1615 C ASP B 107 9.766 -0.452 -13.700 1.00 0.00 C ATOM 1616 O ASP B 107 10.201 0.256 -12.789 1.00 0.00 O ATOM 1617 CB ASP B 107 10.411 1.163 -15.561 1.00 0.00 C ATOM 1618 CG ASP B 107 11.619 0.494 -16.220 1.00 0.00 C ATOM 1619 OD1 ASP B 107 12.317 -0.307 -15.558 1.00 0.00 O ATOM 1620 OD2 ASP B 107 11.904 0.799 -17.406 1.00 0.00 O ATOM 0 H ASP B 107 8.059 1.474 -13.997 1.00 0.00 H new ATOM 0 HA ASP B 107 9.199 -0.625 -15.753 1.00 0.00 H new ATOM 0 HB2 ASP B 107 9.949 1.838 -16.282 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.761 1.775 -14.730 1.00 0.00 H new ATOM 1625 N LEU B 108 9.645 -1.781 -13.555 1.00 0.00 N ATOM 1626 CA LEU B 108 10.031 -2.486 -12.322 1.00 0.00 C ATOM 1627 C LEU B 108 11.559 -2.558 -12.117 1.00 0.00 C ATOM 1628 O LEU B 108 11.978 -2.258 -11.001 1.00 0.00 O ATOM 1629 CB LEU B 108 9.376 -3.888 -12.225 1.00 0.00 C ATOM 1630 CG LEU B 108 7.929 -3.979 -11.693 1.00 0.00 C ATOM 1631 CD1 LEU B 108 7.749 -3.324 -10.315 1.00 0.00 C ATOM 1632 CD2 LEU B 108 6.896 -3.418 -12.675 1.00 0.00 C ATOM 0 H LEU B 108 9.279 -2.394 -14.284 1.00 0.00 H new ATOM 0 HA LEU B 108 9.641 -1.883 -11.502 1.00 0.00 H new ATOM 0 HB2 LEU B 108 9.394 -4.334 -13.219 1.00 0.00 H new ATOM 0 HB3 LEU B 108 10.006 -4.507 -11.586 1.00 0.00 H new ATOM 0 HG LEU B 108 7.747 -5.048 -11.582 1.00 0.00 H new ATOM 0 HD11 LEU B 108 6.711 -3.422 -9.998 1.00 0.00 H new ATOM 0 HD12 LEU B 108 8.398 -3.817 -9.591 1.00 0.00 H new ATOM 0 HD13 LEU B 108 8.011 -2.268 -10.377 1.00 0.00 H new ATOM 0 HD21 LEU B 108 5.898 -3.510 -12.245 1.00 0.00 H new ATOM 0 HD22 LEU B 108 7.112 -2.368 -12.870 1.00 0.00 H new ATOM 0 HD23 LEU B 108 6.941 -3.977 -13.610 1.00 0.00 H new ATOM 1644 N PRO B 109 12.411 -2.910 -13.105 1.00 0.00 N ATOM 1645 CA PRO B 109 13.872 -2.935 -12.937 1.00 0.00 C ATOM 1646 C PRO B 109 14.499 -1.607 -12.483 1.00 0.00 C ATOM 1647 O PRO B 109 15.497 -1.622 -11.762 1.00 0.00 O ATOM 1648 CB PRO B 109 14.433 -3.374 -14.290 1.00 0.00 C ATOM 1649 CG PRO B 109 13.318 -4.264 -14.830 1.00 0.00 C ATOM 1650 CD PRO B 109 12.057 -3.539 -14.369 1.00 0.00 C ATOM 0 HA PRO B 109 14.124 -3.619 -12.126 1.00 0.00 H new ATOM 0 HB2 PRO B 109 14.628 -2.524 -14.944 1.00 0.00 H new ATOM 0 HB3 PRO B 109 15.372 -3.917 -14.184 1.00 0.00 H new ATOM 0 HG2 PRO B 109 13.360 -4.352 -15.916 1.00 0.00 H new ATOM 0 HG3 PRO B 109 13.375 -5.275 -14.426 1.00 0.00 H new ATOM 0 HD2 PRO B 109 11.741 -2.797 -15.102 1.00 0.00 H new ATOM 0 HD3 PRO B 109 11.228 -4.235 -14.242 1.00 0.00 H new ATOM 1658 N ASN B 110 13.914 -0.465 -12.862 1.00 0.00 N ATOM 1659 CA ASN B 110 14.324 0.862 -12.380 1.00 0.00 C ATOM 1660 C ASN B 110 13.457 1.387 -11.210 1.00 0.00 C ATOM 1661 O ASN B 110 13.765 2.435 -10.642 1.00 0.00 O ATOM 1662 CB ASN B 110 14.322 1.838 -13.567 1.00 0.00 C ATOM 1663 CG ASN B 110 15.379 1.473 -14.603 1.00 0.00 C ATOM 1664 OD1 ASN B 110 16.539 1.861 -14.502 1.00 0.00 O ATOM 1665 ND2 ASN B 110 15.034 0.701 -15.613 1.00 0.00 N ATOM 0 H ASN B 110 13.134 -0.434 -13.519 1.00 0.00 H new ATOM 0 HA ASN B 110 15.329 0.776 -11.968 1.00 0.00 H new ATOM 0 HB2 ASN B 110 13.338 1.837 -14.036 1.00 0.00 H new ATOM 0 HB3 ASN B 110 14.502 2.850 -13.205 1.00 0.00 H new ATOM 0 HD21 ASN B 110 15.730 0.428 -16.307 1.00 0.00 H new ATOM 0 HD22 ASN B 110 14.071 0.376 -15.701 1.00 0.00 H new ATOM 1672 N LYS B 111 12.373 0.682 -10.859 1.00 0.00 N ATOM 1673 CA LYS B 111 11.385 1.002 -9.809 1.00 0.00 C ATOM 1674 C LYS B 111 10.738 2.404 -9.956 1.00 0.00 C ATOM 1675 O LYS B 111 10.416 3.080 -8.966 1.00 0.00 O ATOM 1676 CB LYS B 111 11.959 0.701 -8.407 1.00 0.00 C ATOM 1677 CG LYS B 111 12.434 -0.752 -8.247 1.00 0.00 C ATOM 1678 CD LYS B 111 12.674 -1.140 -6.781 1.00 0.00 C ATOM 1679 CE LYS B 111 13.505 -2.429 -6.741 1.00 0.00 C ATOM 1680 NZ LYS B 111 14.009 -2.733 -5.382 1.00 0.00 N ATOM 0 H LYS B 111 12.143 -0.191 -11.333 1.00 0.00 H new ATOM 0 HA LYS B 111 10.537 0.332 -9.948 1.00 0.00 H new ATOM 0 HB2 LYS B 111 12.794 1.373 -8.211 1.00 0.00 H new ATOM 0 HB3 LYS B 111 11.197 0.912 -7.656 1.00 0.00 H new ATOM 0 HG2 LYS B 111 11.691 -1.422 -8.679 1.00 0.00 H new ATOM 0 HG3 LYS B 111 13.356 -0.893 -8.811 1.00 0.00 H new ATOM 0 HD2 LYS B 111 13.196 -0.338 -6.259 1.00 0.00 H new ATOM 0 HD3 LYS B 111 11.723 -1.288 -6.269 1.00 0.00 H new ATOM 0 HE2 LYS B 111 12.897 -3.261 -7.095 1.00 0.00 H new ATOM 0 HE3 LYS B 111 14.348 -2.336 -7.426 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 14.564 -3.612 -5.406 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 14.612 -1.952 -5.052 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 13.206 -2.849 -4.732 1.00 0.00 H new ATOM 1694 N LYS B 112 10.541 2.861 -11.202 1.00 0.00 N ATOM 1695 CA LYS B 112 9.972 4.179 -11.521 1.00 0.00 C ATOM 1696 C LYS B 112 8.573 4.098 -12.152 1.00 0.00 C ATOM 1697 O LYS B 112 8.192 3.087 -12.744 1.00 0.00 O ATOM 1698 CB LYS B 112 10.939 4.997 -12.402 1.00 0.00 C ATOM 1699 CG LYS B 112 11.169 4.409 -13.804 1.00 0.00 C ATOM 1700 CD LYS B 112 12.076 5.266 -14.698 1.00 0.00 C ATOM 1701 CE LYS B 112 11.480 6.650 -14.988 1.00 0.00 C ATOM 1702 NZ LYS B 112 12.258 7.373 -16.019 1.00 0.00 N ATOM 0 H LYS B 112 10.777 2.315 -12.031 1.00 0.00 H new ATOM 0 HA LYS B 112 9.844 4.699 -10.572 1.00 0.00 H new ATOM 0 HB2 LYS B 112 10.549 6.010 -12.505 1.00 0.00 H new ATOM 0 HB3 LYS B 112 11.899 5.075 -11.892 1.00 0.00 H new ATOM 0 HG2 LYS B 112 11.608 3.416 -13.703 1.00 0.00 H new ATOM 0 HG3 LYS B 112 10.205 4.282 -14.297 1.00 0.00 H new ATOM 0 HD2 LYS B 112 13.046 5.386 -14.216 1.00 0.00 H new ATOM 0 HD3 LYS B 112 12.250 4.745 -15.639 1.00 0.00 H new ATOM 0 HE2 LYS B 112 10.448 6.540 -15.321 1.00 0.00 H new ATOM 0 HE3 LYS B 112 11.458 7.237 -14.070 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 12.234 8.394 -15.820 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 13.244 7.041 -16.006 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 11.844 7.193 -16.956 1.00 0.00 H new ATOM 1716 N VAL B 113 7.843 5.209 -12.072 1.00 0.00 N ATOM 1717 CA VAL B 113 6.597 5.454 -12.810 1.00 0.00 C ATOM 1718 C VAL B 113 6.665 6.817 -13.506 1.00 0.00 C ATOM 1719 O VAL B 113 7.161 7.783 -12.928 1.00 0.00 O ATOM 1720 CB VAL B 113 5.345 5.350 -11.904 1.00 0.00 C ATOM 1721 CG1 VAL B 113 5.178 3.921 -11.364 1.00 0.00 C ATOM 1722 CG2 VAL B 113 5.345 6.315 -10.709 1.00 0.00 C ATOM 0 H VAL B 113 8.108 5.991 -11.473 1.00 0.00 H new ATOM 0 HA VAL B 113 6.496 4.673 -13.564 1.00 0.00 H new ATOM 0 HB VAL B 113 4.513 5.629 -12.551 1.00 0.00 H new ATOM 0 HG11 VAL B 113 4.292 3.873 -10.731 1.00 0.00 H new ATOM 0 HG12 VAL B 113 5.066 3.228 -12.198 1.00 0.00 H new ATOM 0 HG13 VAL B 113 6.057 3.648 -10.780 1.00 0.00 H new ATOM 0 HG21 VAL B 113 4.433 6.175 -10.128 1.00 0.00 H new ATOM 0 HG22 VAL B 113 6.211 6.113 -10.079 1.00 0.00 H new ATOM 0 HG23 VAL B 113 5.391 7.342 -11.071 1.00 0.00 H new ATOM 1732 N CYS B 114 6.177 6.880 -14.745 1.00 0.00 N ATOM 1733 CA CYS B 114 6.060 8.090 -15.564 1.00 0.00 C ATOM 1734 C CYS B 114 4.570 8.430 -15.719 1.00 0.00 C ATOM 1735 O CYS B 114 3.854 7.722 -16.427 1.00 0.00 O ATOM 1736 CB CYS B 114 6.710 7.822 -16.934 1.00 0.00 C ATOM 1737 SG CYS B 114 8.484 7.469 -16.759 1.00 0.00 S ATOM 0 H CYS B 114 5.836 6.050 -15.229 1.00 0.00 H new ATOM 0 HA CYS B 114 6.567 8.934 -15.096 1.00 0.00 H new ATOM 0 HB2 CYS B 114 6.214 6.980 -17.417 1.00 0.00 H new ATOM 0 HB3 CYS B 114 6.570 8.688 -17.582 1.00 0.00 H new ATOM 0 HG CYS B 114 9.000 7.246 -17.931 1.00 0.00 H new ATOM 1743 N ILE B 115 4.081 9.476 -15.056 1.00 0.00 N ATOM 1744 CA ILE B 115 2.650 9.827 -14.991 1.00 0.00 C ATOM 1745 C ILE B 115 2.344 11.101 -15.793 1.00 0.00 C ATOM 1746 O ILE B 115 3.107 12.069 -15.768 1.00 0.00 O ATOM 1747 CB ILE B 115 2.167 9.939 -13.519 1.00 0.00 C ATOM 1748 CG1 ILE B 115 2.522 8.653 -12.729 1.00 0.00 C ATOM 1749 CG2 ILE B 115 0.647 10.205 -13.471 1.00 0.00 C ATOM 1750 CD1 ILE B 115 2.039 8.620 -11.272 1.00 0.00 C ATOM 0 H ILE B 115 4.675 10.121 -14.536 1.00 0.00 H new ATOM 0 HA ILE B 115 2.088 9.017 -15.457 1.00 0.00 H new ATOM 0 HB ILE B 115 2.679 10.779 -13.050 1.00 0.00 H new ATOM 0 HG12 ILE B 115 2.099 7.796 -13.254 1.00 0.00 H new ATOM 0 HG13 ILE B 115 3.605 8.529 -12.738 1.00 0.00 H new ATOM 0 HG21 ILE B 115 0.324 10.281 -12.433 1.00 0.00 H new ATOM 0 HG22 ILE B 115 0.424 11.137 -13.990 1.00 0.00 H new ATOM 0 HG23 ILE B 115 0.119 9.385 -13.957 1.00 0.00 H new ATOM 0 HD11 ILE B 115 2.339 7.679 -10.811 1.00 0.00 H new ATOM 0 HD12 ILE B 115 2.482 9.451 -10.723 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.953 8.707 -11.247 1.00 0.00 H new ATOM 1762 N GLU B 116 1.188 11.095 -16.460 1.00 0.00 N ATOM 1763 CA GLU B 116 0.500 12.261 -17.008 1.00 0.00 C ATOM 1764 C GLU B 116 -0.846 12.404 -16.271 1.00 0.00 C ATOM 1765 O GLU B 116 -1.699 11.526 -16.360 1.00 0.00 O ATOM 1766 CB GLU B 116 0.308 12.043 -18.517 1.00 0.00 C ATOM 1767 CG GLU B 116 -0.252 13.267 -19.245 1.00 0.00 C ATOM 1768 CD GLU B 116 -0.428 12.960 -20.728 1.00 0.00 C ATOM 1769 OE1 GLU B 116 0.586 12.818 -21.446 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -1.586 12.836 -21.193 1.00 0.00 O ATOM 0 H GLU B 116 0.681 10.229 -16.641 1.00 0.00 H new ATOM 0 HA GLU B 116 1.071 13.179 -16.869 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.266 11.773 -18.962 1.00 0.00 H new ATOM 0 HB3 GLU B 116 -0.365 11.199 -18.671 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -1.209 13.553 -18.809 1.00 0.00 H new ATOM 0 HG3 GLU B 116 0.422 14.115 -19.119 1.00 0.00 H new ATOM 1777 N SER B 117 -1.029 13.472 -15.497 1.00 0.00 N ATOM 1778 CA SER B 117 -2.120 13.595 -14.508 1.00 0.00 C ATOM 1779 C SER B 117 -2.967 14.887 -14.622 1.00 0.00 C ATOM 1780 O SER B 117 -2.428 15.964 -14.885 1.00 0.00 O ATOM 1781 CB SER B 117 -1.455 13.554 -13.125 1.00 0.00 C ATOM 1782 OG SER B 117 -2.374 13.762 -12.073 1.00 0.00 O ATOM 0 H SER B 117 -0.422 14.291 -15.533 1.00 0.00 H new ATOM 0 HA SER B 117 -2.823 12.781 -14.686 1.00 0.00 H new ATOM 0 HB2 SER B 117 -0.966 12.589 -12.990 1.00 0.00 H new ATOM 0 HB3 SER B 117 -0.676 14.315 -13.078 1.00 0.00 H new ATOM 0 HG SER B 117 -2.057 14.492 -11.501 1.00 0.00 H new ATOM 1788 N GLU B 118 -4.278 14.814 -14.320 1.00 0.00 N ATOM 1789 CA GLU B 118 -5.160 15.979 -14.061 1.00 0.00 C ATOM 1790 C GLU B 118 -4.939 16.633 -12.678 1.00 0.00 C ATOM 1791 O GLU B 118 -5.479 17.705 -12.402 1.00 0.00 O ATOM 1792 CB GLU B 118 -6.645 15.555 -14.154 1.00 0.00 C ATOM 1793 CG GLU B 118 -7.214 15.385 -15.571 1.00 0.00 C ATOM 1794 CD GLU B 118 -7.751 16.689 -16.177 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -6.993 17.676 -16.326 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -8.961 16.754 -16.506 1.00 0.00 O ATOM 0 H GLU B 118 -4.769 13.923 -14.247 1.00 0.00 H new ATOM 0 HA GLU B 118 -4.903 16.714 -14.824 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -6.766 14.612 -13.621 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -7.247 16.297 -13.630 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -6.435 14.986 -16.221 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -8.017 14.648 -15.545 1.00 0.00 H new ATOM 1803 N HIS B 119 -4.168 15.993 -11.801 1.00 0.00 N ATOM 1804 CA HIS B 119 -3.925 16.387 -10.404 1.00 0.00 C ATOM 1805 C HIS B 119 -2.425 16.569 -10.097 1.00 0.00 C ATOM 1806 O HIS B 119 -1.566 16.024 -10.798 1.00 0.00 O ATOM 1807 CB HIS B 119 -4.526 15.319 -9.479 1.00 0.00 C ATOM 1808 CG HIS B 119 -6.025 15.243 -9.570 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -6.910 16.021 -8.861 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -6.763 14.424 -10.382 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -8.152 15.679 -9.232 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -8.118 14.708 -10.165 1.00 0.00 N ATOM 0 H HIS B 119 -3.667 15.141 -12.053 1.00 0.00 H new ATOM 0 HA HIS B 119 -4.401 17.353 -10.235 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -4.102 14.347 -9.731 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -4.240 15.534 -8.450 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -6.370 13.689 -11.069 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -9.055 16.121 -8.837 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -8.917 14.268 -10.621 1.00 0.00 H new ATOM 1820 N SER B 120 -2.094 17.341 -9.064 1.00 0.00 N ATOM 1821 CA SER B 120 -0.723 17.785 -8.785 1.00 0.00 C ATOM 1822 C SER B 120 0.199 16.728 -8.169 1.00 0.00 C ATOM 1823 O SER B 120 -0.254 15.802 -7.496 1.00 0.00 O ATOM 1824 CB SER B 120 -0.734 19.036 -7.896 1.00 0.00 C ATOM 1825 OG SER B 120 -1.194 18.773 -6.577 1.00 0.00 O ATOM 0 H SER B 120 -2.776 17.682 -8.387 1.00 0.00 H new ATOM 0 HA SER B 120 -0.302 18.005 -9.766 1.00 0.00 H new ATOM 0 HB2 SER B 120 0.273 19.451 -7.848 1.00 0.00 H new ATOM 0 HB3 SER B 120 -1.370 19.795 -8.353 1.00 0.00 H new ATOM 0 HG SER B 120 -1.179 19.602 -6.054 1.00 0.00 H new ATOM 1831 N MET B 121 1.518 16.900 -8.327 1.00 0.00 N ATOM 1832 CA MET B 121 2.517 16.008 -7.721 1.00 0.00 C ATOM 1833 C MET B 121 2.426 15.952 -6.189 1.00 0.00 C ATOM 1834 O MET B 121 2.629 14.888 -5.619 1.00 0.00 O ATOM 1835 CB MET B 121 3.939 16.346 -8.213 1.00 0.00 C ATOM 1836 CG MET B 121 4.591 17.586 -7.584 1.00 0.00 C ATOM 1837 SD MET B 121 3.721 19.154 -7.817 1.00 0.00 S ATOM 1838 CE MET B 121 4.943 20.267 -7.084 1.00 0.00 C ATOM 0 H MET B 121 1.922 17.658 -8.876 1.00 0.00 H new ATOM 0 HA MET B 121 2.283 14.999 -8.061 1.00 0.00 H new ATOM 0 HB2 MET B 121 4.582 15.486 -8.024 1.00 0.00 H new ATOM 0 HB3 MET B 121 3.905 16.486 -9.293 1.00 0.00 H new ATOM 0 HG2 MET B 121 4.699 17.410 -6.514 1.00 0.00 H new ATOM 0 HG3 MET B 121 5.596 17.688 -7.993 1.00 0.00 H new ATOM 0 HE1 MET B 121 4.578 21.293 -7.136 1.00 0.00 H new ATOM 0 HE2 MET B 121 5.106 19.993 -6.042 1.00 0.00 H new ATOM 0 HE3 MET B 121 5.882 20.187 -7.631 1.00 0.00 H new ATOM 1848 N ASP B 122 2.048 17.050 -5.524 1.00 0.00 N ATOM 1849 CA ASP B 122 1.752 17.091 -4.082 1.00 0.00 C ATOM 1850 C ASP B 122 0.555 16.200 -3.704 1.00 0.00 C ATOM 1851 O ASP B 122 0.579 15.558 -2.651 1.00 0.00 O ATOM 1852 CB ASP B 122 1.477 18.548 -3.683 1.00 0.00 C ATOM 1853 CG ASP B 122 1.110 18.701 -2.202 1.00 0.00 C ATOM 1854 OD1 ASP B 122 2.027 18.754 -1.349 1.00 0.00 O ATOM 1855 OD2 ASP B 122 -0.098 18.758 -1.871 1.00 0.00 O ATOM 0 H ASP B 122 1.936 17.955 -5.980 1.00 0.00 H new ATOM 0 HA ASP B 122 2.614 16.701 -3.541 1.00 0.00 H new ATOM 0 HB2 ASP B 122 2.359 19.151 -3.898 1.00 0.00 H new ATOM 0 HB3 ASP B 122 0.666 18.940 -4.296 1.00 0.00 H new ATOM 1860 N THR B 123 -0.465 16.146 -4.572 1.00 0.00 N ATOM 1861 CA THR B 123 -1.653 15.288 -4.437 1.00 0.00 C ATOM 1862 C THR B 123 -1.295 13.826 -4.682 1.00 0.00 C ATOM 1863 O THR B 123 -1.746 12.947 -3.944 1.00 0.00 O ATOM 1864 CB THR B 123 -2.747 15.734 -5.416 1.00 0.00 C ATOM 1865 OG1 THR B 123 -2.983 17.114 -5.265 1.00 0.00 O ATOM 1866 CG2 THR B 123 -4.072 15.026 -5.146 1.00 0.00 C ATOM 0 H THR B 123 -0.487 16.718 -5.417 1.00 0.00 H new ATOM 0 HA THR B 123 -2.029 15.385 -3.419 1.00 0.00 H new ATOM 0 HB THR B 123 -2.396 15.489 -6.418 1.00 0.00 H new ATOM 0 HG1 THR B 123 -2.303 17.618 -5.759 1.00 0.00 H new ATOM 0 HG21 THR B 123 -4.820 15.369 -5.860 1.00 0.00 H new ATOM 0 HG22 THR B 123 -3.937 13.949 -5.251 1.00 0.00 H new ATOM 0 HG23 THR B 123 -4.406 15.253 -4.134 1.00 0.00 H new ATOM 1874 N LEU B 124 -0.470 13.557 -5.699 1.00 0.00 N ATOM 1875 CA LEU B 124 0.004 12.208 -6.028 1.00 0.00 C ATOM 1876 C LEU B 124 0.866 11.651 -4.883 1.00 0.00 C ATOM 1877 O LEU B 124 0.635 10.524 -4.440 1.00 0.00 O ATOM 1878 CB LEU B 124 0.773 12.193 -7.370 1.00 0.00 C ATOM 1879 CG LEU B 124 0.080 12.755 -8.642 1.00 0.00 C ATOM 1880 CD1 LEU B 124 0.551 11.977 -9.879 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -1.455 12.749 -8.620 1.00 0.00 C ATOM 0 H LEU B 124 -0.108 14.277 -6.324 1.00 0.00 H new ATOM 0 HA LEU B 124 -0.865 11.561 -6.148 1.00 0.00 H new ATOM 0 HB2 LEU B 124 1.698 12.751 -7.225 1.00 0.00 H new ATOM 0 HB3 LEU B 124 1.053 11.160 -7.577 1.00 0.00 H new ATOM 0 HG LEU B 124 0.377 13.803 -8.675 1.00 0.00 H new ATOM 0 HD11 LEU B 124 0.062 12.376 -10.768 1.00 0.00 H new ATOM 0 HD12 LEU B 124 1.631 12.079 -9.983 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.295 10.924 -9.766 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -1.834 13.162 -9.555 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -1.813 11.726 -8.503 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -1.809 13.355 -7.786 1.00 0.00 H new ATOM 1893 N LEU B 125 1.783 12.473 -4.352 1.00 0.00 N ATOM 1894 CA LEU B 125 2.550 12.199 -3.134 1.00 0.00 C ATOM 1895 C LEU B 125 1.616 11.923 -1.956 1.00 0.00 C ATOM 1896 O LEU B 125 1.730 10.861 -1.361 1.00 0.00 O ATOM 1897 CB LEU B 125 3.502 13.376 -2.819 1.00 0.00 C ATOM 1898 CG LEU B 125 4.771 13.450 -3.694 1.00 0.00 C ATOM 1899 CD1 LEU B 125 5.473 14.798 -3.477 1.00 0.00 C ATOM 1900 CD2 LEU B 125 5.753 12.312 -3.379 1.00 0.00 C ATOM 0 H LEU B 125 2.016 13.372 -4.773 1.00 0.00 H new ATOM 0 HA LEU B 125 3.153 11.307 -3.300 1.00 0.00 H new ATOM 0 HB2 LEU B 125 2.949 14.309 -2.930 1.00 0.00 H new ATOM 0 HB3 LEU B 125 3.805 13.307 -1.774 1.00 0.00 H new ATOM 0 HG LEU B 125 4.459 13.349 -4.733 1.00 0.00 H new ATOM 0 HD11 LEU B 125 6.368 14.846 -4.097 1.00 0.00 H new ATOM 0 HD12 LEU B 125 4.798 15.608 -3.752 1.00 0.00 H new ATOM 0 HD13 LEU B 125 5.752 14.898 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU B 125 6.632 12.403 -4.018 1.00 0.00 H new ATOM 0 HD22 LEU B 125 6.056 12.372 -2.334 1.00 0.00 H new ATOM 0 HD23 LEU B 125 5.269 11.353 -3.562 1.00 0.00 H new ATOM 1912 N ALA B 126 0.673 12.814 -1.631 1.00 0.00 N ATOM 1913 CA ALA B 126 -0.248 12.621 -0.503 1.00 0.00 C ATOM 1914 C ALA B 126 -1.053 11.310 -0.605 1.00 0.00 C ATOM 1915 O ALA B 126 -1.237 10.625 0.403 1.00 0.00 O ATOM 1916 CB ALA B 126 -1.172 13.842 -0.408 1.00 0.00 C ATOM 0 H ALA B 126 0.526 13.686 -2.139 1.00 0.00 H new ATOM 0 HA ALA B 126 0.340 12.530 0.410 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -1.862 13.712 0.426 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -0.574 14.739 -0.248 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -1.738 13.943 -1.334 1.00 0.00 H new ATOM 1922 N THR B 127 -1.483 10.940 -1.822 1.00 0.00 N ATOM 1923 CA THR B 127 -2.216 9.697 -2.102 1.00 0.00 C ATOM 1924 C THR B 127 -1.354 8.474 -1.784 1.00 0.00 C ATOM 1925 O THR B 127 -1.775 7.630 -0.993 1.00 0.00 O ATOM 1926 CB THR B 127 -2.751 9.699 -3.544 1.00 0.00 C ATOM 1927 OG1 THR B 127 -3.529 10.863 -3.731 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.665 8.506 -3.829 1.00 0.00 C ATOM 0 H THR B 127 -1.327 11.508 -2.654 1.00 0.00 H new ATOM 0 HA THR B 127 -3.085 9.639 -1.446 1.00 0.00 H new ATOM 0 HB THR B 127 -1.889 9.653 -4.210 1.00 0.00 H new ATOM 0 HG1 THR B 127 -2.944 11.612 -3.970 1.00 0.00 H new ATOM 0 HG21 THR B 127 -4.016 8.554 -4.860 1.00 0.00 H new ATOM 0 HG22 THR B 127 -3.112 7.579 -3.677 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.520 8.533 -3.153 1.00 0.00 H new ATOM 1936 N LEU B 128 -0.139 8.389 -2.337 1.00 0.00 N ATOM 1937 CA LEU B 128 0.778 7.260 -2.107 1.00 0.00 C ATOM 1938 C LEU B 128 1.338 7.214 -0.676 1.00 0.00 C ATOM 1939 O LEU B 128 1.500 6.131 -0.110 1.00 0.00 O ATOM 1940 CB LEU B 128 1.923 7.327 -3.137 1.00 0.00 C ATOM 1941 CG LEU B 128 1.502 6.939 -4.569 1.00 0.00 C ATOM 1942 CD1 LEU B 128 2.637 7.272 -5.547 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.159 5.442 -4.683 1.00 0.00 C ATOM 0 H LEU B 128 0.240 9.103 -2.959 1.00 0.00 H new ATOM 0 HA LEU B 128 0.207 6.340 -2.233 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.328 8.339 -3.150 1.00 0.00 H new ATOM 0 HB3 LEU B 128 2.727 6.666 -2.814 1.00 0.00 H new ATOM 0 HG LEU B 128 0.607 7.510 -4.815 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.338 6.997 -6.559 1.00 0.00 H new ATOM 0 HD12 LEU B 128 2.848 8.341 -5.509 1.00 0.00 H new ATOM 0 HD13 LEU B 128 3.532 6.715 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU B 128 0.868 5.212 -5.708 1.00 0.00 H new ATOM 0 HD22 LEU B 128 2.031 4.847 -4.412 1.00 0.00 H new ATOM 0 HD23 LEU B 128 0.335 5.205 -4.010 1.00 0.00 H new ATOM 1955 N LYS B 129 1.604 8.370 -0.065 1.00 0.00 N ATOM 1956 CA LYS B 129 2.151 8.460 1.291 1.00 0.00 C ATOM 1957 C LYS B 129 1.128 8.001 2.344 1.00 0.00 C ATOM 1958 O LYS B 129 1.490 7.245 3.242 1.00 0.00 O ATOM 1959 CB LYS B 129 2.652 9.889 1.570 1.00 0.00 C ATOM 1960 CG LYS B 129 3.933 10.187 0.773 1.00 0.00 C ATOM 1961 CD LYS B 129 4.322 11.668 0.763 1.00 0.00 C ATOM 1962 CE LYS B 129 4.780 12.152 2.138 1.00 0.00 C ATOM 1963 NZ LYS B 129 5.314 13.528 2.061 1.00 0.00 N ATOM 0 H LYS B 129 1.445 9.278 -0.501 1.00 0.00 H new ATOM 0 HA LYS B 129 3.002 7.782 1.362 1.00 0.00 H new ATOM 0 HB2 LYS B 129 1.878 10.609 1.304 1.00 0.00 H new ATOM 0 HB3 LYS B 129 2.846 10.009 2.636 1.00 0.00 H new ATOM 0 HG2 LYS B 129 4.755 9.608 1.194 1.00 0.00 H new ATOM 0 HG3 LYS B 129 3.798 9.849 -0.254 1.00 0.00 H new ATOM 0 HD2 LYS B 129 5.121 11.828 0.039 1.00 0.00 H new ATOM 0 HD3 LYS B 129 3.470 12.264 0.435 1.00 0.00 H new ATOM 0 HE2 LYS B 129 3.944 12.121 2.836 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.546 11.481 2.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 5.619 13.835 3.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 6.126 13.549 1.411 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 4.573 14.169 1.711 1.00 0.00 H new ATOM 1977 N LYS B 130 -0.161 8.350 2.204 1.00 0.00 N ATOM 1978 CA LYS B 130 -1.217 7.866 3.112 1.00 0.00 C ATOM 1979 C LYS B 130 -1.502 6.361 2.920 1.00 0.00 C ATOM 1980 O LYS B 130 -1.668 5.651 3.920 1.00 0.00 O ATOM 1981 CB LYS B 130 -2.463 8.765 2.967 1.00 0.00 C ATOM 1982 CG LYS B 130 -3.427 8.715 4.172 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.509 7.622 4.137 1.00 0.00 C ATOM 1984 CE LYS B 130 -5.596 7.933 3.100 1.00 0.00 C ATOM 1985 NZ LYS B 130 -6.632 6.876 3.070 1.00 0.00 N ATOM 0 H LYS B 130 -0.500 8.969 1.467 1.00 0.00 H new ATOM 0 HA LYS B 130 -0.876 7.945 4.144 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -2.138 9.795 2.819 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -3.007 8.470 2.069 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -2.835 8.581 5.078 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -3.922 9.683 4.254 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -4.049 6.662 3.905 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -4.963 7.528 5.123 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -6.059 8.892 3.332 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -5.143 8.029 2.113 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -7.493 7.246 2.619 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -6.281 6.061 2.528 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -6.851 6.577 4.042 1.00 0.00 H new ATOM 1999 N THR B 131 -1.450 5.867 1.668 1.00 0.00 N ATOM 2000 CA THR B 131 -1.433 4.433 1.293 1.00 0.00 C ATOM 2001 C THR B 131 -0.257 3.668 1.916 1.00 0.00 C ATOM 2002 O THR B 131 -0.386 2.469 2.152 1.00 0.00 O ATOM 2003 CB THR B 131 -1.435 4.325 -0.239 1.00 0.00 C ATOM 2004 OG1 THR B 131 -2.722 4.683 -0.675 1.00 0.00 O ATOM 2005 CG2 THR B 131 -1.117 2.938 -0.808 1.00 0.00 C ATOM 0 H THR B 131 -1.417 6.479 0.853 1.00 0.00 H new ATOM 0 HA THR B 131 -2.328 3.959 1.696 1.00 0.00 H new ATOM 0 HB THR B 131 -0.638 4.978 -0.595 1.00 0.00 H new ATOM 0 HG1 THR B 131 -3.354 3.970 -0.448 1.00 0.00 H new ATOM 0 HG21 THR B 131 -1.146 2.976 -1.897 1.00 0.00 H new ATOM 0 HG22 THR B 131 -0.124 2.630 -0.482 1.00 0.00 H new ATOM 0 HG23 THR B 131 -1.855 2.220 -0.451 1.00 0.00 H new ATOM 2013 N GLY B 132 0.833 4.366 2.256 1.00 0.00 N ATOM 2014 CA GLY B 132 1.925 3.885 3.110 1.00 0.00 C ATOM 2015 C GLY B 132 3.125 3.271 2.392 1.00 0.00 C ATOM 2016 O GLY B 132 3.801 2.423 2.971 1.00 0.00 O ATOM 0 H GLY B 132 0.984 5.321 1.930 1.00 0.00 H new ATOM 0 HA2 GLY B 132 2.279 4.719 3.716 1.00 0.00 H new ATOM 0 HA3 GLY B 132 1.520 3.142 3.797 1.00 0.00 H new ATOM 2020 N LYS B 133 3.437 3.687 1.160 1.00 0.00 N ATOM 2021 CA LYS B 133 4.690 3.304 0.481 1.00 0.00 C ATOM 2022 C LYS B 133 5.650 4.488 0.294 1.00 0.00 C ATOM 2023 O LYS B 133 5.231 5.647 0.248 1.00 0.00 O ATOM 2024 CB LYS B 133 4.365 2.524 -0.813 1.00 0.00 C ATOM 2025 CG LYS B 133 5.559 1.680 -1.300 1.00 0.00 C ATOM 2026 CD LYS B 133 5.241 0.745 -2.476 1.00 0.00 C ATOM 2027 CE LYS B 133 4.259 -0.390 -2.141 1.00 0.00 C ATOM 2028 NZ LYS B 133 4.793 -1.335 -1.129 1.00 0.00 N ATOM 0 H LYS B 133 2.836 4.295 0.604 1.00 0.00 H new ATOM 0 HA LYS B 133 5.250 2.626 1.125 1.00 0.00 H new ATOM 0 HB2 LYS B 133 3.509 1.872 -0.637 1.00 0.00 H new ATOM 0 HB3 LYS B 133 4.075 3.226 -1.595 1.00 0.00 H new ATOM 0 HG2 LYS B 133 6.366 2.351 -1.594 1.00 0.00 H new ATOM 0 HG3 LYS B 133 5.929 1.082 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS B 133 4.828 1.337 -3.293 1.00 0.00 H new ATOM 0 HD3 LYS B 133 6.172 0.308 -2.838 1.00 0.00 H new ATOM 0 HE2 LYS B 133 3.327 0.039 -1.774 1.00 0.00 H new ATOM 0 HE3 LYS B 133 4.020 -0.938 -3.052 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 4.239 -2.215 -1.150 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 5.788 -1.547 -1.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 4.726 -0.906 -0.184 1.00 0.00 H new ATOM 2042 N THR B 134 6.950 4.181 0.245 1.00 0.00 N ATOM 2043 CA THR B 134 8.048 5.136 0.099 1.00 0.00 C ATOM 2044 C THR B 134 8.115 5.593 -1.345 1.00 0.00 C ATOM 2045 O THR B 134 8.449 4.812 -2.237 1.00 0.00 O ATOM 2046 CB THR B 134 9.367 4.527 0.580 1.00 0.00 C ATOM 2047 OG1 THR B 134 9.208 4.185 1.939 1.00 0.00 O ATOM 2048 CG2 THR B 134 10.533 5.508 0.469 1.00 0.00 C ATOM 0 H THR B 134 7.278 3.217 0.309 1.00 0.00 H new ATOM 0 HA THR B 134 7.867 6.009 0.726 1.00 0.00 H new ATOM 0 HB THR B 134 9.596 3.663 -0.044 1.00 0.00 H new ATOM 0 HG1 THR B 134 10.039 3.789 2.276 1.00 0.00 H new ATOM 0 HG21 THR B 134 11.446 5.029 0.822 1.00 0.00 H new ATOM 0 HG22 THR B 134 10.659 5.807 -0.572 1.00 0.00 H new ATOM 0 HG23 THR B 134 10.327 6.389 1.077 1.00 0.00 H new ATOM 2056 N VAL B 135 7.773 6.859 -1.541 1.00 0.00 N ATOM 2057 CA VAL B 135 7.664 7.548 -2.836 1.00 0.00 C ATOM 2058 C VAL B 135 8.595 8.774 -2.913 1.00 0.00 C ATOM 2059 O VAL B 135 8.720 9.545 -1.962 1.00 0.00 O ATOM 2060 CB VAL B 135 6.184 7.910 -3.116 1.00 0.00 C ATOM 2061 CG1 VAL B 135 5.527 8.762 -2.018 1.00 0.00 C ATOM 2062 CG2 VAL B 135 5.989 8.613 -4.465 1.00 0.00 C ATOM 0 H VAL B 135 7.550 7.476 -0.760 1.00 0.00 H new ATOM 0 HA VAL B 135 7.999 6.870 -3.621 1.00 0.00 H new ATOM 0 HB VAL B 135 5.685 6.941 -3.135 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.493 8.972 -2.290 1.00 0.00 H new ATOM 0 HG12 VAL B 135 5.551 8.219 -1.073 1.00 0.00 H new ATOM 0 HG13 VAL B 135 6.071 9.700 -1.911 1.00 0.00 H new ATOM 0 HG21 VAL B 135 4.933 8.842 -4.607 1.00 0.00 H new ATOM 0 HG22 VAL B 135 6.566 9.538 -4.480 1.00 0.00 H new ATOM 0 HG23 VAL B 135 6.329 7.960 -5.268 1.00 0.00 H new ATOM 2072 N SER B 136 9.243 8.961 -4.066 1.00 0.00 N ATOM 2073 CA SER B 136 10.194 10.054 -4.336 1.00 0.00 C ATOM 2074 C SER B 136 9.888 10.741 -5.679 1.00 0.00 C ATOM 2075 O SER B 136 9.999 10.114 -6.732 1.00 0.00 O ATOM 2076 CB SER B 136 11.629 9.503 -4.379 1.00 0.00 C ATOM 2077 OG SER B 136 12.003 8.840 -3.181 1.00 0.00 O ATOM 0 H SER B 136 9.120 8.339 -4.865 1.00 0.00 H new ATOM 0 HA SER B 136 10.094 10.785 -3.534 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.722 8.810 -5.216 1.00 0.00 H new ATOM 0 HB3 SER B 136 12.322 10.323 -4.566 1.00 0.00 H new ATOM 0 HG SER B 136 12.922 8.509 -3.263 1.00 0.00 H new ATOM 2083 N TYR B 137 9.517 12.026 -5.659 1.00 0.00 N ATOM 2084 CA TYR B 137 9.114 12.808 -6.844 1.00 0.00 C ATOM 2085 C TYR B 137 10.301 13.313 -7.700 1.00 0.00 C ATOM 2086 O TYR B 137 11.303 13.803 -7.164 1.00 0.00 O ATOM 2087 CB TYR B 137 8.214 13.969 -6.367 1.00 0.00 C ATOM 2088 CG TYR B 137 8.165 15.189 -7.271 1.00 0.00 C ATOM 2089 CD1 TYR B 137 7.577 15.123 -8.551 1.00 0.00 C ATOM 2090 CD2 TYR B 137 8.774 16.386 -6.846 1.00 0.00 C ATOM 2091 CE1 TYR B 137 7.645 16.232 -9.418 1.00 0.00 C ATOM 2092 CE2 TYR B 137 8.831 17.499 -7.701 1.00 0.00 C ATOM 2093 CZ TYR B 137 8.295 17.417 -9.002 1.00 0.00 C ATOM 2094 OH TYR B 137 8.432 18.474 -9.849 1.00 0.00 O ATOM 0 H TYR B 137 9.486 12.570 -4.797 1.00 0.00 H new ATOM 0 HA TYR B 137 8.564 12.149 -7.516 1.00 0.00 H new ATOM 0 HB2 TYR B 137 7.199 13.590 -6.247 1.00 0.00 H new ATOM 0 HB3 TYR B 137 8.555 14.285 -5.381 1.00 0.00 H new ATOM 0 HD1 TYR B 137 7.074 14.221 -8.867 1.00 0.00 H new ATOM 0 HD2 TYR B 137 9.200 16.448 -5.856 1.00 0.00 H new ATOM 0 HE1 TYR B 137 7.200 16.177 -10.401 1.00 0.00 H new ATOM 0 HE2 TYR B 137 9.286 18.418 -7.361 1.00 0.00 H new ATOM 0 HH TYR B 137 8.903 19.201 -9.391 1.00 0.00 H new ATOM 2104 N LEU B 138 10.147 13.251 -9.029 1.00 0.00 N ATOM 2105 CA LEU B 138 11.064 13.729 -10.073 1.00 0.00 C ATOM 2106 C LEU B 138 10.285 14.538 -11.136 1.00 0.00 C ATOM 2107 O LEU B 138 9.096 14.310 -11.370 1.00 0.00 O ATOM 2108 CB LEU B 138 11.762 12.514 -10.723 1.00 0.00 C ATOM 2109 CG LEU B 138 12.609 11.629 -9.783 1.00 0.00 C ATOM 2110 CD1 LEU B 138 13.070 10.375 -10.538 1.00 0.00 C ATOM 2111 CD2 LEU B 138 13.833 12.376 -9.238 1.00 0.00 C ATOM 0 H LEU B 138 9.311 12.831 -9.435 1.00 0.00 H new ATOM 0 HA LEU B 138 11.815 14.383 -9.631 1.00 0.00 H new ATOM 0 HB2 LEU B 138 10.999 11.889 -11.187 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.406 12.877 -11.524 1.00 0.00 H new ATOM 0 HG LEU B 138 11.983 11.352 -8.934 1.00 0.00 H new ATOM 0 HD11 LEU B 138 13.668 9.750 -9.875 1.00 0.00 H new ATOM 0 HD12 LEU B 138 12.199 9.814 -10.878 1.00 0.00 H new ATOM 0 HD13 LEU B 138 13.671 10.669 -11.399 1.00 0.00 H new ATOM 0 HD21 LEU B 138 14.400 11.716 -8.582 1.00 0.00 H new ATOM 0 HD22 LEU B 138 14.465 12.693 -10.068 1.00 0.00 H new ATOM 0 HD23 LEU B 138 13.505 13.251 -8.677 1.00 0.00 H new ATOM 2123 N GLY B 139 10.947 15.509 -11.774 1.00 0.00 N ATOM 2124 CA GLY B 139 10.282 16.583 -12.524 1.00 0.00 C ATOM 2125 C GLY B 139 9.838 16.258 -13.958 1.00 0.00 C ATOM 2126 O GLY B 139 9.471 15.131 -14.296 1.00 0.00 O ATOM 0 H GLY B 139 11.965 15.573 -11.785 1.00 0.00 H new ATOM 0 HA2 GLY B 139 9.404 16.897 -11.960 1.00 0.00 H new ATOM 0 HA3 GLY B 139 10.958 17.438 -12.564 1.00 0.00 H new ATOM 2130 N LEU B 140 9.789 17.307 -14.785 1.00 0.00 N ATOM 2131 CA LEU B 140 9.190 17.342 -16.125 1.00 0.00 C ATOM 2132 C LEU B 140 10.002 16.567 -17.182 1.00 0.00 C ATOM 2133 O LEU B 140 11.212 16.361 -17.046 1.00 0.00 O ATOM 2134 CB LEU B 140 8.995 18.833 -16.492 1.00 0.00 C ATOM 2135 CG LEU B 140 8.281 19.155 -17.823 1.00 0.00 C ATOM 2136 CD1 LEU B 140 6.865 18.560 -17.894 1.00 0.00 C ATOM 2137 CD2 LEU B 140 8.203 20.678 -18.000 1.00 0.00 C ATOM 0 H LEU B 140 10.190 18.208 -14.523 1.00 0.00 H new ATOM 0 HA LEU B 140 8.231 16.824 -16.113 1.00 0.00 H new ATOM 0 HB2 LEU B 140 8.433 19.306 -15.687 1.00 0.00 H new ATOM 0 HB3 LEU B 140 9.978 19.304 -16.515 1.00 0.00 H new ATOM 0 HG LEU B 140 8.864 18.701 -18.624 1.00 0.00 H new ATOM 0 HD11 LEU B 140 6.410 18.817 -18.850 1.00 0.00 H new ATOM 0 HD12 LEU B 140 6.921 17.476 -17.799 1.00 0.00 H new ATOM 0 HD13 LEU B 140 6.259 18.965 -17.083 1.00 0.00 H new ATOM 0 HD21 LEU B 140 7.700 20.910 -18.939 1.00 0.00 H new ATOM 0 HD22 LEU B 140 7.644 21.112 -17.171 1.00 0.00 H new ATOM 0 HD23 LEU B 140 9.210 21.094 -18.016 1.00 0.00 H new ATOM 2149 N GLU B 141 9.313 16.163 -18.253 1.00 0.00 N ATOM 2150 CA GLU B 141 9.847 15.449 -19.423 1.00 0.00 C ATOM 2151 C GLU B 141 10.479 16.371 -20.473 1.00 0.00 C ATOM 2152 O GLU B 141 9.782 17.192 -21.114 1.00 0.00 O ATOM 2153 CB GLU B 141 8.727 14.571 -20.012 1.00 0.00 C ATOM 2154 CG GLU B 141 9.234 13.736 -21.199 1.00 0.00 C ATOM 2155 CD GLU B 141 8.301 12.592 -21.624 1.00 0.00 C ATOM 2156 OE1 GLU B 141 7.467 12.110 -20.824 1.00 0.00 O ATOM 2157 OE2 GLU B 141 8.450 12.096 -22.768 1.00 0.00 O ATOM 2158 OXT GLU B 141 11.709 16.262 -20.674 1.00 0.00 O ATOM 0 H GLU B 141 8.311 16.334 -18.334 1.00 0.00 H new ATOM 0 HA GLU B 141 10.673 14.820 -19.092 1.00 0.00 H new ATOM 0 HB2 GLU B 141 8.338 13.908 -19.239 1.00 0.00 H new ATOM 0 HB3 GLU B 141 7.900 15.203 -20.336 1.00 0.00 H new ATOM 0 HG2 GLU B 141 9.387 14.397 -22.052 1.00 0.00 H new ATOM 0 HG3 GLU B 141 10.207 13.317 -20.942 1.00 0.00 H new