USER MOD reduce.3.24.130724 H: found=0, std=0, add=1193, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1192 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 MET CE :methyl -117:sc= -1.3 (180deg=-1.43) USER MOD Set 1.2: A 125 GLN :FLIP amide:sc= -1.55 F(o=-5.5,f=-2.9) USER MOD Set 2.1: A 121 THR OG1 : rot 180:sc= 0.00205 USER MOD Set 2.2: A 123 GLN : amide:sc= -2.24 X(o=-2.2,f=-2.5!) USER MOD Set 3.1: A 70 THR OG1 : rot -79:sc= 1.11 USER MOD Set 3.2: A 109 THR OG1 : rot -129:sc= 0.771! USER MOD Set 4.1: A 47 SER OG : rot 151:sc= 0.387 USER MOD Set 4.2: A 50 ASN : amide:sc= 0.992 K(o=1.4,f=-0.46) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 HIS :FLIP no HD1:sc= -1.79 F(o=-2.4,f=-1.8) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 166:sc= -2.89! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 99:sc= -1.02! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.123 USER MOD Single : A 36 ASN :FLIP amide:sc= -0.832 F(o=-1.8,f=-0.83) USER MOD Single : A 37 ASN :FLIP amide:sc= 0.968 F(o=-0.005,f=0.97) USER MOD Single : A 40 HIS : no HD1:sc= -0.377 X(o=-0.38,f=-0.3) USER MOD Single : A 41 HIS :FLIP no HE2:sc= -7.13! C(o=-8!,f=-7.1!) USER MOD Single : A 43 MET CE :methyl -140:sc= -3.01! (180deg=-6.1!) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -95:sc= 0.863 USER MOD Single : A 57 GLN : amide:sc= -3.72! C(o=-3.7!,f=-6.8!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 40:sc= -1.62 USER MOD Single : A 62 MET CE :methyl 155:sc= -8.77! (180deg=-10.5!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.109 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 119:sc= 0.0307 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 109:sc= 1.13 USER MOD Single : A 86 HIS :FLIP no HD1:sc= -0.751 F(o=-1.8!,f=-0.75) USER MOD Single : A 88 ASN : amide:sc= -4.55! C(o=-4.5!,f=-4.4!) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0276 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.00964) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -142:sc= -6.6! (180deg=-12.6!) USER MOD Single : A 111 SER OG : rot 155:sc= 0.0664 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00605 USER MOD Single : A 119 SER OG : rot 180:sc= 0.00313 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 91:sc= 0.0901 USER MOD Single : A 141 ASN :FLIP amide:sc= -0.979 F(o=-2.5,f=-0.98) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -14.914 4.121 -39.169 1.00 0.00 N ATOM 2 CA GLY A 2 -13.465 3.913 -38.898 1.00 0.00 C ATOM 3 C GLY A 2 -12.619 5.094 -39.334 1.00 0.00 C ATOM 4 O GLY A 2 -11.971 5.050 -40.380 1.00 0.00 O ATOM 0 HA2 GLY A 2 -13.319 3.739 -37.832 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -13.126 3.016 -39.417 1.00 0.00 H new ATOM 10 N SER A 3 -12.624 6.152 -38.530 1.00 0.00 N ATOM 11 CA SER A 3 -11.852 7.350 -38.837 1.00 0.00 C ATOM 12 C SER A 3 -11.121 7.862 -37.600 1.00 0.00 C ATOM 13 O SER A 3 -9.937 8.194 -37.660 1.00 0.00 O ATOM 14 CB SER A 3 -12.767 8.443 -39.392 1.00 0.00 C ATOM 15 OG SER A 3 -12.990 8.266 -40.780 1.00 0.00 O ATOM 0 H SER A 3 -13.155 6.204 -37.660 1.00 0.00 H new ATOM 0 HA SER A 3 -11.110 7.088 -39.591 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.720 8.427 -38.863 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.320 9.421 -39.214 1.00 0.00 H new ATOM 0 HG SER A 3 -13.579 8.976 -41.110 1.00 0.00 H new ATOM 21 N HIS A 4 -11.833 7.923 -36.479 1.00 0.00 N ATOM 22 CA HIS A 4 -11.252 8.395 -35.227 1.00 0.00 C ATOM 23 C HIS A 4 -10.023 7.573 -34.848 1.00 0.00 C ATOM 24 O HIS A 4 -9.806 6.483 -35.377 1.00 0.00 O ATOM 25 CB HIS A 4 -12.289 8.336 -34.104 1.00 0.00 C ATOM 26 CG HIS A 4 -12.875 6.974 -33.896 1.00 0.00 C ATOM 27 ND1 HIS A 4 -13.730 6.251 -34.658 1.00 0.00 N flip ATOM 28 CD2 HIS A 4 -12.598 6.196 -32.793 1.00 0.00 C flip ATOM 29 CE1 HIS A 4 -13.951 5.064 -34.006 1.00 0.00 C flip ATOM 30 NE2 HIS A 4 -13.258 5.055 -32.883 1.00 0.00 N flip ATOM 0 H HIS A 4 -12.814 7.651 -36.412 1.00 0.00 H new ATOM 0 HA HIS A 4 -10.941 9.430 -35.370 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -11.825 8.668 -33.175 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -13.093 9.037 -34.327 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -11.943 6.475 -31.981 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -14.589 4.266 -34.356 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -13.236 4.297 -32.201 1.00 0.00 H new ATOM 38 N MET A 5 -9.223 8.105 -33.930 1.00 0.00 N ATOM 39 CA MET A 5 -8.014 7.424 -33.481 1.00 0.00 C ATOM 40 C MET A 5 -8.342 6.063 -32.875 1.00 0.00 C ATOM 41 O MET A 5 -8.097 5.025 -33.489 1.00 0.00 O ATOM 42 CB MET A 5 -7.272 8.284 -32.457 1.00 0.00 C ATOM 43 CG MET A 5 -6.716 9.576 -33.034 1.00 0.00 C ATOM 44 SD MET A 5 -5.448 10.316 -31.987 1.00 0.00 S ATOM 45 CE MET A 5 -6.106 11.967 -31.775 1.00 0.00 C ATOM 0 H MET A 5 -9.390 9.006 -33.482 1.00 0.00 H new ATOM 0 HA MET A 5 -7.374 7.267 -34.350 1.00 0.00 H new ATOM 0 HB2 MET A 5 -7.950 8.524 -31.638 1.00 0.00 H new ATOM 0 HB3 MET A 5 -6.453 7.703 -32.033 1.00 0.00 H new ATOM 0 HG2 MET A 5 -6.297 9.378 -34.020 1.00 0.00 H new ATOM 0 HG3 MET A 5 -7.530 10.288 -33.171 1.00 0.00 H new ATOM 0 HE1 MET A 5 -5.431 12.550 -31.148 1.00 0.00 H new ATOM 0 HE2 MET A 5 -6.203 12.448 -32.748 1.00 0.00 H new ATOM 0 HE3 MET A 5 -7.085 11.910 -31.300 1.00 0.00 H new ATOM 55 N ARG A 6 -8.895 6.076 -31.667 1.00 0.00 N ATOM 56 CA ARG A 6 -9.255 4.842 -30.974 1.00 0.00 C ATOM 57 C ARG A 6 -10.165 3.974 -31.839 1.00 0.00 C ATOM 58 O ARG A 6 -10.603 4.388 -32.912 1.00 0.00 O ATOM 59 CB ARG A 6 -9.945 5.164 -29.646 1.00 0.00 C ATOM 60 CG ARG A 6 -9.135 4.752 -28.426 1.00 0.00 C ATOM 61 CD ARG A 6 -8.801 5.947 -27.547 1.00 0.00 C ATOM 62 NE ARG A 6 -7.670 6.711 -28.068 1.00 0.00 N ATOM 63 CZ ARG A 6 -6.397 6.359 -27.899 1.00 0.00 C ATOM 64 NH1 ARG A 6 -6.087 5.257 -27.227 1.00 0.00 N ATOM 65 NH2 ARG A 6 -5.428 7.110 -28.407 1.00 0.00 N ATOM 0 H ARG A 6 -9.104 6.928 -31.146 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.339 4.285 -30.775 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -10.141 6.235 -29.598 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -10.912 4.662 -29.617 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -9.696 4.019 -27.847 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -8.213 4.267 -28.747 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -9.673 6.596 -27.472 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -8.572 5.602 -26.539 1.00 0.00 H new ATOM 0 HE ARG A 6 -7.867 7.564 -28.592 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -6.826 4.673 -26.836 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -5.109 4.994 -27.102 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -5.658 7.957 -28.927 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -4.453 6.840 -28.278 1.00 0.00 H new ATOM 79 N VAL A 7 -10.445 2.764 -31.363 1.00 0.00 N ATOM 80 CA VAL A 7 -11.303 1.835 -32.088 1.00 0.00 C ATOM 81 C VAL A 7 -12.125 0.984 -31.130 1.00 0.00 C ATOM 82 O VAL A 7 -11.590 0.117 -30.439 1.00 0.00 O ATOM 83 CB VAL A 7 -10.493 0.898 -33.008 1.00 0.00 C ATOM 84 CG1 VAL A 7 -10.347 1.508 -34.393 1.00 0.00 C ATOM 85 CG2 VAL A 7 -9.130 0.591 -32.405 1.00 0.00 C ATOM 0 H VAL A 7 -10.089 2.405 -30.477 1.00 0.00 H new ATOM 0 HA VAL A 7 -11.966 2.446 -32.701 1.00 0.00 H new ATOM 0 HB VAL A 7 -11.037 -0.042 -33.103 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -9.773 0.834 -35.029 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.334 1.664 -34.828 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -9.829 2.464 -34.317 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.578 -0.071 -33.072 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -8.573 1.519 -32.272 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -9.261 0.105 -31.438 1.00 0.00 H new ATOM 95 N THR A 8 -13.428 1.233 -31.095 1.00 0.00 N ATOM 96 CA THR A 8 -14.319 0.485 -30.222 1.00 0.00 C ATOM 97 C THR A 8 -15.775 0.658 -30.646 1.00 0.00 C ATOM 98 O THR A 8 -16.125 1.631 -31.314 1.00 0.00 O ATOM 99 CB THR A 8 -14.134 0.934 -28.772 1.00 0.00 C ATOM 100 OG1 THR A 8 -14.820 0.065 -27.886 1.00 0.00 O ATOM 101 CG2 THR A 8 -14.628 2.341 -28.510 1.00 0.00 C ATOM 0 H THR A 8 -13.889 1.946 -31.660 1.00 0.00 H new ATOM 0 HA THR A 8 -14.066 -0.572 -30.303 1.00 0.00 H new ATOM 0 HB THR A 8 -13.058 0.908 -28.598 1.00 0.00 H new ATOM 0 HG1 THR A 8 -14.688 0.368 -26.963 1.00 0.00 H new ATOM 0 HG21 THR A 8 -14.466 2.594 -27.462 1.00 0.00 H new ATOM 0 HG22 THR A 8 -14.082 3.042 -29.141 1.00 0.00 H new ATOM 0 HG23 THR A 8 -15.692 2.401 -28.737 1.00 0.00 H new ATOM 109 N GLN A 9 -16.617 -0.291 -30.251 1.00 0.00 N ATOM 110 CA GLN A 9 -18.035 -0.242 -30.588 1.00 0.00 C ATOM 111 C GLN A 9 -18.852 0.279 -29.410 1.00 0.00 C ATOM 112 O GLN A 9 -18.703 -0.194 -28.283 1.00 0.00 O ATOM 113 CB GLN A 9 -18.532 -1.629 -30.998 1.00 0.00 C ATOM 114 CG GLN A 9 -18.236 -1.976 -32.447 1.00 0.00 C ATOM 115 CD GLN A 9 -18.637 -3.396 -32.800 1.00 0.00 C ATOM 116 OE1 GLN A 9 -18.104 -4.359 -32.248 1.00 0.00 O ATOM 117 NE2 GLN A 9 -19.581 -3.532 -33.724 1.00 0.00 N ATOM 0 H GLN A 9 -16.342 -1.103 -29.698 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.163 0.442 -31.427 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -18.071 -2.377 -30.352 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -19.608 -1.684 -30.832 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -18.765 -1.280 -33.099 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -17.171 -1.845 -32.638 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -19.995 -2.706 -34.155 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -19.892 -4.463 -34.002 1.00 0.00 H new ATOM 126 N GLU A 10 -19.712 1.254 -29.678 1.00 0.00 N ATOM 127 CA GLU A 10 -20.551 1.839 -28.638 1.00 0.00 C ATOM 128 C GLU A 10 -21.909 1.143 -28.577 1.00 0.00 C ATOM 129 O GLU A 10 -22.951 1.793 -28.489 1.00 0.00 O ATOM 130 CB GLU A 10 -20.735 3.340 -28.889 1.00 0.00 C ATOM 131 CG GLU A 10 -20.336 4.206 -27.705 1.00 0.00 C ATOM 132 CD GLU A 10 -18.887 4.650 -27.769 1.00 0.00 C ATOM 133 OE1 GLU A 10 -18.607 5.659 -28.451 1.00 0.00 O ATOM 134 OE2 GLU A 10 -18.036 3.990 -27.140 1.00 0.00 O ATOM 0 H GLU A 10 -19.847 1.656 -30.606 1.00 0.00 H new ATOM 0 HA GLU A 10 -20.053 1.699 -27.678 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -20.143 3.630 -29.757 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -21.779 3.534 -29.135 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -20.980 5.085 -27.669 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -20.502 3.651 -26.782 1.00 0.00 H new ATOM 141 N GLU A 11 -21.889 -0.185 -28.621 1.00 0.00 N ATOM 142 CA GLU A 11 -23.116 -0.973 -28.569 1.00 0.00 C ATOM 143 C GLU A 11 -22.866 -2.334 -27.928 1.00 0.00 C ATOM 144 O GLU A 11 -23.602 -3.289 -28.173 1.00 0.00 O ATOM 145 CB GLU A 11 -23.688 -1.155 -29.976 1.00 0.00 C ATOM 146 CG GLU A 11 -22.693 -1.740 -30.965 1.00 0.00 C ATOM 147 CD GLU A 11 -23.324 -2.064 -32.305 1.00 0.00 C ATOM 148 OE1 GLU A 11 -23.993 -3.115 -32.406 1.00 0.00 O ATOM 149 OE2 GLU A 11 -23.152 -1.268 -33.251 1.00 0.00 O ATOM 0 H GLU A 11 -21.036 -0.739 -28.693 1.00 0.00 H new ATOM 0 HA GLU A 11 -23.838 -0.433 -27.956 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -24.561 -1.806 -29.923 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -24.032 -0.190 -30.347 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.876 -1.034 -31.114 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -22.258 -2.646 -30.544 1.00 0.00 H new ATOM 156 N ILE A 12 -21.823 -2.417 -27.107 1.00 0.00 N ATOM 157 CA ILE A 12 -21.478 -3.663 -26.432 1.00 0.00 C ATOM 158 C ILE A 12 -21.007 -3.402 -25.005 1.00 0.00 C ATOM 159 O ILE A 12 -20.053 -2.657 -24.784 1.00 0.00 O ATOM 160 CB ILE A 12 -20.377 -4.429 -27.190 1.00 0.00 C ATOM 161 CG1 ILE A 12 -20.696 -4.485 -28.686 1.00 0.00 C ATOM 162 CG2 ILE A 12 -20.220 -5.831 -26.622 1.00 0.00 C ATOM 163 CD1 ILE A 12 -21.934 -5.293 -29.011 1.00 0.00 C ATOM 0 H ILE A 12 -21.203 -1.636 -26.893 1.00 0.00 H new ATOM 0 HA ILE A 12 -22.383 -4.270 -26.410 1.00 0.00 H new ATOM 0 HB ILE A 12 -19.434 -3.898 -27.061 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -20.827 -3.469 -29.060 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -19.844 -4.912 -29.215 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -19.439 -6.359 -27.168 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -19.948 -5.768 -25.568 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -21.161 -6.372 -26.722 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -22.099 -5.289 -30.088 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -21.799 -6.319 -28.668 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -22.797 -4.854 -28.510 1.00 0.00 H new ATOM 175 N LYS A 13 -21.683 -4.019 -24.042 1.00 0.00 N ATOM 176 CA LYS A 13 -21.334 -3.852 -22.636 1.00 0.00 C ATOM 177 C LYS A 13 -20.320 -4.904 -22.197 1.00 0.00 C ATOM 178 O LYS A 13 -20.578 -6.105 -22.293 1.00 0.00 O ATOM 179 CB LYS A 13 -22.588 -3.938 -21.762 1.00 0.00 C ATOM 180 CG LYS A 13 -23.283 -5.289 -21.828 1.00 0.00 C ATOM 181 CD LYS A 13 -24.789 -5.147 -21.673 1.00 0.00 C ATOM 182 CE LYS A 13 -25.238 -5.476 -20.258 1.00 0.00 C ATOM 183 NZ LYS A 13 -25.594 -6.915 -20.107 1.00 0.00 N ATOM 0 H LYS A 13 -22.475 -4.639 -24.209 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.883 -2.867 -22.515 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -22.315 -3.729 -20.728 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -23.289 -3.162 -22.070 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.058 -5.770 -22.780 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.895 -5.938 -21.043 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -25.087 -4.129 -21.923 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -25.292 -5.808 -22.378 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.442 -5.224 -19.557 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -26.099 -4.860 -19.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -25.895 -7.097 -19.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -26.371 -7.151 -20.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -24.766 -7.503 -20.330 1.00 0.00 H new ATOM 197 N LYS A 14 -19.169 -4.446 -21.717 1.00 0.00 N ATOM 198 CA LYS A 14 -18.117 -5.348 -21.263 1.00 0.00 C ATOM 199 C LYS A 14 -17.549 -4.891 -19.924 1.00 0.00 C ATOM 200 O LYS A 14 -17.414 -3.692 -19.671 1.00 0.00 O ATOM 201 CB LYS A 14 -16.999 -5.427 -22.305 1.00 0.00 C ATOM 202 CG LYS A 14 -17.368 -6.243 -23.533 1.00 0.00 C ATOM 203 CD LYS A 14 -16.797 -7.650 -23.461 1.00 0.00 C ATOM 204 CE LYS A 14 -17.864 -8.668 -23.087 1.00 0.00 C ATOM 205 NZ LYS A 14 -18.739 -9.004 -24.244 1.00 0.00 N ATOM 0 H LYS A 14 -18.941 -3.455 -21.632 1.00 0.00 H new ATOM 0 HA LYS A 14 -18.553 -6.338 -21.133 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.732 -4.417 -22.617 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.113 -5.862 -21.843 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -18.453 -6.294 -23.624 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -16.996 -5.744 -24.428 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.361 -7.916 -24.424 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.992 -7.680 -22.727 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -17.387 -9.575 -22.717 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.473 -8.274 -22.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -19.453 -9.700 -23.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -19.214 -8.143 -24.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.162 -9.404 -25.011 1.00 0.00 H new ATOM 219 N GLU A 15 -17.216 -5.852 -19.068 1.00 0.00 N ATOM 220 CA GLU A 15 -16.661 -5.549 -17.753 1.00 0.00 C ATOM 221 C GLU A 15 -15.252 -6.126 -17.609 1.00 0.00 C ATOM 222 O GLU A 15 -15.086 -7.319 -17.361 1.00 0.00 O ATOM 223 CB GLU A 15 -17.566 -6.110 -16.655 1.00 0.00 C ATOM 224 CG GLU A 15 -18.687 -5.167 -16.249 1.00 0.00 C ATOM 225 CD GLU A 15 -18.370 -4.393 -14.985 1.00 0.00 C ATOM 226 OE1 GLU A 15 -17.677 -3.358 -15.081 1.00 0.00 O ATOM 227 OE2 GLU A 15 -18.814 -4.821 -13.899 1.00 0.00 O ATOM 0 H GLU A 15 -17.321 -6.848 -19.261 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.603 -4.465 -17.651 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.999 -7.050 -16.998 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.960 -6.339 -15.778 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.879 -4.466 -17.061 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.602 -5.740 -16.100 1.00 0.00 H new ATOM 234 N PRO A 16 -14.215 -5.281 -17.768 1.00 0.00 N ATOM 235 CA PRO A 16 -12.822 -5.713 -17.661 1.00 0.00 C ATOM 236 C PRO A 16 -12.308 -5.721 -16.221 1.00 0.00 C ATOM 237 O PRO A 16 -11.099 -5.754 -15.989 1.00 0.00 O ATOM 238 CB PRO A 16 -12.088 -4.657 -18.482 1.00 0.00 C ATOM 239 CG PRO A 16 -12.883 -3.411 -18.281 1.00 0.00 C ATOM 240 CD PRO A 16 -14.316 -3.840 -18.077 1.00 0.00 C ATOM 0 HA PRO A 16 -12.681 -6.737 -18.006 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -11.060 -4.532 -18.141 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -12.043 -4.934 -19.535 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -12.519 -2.854 -17.417 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -12.795 -2.752 -19.145 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -14.786 -3.289 -17.263 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -14.917 -3.664 -18.969 1.00 0.00 H new ATOM 248 N GLU A 17 -13.224 -5.688 -15.258 1.00 0.00 N ATOM 249 CA GLU A 17 -12.849 -5.691 -13.849 1.00 0.00 C ATOM 250 C GLU A 17 -12.973 -7.089 -13.253 1.00 0.00 C ATOM 251 O GLU A 17 -14.066 -7.528 -12.894 1.00 0.00 O ATOM 252 CB GLU A 17 -13.725 -4.711 -13.066 1.00 0.00 C ATOM 253 CG GLU A 17 -13.162 -3.300 -13.012 1.00 0.00 C ATOM 254 CD GLU A 17 -13.865 -2.355 -13.968 1.00 0.00 C ATOM 255 OE1 GLU A 17 -13.459 -2.292 -15.147 1.00 0.00 O ATOM 256 OE2 GLU A 17 -14.823 -1.679 -13.536 1.00 0.00 O ATOM 0 H GLU A 17 -14.229 -5.659 -15.428 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.808 -5.378 -13.776 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -14.716 -4.681 -13.519 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.851 -5.082 -12.049 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.251 -2.916 -11.996 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.099 -3.328 -13.250 1.00 0.00 H new ATOM 263 N LYS A 18 -11.845 -7.785 -13.147 1.00 0.00 N ATOM 264 CA LYS A 18 -11.826 -9.133 -12.592 1.00 0.00 C ATOM 265 C LYS A 18 -10.871 -9.219 -11.402 1.00 0.00 C ATOM 266 O LYS A 18 -9.875 -8.499 -11.340 1.00 0.00 O ATOM 267 CB LYS A 18 -11.418 -10.145 -13.666 1.00 0.00 C ATOM 268 CG LYS A 18 -12.535 -11.100 -14.058 1.00 0.00 C ATOM 269 CD LYS A 18 -12.029 -12.528 -14.200 1.00 0.00 C ATOM 270 CE LYS A 18 -12.583 -13.429 -13.108 1.00 0.00 C ATOM 271 NZ LYS A 18 -12.522 -14.867 -13.490 1.00 0.00 N ATOM 0 H LYS A 18 -10.932 -7.437 -13.439 1.00 0.00 H new ATOM 0 HA LYS A 18 -12.832 -9.370 -12.245 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.084 -9.606 -14.553 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -10.567 -10.723 -13.305 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -13.324 -11.066 -13.306 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -12.978 -10.775 -15.000 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.314 -12.920 -15.176 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -10.940 -12.534 -14.160 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -12.019 -13.274 -12.188 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -13.616 -13.153 -12.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -12.909 -15.448 -12.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -13.081 -15.021 -14.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.533 -15.138 -13.665 1.00 0.00 H new ATOM 285 N PRO A 19 -11.164 -10.108 -10.435 1.00 0.00 N ATOM 286 CA PRO A 19 -10.328 -10.286 -9.244 1.00 0.00 C ATOM 287 C PRO A 19 -8.968 -10.892 -9.571 1.00 0.00 C ATOM 288 O PRO A 19 -8.820 -11.617 -10.554 1.00 0.00 O ATOM 289 CB PRO A 19 -11.146 -11.245 -8.371 1.00 0.00 C ATOM 290 CG PRO A 19 -12.020 -11.979 -9.329 1.00 0.00 C ATOM 291 CD PRO A 19 -12.335 -11.006 -10.431 1.00 0.00 C ATOM 0 HA PRO A 19 -10.105 -9.335 -8.761 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -10.499 -11.929 -7.821 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -11.736 -10.702 -7.633 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -11.515 -12.862 -9.721 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -12.931 -12.324 -8.840 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.459 -11.510 -11.390 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -13.259 -10.462 -10.235 1.00 0.00 H new ATOM 299 N ILE A 20 -7.975 -10.589 -8.739 1.00 0.00 N ATOM 300 CA ILE A 20 -6.624 -11.101 -8.937 1.00 0.00 C ATOM 301 C ILE A 20 -6.303 -12.206 -7.934 1.00 0.00 C ATOM 302 O ILE A 20 -6.666 -12.119 -6.761 1.00 0.00 O ATOM 303 CB ILE A 20 -5.578 -9.975 -8.801 1.00 0.00 C ATOM 304 CG1 ILE A 20 -5.970 -8.774 -9.668 1.00 0.00 C ATOM 305 CG2 ILE A 20 -4.194 -10.481 -9.181 1.00 0.00 C ATOM 306 CD1 ILE A 20 -5.946 -7.459 -8.922 1.00 0.00 C ATOM 0 H ILE A 20 -8.082 -9.990 -7.920 1.00 0.00 H new ATOM 0 HA ILE A 20 -6.580 -11.510 -9.946 1.00 0.00 H new ATOM 0 HB ILE A 20 -5.550 -9.654 -7.760 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -5.291 -8.713 -10.518 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -6.970 -8.937 -10.070 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -3.470 -9.672 -9.079 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.914 -11.304 -8.523 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -4.205 -10.830 -10.214 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -6.234 -6.653 -9.597 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -6.646 -7.501 -8.087 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.941 -7.274 -8.543 1.00 0.00 H new ATOM 318 N ASP A 21 -5.624 -13.248 -8.404 1.00 0.00 N ATOM 319 CA ASP A 21 -5.257 -14.376 -7.551 1.00 0.00 C ATOM 320 C ASP A 21 -4.225 -13.960 -6.506 1.00 0.00 C ATOM 321 O ASP A 21 -3.142 -13.487 -6.846 1.00 0.00 O ATOM 322 CB ASP A 21 -4.710 -15.525 -8.400 1.00 0.00 C ATOM 323 CG ASP A 21 -5.294 -16.867 -8.000 1.00 0.00 C ATOM 324 OD1 ASP A 21 -6.411 -17.186 -8.460 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.635 -17.595 -7.229 1.00 0.00 O ATOM 0 H ASP A 21 -5.316 -13.336 -9.372 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.154 -14.712 -7.030 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.930 -15.334 -9.450 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.625 -15.560 -8.303 1.00 0.00 H new ATOM 330 N ARG A 22 -4.570 -14.137 -5.234 1.00 0.00 N ATOM 331 CA ARG A 22 -3.682 -13.777 -4.132 1.00 0.00 C ATOM 332 C ARG A 22 -2.340 -14.510 -4.220 1.00 0.00 C ATOM 333 O ARG A 22 -1.353 -14.084 -3.621 1.00 0.00 O ATOM 334 CB ARG A 22 -4.355 -14.093 -2.793 1.00 0.00 C ATOM 335 CG ARG A 22 -4.784 -12.855 -2.021 1.00 0.00 C ATOM 336 CD ARG A 22 -6.262 -12.558 -2.220 1.00 0.00 C ATOM 337 NE ARG A 22 -7.074 -13.042 -1.106 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.310 -12.619 -0.851 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.881 -11.706 -1.628 1.00 0.00 N ATOM 340 NH2 ARG A 22 -8.979 -13.111 0.183 1.00 0.00 N ATOM 0 H ARG A 22 -5.464 -14.530 -4.939 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.485 -12.707 -4.203 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.229 -14.719 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.668 -14.674 -2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.580 -12.998 -0.960 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.193 -11.999 -2.346 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.404 -11.483 -2.331 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -6.603 -13.022 -3.145 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.670 -13.745 -0.487 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -8.372 -11.325 -2.426 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.828 -11.386 -1.427 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.546 -13.813 0.783 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.926 -12.787 0.379 1.00 0.00 H new ATOM 354 N GLU A 23 -2.313 -15.617 -4.954 1.00 0.00 N ATOM 355 CA GLU A 23 -1.092 -16.409 -5.101 1.00 0.00 C ATOM 356 C GLU A 23 -0.399 -16.128 -6.432 1.00 0.00 C ATOM 357 O GLU A 23 0.798 -15.842 -6.470 1.00 0.00 O ATOM 358 CB GLU A 23 -1.410 -17.901 -4.987 1.00 0.00 C ATOM 359 CG GLU A 23 -1.556 -18.383 -3.552 1.00 0.00 C ATOM 360 CD GLU A 23 -2.935 -18.938 -3.258 1.00 0.00 C ATOM 361 OE1 GLU A 23 -3.841 -18.139 -2.936 1.00 0.00 O ATOM 362 OE2 GLU A 23 -3.111 -20.172 -3.349 1.00 0.00 O ATOM 0 H GLU A 23 -3.120 -15.988 -5.456 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.414 -16.121 -4.298 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -2.333 -18.110 -5.528 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.619 -18.471 -5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.810 -19.152 -3.354 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -1.349 -17.556 -2.873 1.00 0.00 H new ATOM 369 N LYS A 24 -1.156 -16.212 -7.522 1.00 0.00 N ATOM 370 CA LYS A 24 -0.613 -15.970 -8.857 1.00 0.00 C ATOM 371 C LYS A 24 -0.714 -14.491 -9.230 1.00 0.00 C ATOM 372 O LYS A 24 -0.852 -14.146 -10.403 1.00 0.00 O ATOM 373 CB LYS A 24 -1.353 -16.822 -9.891 1.00 0.00 C ATOM 374 CG LYS A 24 -0.432 -17.522 -10.875 1.00 0.00 C ATOM 375 CD LYS A 24 -1.114 -17.743 -12.216 1.00 0.00 C ATOM 376 CE LYS A 24 -0.843 -16.595 -13.174 1.00 0.00 C ATOM 377 NZ LYS A 24 0.360 -16.845 -14.015 1.00 0.00 N ATOM 0 H LYS A 24 -2.149 -16.446 -7.508 1.00 0.00 H new ATOM 0 HA LYS A 24 0.440 -16.250 -8.850 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.951 -17.570 -9.371 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.046 -16.187 -10.443 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.470 -16.926 -11.018 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.119 -18.481 -10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.761 -18.676 -12.655 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.189 -17.847 -12.066 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.711 -16.446 -13.817 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.705 -15.674 -12.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.510 -16.039 -14.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.193 -16.962 -13.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.218 -17.710 -14.575 1.00 0.00 H new ATOM 391 N THR A 25 -0.657 -13.627 -8.222 1.00 0.00 N ATOM 392 CA THR A 25 -0.754 -12.188 -8.434 1.00 0.00 C ATOM 393 C THR A 25 0.496 -11.625 -9.101 1.00 0.00 C ATOM 394 O THR A 25 1.576 -12.213 -9.025 1.00 0.00 O ATOM 395 CB THR A 25 -0.971 -11.480 -7.099 1.00 0.00 C ATOM 396 OG1 THR A 25 -1.129 -10.089 -7.296 1.00 0.00 O ATOM 397 CG2 THR A 25 0.172 -11.681 -6.127 1.00 0.00 C ATOM 0 H THR A 25 -0.544 -13.900 -7.246 1.00 0.00 H new ATOM 0 HA THR A 25 -1.601 -12.013 -9.097 1.00 0.00 H new ATOM 0 HB THR A 25 -1.871 -11.924 -6.673 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.486 -9.681 -6.479 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.043 -11.153 -5.198 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.291 -12.745 -5.921 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.092 -11.290 -6.562 1.00 0.00 H new ATOM 405 N SER A 26 0.338 -10.469 -9.738 1.00 0.00 N ATOM 406 CA SER A 26 1.446 -9.794 -10.405 1.00 0.00 C ATOM 407 C SER A 26 1.877 -8.572 -9.594 1.00 0.00 C ATOM 408 O SER A 26 1.055 -7.709 -9.283 1.00 0.00 O ATOM 409 CB SER A 26 1.041 -9.372 -11.817 1.00 0.00 C ATOM 410 OG SER A 26 1.108 -10.465 -12.716 1.00 0.00 O ATOM 0 H SER A 26 -0.553 -9.977 -9.806 1.00 0.00 H new ATOM 0 HA SER A 26 2.285 -10.486 -10.477 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.028 -8.970 -11.803 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.696 -8.572 -12.163 1.00 0.00 H new ATOM 0 HG SER A 26 0.842 -10.169 -13.612 1.00 0.00 H new ATOM 416 N PRO A 27 3.167 -8.479 -9.225 1.00 0.00 N ATOM 417 CA PRO A 27 3.679 -7.353 -8.434 1.00 0.00 C ATOM 418 C PRO A 27 3.692 -6.040 -9.207 1.00 0.00 C ATOM 419 O PRO A 27 3.913 -6.016 -10.418 1.00 0.00 O ATOM 420 CB PRO A 27 5.105 -7.778 -8.084 1.00 0.00 C ATOM 421 CG PRO A 27 5.488 -8.748 -9.149 1.00 0.00 C ATOM 422 CD PRO A 27 4.222 -9.463 -9.533 1.00 0.00 C ATOM 0 HA PRO A 27 3.049 -7.158 -7.566 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.780 -6.922 -8.068 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.149 -8.237 -7.097 1.00 0.00 H new ATOM 0 HG2 PRO A 27 5.922 -8.234 -10.007 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.238 -9.450 -8.786 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.220 -9.738 -10.588 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.092 -10.383 -8.964 1.00 0.00 H new ATOM 430 N LEU A 28 3.463 -4.945 -8.488 1.00 0.00 N ATOM 431 CA LEU A 28 3.455 -3.613 -9.081 1.00 0.00 C ATOM 432 C LEU A 28 4.119 -2.612 -8.142 1.00 0.00 C ATOM 433 O LEU A 28 3.967 -2.697 -6.920 1.00 0.00 O ATOM 434 CB LEU A 28 2.024 -3.172 -9.404 1.00 0.00 C ATOM 435 CG LEU A 28 1.076 -3.103 -8.203 1.00 0.00 C ATOM 436 CD1 LEU A 28 0.860 -1.660 -7.773 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.253 -3.767 -8.535 1.00 0.00 C ATOM 0 H LEU A 28 3.279 -4.956 -7.485 1.00 0.00 H new ATOM 0 HA LEU A 28 4.021 -3.648 -10.012 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.061 -2.189 -9.874 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.605 -3.861 -10.138 1.00 0.00 H new ATOM 0 HG LEU A 28 1.533 -3.642 -7.373 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.184 -1.632 -6.919 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.816 -1.217 -7.494 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.425 -1.096 -8.598 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.915 -3.709 -7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.714 -3.256 -9.380 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.083 -4.812 -8.792 1.00 0.00 H new ATOM 449 N LEU A 29 4.868 -1.677 -8.714 1.00 0.00 N ATOM 450 CA LEU A 29 5.570 -0.669 -7.928 1.00 0.00 C ATOM 451 C LEU A 29 4.675 0.532 -7.636 1.00 0.00 C ATOM 452 O LEU A 29 4.118 1.140 -8.549 1.00 0.00 O ATOM 453 CB LEU A 29 6.834 -0.215 -8.668 1.00 0.00 C ATOM 454 CG LEU A 29 7.513 1.033 -8.100 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.765 0.872 -6.609 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.814 1.312 -8.836 1.00 0.00 C ATOM 0 H LEU A 29 5.005 -1.596 -9.721 1.00 0.00 H new ATOM 0 HA LEU A 29 5.850 -1.119 -6.975 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.553 -1.034 -8.661 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.577 -0.026 -9.710 1.00 0.00 H new ATOM 0 HG LEU A 29 6.847 1.884 -8.244 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.248 1.769 -6.223 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.816 0.721 -6.094 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.411 0.011 -6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.284 2.203 -8.419 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.486 0.461 -8.723 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.606 1.472 -9.894 1.00 0.00 H new ATOM 468 N LEU A 30 4.547 0.874 -6.355 1.00 0.00 N ATOM 469 CA LEU A 30 3.725 2.011 -5.950 1.00 0.00 C ATOM 470 C LEU A 30 4.474 2.906 -4.959 1.00 0.00 C ATOM 471 O LEU A 30 5.455 2.483 -4.343 1.00 0.00 O ATOM 472 CB LEU A 30 2.399 1.526 -5.356 1.00 0.00 C ATOM 473 CG LEU A 30 2.421 1.201 -3.861 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.237 2.468 -3.043 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.344 0.181 -3.522 1.00 0.00 C ATOM 0 H LEU A 30 5.000 0.383 -5.584 1.00 0.00 H new ATOM 0 HA LEU A 30 3.507 2.608 -6.836 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.642 2.290 -5.532 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.084 0.635 -5.898 1.00 0.00 H new ATOM 0 HG LEU A 30 3.390 0.769 -3.613 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.255 2.221 -1.981 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.044 3.166 -3.267 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.280 2.927 -3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.374 -0.039 -2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.366 0.585 -3.782 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.520 -0.735 -4.086 1.00 0.00 H new ATOM 487 N ARG A 31 4.007 4.150 -4.828 1.00 0.00 N ATOM 488 CA ARG A 31 4.630 5.124 -3.933 1.00 0.00 C ATOM 489 C ARG A 31 3.980 5.121 -2.552 1.00 0.00 C ATOM 490 O ARG A 31 2.753 5.077 -2.427 1.00 0.00 O ATOM 491 CB ARG A 31 4.550 6.529 -4.546 1.00 0.00 C ATOM 492 CG ARG A 31 3.205 6.848 -5.183 1.00 0.00 C ATOM 493 CD ARG A 31 3.214 6.579 -6.681 1.00 0.00 C ATOM 494 NE ARG A 31 4.312 7.268 -7.359 1.00 0.00 N ATOM 495 CZ ARG A 31 4.163 8.361 -8.106 1.00 0.00 C ATOM 496 NH1 ARG A 31 2.967 8.914 -8.267 1.00 0.00 N ATOM 497 NH2 ARG A 31 5.219 8.907 -8.693 1.00 0.00 N ATOM 0 H ARG A 31 3.196 4.506 -5.334 1.00 0.00 H new ATOM 0 HA ARG A 31 5.675 4.838 -3.810 1.00 0.00 H new ATOM 0 HB2 ARG A 31 4.757 7.266 -3.770 1.00 0.00 H new ATOM 0 HB3 ARG A 31 5.331 6.631 -5.299 1.00 0.00 H new ATOM 0 HG2 ARG A 31 2.427 6.249 -4.710 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.956 7.894 -5.002 1.00 0.00 H new ATOM 0 HD2 ARG A 31 3.298 5.506 -6.855 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.265 6.899 -7.112 1.00 0.00 H new ATOM 0 HE ARG A 31 5.252 6.887 -7.253 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.150 8.502 -7.816 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.865 9.751 -8.841 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.142 8.490 -8.572 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.108 9.744 -9.266 1.00 0.00 H new ATOM 511 N VAL A 32 4.817 5.170 -1.515 1.00 0.00 N ATOM 512 CA VAL A 32 4.336 5.168 -0.132 1.00 0.00 C ATOM 513 C VAL A 32 5.074 6.197 0.721 1.00 0.00 C ATOM 514 O VAL A 32 6.294 6.316 0.639 1.00 0.00 O ATOM 515 CB VAL A 32 4.507 3.787 0.527 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.286 2.920 0.278 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.771 3.103 0.026 1.00 0.00 C ATOM 0 H VAL A 32 5.832 5.212 -1.606 1.00 0.00 H new ATOM 0 HA VAL A 32 3.277 5.422 -0.180 1.00 0.00 H new ATOM 0 HB VAL A 32 4.606 3.931 1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.427 1.949 0.752 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.404 3.404 0.698 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.149 2.784 -0.795 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.872 2.129 0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.710 2.972 -1.054 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.638 3.718 0.268 1.00 0.00 H new ATOM 527 N PHE A 33 4.328 6.922 1.549 1.00 0.00 N ATOM 528 CA PHE A 33 4.911 7.925 2.431 1.00 0.00 C ATOM 529 C PHE A 33 4.710 7.511 3.880 1.00 0.00 C ATOM 530 O PHE A 33 3.598 7.563 4.402 1.00 0.00 O ATOM 531 CB PHE A 33 4.278 9.291 2.166 1.00 0.00 C ATOM 532 CG PHE A 33 4.218 9.633 0.706 1.00 0.00 C ATOM 533 CD1 PHE A 33 3.379 8.933 -0.144 1.00 0.00 C ATOM 534 CD2 PHE A 33 5.006 10.645 0.184 1.00 0.00 C ATOM 535 CE1 PHE A 33 3.326 9.234 -1.490 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.959 10.951 -1.162 1.00 0.00 C ATOM 537 CZ PHE A 33 4.118 10.245 -2.001 1.00 0.00 C ATOM 0 H PHE A 33 3.315 6.832 1.627 1.00 0.00 H new ATOM 0 HA PHE A 33 5.980 8.001 2.234 1.00 0.00 H new ATOM 0 HB2 PHE A 33 3.269 9.305 2.579 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.848 10.058 2.691 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.759 8.142 0.251 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.664 11.201 0.836 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.667 8.681 -2.143 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.579 11.741 -1.558 1.00 0.00 H new ATOM 0 HZ PHE A 33 4.080 10.483 -3.054 1.00 0.00 H new ATOM 547 N THR A 34 5.789 7.068 4.513 1.00 0.00 N ATOM 548 CA THR A 34 5.726 6.605 5.892 1.00 0.00 C ATOM 549 C THR A 34 6.382 7.585 6.859 1.00 0.00 C ATOM 550 O THR A 34 7.557 7.924 6.722 1.00 0.00 O ATOM 551 CB THR A 34 6.400 5.236 6.013 1.00 0.00 C ATOM 552 OG1 THR A 34 7.217 4.977 4.885 1.00 0.00 O ATOM 553 CG2 THR A 34 5.419 4.093 6.135 1.00 0.00 C ATOM 0 H THR A 34 6.717 7.020 4.093 1.00 0.00 H new ATOM 0 HA THR A 34 4.673 6.529 6.162 1.00 0.00 H new ATOM 0 HB THR A 34 6.990 5.288 6.928 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.151 5.177 5.105 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.964 3.153 6.217 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.804 4.235 7.024 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.780 4.066 5.252 1.00 0.00 H new ATOM 561 N THR A 35 5.616 8.005 7.859 1.00 0.00 N ATOM 562 CA THR A 35 6.125 8.910 8.885 1.00 0.00 C ATOM 563 C THR A 35 6.482 8.095 10.131 1.00 0.00 C ATOM 564 O THR A 35 6.050 6.949 10.252 1.00 0.00 O ATOM 565 CB THR A 35 5.103 10.013 9.220 1.00 0.00 C ATOM 566 OG1 THR A 35 5.217 10.416 10.578 1.00 0.00 O ATOM 567 CG2 THR A 35 3.660 9.615 8.971 1.00 0.00 C ATOM 0 H THR A 35 4.640 7.734 7.982 1.00 0.00 H new ATOM 0 HA THR A 35 7.018 9.410 8.509 1.00 0.00 H new ATOM 0 HB THR A 35 5.347 10.832 8.543 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.560 11.118 10.767 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.003 10.445 9.231 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.528 9.364 7.918 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.410 8.749 9.584 1.00 0.00 H new ATOM 575 N ASN A 36 7.268 8.663 11.047 1.00 0.00 N ATOM 576 CA ASN A 36 7.663 7.936 12.249 1.00 0.00 C ATOM 577 C ASN A 36 6.883 8.411 13.470 1.00 0.00 C ATOM 578 O ASN A 36 7.380 8.344 14.597 1.00 0.00 O ATOM 579 CB ASN A 36 9.164 8.096 12.491 1.00 0.00 C ATOM 580 CG ASN A 36 9.659 7.241 13.641 1.00 0.00 C ATOM 581 OD1 ASN A 36 9.289 5.965 13.637 1.00 0.00 O flip ATOM 582 ND2 ASN A 36 10.370 7.721 14.527 1.00 0.00 N flip ATOM 0 H ASN A 36 7.638 9.611 10.980 1.00 0.00 H new ATOM 0 HA ASN A 36 7.433 6.882 12.093 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.706 7.829 11.584 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.386 9.143 12.698 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.632 8.706 14.493 1.00 0.00 H new ATOM 0 HD22 ASN A 36 10.696 7.133 15.294 1.00 0.00 H new ATOM 589 N ASN A 37 5.665 8.883 13.248 1.00 0.00 N ATOM 590 CA ASN A 37 4.825 9.360 14.343 1.00 0.00 C ATOM 591 C ASN A 37 3.366 8.961 14.141 1.00 0.00 C ATOM 592 O ASN A 37 2.481 9.399 14.877 1.00 0.00 O ATOM 593 CB ASN A 37 4.934 10.879 14.472 1.00 0.00 C ATOM 594 CG ASN A 37 4.856 11.343 15.913 1.00 0.00 C ATOM 595 OD1 ASN A 37 5.845 12.120 16.339 1.00 0.00 O flip ATOM 596 ND2 ASN A 37 3.918 11.008 16.634 1.00 0.00 N flip ATOM 0 H ASN A 37 5.236 8.947 12.325 1.00 0.00 H new ATOM 0 HA ASN A 37 5.181 8.893 15.261 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.876 11.211 14.037 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.135 11.348 13.898 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.179 10.409 16.265 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.879 11.329 17.601 1.00 0.00 H new ATOM 603 N GLY A 38 3.114 8.127 13.136 1.00 0.00 N ATOM 604 CA GLY A 38 1.749 7.688 12.860 1.00 0.00 C ATOM 605 C GLY A 38 0.782 8.851 12.790 1.00 0.00 C ATOM 606 O GLY A 38 -0.200 8.896 13.531 1.00 0.00 O ATOM 0 H GLY A 38 3.823 7.747 12.509 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.728 7.142 11.917 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.427 6.995 13.637 1.00 0.00 H new ATOM 610 N ARG A 39 1.070 9.805 11.911 1.00 0.00 N ATOM 611 CA ARG A 39 0.222 10.983 11.768 1.00 0.00 C ATOM 612 C ARG A 39 -0.271 11.165 10.339 1.00 0.00 C ATOM 613 O ARG A 39 0.519 11.274 9.401 1.00 0.00 O ATOM 614 CB ARG A 39 0.981 12.232 12.209 1.00 0.00 C ATOM 615 CG ARG A 39 1.333 12.243 13.686 1.00 0.00 C ATOM 616 CD ARG A 39 0.141 12.642 14.541 1.00 0.00 C ATOM 617 NE ARG A 39 0.085 11.887 15.790 1.00 0.00 N ATOM 618 CZ ARG A 39 -1.005 11.783 16.547 1.00 0.00 C ATOM 619 NH1 ARG A 39 -2.130 12.386 16.186 1.00 0.00 N ATOM 620 NH2 ARG A 39 -0.968 11.076 17.667 1.00 0.00 N ATOM 0 H ARG A 39 1.879 9.786 11.290 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.650 10.833 12.405 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.898 12.314 11.625 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.379 13.112 11.982 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.682 11.255 13.985 1.00 0.00 H new ATOM 0 HG3 ARG A 39 2.155 12.937 13.860 1.00 0.00 H new ATOM 0 HD2 ARG A 39 0.195 13.708 14.764 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.779 12.481 13.979 1.00 0.00 H new ATOM 0 HE ARG A 39 0.932 11.411 16.101 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -2.162 12.932 15.325 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -2.963 12.303 16.769 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -0.105 10.612 17.949 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -1.803 10.996 18.247 1.00 0.00 H new ATOM 634 N HIS A 40 -1.588 11.212 10.193 1.00 0.00 N ATOM 635 CA HIS A 40 -2.222 11.400 8.893 1.00 0.00 C ATOM 636 C HIS A 40 -2.464 12.885 8.607 1.00 0.00 C ATOM 637 O HIS A 40 -3.259 13.227 7.731 1.00 0.00 O ATOM 638 CB HIS A 40 -3.544 10.631 8.827 1.00 0.00 C ATOM 639 CG HIS A 40 -4.429 10.859 10.013 1.00 0.00 C ATOM 640 ND1 HIS A 40 -4.779 9.857 10.892 1.00 0.00 N ATOM 641 CD2 HIS A 40 -5.039 11.981 10.463 1.00 0.00 C ATOM 642 CE1 HIS A 40 -5.566 10.352 11.832 1.00 0.00 C ATOM 643 NE2 HIS A 40 -5.737 11.639 11.593 1.00 0.00 N ATOM 0 H HIS A 40 -2.245 11.121 10.968 1.00 0.00 H new ATOM 0 HA HIS A 40 -1.546 11.010 8.132 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -4.079 10.922 7.923 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -3.331 9.565 8.742 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.986 12.962 10.015 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -5.995 9.799 12.654 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -6.298 12.277 12.158 1.00 0.00 H new ATOM 651 N HIS A 41 -1.800 13.761 9.373 1.00 0.00 N ATOM 652 CA HIS A 41 -1.963 15.215 9.229 1.00 0.00 C ATOM 653 C HIS A 41 -2.273 15.623 7.789 1.00 0.00 C ATOM 654 O HIS A 41 -3.423 15.905 7.452 1.00 0.00 O ATOM 655 CB HIS A 41 -0.700 15.945 9.694 1.00 0.00 C ATOM 656 CG HIS A 41 -0.335 15.697 11.122 1.00 0.00 C ATOM 657 ND1 HIS A 41 -1.060 15.807 12.261 1.00 0.00 N flip ATOM 658 CD2 HIS A 41 0.924 15.294 11.508 1.00 0.00 C flip ATOM 659 CE1 HIS A 41 -0.229 15.473 13.304 1.00 0.00 C flip ATOM 660 NE2 HIS A 41 0.962 15.166 12.822 1.00 0.00 N flip ATOM 0 H HIS A 41 -1.142 13.487 10.102 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.810 15.498 9.854 1.00 0.00 H new ATOM 0 HB2 HIS A 41 0.134 15.643 9.061 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -0.839 17.016 9.548 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -2.039 16.085 12.332 1.00 0.00 H new ATOM 0 HD2 HIS A 41 1.752 15.111 10.840 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -0.505 15.463 14.348 1.00 0.00 H new ATOM 668 N ARG A 42 -1.247 15.663 6.944 1.00 0.00 N ATOM 669 CA ARG A 42 -1.432 16.047 5.551 1.00 0.00 C ATOM 670 C ARG A 42 -0.152 15.842 4.748 1.00 0.00 C ATOM 671 O ARG A 42 0.952 15.966 5.277 1.00 0.00 O ATOM 672 CB ARG A 42 -1.876 17.510 5.463 1.00 0.00 C ATOM 673 CG ARG A 42 -2.974 17.753 4.443 1.00 0.00 C ATOM 674 CD ARG A 42 -3.540 19.160 4.559 1.00 0.00 C ATOM 675 NE ARG A 42 -4.982 19.191 4.333 1.00 0.00 N ATOM 676 CZ ARG A 42 -5.885 18.852 5.250 1.00 0.00 C ATOM 677 NH1 ARG A 42 -5.498 18.454 6.456 1.00 0.00 N ATOM 678 NH2 ARG A 42 -7.178 18.908 4.959 1.00 0.00 N ATOM 0 H ARG A 42 -0.286 15.436 7.198 1.00 0.00 H new ATOM 0 HA ARG A 42 -2.206 15.409 5.125 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -2.224 17.835 6.443 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -1.014 18.128 5.210 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -2.579 17.600 3.439 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -3.773 17.025 4.586 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -3.320 19.559 5.549 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -3.046 19.810 3.837 1.00 0.00 H new ATOM 0 HE ARG A 42 -5.317 19.490 3.417 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -4.505 18.407 6.683 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -6.194 18.195 7.155 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.480 19.211 4.033 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -7.871 18.648 5.661 1.00 0.00 H new ATOM 692 N MET A 43 -0.313 15.531 3.467 1.00 0.00 N ATOM 693 CA MET A 43 0.824 15.310 2.577 1.00 0.00 C ATOM 694 C MET A 43 1.838 16.447 2.685 1.00 0.00 C ATOM 695 O MET A 43 3.029 16.254 2.440 1.00 0.00 O ATOM 696 CB MET A 43 0.351 15.161 1.128 1.00 0.00 C ATOM 697 CG MET A 43 -0.220 16.438 0.525 1.00 0.00 C ATOM 698 SD MET A 43 -1.927 16.763 1.018 1.00 0.00 S ATOM 699 CE MET A 43 -2.641 15.122 0.939 1.00 0.00 C ATOM 0 H MET A 43 -1.223 15.426 3.019 1.00 0.00 H new ATOM 0 HA MET A 43 1.314 14.386 2.885 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.189 14.826 0.516 1.00 0.00 H new ATOM 0 HB3 MET A 43 -0.408 14.380 1.084 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.403 17.282 0.822 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.170 16.372 -0.562 1.00 0.00 H new ATOM 0 HE1 MET A 43 -3.644 15.182 0.517 1.00 0.00 H new ATOM 0 HE2 MET A 43 -2.020 14.485 0.309 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.694 14.699 1.942 1.00 0.00 H new ATOM 709 N ASP A 44 1.360 17.633 3.057 1.00 0.00 N ATOM 710 CA ASP A 44 2.231 18.796 3.202 1.00 0.00 C ATOM 711 C ASP A 44 3.427 18.469 4.093 1.00 0.00 C ATOM 712 O ASP A 44 4.503 19.047 3.945 1.00 0.00 O ATOM 713 CB ASP A 44 1.447 19.975 3.787 1.00 0.00 C ATOM 714 CG ASP A 44 1.573 21.228 2.942 1.00 0.00 C ATOM 715 OD1 ASP A 44 2.717 21.627 2.636 1.00 0.00 O ATOM 716 OD2 ASP A 44 0.527 21.811 2.586 1.00 0.00 O ATOM 0 H ASP A 44 0.377 17.813 3.263 1.00 0.00 H new ATOM 0 HA ASP A 44 2.601 19.071 2.214 1.00 0.00 H new ATOM 0 HB2 ASP A 44 0.395 19.702 3.873 1.00 0.00 H new ATOM 0 HB3 ASP A 44 1.806 20.182 4.795 1.00 0.00 H new ATOM 721 N GLU A 45 3.228 17.530 5.014 1.00 0.00 N ATOM 722 CA GLU A 45 4.287 17.117 5.927 1.00 0.00 C ATOM 723 C GLU A 45 5.378 16.361 5.174 1.00 0.00 C ATOM 724 O GLU A 45 6.558 16.450 5.517 1.00 0.00 O ATOM 725 CB GLU A 45 3.710 16.238 7.040 1.00 0.00 C ATOM 726 CG GLU A 45 4.098 16.693 8.436 1.00 0.00 C ATOM 727 CD GLU A 45 3.136 17.718 9.002 1.00 0.00 C ATOM 728 OE1 GLU A 45 3.220 18.898 8.599 1.00 0.00 O ATOM 729 OE2 GLU A 45 2.297 17.344 9.849 1.00 0.00 O ATOM 0 H GLU A 45 2.343 17.041 5.147 1.00 0.00 H new ATOM 0 HA GLU A 45 4.728 18.009 6.373 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.623 16.230 6.958 1.00 0.00 H new ATOM 0 HB3 GLU A 45 4.048 15.212 6.894 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.134 15.829 9.099 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.102 17.117 8.410 1.00 0.00 H new ATOM 736 N PHE A 46 4.975 15.622 4.147 1.00 0.00 N ATOM 737 CA PHE A 46 5.916 14.850 3.340 1.00 0.00 C ATOM 738 C PHE A 46 5.575 14.962 1.857 1.00 0.00 C ATOM 739 O PHE A 46 4.508 14.529 1.421 1.00 0.00 O ATOM 740 CB PHE A 46 5.920 13.377 3.767 1.00 0.00 C ATOM 741 CG PHE A 46 4.700 12.955 4.539 1.00 0.00 C ATOM 742 CD1 PHE A 46 3.433 13.070 3.985 1.00 0.00 C ATOM 743 CD2 PHE A 46 4.821 12.442 5.821 1.00 0.00 C ATOM 744 CE1 PHE A 46 2.314 12.681 4.694 1.00 0.00 C ATOM 745 CE2 PHE A 46 3.703 12.051 6.535 1.00 0.00 C ATOM 746 CZ PHE A 46 2.449 12.172 5.971 1.00 0.00 C ATOM 0 H PHE A 46 4.002 15.540 3.852 1.00 0.00 H new ATOM 0 HA PHE A 46 6.912 15.263 3.502 1.00 0.00 H new ATOM 0 HB2 PHE A 46 6.007 12.753 2.878 1.00 0.00 H new ATOM 0 HB3 PHE A 46 6.804 13.189 4.376 1.00 0.00 H new ATOM 0 HD1 PHE A 46 3.321 13.468 2.987 1.00 0.00 H new ATOM 0 HD2 PHE A 46 5.800 12.347 6.267 1.00 0.00 H new ATOM 0 HE1 PHE A 46 1.334 12.775 4.250 1.00 0.00 H new ATOM 0 HE2 PHE A 46 3.811 11.652 7.533 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.574 11.869 6.528 1.00 0.00 H new ATOM 756 N SER A 47 6.488 15.544 1.087 1.00 0.00 N ATOM 757 CA SER A 47 6.285 15.714 -0.347 1.00 0.00 C ATOM 758 C SER A 47 7.262 14.852 -1.140 1.00 0.00 C ATOM 759 O SER A 47 8.166 14.239 -0.574 1.00 0.00 O ATOM 760 CB SER A 47 6.448 17.182 -0.738 1.00 0.00 C ATOM 761 OG SER A 47 7.680 17.703 -0.265 1.00 0.00 O ATOM 0 H SER A 47 7.377 15.906 1.432 1.00 0.00 H new ATOM 0 HA SER A 47 5.270 15.395 -0.585 1.00 0.00 H new ATOM 0 HB2 SER A 47 6.401 17.280 -1.823 1.00 0.00 H new ATOM 0 HB3 SER A 47 5.622 17.764 -0.329 1.00 0.00 H new ATOM 0 HG SER A 47 7.985 18.416 -0.864 1.00 0.00 H new ATOM 767 N ARG A 48 7.072 14.811 -2.454 1.00 0.00 N ATOM 768 CA ARG A 48 7.934 14.024 -3.327 1.00 0.00 C ATOM 769 C ARG A 48 9.214 14.785 -3.659 1.00 0.00 C ATOM 770 O ARG A 48 9.192 15.759 -4.412 1.00 0.00 O ATOM 771 CB ARG A 48 7.196 13.659 -4.616 1.00 0.00 C ATOM 772 CG ARG A 48 7.784 12.457 -5.334 1.00 0.00 C ATOM 773 CD ARG A 48 7.016 12.138 -6.607 1.00 0.00 C ATOM 774 NE ARG A 48 7.619 11.033 -7.348 1.00 0.00 N ATOM 775 CZ ARG A 48 7.384 10.788 -8.634 1.00 0.00 C ATOM 776 NH1 ARG A 48 6.560 11.564 -9.326 1.00 0.00 N ATOM 777 NH2 ARG A 48 7.978 9.762 -9.232 1.00 0.00 N ATOM 0 H ARG A 48 6.328 15.314 -2.938 1.00 0.00 H new ATOM 0 HA ARG A 48 8.203 13.109 -2.799 1.00 0.00 H new ATOM 0 HB2 ARG A 48 6.151 13.456 -4.381 1.00 0.00 H new ATOM 0 HB3 ARG A 48 7.211 14.517 -5.289 1.00 0.00 H new ATOM 0 HG2 ARG A 48 8.828 12.652 -5.577 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.767 11.592 -4.671 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.986 11.886 -6.355 1.00 0.00 H new ATOM 0 HD3 ARG A 48 6.982 13.024 -7.241 1.00 0.00 H new ATOM 0 HE ARG A 48 8.258 10.413 -6.850 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.102 12.354 -8.872 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.384 11.370 -10.312 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.614 9.163 -8.705 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.799 9.573 -10.218 1.00 0.00 H new ATOM 791 N GLY A 49 10.326 14.332 -3.092 1.00 0.00 N ATOM 792 CA GLY A 49 11.601 14.980 -3.336 1.00 0.00 C ATOM 793 C GLY A 49 12.076 15.804 -2.153 1.00 0.00 C ATOM 794 O GLY A 49 13.072 16.520 -2.251 1.00 0.00 O ATOM 0 H GLY A 49 10.367 13.527 -2.467 1.00 0.00 H new ATOM 0 HA2 GLY A 49 12.350 14.223 -3.570 1.00 0.00 H new ATOM 0 HA3 GLY A 49 11.515 15.624 -4.211 1.00 0.00 H new ATOM 798 N ASN A 50 11.365 15.703 -1.034 1.00 0.00 N ATOM 799 CA ASN A 50 11.726 16.445 0.168 1.00 0.00 C ATOM 800 C ASN A 50 12.831 15.735 0.940 1.00 0.00 C ATOM 801 O ASN A 50 13.694 16.377 1.538 1.00 0.00 O ATOM 802 CB ASN A 50 10.501 16.632 1.066 1.00 0.00 C ATOM 803 CG ASN A 50 10.525 17.954 1.809 1.00 0.00 C ATOM 804 OD1 ASN A 50 11.361 18.171 2.685 1.00 0.00 O ATOM 805 ND2 ASN A 50 9.605 18.845 1.460 1.00 0.00 N ATOM 0 H ASN A 50 10.537 15.116 -0.935 1.00 0.00 H new ATOM 0 HA ASN A 50 12.096 17.423 -0.141 1.00 0.00 H new ATOM 0 HB2 ASN A 50 9.597 16.576 0.459 1.00 0.00 H new ATOM 0 HB3 ASN A 50 10.453 15.815 1.786 1.00 0.00 H new ATOM 0 HD21 ASN A 50 9.572 19.753 1.924 1.00 0.00 H new ATOM 0 HD22 ASN A 50 8.931 18.622 0.728 1.00 0.00 H new ATOM 812 N VAL A 51 12.802 14.407 0.923 1.00 0.00 N ATOM 813 CA VAL A 51 13.804 13.616 1.624 1.00 0.00 C ATOM 814 C VAL A 51 13.616 12.121 1.354 1.00 0.00 C ATOM 815 O VAL A 51 12.492 11.621 1.359 1.00 0.00 O ATOM 816 CB VAL A 51 13.752 13.885 3.146 1.00 0.00 C ATOM 817 CG1 VAL A 51 12.476 13.320 3.757 1.00 0.00 C ATOM 818 CG2 VAL A 51 14.981 13.316 3.835 1.00 0.00 C ATOM 0 H VAL A 51 12.097 13.857 0.432 1.00 0.00 H new ATOM 0 HA VAL A 51 14.781 13.916 1.246 1.00 0.00 H new ATOM 0 HB VAL A 51 13.746 14.964 3.298 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.465 13.523 4.828 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.610 13.789 3.290 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.439 12.243 3.591 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.924 13.516 4.905 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.025 12.240 3.669 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.877 13.783 3.426 1.00 0.00 H new ATOM 828 N PRO A 52 14.718 11.385 1.111 1.00 0.00 N ATOM 829 CA PRO A 52 14.666 9.940 0.837 1.00 0.00 C ATOM 830 C PRO A 52 14.011 9.140 1.964 1.00 0.00 C ATOM 831 O PRO A 52 13.691 7.966 1.786 1.00 0.00 O ATOM 832 CB PRO A 52 16.143 9.542 0.684 1.00 0.00 C ATOM 833 CG PRO A 52 16.915 10.657 1.304 1.00 0.00 C ATOM 834 CD PRO A 52 16.099 11.895 1.080 1.00 0.00 C ATOM 0 HA PRO A 52 14.059 9.726 -0.043 1.00 0.00 H new ATOM 0 HB2 PRO A 52 16.349 8.595 1.183 1.00 0.00 H new ATOM 0 HB3 PRO A 52 16.410 9.414 -0.365 1.00 0.00 H new ATOM 0 HG2 PRO A 52 17.072 10.479 2.368 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.901 10.751 0.848 1.00 0.00 H new ATOM 0 HD2 PRO A 52 16.273 12.640 1.857 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.334 12.368 0.126 1.00 0.00 H new ATOM 842 N SER A 53 13.837 9.770 3.124 1.00 0.00 N ATOM 843 CA SER A 53 13.229 9.104 4.271 1.00 0.00 C ATOM 844 C SER A 53 11.739 9.421 4.356 1.00 0.00 C ATOM 845 O SER A 53 11.079 9.109 5.345 1.00 0.00 O ATOM 846 CB SER A 53 13.929 9.521 5.563 1.00 0.00 C ATOM 847 OG SER A 53 14.984 8.631 5.882 1.00 0.00 O ATOM 0 H SER A 53 14.108 10.739 3.293 1.00 0.00 H new ATOM 0 HA SER A 53 13.346 8.028 4.139 1.00 0.00 H new ATOM 0 HB2 SER A 53 14.322 10.532 5.457 1.00 0.00 H new ATOM 0 HB3 SER A 53 13.208 9.543 6.380 1.00 0.00 H new ATOM 0 HG SER A 53 15.417 8.921 6.712 1.00 0.00 H new ATOM 853 N SER A 54 11.218 10.055 3.316 1.00 0.00 N ATOM 854 CA SER A 54 9.800 10.425 3.275 1.00 0.00 C ATOM 855 C SER A 54 8.972 9.363 2.561 1.00 0.00 C ATOM 856 O SER A 54 8.059 8.775 3.144 1.00 0.00 O ATOM 857 CB SER A 54 9.615 11.776 2.583 1.00 0.00 C ATOM 858 OG SER A 54 10.015 11.714 1.225 1.00 0.00 O ATOM 0 H SER A 54 11.749 10.326 2.488 1.00 0.00 H new ATOM 0 HA SER A 54 9.451 10.501 4.305 1.00 0.00 H new ATOM 0 HB2 SER A 54 8.570 12.079 2.644 1.00 0.00 H new ATOM 0 HB3 SER A 54 10.198 12.537 3.102 1.00 0.00 H new ATOM 0 HG SER A 54 10.942 12.022 1.143 1.00 0.00 H new ATOM 864 N GLU A 55 9.288 9.127 1.294 1.00 0.00 N ATOM 865 CA GLU A 55 8.566 8.140 0.500 1.00 0.00 C ATOM 866 C GLU A 55 9.464 6.963 0.122 1.00 0.00 C ATOM 867 O GLU A 55 10.669 7.125 -0.071 1.00 0.00 O ATOM 868 CB GLU A 55 8.001 8.790 -0.763 1.00 0.00 C ATOM 869 CG GLU A 55 9.058 9.451 -1.633 1.00 0.00 C ATOM 870 CD GLU A 55 8.717 9.392 -3.109 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.560 9.702 -3.464 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.607 9.037 -3.911 1.00 0.00 O ATOM 0 H GLU A 55 10.038 9.605 0.794 1.00 0.00 H new ATOM 0 HA GLU A 55 7.746 7.758 1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.481 8.033 -1.350 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.260 9.536 -0.477 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.173 10.492 -1.331 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.018 8.963 -1.466 1.00 0.00 H new ATOM 879 N LEU A 56 8.861 5.783 0.008 1.00 0.00 N ATOM 880 CA LEU A 56 9.598 4.577 -0.358 1.00 0.00 C ATOM 881 C LEU A 56 8.888 3.827 -1.480 1.00 0.00 C ATOM 882 O LEU A 56 7.811 4.225 -1.923 1.00 0.00 O ATOM 883 CB LEU A 56 9.789 3.643 0.848 1.00 0.00 C ATOM 884 CG LEU A 56 8.931 3.943 2.084 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.797 2.934 2.211 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.791 3.927 3.337 1.00 0.00 C ATOM 0 H LEU A 56 7.864 5.636 0.164 1.00 0.00 H new ATOM 0 HA LEU A 56 10.581 4.895 -0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.581 2.623 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.838 3.676 1.143 1.00 0.00 H new ATOM 0 HG LEU A 56 8.496 4.936 1.967 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.201 3.165 3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.165 2.983 1.324 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.212 1.930 2.306 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.170 4.141 4.207 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.249 2.945 3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.571 4.684 3.253 1.00 0.00 H new ATOM 898 N GLN A 57 9.501 2.738 -1.930 1.00 0.00 N ATOM 899 CA GLN A 57 8.936 1.926 -3.000 1.00 0.00 C ATOM 900 C GLN A 57 8.543 0.544 -2.483 1.00 0.00 C ATOM 901 O GLN A 57 9.285 -0.076 -1.721 1.00 0.00 O ATOM 902 CB GLN A 57 9.944 1.787 -4.142 1.00 0.00 C ATOM 903 CG GLN A 57 10.380 3.118 -4.735 1.00 0.00 C ATOM 904 CD GLN A 57 9.263 3.818 -5.484 1.00 0.00 C ATOM 905 OE1 GLN A 57 9.115 3.656 -6.697 1.00 0.00 O ATOM 906 NE2 GLN A 57 8.470 4.603 -4.767 1.00 0.00 N ATOM 0 H GLN A 57 10.392 2.397 -1.569 1.00 0.00 H new ATOM 0 HA GLN A 57 8.040 2.424 -3.370 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.823 1.256 -3.777 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.506 1.174 -4.930 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.739 3.767 -3.936 1.00 0.00 H new ATOM 0 HG3 GLN A 57 11.218 2.953 -5.412 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.628 4.709 -3.765 1.00 0.00 H new ATOM 0 HE22 GLN A 57 7.702 5.101 -5.218 1.00 0.00 H new ATOM 915 N ILE A 58 7.376 0.065 -2.902 1.00 0.00 N ATOM 916 CA ILE A 58 6.891 -1.248 -2.476 1.00 0.00 C ATOM 917 C ILE A 58 6.349 -2.051 -3.652 1.00 0.00 C ATOM 918 O ILE A 58 5.420 -1.620 -4.334 1.00 0.00 O ATOM 919 CB ILE A 58 5.777 -1.141 -1.415 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.006 0.171 -1.553 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.365 -1.270 -0.021 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.546 0.050 -1.176 1.00 0.00 C ATOM 0 H ILE A 58 6.749 0.563 -3.534 1.00 0.00 H new ATOM 0 HA ILE A 58 7.753 -1.756 -2.043 1.00 0.00 H new ATOM 0 HB ILE A 58 5.075 -1.959 -1.577 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.475 0.928 -0.924 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.080 0.521 -2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.568 -1.193 0.719 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.859 -2.237 0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.091 -0.473 0.143 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.058 1.017 -1.297 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.063 -0.683 -1.822 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.464 -0.271 -0.138 1.00 0.00 H new ATOM 934 N TYR A 59 6.914 -3.233 -3.862 1.00 0.00 N ATOM 935 CA TYR A 59 6.462 -4.108 -4.932 1.00 0.00 C ATOM 936 C TYR A 59 5.364 -5.018 -4.400 1.00 0.00 C ATOM 937 O TYR A 59 5.613 -6.168 -4.035 1.00 0.00 O ATOM 938 CB TYR A 59 7.625 -4.939 -5.477 1.00 0.00 C ATOM 939 CG TYR A 59 8.410 -4.240 -6.565 1.00 0.00 C ATOM 940 CD1 TYR A 59 9.159 -3.104 -6.286 1.00 0.00 C ATOM 941 CD2 TYR A 59 8.399 -4.716 -7.872 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.877 -2.462 -7.277 1.00 0.00 C ATOM 943 CE2 TYR A 59 9.114 -4.079 -8.868 1.00 0.00 C ATOM 944 CZ TYR A 59 9.851 -2.952 -8.565 1.00 0.00 C ATOM 945 OH TYR A 59 10.565 -2.315 -9.555 1.00 0.00 O ATOM 0 H TYR A 59 7.684 -3.606 -3.306 1.00 0.00 H new ATOM 0 HA TYR A 59 6.070 -3.503 -5.750 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.299 -5.188 -4.657 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.237 -5.880 -5.867 1.00 0.00 H new ATOM 0 HD1 TYR A 59 9.181 -2.716 -5.278 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.823 -5.597 -8.112 1.00 0.00 H new ATOM 0 HE1 TYR A 59 10.456 -1.581 -7.043 1.00 0.00 H new ATOM 0 HE2 TYR A 59 9.096 -4.461 -9.878 1.00 0.00 H new ATOM 0 HH TYR A 59 10.441 -2.788 -10.404 1.00 0.00 H new ATOM 955 N THR A 60 4.148 -4.487 -4.343 1.00 0.00 N ATOM 956 CA THR A 60 3.008 -5.237 -3.837 1.00 0.00 C ATOM 957 C THR A 60 2.015 -5.543 -4.950 1.00 0.00 C ATOM 958 O THR A 60 2.242 -5.199 -6.110 1.00 0.00 O ATOM 959 CB THR A 60 2.311 -4.452 -2.722 1.00 0.00 C ATOM 960 OG1 THR A 60 1.357 -5.262 -2.060 1.00 0.00 O ATOM 961 CG2 THR A 60 1.597 -3.212 -3.213 1.00 0.00 C ATOM 0 H THR A 60 3.927 -3.537 -4.642 1.00 0.00 H new ATOM 0 HA THR A 60 3.378 -6.181 -3.437 1.00 0.00 H new ATOM 0 HB THR A 60 3.109 -4.146 -2.046 1.00 0.00 H new ATOM 0 HG1 THR A 60 1.716 -6.167 -1.950 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.126 -2.706 -2.370 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.315 -2.541 -3.684 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.834 -3.495 -3.939 1.00 0.00 H new ATOM 969 N TRP A 61 0.904 -6.178 -4.594 1.00 0.00 N ATOM 970 CA TRP A 61 -0.122 -6.507 -5.576 1.00 0.00 C ATOM 971 C TRP A 61 -1.501 -6.023 -5.139 1.00 0.00 C ATOM 972 O TRP A 61 -1.995 -6.373 -4.072 1.00 0.00 O ATOM 973 CB TRP A 61 -0.151 -8.005 -5.880 1.00 0.00 C ATOM 974 CG TRP A 61 -0.274 -8.889 -4.678 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.364 -9.628 -4.317 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.731 -9.142 -3.694 1.00 0.00 C ATOM 977 NE1 TRP A 61 -1.095 -10.331 -3.168 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.184 -10.046 -2.762 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.042 -8.692 -3.506 1.00 0.00 C ATOM 980 CZ2 TRP A 61 0.903 -10.510 -1.665 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.754 -9.152 -2.415 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.184 -10.054 -1.507 1.00 0.00 C ATOM 0 H TRP A 61 0.692 -6.473 -3.641 1.00 0.00 H new ATOM 0 HA TRP A 61 0.142 -5.981 -6.493 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -0.986 -8.209 -6.550 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.760 -8.270 -6.416 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.300 -9.656 -4.856 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.741 -10.962 -2.694 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.490 -7.997 -4.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.466 -11.205 -0.963 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.767 -8.811 -2.260 1.00 0.00 H new ATOM 0 HH2 TRP A 61 2.767 -10.397 -0.665 1.00 0.00 H new ATOM 993 N MET A 62 -2.095 -5.198 -5.996 1.00 0.00 N ATOM 994 CA MET A 62 -3.421 -4.607 -5.760 1.00 0.00 C ATOM 995 C MET A 62 -4.340 -5.509 -4.923 1.00 0.00 C ATOM 996 O MET A 62 -5.115 -5.016 -4.102 1.00 0.00 O ATOM 997 CB MET A 62 -4.100 -4.300 -7.098 1.00 0.00 C ATOM 998 CG MET A 62 -4.924 -3.024 -7.085 1.00 0.00 C ATOM 999 SD MET A 62 -4.308 -1.787 -8.246 1.00 0.00 S ATOM 1000 CE MET A 62 -2.956 -1.086 -7.304 1.00 0.00 C ATOM 0 H MET A 62 -1.673 -4.915 -6.880 1.00 0.00 H new ATOM 0 HA MET A 62 -3.258 -3.691 -5.192 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.338 -4.222 -7.873 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.745 -5.136 -7.368 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.959 -3.262 -7.329 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.922 -2.605 -6.079 1.00 0.00 H new ATOM 0 HE1 MET A 62 -2.221 -0.657 -7.986 1.00 0.00 H new ATOM 0 HE2 MET A 62 -3.338 -0.306 -6.645 1.00 0.00 H new ATOM 0 HE3 MET A 62 -2.485 -1.867 -6.707 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.254 -6.818 -5.134 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.086 -7.766 -4.396 1.00 0.00 C ATOM 1012 C ASP A 63 -4.342 -8.348 -3.193 1.00 0.00 C ATOM 1013 O ASP A 63 -4.590 -9.483 -2.789 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.550 -8.891 -5.317 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.830 -9.544 -4.836 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.960 -9.765 -3.613 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.704 -9.832 -5.679 1.00 0.00 O ATOM 0 H ASP A 63 -3.619 -7.247 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.955 -7.224 -4.024 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.703 -8.495 -6.321 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.766 -9.645 -5.388 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.427 -7.565 -2.630 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.645 -8.002 -1.479 1.00 0.00 C ATOM 1024 C ALA A 64 -3.326 -7.620 -0.172 1.00 0.00 C ATOM 1025 O ALA A 64 -3.914 -6.544 -0.058 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.248 -7.397 -1.529 1.00 0.00 C ATOM 0 H ALA A 64 -3.209 -6.623 -2.953 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.569 -9.089 -1.521 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.675 -7.732 -0.664 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.746 -7.716 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.322 -6.310 -1.517 1.00 0.00 H new ATOM 1032 N THR A 65 -3.234 -8.501 0.818 1.00 0.00 N ATOM 1033 CA THR A 65 -3.832 -8.241 2.119 1.00 0.00 C ATOM 1034 C THR A 65 -2.994 -7.227 2.890 1.00 0.00 C ATOM 1035 O THR A 65 -1.768 -7.200 2.764 1.00 0.00 O ATOM 1036 CB THR A 65 -3.963 -9.537 2.923 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.113 -10.541 2.401 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.373 -10.088 2.938 1.00 0.00 C ATOM 0 H THR A 65 -2.753 -9.397 0.744 1.00 0.00 H new ATOM 0 HA THR A 65 -4.830 -7.830 1.963 1.00 0.00 H new ATOM 0 HB THR A 65 -3.680 -9.276 3.943 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.211 -11.360 2.930 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.398 -11.007 3.524 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.045 -9.355 3.383 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.692 -10.300 1.917 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.660 -6.392 3.687 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.975 -5.371 4.474 1.00 0.00 C ATOM 1048 C LEU A 66 -1.724 -5.940 5.133 1.00 0.00 C ATOM 1049 O LEU A 66 -0.742 -5.227 5.346 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.914 -4.791 5.534 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.752 -3.600 5.066 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -5.706 -3.151 6.163 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -3.849 -2.451 4.635 1.00 0.00 C ATOM 0 H LEU A 66 -4.673 -6.404 3.804 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.673 -4.571 3.798 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.586 -5.579 5.874 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.321 -4.484 6.396 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.345 -3.913 4.207 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.293 -2.303 5.810 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.374 -3.972 6.422 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.135 -2.856 7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.461 -1.612 4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.230 -2.140 5.476 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.210 -2.779 3.815 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.761 -7.231 5.449 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.622 -7.890 6.075 1.00 0.00 C ATOM 1067 C LYS A 67 0.606 -7.815 5.177 1.00 0.00 C ATOM 1068 O LYS A 67 1.690 -7.429 5.615 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.945 -9.351 6.409 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.778 -10.064 5.354 1.00 0.00 C ATOM 1071 CD LYS A 67 -1.284 -11.483 5.118 1.00 0.00 C ATOM 1072 CE LYS A 67 -2.056 -12.489 5.958 1.00 0.00 C ATOM 1073 NZ LYS A 67 -2.476 -13.674 5.161 1.00 0.00 N ATOM 0 H LYS A 67 -2.564 -7.838 5.283 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.406 -7.366 7.006 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -0.011 -9.895 6.547 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.477 -9.385 7.360 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.821 -10.089 5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.740 -9.504 4.419 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.386 -11.734 4.062 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -0.223 -11.545 5.359 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.437 -12.815 6.794 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -2.937 -12.007 6.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.999 -14.335 5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -3.088 -13.367 4.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.635 -14.150 4.776 1.00 0.00 H new ATOM 1087 N GLU A 68 0.436 -8.169 3.908 1.00 0.00 N ATOM 1088 CA GLU A 68 1.536 -8.128 2.948 1.00 0.00 C ATOM 1089 C GLU A 68 2.132 -6.727 2.877 1.00 0.00 C ATOM 1090 O GLU A 68 3.343 -6.557 2.731 1.00 0.00 O ATOM 1091 CB GLU A 68 1.045 -8.558 1.566 1.00 0.00 C ATOM 1092 CG GLU A 68 0.583 -10.003 1.515 1.00 0.00 C ATOM 1093 CD GLU A 68 1.739 -10.985 1.505 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.729 -10.742 2.224 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.652 -11.996 0.776 1.00 0.00 O ATOM 0 H GLU A 68 -0.452 -8.487 3.519 1.00 0.00 H new ATOM 0 HA GLU A 68 2.310 -8.819 3.281 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.223 -7.910 1.263 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.847 -8.415 0.842 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.055 -10.207 2.375 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.026 -10.155 0.624 1.00 0.00 H new ATOM 1102 N LEU A 69 1.268 -5.726 2.990 1.00 0.00 N ATOM 1103 CA LEU A 69 1.702 -4.336 2.950 1.00 0.00 C ATOM 1104 C LEU A 69 2.424 -3.963 4.243 1.00 0.00 C ATOM 1105 O LEU A 69 3.262 -3.061 4.262 1.00 0.00 O ATOM 1106 CB LEU A 69 0.509 -3.404 2.718 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.274 -3.658 1.425 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.672 -3.851 0.249 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.184 -4.865 1.585 1.00 0.00 C ATOM 0 H LEU A 69 0.263 -5.851 3.110 1.00 0.00 H new ATOM 0 HA LEU A 69 2.397 -4.219 2.119 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.174 -3.497 3.562 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.868 -2.375 2.711 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.892 -2.784 1.221 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.094 -4.030 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.280 -2.956 0.121 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.320 -4.706 0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.733 -5.032 0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.584 -5.745 1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.889 -4.684 2.397 1.00 0.00 H new ATOM 1121 N THR A 70 2.100 -4.673 5.320 1.00 0.00 N ATOM 1122 CA THR A 70 2.723 -4.431 6.615 1.00 0.00 C ATOM 1123 C THR A 70 4.195 -4.817 6.573 1.00 0.00 C ATOM 1124 O THR A 70 5.029 -4.190 7.222 1.00 0.00 O ATOM 1125 CB THR A 70 2.005 -5.226 7.706 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.635 -4.874 7.765 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.591 -5.021 9.087 1.00 0.00 C ATOM 0 H THR A 70 1.408 -5.422 5.320 1.00 0.00 H new ATOM 0 HA THR A 70 2.644 -3.368 6.844 1.00 0.00 H new ATOM 0 HB THR A 70 2.134 -6.272 7.428 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.535 -4.028 8.249 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.033 -5.615 9.811 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.635 -5.334 9.089 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.527 -3.967 9.356 1.00 0.00 H new ATOM 1135 N SER A 71 4.506 -5.853 5.799 1.00 0.00 N ATOM 1136 CA SER A 71 5.879 -6.326 5.666 1.00 0.00 C ATOM 1137 C SER A 71 6.635 -5.525 4.610 1.00 0.00 C ATOM 1138 O SER A 71 7.798 -5.176 4.801 1.00 0.00 O ATOM 1139 CB SER A 71 5.896 -7.813 5.305 1.00 0.00 C ATOM 1140 OG SER A 71 6.882 -8.509 6.049 1.00 0.00 O ATOM 0 H SER A 71 3.824 -6.381 5.254 1.00 0.00 H new ATOM 0 HA SER A 71 6.378 -6.186 6.625 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.916 -8.248 5.499 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.091 -7.929 4.239 1.00 0.00 H new ATOM 0 HG SER A 71 6.871 -9.457 5.801 1.00 0.00 H new ATOM 1146 N LEU A 72 5.970 -5.239 3.497 1.00 0.00 N ATOM 1147 CA LEU A 72 6.580 -4.479 2.408 1.00 0.00 C ATOM 1148 C LEU A 72 7.142 -3.146 2.905 1.00 0.00 C ATOM 1149 O LEU A 72 8.286 -2.799 2.604 1.00 0.00 O ATOM 1150 CB LEU A 72 5.553 -4.248 1.300 1.00 0.00 C ATOM 1151 CG LEU A 72 5.191 -5.496 0.493 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.759 -5.413 -0.014 1.00 0.00 C ATOM 1153 CD2 LEU A 72 6.161 -5.677 -0.665 1.00 0.00 C ATOM 0 H LEU A 72 5.006 -5.522 3.323 1.00 0.00 H new ATOM 0 HA LEU A 72 7.413 -5.059 2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.644 -3.843 1.745 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.939 -3.490 0.618 1.00 0.00 H new ATOM 0 HG LEU A 72 5.268 -6.364 1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.523 -6.311 -0.585 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.077 -5.332 0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.650 -4.537 -0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.891 -6.569 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.114 -4.806 -1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.174 -5.786 -0.277 1.00 0.00 H new ATOM 1165 N VAL A 73 6.342 -2.405 3.672 1.00 0.00 N ATOM 1166 CA VAL A 73 6.776 -1.118 4.210 1.00 0.00 C ATOM 1167 C VAL A 73 7.777 -1.305 5.348 1.00 0.00 C ATOM 1168 O VAL A 73 8.807 -0.638 5.398 1.00 0.00 O ATOM 1169 CB VAL A 73 5.580 -0.288 4.721 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.046 1.040 5.308 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.579 -0.052 3.600 1.00 0.00 C ATOM 0 H VAL A 73 5.393 -2.674 3.933 1.00 0.00 H new ATOM 0 HA VAL A 73 7.257 -0.581 3.393 1.00 0.00 H new ATOM 0 HB VAL A 73 5.090 -0.854 5.513 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.183 1.605 5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.722 0.852 6.142 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.567 1.614 4.541 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.742 0.535 3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.064 0.489 2.787 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.213 -1.010 3.231 1.00 0.00 H new ATOM 1181 N LYS A 74 7.463 -2.211 6.268 1.00 0.00 N ATOM 1182 CA LYS A 74 8.332 -2.475 7.409 1.00 0.00 C ATOM 1183 C LYS A 74 9.706 -2.977 6.956 1.00 0.00 C ATOM 1184 O LYS A 74 10.717 -2.704 7.603 1.00 0.00 O ATOM 1185 CB LYS A 74 7.654 -3.487 8.347 1.00 0.00 C ATOM 1186 CG LYS A 74 8.608 -4.357 9.154 1.00 0.00 C ATOM 1187 CD LYS A 74 8.683 -5.764 8.582 1.00 0.00 C ATOM 1188 CE LYS A 74 8.602 -6.817 9.676 1.00 0.00 C ATOM 1189 NZ LYS A 74 9.561 -7.933 9.443 1.00 0.00 N ATOM 0 H LYS A 74 6.613 -2.775 6.246 1.00 0.00 H new ATOM 0 HA LYS A 74 8.494 -1.543 7.951 1.00 0.00 H new ATOM 0 HB2 LYS A 74 7.009 -2.944 9.038 1.00 0.00 H new ATOM 0 HB3 LYS A 74 7.010 -4.135 7.753 1.00 0.00 H new ATOM 0 HG2 LYS A 74 9.601 -3.908 9.155 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.276 -4.400 10.191 1.00 0.00 H new ATOM 0 HD2 LYS A 74 7.870 -5.913 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 74 9.615 -5.884 8.029 1.00 0.00 H new ATOM 0 HE2 LYS A 74 8.810 -6.355 10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 74 7.588 -7.214 9.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.475 -8.630 10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 9.347 -8.390 8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 10.531 -7.559 9.422 1.00 0.00 H new ATOM 1203 N GLU A 75 9.739 -3.708 5.846 1.00 0.00 N ATOM 1204 CA GLU A 75 10.991 -4.241 5.319 1.00 0.00 C ATOM 1205 C GLU A 75 11.818 -3.136 4.670 1.00 0.00 C ATOM 1206 O GLU A 75 13.048 -3.154 4.715 1.00 0.00 O ATOM 1207 CB GLU A 75 10.719 -5.359 4.311 1.00 0.00 C ATOM 1208 CG GLU A 75 11.895 -6.304 4.119 1.00 0.00 C ATOM 1209 CD GLU A 75 11.490 -7.614 3.471 1.00 0.00 C ATOM 1210 OE1 GLU A 75 10.766 -8.399 4.121 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.900 -7.858 2.318 1.00 0.00 O ATOM 0 H GLU A 75 8.914 -3.945 5.295 1.00 0.00 H new ATOM 0 HA GLU A 75 11.559 -4.654 6.152 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.853 -5.932 4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.459 -4.915 3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.651 -5.817 3.503 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.354 -6.508 5.086 1.00 0.00 H new ATOM 1218 N VAL A 76 11.130 -2.167 4.073 1.00 0.00 N ATOM 1219 CA VAL A 76 11.796 -1.043 3.421 1.00 0.00 C ATOM 1220 C VAL A 76 12.152 0.034 4.444 1.00 0.00 C ATOM 1221 O VAL A 76 13.124 0.769 4.275 1.00 0.00 O ATOM 1222 CB VAL A 76 10.903 -0.428 2.322 1.00 0.00 C ATOM 1223 CG1 VAL A 76 9.558 -0.029 2.889 1.00 0.00 C ATOM 1224 CG2 VAL A 76 11.576 0.766 1.666 1.00 0.00 C ATOM 0 H VAL A 76 10.111 -2.137 4.027 1.00 0.00 H new ATOM 0 HA VAL A 76 12.708 -1.423 2.961 1.00 0.00 H new ATOM 0 HB VAL A 76 10.748 -1.189 1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.943 0.402 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.060 -0.908 3.297 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.701 0.707 3.680 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.921 1.176 0.897 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.775 1.530 2.418 1.00 0.00 H new ATOM 0 HG23 VAL A 76 12.515 0.450 1.212 1.00 0.00 H new ATOM 1234 N TYR A 77 11.355 0.117 5.503 1.00 0.00 N ATOM 1235 CA TYR A 77 11.574 1.098 6.559 1.00 0.00 C ATOM 1236 C TYR A 77 12.250 0.450 7.769 1.00 0.00 C ATOM 1237 O TYR A 77 11.697 -0.464 8.379 1.00 0.00 O ATOM 1238 CB TYR A 77 10.242 1.725 6.971 1.00 0.00 C ATOM 1239 CG TYR A 77 10.329 3.206 7.253 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.317 3.718 8.085 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.423 4.093 6.686 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.399 5.073 8.345 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.500 5.449 6.941 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.489 5.934 7.770 1.00 0.00 C ATOM 1245 OH TYR A 77 10.568 7.284 8.026 1.00 0.00 O ATOM 0 H TYR A 77 10.547 -0.487 5.653 1.00 0.00 H new ATOM 0 HA TYR A 77 12.233 1.878 6.177 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.512 1.557 6.180 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.871 1.216 7.861 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.033 3.046 8.536 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.647 3.717 6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.172 5.455 8.995 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.788 6.126 6.493 1.00 0.00 H new ATOM 0 HH TYR A 77 10.722 7.768 7.188 1.00 0.00 H new ATOM 1255 N PRO A 78 13.464 0.909 8.125 1.00 0.00 N ATOM 1256 CA PRO A 78 14.214 0.359 9.261 1.00 0.00 C ATOM 1257 C PRO A 78 13.519 0.589 10.600 1.00 0.00 C ATOM 1258 O PRO A 78 13.434 -0.319 11.428 1.00 0.00 O ATOM 1259 CB PRO A 78 15.550 1.115 9.221 1.00 0.00 C ATOM 1260 CG PRO A 78 15.623 1.729 7.864 1.00 0.00 C ATOM 1261 CD PRO A 78 14.205 1.986 7.450 1.00 0.00 C ATOM 0 HA PRO A 78 14.316 -0.723 9.178 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.592 1.877 9.999 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.388 0.439 9.391 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.197 2.655 7.885 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.120 1.062 7.160 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.864 2.971 7.768 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.086 1.941 6.367 1.00 0.00 H new ATOM 1269 N GLU A 79 13.035 1.807 10.813 1.00 0.00 N ATOM 1270 CA GLU A 79 12.360 2.157 12.060 1.00 0.00 C ATOM 1271 C GLU A 79 11.021 1.433 12.206 1.00 0.00 C ATOM 1272 O GLU A 79 10.412 1.458 13.275 1.00 0.00 O ATOM 1273 CB GLU A 79 12.142 3.669 12.136 1.00 0.00 C ATOM 1274 CG GLU A 79 12.306 4.238 13.536 1.00 0.00 C ATOM 1275 CD GLU A 79 13.420 5.263 13.624 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.333 6.297 12.930 1.00 0.00 O ATOM 1277 OE2 GLU A 79 14.383 5.030 14.387 1.00 0.00 O ATOM 0 H GLU A 79 13.097 2.570 10.139 1.00 0.00 H new ATOM 0 HA GLU A 79 13.003 1.838 12.880 1.00 0.00 H new ATOM 0 HB2 GLU A 79 12.847 4.163 11.467 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.141 3.902 11.773 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.369 4.698 13.849 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.510 3.425 14.233 1.00 0.00 H new ATOM 1284 N ALA A 80 10.561 0.796 11.132 1.00 0.00 N ATOM 1285 CA ALA A 80 9.292 0.079 11.161 1.00 0.00 C ATOM 1286 C ALA A 80 9.471 -1.364 11.624 1.00 0.00 C ATOM 1287 O ALA A 80 8.602 -1.924 12.292 1.00 0.00 O ATOM 1288 CB ALA A 80 8.640 0.113 9.788 1.00 0.00 C ATOM 0 H ALA A 80 11.046 0.762 10.236 1.00 0.00 H new ATOM 0 HA ALA A 80 8.643 0.580 11.880 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.693 -0.426 9.822 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.459 1.148 9.497 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.300 -0.359 9.060 1.00 0.00 H new ATOM 1294 N ARG A 81 10.601 -1.963 11.260 1.00 0.00 N ATOM 1295 CA ARG A 81 10.892 -3.346 11.632 1.00 0.00 C ATOM 1296 C ARG A 81 10.794 -3.556 13.143 1.00 0.00 C ATOM 1297 O ARG A 81 10.610 -4.683 13.606 1.00 0.00 O ATOM 1298 CB ARG A 81 12.285 -3.744 11.137 1.00 0.00 C ATOM 1299 CG ARG A 81 12.257 -4.713 9.966 1.00 0.00 C ATOM 1300 CD ARG A 81 13.638 -5.277 9.670 1.00 0.00 C ATOM 1301 NE ARG A 81 13.598 -6.711 9.394 1.00 0.00 N ATOM 1302 CZ ARG A 81 13.648 -7.653 10.334 1.00 0.00 C ATOM 1303 NH1 ARG A 81 13.738 -7.320 11.615 1.00 0.00 N ATOM 1304 NH2 ARG A 81 13.606 -8.934 9.990 1.00 0.00 N ATOM 0 H ARG A 81 11.331 -1.513 10.708 1.00 0.00 H new ATOM 0 HA ARG A 81 10.144 -3.981 11.157 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.828 -2.846 10.843 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.839 -4.196 11.960 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.570 -5.530 10.186 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.874 -4.204 9.081 1.00 0.00 H new ATOM 0 HD2 ARG A 81 14.066 -4.755 8.814 1.00 0.00 H new ATOM 0 HD3 ARG A 81 14.295 -5.090 10.519 1.00 0.00 H new ATOM 0 HE ARG A 81 13.527 -7.009 8.421 1.00 0.00 H new ATOM 0 HH11 ARG A 81 13.769 -6.337 11.885 1.00 0.00 H new ATOM 0 HH12 ARG A 81 13.776 -8.047 12.329 1.00 0.00 H new ATOM 0 HH21 ARG A 81 13.536 -9.196 9.007 1.00 0.00 H new ATOM 0 HH22 ARG A 81 13.644 -9.657 10.709 1.00 0.00 H new ATOM 1318 N LYS A 82 10.918 -2.475 13.907 1.00 0.00 N ATOM 1319 CA LYS A 82 10.842 -2.557 15.363 1.00 0.00 C ATOM 1320 C LYS A 82 9.528 -3.191 15.810 1.00 0.00 C ATOM 1321 O LYS A 82 8.459 -2.843 15.309 1.00 0.00 O ATOM 1322 CB LYS A 82 10.988 -1.164 15.980 1.00 0.00 C ATOM 1323 CG LYS A 82 12.424 -0.797 16.320 1.00 0.00 C ATOM 1324 CD LYS A 82 12.517 0.599 16.916 1.00 0.00 C ATOM 1325 CE LYS A 82 13.156 1.579 15.944 1.00 0.00 C ATOM 1326 NZ LYS A 82 14.616 1.736 16.193 1.00 0.00 N ATOM 0 H LYS A 82 11.071 -1.534 13.544 1.00 0.00 H new ATOM 0 HA LYS A 82 11.660 -3.189 15.708 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.587 -0.425 15.287 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.384 -1.112 16.886 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.829 -1.523 17.026 1.00 0.00 H new ATOM 0 HG3 LYS A 82 13.037 -0.851 15.420 1.00 0.00 H new ATOM 0 HD2 LYS A 82 11.520 0.949 17.184 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.101 0.565 17.836 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.997 1.233 14.923 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.666 2.549 16.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 15.014 2.412 15.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 14.767 2.090 17.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 15.088 0.816 16.084 1.00 0.00 H new ATOM 1340 N LYS A 83 9.616 -4.121 16.757 1.00 0.00 N ATOM 1341 CA LYS A 83 8.434 -4.801 17.273 1.00 0.00 C ATOM 1342 C LYS A 83 7.580 -3.850 18.105 1.00 0.00 C ATOM 1343 O LYS A 83 8.102 -2.997 18.821 1.00 0.00 O ATOM 1344 CB LYS A 83 8.842 -6.010 18.118 1.00 0.00 C ATOM 1345 CG LYS A 83 9.642 -7.047 17.346 1.00 0.00 C ATOM 1346 CD LYS A 83 8.761 -8.194 16.878 1.00 0.00 C ATOM 1347 CE LYS A 83 9.575 -9.450 16.611 1.00 0.00 C ATOM 1348 NZ LYS A 83 10.487 -9.285 15.447 1.00 0.00 N ATOM 0 H LYS A 83 10.494 -4.420 17.182 1.00 0.00 H new ATOM 0 HA LYS A 83 7.843 -5.144 16.424 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.432 -5.667 18.968 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.945 -6.481 18.521 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.116 -6.576 16.485 1.00 0.00 H new ATOM 0 HG3 LYS A 83 10.442 -7.435 17.977 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.004 -8.404 17.633 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.233 -7.902 15.970 1.00 0.00 H new ATOM 0 HE2 LYS A 83 10.159 -9.699 17.497 1.00 0.00 H new ATOM 0 HE3 LYS A 83 8.901 -10.287 16.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.023 -10.164 15.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.929 -9.073 14.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.147 -8.503 15.632 1.00 0.00 H new ATOM 1362 N GLY A 84 6.263 -3.999 17.999 1.00 0.00 N ATOM 1363 CA GLY A 84 5.360 -3.141 18.743 1.00 0.00 C ATOM 1364 C GLY A 84 4.941 -1.912 17.956 1.00 0.00 C ATOM 1365 O GLY A 84 4.122 -1.120 18.421 1.00 0.00 O ATOM 0 H GLY A 84 5.806 -4.697 17.412 1.00 0.00 H new ATOM 0 HA2 GLY A 84 4.473 -3.709 19.022 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.842 -2.828 19.669 1.00 0.00 H new ATOM 1369 N THR A 85 5.506 -1.750 16.761 1.00 0.00 N ATOM 1370 CA THR A 85 5.188 -0.610 15.911 1.00 0.00 C ATOM 1371 C THR A 85 3.791 -0.741 15.312 1.00 0.00 C ATOM 1372 O THR A 85 3.413 -1.805 14.822 1.00 0.00 O ATOM 1373 CB THR A 85 6.225 -0.484 14.795 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.538 -0.518 15.326 1.00 0.00 O ATOM 1375 CG2 THR A 85 6.086 0.790 13.993 1.00 0.00 C ATOM 0 H THR A 85 6.187 -2.396 16.361 1.00 0.00 H new ATOM 0 HA THR A 85 5.210 0.288 16.528 1.00 0.00 H new ATOM 0 HB THR A 85 6.045 -1.332 14.134 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.968 -1.364 15.082 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.852 0.817 13.218 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.100 0.823 13.530 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.206 1.650 14.652 1.00 0.00 H new ATOM 1383 N HIS A 86 3.030 0.347 15.354 1.00 0.00 N ATOM 1384 CA HIS A 86 1.673 0.361 14.815 1.00 0.00 C ATOM 1385 C HIS A 86 1.532 1.428 13.734 1.00 0.00 C ATOM 1386 O HIS A 86 1.633 2.623 14.014 1.00 0.00 O ATOM 1387 CB HIS A 86 0.664 0.614 15.938 1.00 0.00 C ATOM 1388 CG HIS A 86 -0.619 -0.138 15.776 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.017 -1.329 16.285 1.00 0.00 N flip ATOM 1390 CD2 HIS A 86 -1.674 0.325 15.017 1.00 0.00 C flip ATOM 1391 CE1 HIS A 86 -2.293 -1.559 15.829 1.00 0.00 C flip ATOM 1392 NE2 HIS A 86 -2.665 -0.547 15.068 1.00 0.00 N flip ATOM 0 H HIS A 86 3.330 1.234 15.757 1.00 0.00 H new ATOM 0 HA HIS A 86 1.471 -0.612 14.367 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.118 0.340 16.890 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.446 1.681 15.985 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.688 1.255 14.467 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -2.894 -2.427 16.057 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.566 -0.454 14.598 1.00 0.00 H new ATOM 1400 N PHE A 87 1.304 0.994 12.496 1.00 0.00 N ATOM 1401 CA PHE A 87 1.160 1.921 11.375 1.00 0.00 C ATOM 1402 C PHE A 87 -0.251 1.881 10.800 1.00 0.00 C ATOM 1403 O PHE A 87 -0.963 0.886 10.941 1.00 0.00 O ATOM 1404 CB PHE A 87 2.178 1.610 10.265 1.00 0.00 C ATOM 1405 CG PHE A 87 2.904 0.305 10.436 1.00 0.00 C ATOM 1406 CD1 PHE A 87 3.732 0.094 11.525 1.00 0.00 C ATOM 1407 CD2 PHE A 87 2.757 -0.710 9.505 1.00 0.00 C ATOM 1408 CE1 PHE A 87 4.400 -1.105 11.683 1.00 0.00 C ATOM 1409 CE2 PHE A 87 3.422 -1.911 9.658 1.00 0.00 C ATOM 1410 CZ PHE A 87 4.245 -2.109 10.748 1.00 0.00 C ATOM 0 H PHE A 87 1.215 0.010 12.244 1.00 0.00 H new ATOM 0 HA PHE A 87 1.352 2.922 11.761 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.660 1.601 9.306 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.910 2.416 10.224 1.00 0.00 H new ATOM 0 HD1 PHE A 87 3.857 0.876 12.260 1.00 0.00 H new ATOM 0 HD2 PHE A 87 2.115 -0.561 8.649 1.00 0.00 H new ATOM 0 HE1 PHE A 87 5.043 -1.257 12.537 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.298 -2.695 8.925 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.766 -3.047 10.869 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.645 2.968 10.140 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.967 3.055 9.532 1.00 0.00 C ATOM 1422 C ASN A 88 -1.865 3.404 8.051 1.00 0.00 C ATOM 1423 O ASN A 88 -0.965 4.132 7.633 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.829 4.091 10.260 1.00 0.00 C ATOM 1425 CG ASN A 88 -2.085 5.384 10.529 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -1.278 5.466 11.455 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -2.356 6.401 9.721 1.00 0.00 N ATOM 0 H ASN A 88 -0.067 3.799 10.014 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.442 2.078 9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.716 4.304 9.663 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.174 3.671 11.205 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -1.888 7.297 9.855 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.033 6.287 8.966 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.792 2.872 7.262 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.811 3.115 5.825 1.00 0.00 C ATOM 1436 C PHE A 89 -3.907 4.104 5.441 1.00 0.00 C ATOM 1437 O PHE A 89 -5.077 3.923 5.794 1.00 0.00 O ATOM 1438 CB PHE A 89 -3.020 1.804 5.065 1.00 0.00 C ATOM 1439 CG PHE A 89 -2.141 0.684 5.542 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -0.832 0.579 5.106 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -2.626 -0.260 6.430 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -0.021 -0.449 5.548 1.00 0.00 C ATOM 1443 CE2 PHE A 89 -1.823 -1.289 6.877 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.517 -1.385 6.435 1.00 0.00 C ATOM 0 H PHE A 89 -3.543 2.267 7.595 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.847 3.545 5.553 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -4.063 1.501 5.160 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.833 1.975 4.005 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.440 1.308 4.413 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.646 -0.190 6.778 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.999 -0.521 5.201 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.214 -2.018 7.571 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.114 -2.190 6.782 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.516 5.142 4.707 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.448 6.164 4.252 1.00 0.00 C ATOM 1456 C ALA A 90 -4.084 6.634 2.852 1.00 0.00 C ATOM 1457 O ALA A 90 -2.910 6.680 2.493 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.461 7.345 5.213 1.00 0.00 C ATOM 0 H ALA A 90 -2.551 5.296 4.414 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.446 5.726 4.225 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.164 8.098 4.855 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.766 7.005 6.203 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.463 7.779 5.270 1.00 0.00 H new ATOM 1464 N ILE A 91 -5.091 6.984 2.066 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.859 7.458 0.707 1.00 0.00 C ATOM 1466 C ILE A 91 -4.773 8.977 0.690 1.00 0.00 C ATOM 1467 O ILE A 91 -5.739 9.659 1.024 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.966 7.007 -0.276 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.771 5.833 0.291 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.356 6.632 -1.618 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -5.932 4.613 0.605 1.00 0.00 C ATOM 0 H ILE A 91 -6.072 6.950 2.342 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.917 7.018 0.378 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.651 7.843 -0.418 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.278 6.157 1.200 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.545 5.556 -0.425 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.145 6.316 -2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -4.838 7.495 -2.036 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.647 5.815 -1.480 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.571 3.824 1.002 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.445 4.262 -0.305 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.174 4.873 1.344 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.612 9.502 0.310 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.409 10.948 0.265 1.00 0.00 C ATOM 1485 C VAL A 92 -2.740 11.358 -1.047 1.00 0.00 C ATOM 1486 O VAL A 92 -2.071 10.550 -1.688 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.570 11.453 1.472 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -2.711 10.521 2.671 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.102 11.620 1.100 1.00 0.00 C ATOM 0 H VAL A 92 -2.800 8.952 0.030 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.393 11.413 0.325 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.962 12.431 1.750 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.113 10.901 3.499 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.757 10.471 2.972 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.364 9.524 2.400 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.545 11.974 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.697 10.661 0.776 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.012 12.344 0.290 1.00 0.00 H new ATOM 1499 N PHE A 93 -2.929 12.614 -1.443 1.00 0.00 N ATOM 1500 CA PHE A 93 -2.345 13.118 -2.686 1.00 0.00 C ATOM 1501 C PHE A 93 -1.373 14.263 -2.414 1.00 0.00 C ATOM 1502 O PHE A 93 -1.753 15.295 -1.861 1.00 0.00 O ATOM 1503 CB PHE A 93 -3.442 13.590 -3.647 1.00 0.00 C ATOM 1504 CG PHE A 93 -4.776 12.931 -3.426 1.00 0.00 C ATOM 1505 CD1 PHE A 93 -5.543 13.247 -2.315 1.00 0.00 C ATOM 1506 CD2 PHE A 93 -5.262 11.998 -4.327 1.00 0.00 C ATOM 1507 CE1 PHE A 93 -6.767 12.645 -2.108 1.00 0.00 C ATOM 1508 CE2 PHE A 93 -6.487 11.392 -4.126 1.00 0.00 C ATOM 1509 CZ PHE A 93 -7.241 11.716 -3.015 1.00 0.00 C ATOM 0 H PHE A 93 -3.479 13.300 -0.925 1.00 0.00 H new ATOM 0 HA PHE A 93 -1.795 12.297 -3.147 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.560 14.669 -3.545 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -3.120 13.400 -4.671 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -5.178 13.973 -1.603 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -4.676 11.741 -5.197 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -7.354 12.899 -1.238 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -6.855 10.666 -4.836 1.00 0.00 H new ATOM 0 HZ PHE A 93 -8.199 11.244 -2.855 1.00 0.00 H new ATOM 1519 N THR A 94 -0.119 14.076 -2.815 1.00 0.00 N ATOM 1520 CA THR A 94 0.909 15.096 -2.623 1.00 0.00 C ATOM 1521 C THR A 94 0.476 16.428 -3.231 1.00 0.00 C ATOM 1522 O THR A 94 -0.047 16.472 -4.343 1.00 0.00 O ATOM 1523 CB THR A 94 2.228 14.642 -3.248 1.00 0.00 C ATOM 1524 OG1 THR A 94 2.445 13.261 -3.017 1.00 0.00 O ATOM 1525 CG2 THR A 94 3.431 15.390 -2.715 1.00 0.00 C ATOM 0 H THR A 94 0.211 13.228 -3.275 1.00 0.00 H new ATOM 0 HA THR A 94 1.051 15.236 -1.551 1.00 0.00 H new ATOM 0 HB THR A 94 2.130 14.853 -4.313 1.00 0.00 H new ATOM 0 HG1 THR A 94 3.293 12.990 -3.426 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.334 15.019 -3.200 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.319 16.454 -2.922 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.508 15.236 -1.639 1.00 0.00 H new ATOM 1533 N ASP A 95 0.699 17.511 -2.493 1.00 0.00 N ATOM 1534 CA ASP A 95 0.331 18.842 -2.959 1.00 0.00 C ATOM 1535 C ASP A 95 1.115 19.916 -2.213 1.00 0.00 C ATOM 1536 O ASP A 95 1.923 19.610 -1.335 1.00 0.00 O ATOM 1537 CB ASP A 95 -1.171 19.074 -2.781 1.00 0.00 C ATOM 1538 CG ASP A 95 -1.771 19.875 -3.919 1.00 0.00 C ATOM 1539 OD1 ASP A 95 -2.009 19.288 -4.997 1.00 0.00 O ATOM 1540 OD2 ASP A 95 -2.005 21.087 -3.734 1.00 0.00 O ATOM 0 H ASP A 95 1.133 17.492 -1.570 1.00 0.00 H new ATOM 0 HA ASP A 95 0.577 18.908 -4.019 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.679 18.112 -2.710 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -1.346 19.597 -1.841 1.00 0.00 H new ATOM 1545 N VAL A 96 0.877 21.175 -2.568 1.00 0.00 N ATOM 1546 CA VAL A 96 1.568 22.288 -1.927 1.00 0.00 C ATOM 1547 C VAL A 96 0.863 22.722 -0.645 1.00 0.00 C ATOM 1548 O VAL A 96 1.485 22.805 0.413 1.00 0.00 O ATOM 1549 CB VAL A 96 1.697 23.501 -2.875 1.00 0.00 C ATOM 1550 CG1 VAL A 96 2.533 23.140 -4.092 1.00 0.00 C ATOM 1551 CG2 VAL A 96 0.327 24.013 -3.296 1.00 0.00 C ATOM 0 H VAL A 96 0.214 21.449 -3.293 1.00 0.00 H new ATOM 0 HA VAL A 96 2.566 21.929 -1.677 1.00 0.00 H new ATOM 0 HB VAL A 96 2.203 24.301 -2.334 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.613 24.006 -4.748 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.529 22.834 -3.772 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.057 22.320 -4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.447 24.867 -3.963 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -0.214 23.221 -3.814 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.234 24.318 -2.413 1.00 0.00 H new ATOM 1561 N LYS A 97 -0.436 22.996 -0.740 1.00 0.00 N ATOM 1562 CA LYS A 97 -1.212 23.417 0.422 1.00 0.00 C ATOM 1563 C LYS A 97 -2.261 22.372 0.789 1.00 0.00 C ATOM 1564 O LYS A 97 -2.313 21.904 1.927 1.00 0.00 O ATOM 1565 CB LYS A 97 -1.880 24.766 0.152 1.00 0.00 C ATOM 1566 CG LYS A 97 -1.166 25.939 0.805 1.00 0.00 C ATOM 1567 CD LYS A 97 -1.176 25.824 2.321 1.00 0.00 C ATOM 1568 CE LYS A 97 -1.512 27.152 2.979 1.00 0.00 C ATOM 1569 NZ LYS A 97 -0.843 27.304 4.301 1.00 0.00 N ATOM 0 H LYS A 97 -0.971 22.934 -1.606 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.529 23.522 1.265 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.924 24.932 -0.924 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.908 24.731 0.511 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.137 25.983 0.449 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.647 26.871 0.507 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.904 25.072 2.625 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -0.201 25.482 2.667 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -1.209 27.968 2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -2.592 27.230 3.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.098 28.223 4.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -1.151 26.540 4.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 0.188 27.255 4.176 1.00 0.00 H new ATOM 1583 N ARG A 98 -3.094 22.005 -0.181 1.00 0.00 N ATOM 1584 CA ARG A 98 -4.139 21.014 0.046 1.00 0.00 C ATOM 1585 C ARG A 98 -4.848 20.648 -1.260 1.00 0.00 C ATOM 1586 O ARG A 98 -5.286 21.528 -2.002 1.00 0.00 O ATOM 1587 CB ARG A 98 -5.157 21.535 1.066 1.00 0.00 C ATOM 1588 CG ARG A 98 -5.872 22.807 0.632 1.00 0.00 C ATOM 1589 CD ARG A 98 -5.283 24.038 1.301 1.00 0.00 C ATOM 1590 NE ARG A 98 -6.311 24.871 1.923 1.00 0.00 N ATOM 1591 CZ ARG A 98 -6.944 25.863 1.299 1.00 0.00 C ATOM 1592 NH1 ARG A 98 -6.676 26.141 0.028 1.00 0.00 N ATOM 1593 NH2 ARG A 98 -7.855 26.578 1.947 1.00 0.00 N ATOM 0 H ARG A 98 -3.065 22.379 -1.130 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.666 20.115 0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -5.899 20.759 1.252 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.647 21.722 2.011 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -5.802 22.913 -0.451 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -6.931 22.731 0.877 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -4.561 23.729 2.057 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -4.739 24.626 0.562 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.559 24.681 2.894 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -5.981 25.593 -0.478 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.166 26.903 -0.442 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -8.070 26.368 2.922 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -8.340 27.338 1.470 1.00 0.00 H new ATOM 1607 N PRO A 99 -4.975 19.342 -1.565 1.00 0.00 N ATOM 1608 CA PRO A 99 -5.637 18.879 -2.789 1.00 0.00 C ATOM 1609 C PRO A 99 -7.139 19.136 -2.758 1.00 0.00 C ATOM 1610 O PRO A 99 -7.667 19.896 -3.571 1.00 0.00 O ATOM 1611 CB PRO A 99 -5.357 17.368 -2.819 1.00 0.00 C ATOM 1612 CG PRO A 99 -4.321 17.125 -1.775 1.00 0.00 C ATOM 1613 CD PRO A 99 -4.487 18.216 -0.756 1.00 0.00 C ATOM 0 HA PRO A 99 -5.266 19.404 -3.669 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -6.263 16.798 -2.611 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -5.003 17.056 -3.801 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -4.451 16.144 -1.319 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -3.321 17.145 -2.207 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -5.198 17.938 0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -3.546 18.452 -0.259 1.00 0.00 H new ATOM 1621 N GLY A 100 -7.823 18.496 -1.813 1.00 0.00 N ATOM 1622 CA GLY A 100 -9.259 18.666 -1.693 1.00 0.00 C ATOM 1623 C GLY A 100 -10.031 17.665 -2.528 1.00 0.00 C ATOM 1624 O GLY A 100 -11.080 17.990 -3.088 1.00 0.00 O ATOM 0 H GLY A 100 -7.408 17.863 -1.129 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.548 18.562 -0.647 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.529 19.676 -2.000 1.00 0.00 H new ATOM 1628 N TYR A 101 -9.513 16.443 -2.618 1.00 0.00 N ATOM 1629 CA TYR A 101 -10.162 15.394 -3.396 1.00 0.00 C ATOM 1630 C TYR A 101 -10.835 14.370 -2.486 1.00 0.00 C ATOM 1631 O TYR A 101 -12.049 14.403 -2.287 1.00 0.00 O ATOM 1632 CB TYR A 101 -9.143 14.704 -4.308 1.00 0.00 C ATOM 1633 CG TYR A 101 -9.425 14.886 -5.783 1.00 0.00 C ATOM 1634 CD1 TYR A 101 -10.295 14.036 -6.452 1.00 0.00 C ATOM 1635 CD2 TYR A 101 -8.819 15.906 -6.505 1.00 0.00 C ATOM 1636 CE1 TYR A 101 -10.555 14.198 -7.800 1.00 0.00 C ATOM 1637 CE2 TYR A 101 -9.074 16.075 -7.852 1.00 0.00 C ATOM 1638 CZ TYR A 101 -9.942 15.218 -8.495 1.00 0.00 C ATOM 1639 OH TYR A 101 -10.197 15.383 -9.837 1.00 0.00 O ATOM 0 H TYR A 101 -8.647 16.156 -2.162 1.00 0.00 H new ATOM 0 HA TYR A 101 -10.933 15.857 -4.012 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -8.149 15.093 -4.087 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -9.127 13.638 -4.079 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -10.777 13.235 -5.911 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -8.137 16.578 -6.005 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -11.235 13.529 -8.306 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -8.596 16.874 -8.399 1.00 0.00 H new ATOM 0 HH TYR A 101 -9.686 16.148 -10.175 1.00 0.00 H new ATOM 1649 N ARG A 102 -10.037 13.461 -1.939 1.00 0.00 N ATOM 1650 CA ARG A 102 -10.549 12.425 -1.051 1.00 0.00 C ATOM 1651 C ARG A 102 -9.399 11.695 -0.366 1.00 0.00 C ATOM 1652 O ARG A 102 -9.057 10.570 -0.731 1.00 0.00 O ATOM 1653 CB ARG A 102 -11.408 11.429 -1.834 1.00 0.00 C ATOM 1654 CG ARG A 102 -12.461 10.736 -0.986 1.00 0.00 C ATOM 1655 CD ARG A 102 -13.707 11.592 -0.830 1.00 0.00 C ATOM 1656 NE ARG A 102 -14.107 11.727 0.569 1.00 0.00 N ATOM 1657 CZ ARG A 102 -14.768 10.789 1.245 1.00 0.00 C ATOM 1658 NH1 ARG A 102 -15.105 9.650 0.654 1.00 0.00 N ATOM 1659 NH2 ARG A 102 -15.093 10.992 2.514 1.00 0.00 N ATOM 0 H ARG A 102 -9.030 13.421 -2.096 1.00 0.00 H new ATOM 0 HA ARG A 102 -11.167 12.900 -0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.900 11.952 -2.654 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.760 10.675 -2.281 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.728 9.784 -1.444 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -12.047 10.512 -0.003 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.523 12.580 -1.251 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -14.524 11.150 -1.400 1.00 0.00 H new ATOM 0 HE ARG A 102 -13.866 12.590 1.056 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.858 9.490 -0.323 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.611 8.935 1.176 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.837 11.866 2.972 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -15.599 10.274 3.032 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.800 12.349 0.621 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.681 11.771 1.353 1.00 0.00 C ATOM 1675 C VAL A 103 -8.103 11.359 2.764 1.00 0.00 C ATOM 1676 O VAL A 103 -8.448 12.203 3.591 1.00 0.00 O ATOM 1677 CB VAL A 103 -6.491 12.760 1.418 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.978 14.171 1.711 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.453 12.320 2.446 1.00 0.00 C ATOM 0 H VAL A 103 -9.071 13.281 0.933 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.360 10.879 0.815 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.007 12.759 0.441 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.125 14.849 1.752 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.659 14.492 0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.499 14.185 2.668 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.632 13.037 2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.915 12.272 3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.069 11.336 2.177 1.00 0.00 H new ATOM 1689 N LYS A 104 -8.074 10.054 3.027 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.455 9.526 4.334 1.00 0.00 C ATOM 1691 C LYS A 104 -7.860 8.137 4.563 1.00 0.00 C ATOM 1692 O LYS A 104 -7.312 7.528 3.646 1.00 0.00 O ATOM 1693 CB LYS A 104 -9.979 9.467 4.457 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.633 8.524 3.461 1.00 0.00 C ATOM 1695 CD LYS A 104 -10.871 9.204 2.124 1.00 0.00 C ATOM 1696 CE LYS A 104 -10.590 8.263 0.963 1.00 0.00 C ATOM 1697 NZ LYS A 104 -11.830 7.601 0.472 1.00 0.00 N ATOM 0 H LYS A 104 -7.791 9.344 2.352 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.059 10.197 5.096 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.242 9.154 5.468 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.386 10.469 4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.000 7.649 3.317 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.582 8.169 3.864 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -11.902 9.552 2.070 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -10.233 10.084 2.043 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -10.129 8.820 0.148 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -9.873 7.504 1.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -11.610 7.034 -0.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -12.211 6.982 1.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -12.537 8.324 0.228 1.00 0.00 H new ATOM 1711 N GLU A 105 -7.976 7.643 5.795 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.454 6.325 6.146 1.00 0.00 C ATOM 1713 C GLU A 105 -8.514 5.247 5.934 1.00 0.00 C ATOM 1714 O GLU A 105 -9.708 5.489 6.114 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.957 6.321 7.596 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.572 4.946 8.123 1.00 0.00 C ATOM 1717 CD GLU A 105 -6.628 4.865 9.636 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -5.825 5.557 10.297 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -7.474 4.112 10.161 1.00 0.00 O ATOM 0 H GLU A 105 -8.427 8.136 6.566 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.612 6.101 5.490 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.093 6.982 7.673 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.735 6.737 8.236 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.241 4.198 7.698 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.565 4.701 7.787 1.00 0.00 H new ATOM 1726 N ILE A 106 -8.066 4.056 5.542 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.974 2.938 5.294 1.00 0.00 C ATOM 1728 C ILE A 106 -8.723 1.777 6.255 1.00 0.00 C ATOM 1729 O ILE A 106 -9.590 0.923 6.442 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.862 2.423 3.841 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.449 2.642 3.288 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.890 3.113 2.955 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.402 1.754 3.926 1.00 0.00 C ATOM 0 H ILE A 106 -7.081 3.840 5.389 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.980 3.323 5.460 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.063 1.352 3.844 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.458 2.464 2.213 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.168 3.685 3.436 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.799 2.740 1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.892 2.904 3.330 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.716 4.189 2.965 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.428 1.965 3.485 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.365 1.948 4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.659 0.708 3.755 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.539 1.743 6.860 1.00 0.00 N ATOM 1746 CA GLY A 107 -7.218 0.671 7.790 1.00 0.00 C ATOM 1747 C GLY A 107 -5.784 0.735 8.266 1.00 0.00 C ATOM 1748 O GLY A 107 -4.928 1.287 7.581 1.00 0.00 O ATOM 0 H GLY A 107 -6.800 2.433 6.725 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.887 0.726 8.649 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.396 -0.290 7.308 1.00 0.00 H new ATOM 1752 N SER A 108 -5.525 0.227 9.472 1.00 0.00 N ATOM 1753 CA SER A 108 -4.184 0.278 10.037 1.00 0.00 C ATOM 1754 C SER A 108 -3.747 -1.077 10.584 1.00 0.00 C ATOM 1755 O SER A 108 -4.550 -1.829 11.137 1.00 0.00 O ATOM 1756 CB SER A 108 -4.121 1.325 11.154 1.00 0.00 C ATOM 1757 OG SER A 108 -4.898 0.928 12.273 1.00 0.00 O ATOM 0 H SER A 108 -6.222 -0.220 10.068 1.00 0.00 H new ATOM 0 HA SER A 108 -3.502 0.554 9.233 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.085 1.472 11.461 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.481 2.283 10.779 1.00 0.00 H new ATOM 0 HG SER A 108 -4.839 1.613 12.972 1.00 0.00 H new ATOM 1763 N THR A 109 -2.459 -1.368 10.436 1.00 0.00 N ATOM 1764 CA THR A 109 -1.881 -2.615 10.920 1.00 0.00 C ATOM 1765 C THR A 109 -0.701 -2.321 11.840 1.00 0.00 C ATOM 1766 O THR A 109 -0.483 -1.174 12.228 1.00 0.00 O ATOM 1767 CB THR A 109 -1.431 -3.487 9.745 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.594 -2.755 8.868 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.584 -4.033 8.933 1.00 0.00 C ATOM 0 H THR A 109 -1.789 -0.749 9.979 1.00 0.00 H new ATOM 0 HA THR A 109 -2.641 -3.157 11.482 1.00 0.00 H new ATOM 0 HB THR A 109 -0.894 -4.323 10.193 1.00 0.00 H new ATOM 0 HG1 THR A 109 -0.927 -2.841 7.950 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.197 -4.642 8.116 1.00 0.00 H new ATOM 0 HG22 THR A 109 -3.221 -4.645 9.572 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.166 -3.206 8.525 1.00 0.00 H new ATOM 1777 N MET A 110 0.063 -3.352 12.188 1.00 0.00 N ATOM 1778 CA MET A 110 1.215 -3.169 13.062 1.00 0.00 C ATOM 1779 C MET A 110 2.345 -4.128 12.693 1.00 0.00 C ATOM 1780 O MET A 110 2.154 -5.053 11.903 1.00 0.00 O ATOM 1781 CB MET A 110 0.796 -3.324 14.533 1.00 0.00 C ATOM 1782 CG MET A 110 0.870 -4.742 15.086 1.00 0.00 C ATOM 1783 SD MET A 110 1.385 -4.770 16.814 1.00 0.00 S ATOM 1784 CE MET A 110 2.933 -3.876 16.714 1.00 0.00 C ATOM 0 H MET A 110 -0.093 -4.312 11.882 1.00 0.00 H new ATOM 0 HA MET A 110 1.598 -2.158 12.925 1.00 0.00 H new ATOM 0 HB2 MET A 110 1.429 -2.680 15.144 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.226 -2.962 14.642 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.105 -5.219 14.991 1.00 0.00 H new ATOM 0 HG3 MET A 110 1.570 -5.327 14.490 1.00 0.00 H new ATOM 0 HE1 MET A 110 3.658 -4.327 17.391 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.313 -3.920 15.693 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.771 -2.836 16.996 1.00 0.00 H new ATOM 1794 N SER A 111 3.524 -3.889 13.257 1.00 0.00 N ATOM 1795 CA SER A 111 4.690 -4.719 12.977 1.00 0.00 C ATOM 1796 C SER A 111 4.719 -5.973 13.844 1.00 0.00 C ATOM 1797 O SER A 111 4.865 -5.892 15.065 1.00 0.00 O ATOM 1798 CB SER A 111 5.973 -3.915 13.193 1.00 0.00 C ATOM 1799 OG SER A 111 7.113 -4.652 12.789 1.00 0.00 O ATOM 0 H SER A 111 3.698 -3.126 13.912 1.00 0.00 H new ATOM 0 HA SER A 111 4.623 -5.034 11.936 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.921 -2.983 12.630 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.064 -3.647 14.245 1.00 0.00 H new ATOM 0 HG SER A 111 7.837 -4.034 12.557 1.00 0.00 H new ATOM 1805 N GLY A 112 4.599 -7.134 13.205 1.00 0.00 N ATOM 1806 CA GLY A 112 4.637 -8.390 13.932 1.00 0.00 C ATOM 1807 C GLY A 112 3.290 -8.816 14.481 1.00 0.00 C ATOM 1808 O GLY A 112 3.227 -9.581 15.444 1.00 0.00 O ATOM 0 H GLY A 112 4.476 -7.227 12.197 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.014 -9.171 13.271 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.344 -8.301 14.757 1.00 0.00 H new ATOM 1812 N ARG A 113 2.208 -8.331 13.882 1.00 0.00 N ATOM 1813 CA ARG A 113 0.870 -8.689 14.343 1.00 0.00 C ATOM 1814 C ARG A 113 -0.173 -8.459 13.256 1.00 0.00 C ATOM 1815 O ARG A 113 -0.005 -7.604 12.386 1.00 0.00 O ATOM 1816 CB ARG A 113 0.513 -7.886 15.595 1.00 0.00 C ATOM 1817 CG ARG A 113 0.453 -8.729 16.860 1.00 0.00 C ATOM 1818 CD ARG A 113 1.429 -8.228 17.916 1.00 0.00 C ATOM 1819 NE ARG A 113 2.123 -9.326 18.584 1.00 0.00 N ATOM 1820 CZ ARG A 113 3.167 -9.160 19.393 1.00 0.00 C ATOM 1821 NH1 ARG A 113 3.637 -7.944 19.638 1.00 0.00 N ATOM 1822 NH2 ARG A 113 3.739 -10.213 19.962 1.00 0.00 N ATOM 0 H ARG A 113 2.229 -7.696 13.084 1.00 0.00 H new ATOM 0 HA ARG A 113 0.871 -9.752 14.586 1.00 0.00 H new ATOM 0 HB2 ARG A 113 1.249 -7.093 15.731 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.452 -7.403 15.444 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -0.560 -8.710 17.262 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.681 -9.767 16.617 1.00 0.00 H new ATOM 0 HD2 ARG A 113 2.160 -7.567 17.450 1.00 0.00 H new ATOM 0 HD3 ARG A 113 0.890 -7.636 18.656 1.00 0.00 H new ATOM 0 HE ARG A 113 1.788 -10.276 18.421 1.00 0.00 H new ATOM 0 HH11 ARG A 113 3.198 -7.131 19.206 1.00 0.00 H new ATOM 0 HH12 ARG A 113 4.437 -7.822 20.259 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.379 -11.150 19.780 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.539 -10.086 20.582 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.252 -9.233 13.315 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.328 -9.121 12.339 1.00 0.00 C ATOM 1838 C LYS A 114 -3.535 -8.408 12.939 1.00 0.00 C ATOM 1839 O LYS A 114 -4.340 -9.015 13.647 1.00 0.00 O ATOM 1840 CB LYS A 114 -2.738 -10.506 11.839 1.00 0.00 C ATOM 1841 CG LYS A 114 -1.726 -11.138 10.895 1.00 0.00 C ATOM 1842 CD LYS A 114 -1.570 -12.626 11.159 1.00 0.00 C ATOM 1843 CE LYS A 114 -2.895 -13.359 11.029 1.00 0.00 C ATOM 1844 NZ LYS A 114 -2.835 -14.731 11.607 1.00 0.00 N ATOM 0 H LYS A 114 -1.404 -9.945 14.029 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.961 -8.532 11.498 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.883 -11.164 12.696 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.699 -10.429 11.330 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.042 -10.982 9.864 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -0.761 -10.644 11.011 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.850 -13.047 10.457 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.166 -12.778 12.160 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.676 -12.788 11.532 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.173 -13.421 9.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.759 -15.195 11.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.108 -15.285 11.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.595 -14.672 12.617 1.00 0.00 H new ATOM 1858 N GLY A 115 -3.652 -7.119 12.649 1.00 0.00 N ATOM 1859 CA GLY A 115 -4.763 -6.340 13.166 1.00 0.00 C ATOM 1860 C GLY A 115 -6.100 -6.810 12.625 1.00 0.00 C ATOM 1861 O GLY A 115 -6.240 -7.962 12.214 1.00 0.00 O ATOM 0 H GLY A 115 -2.998 -6.598 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -4.772 -6.403 14.254 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.618 -5.291 12.909 1.00 0.00 H new ATOM 1865 N THR A 116 -7.084 -5.918 12.628 1.00 0.00 N ATOM 1866 CA THR A 116 -8.416 -6.247 12.134 1.00 0.00 C ATOM 1867 C THR A 116 -8.503 -6.040 10.626 1.00 0.00 C ATOM 1868 O THR A 116 -9.176 -6.795 9.923 1.00 0.00 O ATOM 1869 CB THR A 116 -9.470 -5.393 12.840 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.127 -4.020 12.777 1.00 0.00 O ATOM 1871 CG2 THR A 116 -9.653 -5.753 14.300 1.00 0.00 C ATOM 0 H THR A 116 -6.985 -4.961 12.967 1.00 0.00 H new ATOM 0 HA THR A 116 -8.607 -7.298 12.350 1.00 0.00 H new ATOM 0 HB THR A 116 -10.403 -5.592 12.313 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.814 -3.490 13.232 1.00 0.00 H new ATOM 0 HG21 THR A 116 -10.415 -5.110 14.741 1.00 0.00 H new ATOM 0 HG22 THR A 116 -9.966 -6.794 14.382 1.00 0.00 H new ATOM 0 HG23 THR A 116 -8.710 -5.615 14.830 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.818 -5.013 10.135 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.814 -4.706 8.709 1.00 0.00 C ATOM 1881 C ASP A 117 -6.739 -5.507 7.973 1.00 0.00 C ATOM 1882 O ASP A 117 -6.766 -5.617 6.748 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.592 -3.208 8.489 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.459 -2.355 9.397 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -8.066 -2.140 10.563 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -9.531 -1.903 8.941 1.00 0.00 O ATOM 0 H ASP A 117 -7.258 -4.378 10.704 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.786 -4.987 8.304 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.543 -2.969 8.664 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.806 -2.961 7.449 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.792 -6.059 8.729 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.705 -6.846 8.153 1.00 0.00 C ATOM 1893 C ASP A 118 -5.234 -7.904 7.184 1.00 0.00 C ATOM 1894 O ASP A 118 -4.583 -8.229 6.190 1.00 0.00 O ATOM 1895 CB ASP A 118 -3.901 -7.522 9.265 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.415 -7.555 8.967 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.912 -6.589 8.357 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.756 -8.546 9.341 1.00 0.00 O ATOM 0 H ASP A 118 -5.756 -5.975 9.745 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.060 -6.166 7.596 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.069 -6.993 10.203 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.263 -8.541 9.404 1.00 0.00 H new ATOM 1903 N SER A 119 -6.415 -8.441 7.483 1.00 0.00 N ATOM 1904 CA SER A 119 -7.027 -9.466 6.642 1.00 0.00 C ATOM 1905 C SER A 119 -7.669 -8.861 5.392 1.00 0.00 C ATOM 1906 O SER A 119 -8.069 -9.586 4.481 1.00 0.00 O ATOM 1907 CB SER A 119 -8.077 -10.243 7.436 1.00 0.00 C ATOM 1908 OG SER A 119 -9.009 -9.364 8.044 1.00 0.00 O ATOM 0 H SER A 119 -6.967 -8.183 8.301 1.00 0.00 H new ATOM 0 HA SER A 119 -6.236 -10.144 6.322 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.601 -10.933 6.775 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.587 -10.845 8.201 1.00 0.00 H new ATOM 0 HG SER A 119 -9.671 -9.885 8.545 1.00 0.00 H new ATOM 1914 N MET A 120 -7.763 -7.532 5.350 1.00 0.00 N ATOM 1915 CA MET A 120 -8.349 -6.849 4.205 1.00 0.00 C ATOM 1916 C MET A 120 -7.331 -6.729 3.077 1.00 0.00 C ATOM 1917 O MET A 120 -6.130 -6.845 3.304 1.00 0.00 O ATOM 1918 CB MET A 120 -8.841 -5.458 4.614 1.00 0.00 C ATOM 1919 CG MET A 120 -9.774 -4.821 3.596 1.00 0.00 C ATOM 1920 SD MET A 120 -10.632 -3.374 4.250 1.00 0.00 S ATOM 1921 CE MET A 120 -9.247 -2.360 4.762 1.00 0.00 C ATOM 0 H MET A 120 -7.441 -6.912 6.094 1.00 0.00 H new ATOM 0 HA MET A 120 -9.197 -7.436 3.850 1.00 0.00 H new ATOM 0 HB2 MET A 120 -9.356 -5.531 5.572 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.980 -4.806 4.764 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.201 -4.532 2.715 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.508 -5.558 3.271 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.284 -2.212 5.841 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.314 -2.857 4.495 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.299 -1.393 4.261 1.00 0.00 H new ATOM 1931 N THR A 121 -7.815 -6.494 1.862 1.00 0.00 N ATOM 1932 CA THR A 121 -6.935 -6.358 0.703 1.00 0.00 C ATOM 1933 C THR A 121 -6.903 -4.916 0.214 1.00 0.00 C ATOM 1934 O THR A 121 -7.833 -4.150 0.467 1.00 0.00 O ATOM 1935 CB THR A 121 -7.397 -7.284 -0.423 1.00 0.00 C ATOM 1936 OG1 THR A 121 -8.812 -7.298 -0.515 1.00 0.00 O ATOM 1937 CG2 THR A 121 -6.934 -8.714 -0.250 1.00 0.00 C ATOM 0 H THR A 121 -8.808 -6.394 1.653 1.00 0.00 H new ATOM 0 HA THR A 121 -5.927 -6.641 1.005 1.00 0.00 H new ATOM 0 HB THR A 121 -6.947 -6.881 -1.330 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.087 -7.895 -1.242 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.296 -9.317 -1.083 1.00 0.00 H new ATOM 0 HG22 THR A 121 -5.845 -8.744 -0.227 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.327 -9.113 0.685 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.829 -4.541 -0.484 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.695 -3.186 -0.997 1.00 0.00 C ATOM 1947 C LEU A 122 -6.841 -2.853 -1.946 1.00 0.00 C ATOM 1948 O LEU A 122 -7.461 -1.796 -1.840 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.350 -3.024 -1.708 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.333 -2.144 -0.976 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -1.964 -2.256 -1.629 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.801 -0.697 -0.955 1.00 0.00 C ATOM 0 H LEU A 122 -5.046 -5.157 -0.703 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.735 -2.492 -0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.913 -4.012 -1.856 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.527 -2.602 -2.697 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.250 -2.493 0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.254 -1.624 -1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.627 -3.292 -1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.029 -1.932 -2.668 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.067 -0.085 -0.431 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.912 -0.336 -1.977 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.760 -0.632 -0.441 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.103 -3.751 -2.890 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.167 -3.553 -3.875 1.00 0.00 C ATOM 1966 C GLN A 123 -9.465 -3.094 -3.213 1.00 0.00 C ATOM 1967 O GLN A 123 -10.243 -2.348 -3.805 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.411 -4.844 -4.656 1.00 0.00 C ATOM 1969 CG GLN A 123 -8.727 -6.039 -3.771 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.404 -7.164 -4.529 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.012 -6.945 -5.577 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.300 -8.379 -4.003 1.00 0.00 N ATOM 0 H GLN A 123 -6.592 -4.627 -2.996 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.842 -2.771 -4.561 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.236 -4.688 -5.351 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.529 -5.069 -5.255 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.804 -6.410 -3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -9.371 -5.719 -2.952 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.787 -8.516 -3.132 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.734 -9.176 -4.470 1.00 0.00 H new ATOM 1981 N SER A 124 -9.695 -3.548 -1.985 1.00 0.00 N ATOM 1982 CA SER A 124 -10.904 -3.186 -1.248 1.00 0.00 C ATOM 1983 C SER A 124 -10.808 -1.770 -0.681 1.00 0.00 C ATOM 1984 O SER A 124 -11.817 -1.175 -0.305 1.00 0.00 O ATOM 1985 CB SER A 124 -11.152 -4.184 -0.117 1.00 0.00 C ATOM 1986 OG SER A 124 -12.033 -5.215 -0.528 1.00 0.00 O ATOM 0 H SER A 124 -9.062 -4.167 -1.478 1.00 0.00 H new ATOM 0 HA SER A 124 -11.741 -3.216 -1.946 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.205 -4.618 0.203 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.572 -3.665 0.744 1.00 0.00 H new ATOM 0 HG SER A 124 -12.173 -5.840 0.213 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.591 -1.238 -0.619 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.370 0.105 -0.095 1.00 0.00 C ATOM 1994 C GLN A 125 -9.455 1.161 -1.198 1.00 0.00 C ATOM 1995 O GLN A 125 -9.063 2.310 -0.996 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.005 0.181 0.589 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.974 -0.496 1.949 1.00 0.00 C ATOM 1998 CD GLN A 125 -6.787 -1.425 2.113 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -7.062 -2.681 2.435 1.00 0.00 O flip ATOM 2000 NE2 GLN A 125 -5.637 -1.016 1.949 1.00 0.00 N flip ATOM 0 H GLN A 125 -8.744 -1.716 -0.925 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.156 0.312 0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.257 -0.281 -0.056 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.723 1.227 0.706 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.945 0.265 2.729 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.895 -1.062 2.090 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.473 -0.040 1.702 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -4.848 -1.653 2.061 1.00 0.00 H new ATOM 2009 N LYS A 126 -9.971 0.767 -2.362 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.111 1.678 -3.496 1.00 0.00 C ATOM 2011 C LYS A 126 -8.757 2.019 -4.122 1.00 0.00 C ATOM 2012 O LYS A 126 -8.682 2.852 -5.027 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.826 2.964 -3.070 1.00 0.00 C ATOM 2014 CG LYS A 126 -12.121 2.718 -2.310 1.00 0.00 C ATOM 2015 CD LYS A 126 -11.977 3.054 -0.835 1.00 0.00 C ATOM 2016 CE LYS A 126 -13.315 3.424 -0.214 1.00 0.00 C ATOM 2017 NZ LYS A 126 -14.076 2.221 0.220 1.00 0.00 N ATOM 0 H LYS A 126 -10.300 -0.181 -2.544 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.711 1.166 -4.249 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -10.154 3.553 -2.446 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -11.042 3.560 -3.956 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.919 3.320 -2.745 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -12.415 1.674 -2.419 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.553 2.200 -0.306 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -11.278 3.882 -0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -13.150 4.078 0.642 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -13.907 3.987 -0.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -14.982 2.515 0.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -14.256 1.609 -0.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.523 1.697 0.927 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.692 1.375 -3.649 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.358 1.624 -4.183 1.00 0.00 C ATOM 2033 C PHE A 127 -6.232 1.077 -5.601 1.00 0.00 C ATOM 2034 O PHE A 127 -6.694 -0.026 -5.896 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.300 0.985 -3.282 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.891 1.256 -3.727 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.350 2.527 -3.624 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.108 0.239 -4.251 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.054 2.780 -4.032 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.811 0.485 -4.662 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.284 1.758 -4.553 1.00 0.00 C ATOM 0 H PHE A 127 -7.727 0.682 -2.902 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.198 2.702 -4.212 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.429 1.355 -2.265 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.462 -0.092 -3.252 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -3.948 3.330 -3.220 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.516 -0.757 -4.339 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.644 3.775 -3.944 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.211 -0.316 -5.067 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.272 1.954 -4.875 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.608 1.856 -6.480 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.426 1.450 -7.870 1.00 0.00 C ATOM 2053 C GLN A 128 -3.960 1.558 -8.282 1.00 0.00 C ATOM 2054 O GLN A 128 -3.112 1.969 -7.491 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.295 2.308 -8.791 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.034 1.506 -9.849 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.284 0.840 -9.309 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -8.273 -0.342 -8.963 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.372 1.599 -9.231 1.00 0.00 N ATOM 0 H GLN A 128 -5.220 2.772 -6.254 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.732 0.408 -7.962 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -7.021 2.854 -8.188 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.666 3.050 -9.283 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.305 2.164 -10.675 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -6.367 0.745 -10.254 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.336 2.574 -9.529 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -10.243 1.207 -8.873 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.670 1.188 -9.526 1.00 0.00 N ATOM 2069 CA ILE A 129 -2.307 1.247 -10.041 1.00 0.00 C ATOM 2070 C ILE A 129 -1.843 2.693 -10.183 1.00 0.00 C ATOM 2071 O ILE A 129 -2.386 3.455 -10.984 1.00 0.00 O ATOM 2072 CB ILE A 129 -2.186 0.544 -11.408 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.755 -0.876 -11.330 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.734 0.516 -11.868 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.913 -1.824 -10.502 1.00 0.00 C ATOM 0 H ILE A 129 -4.360 0.845 -10.195 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.673 0.728 -9.322 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.765 1.107 -12.140 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -3.759 -0.833 -10.908 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.850 -1.276 -12.340 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.668 0.016 -12.834 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -0.362 1.536 -11.961 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -0.131 -0.025 -11.138 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.378 -2.810 -10.492 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -0.915 -1.898 -10.935 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -1.839 -1.448 -9.482 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.837 3.065 -9.400 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.319 4.420 -9.453 1.00 0.00 C ATOM 2089 C GLY A 130 -0.858 5.300 -8.339 1.00 0.00 C ATOM 2090 O GLY A 130 -0.393 6.423 -8.151 1.00 0.00 O ATOM 0 H GLY A 130 -0.371 2.453 -8.730 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.769 4.391 -9.393 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.573 4.864 -10.416 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.841 4.789 -7.598 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.435 5.543 -6.501 1.00 0.00 C ATOM 2096 C ASP A 131 -1.380 5.935 -5.472 1.00 0.00 C ATOM 2097 O ASP A 131 -0.376 5.243 -5.302 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.541 4.722 -5.831 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.927 5.187 -6.234 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.455 6.113 -5.583 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.484 4.625 -7.200 1.00 0.00 O ATOM 0 H ASP A 131 -2.239 3.861 -7.738 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.867 6.455 -6.913 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.421 3.671 -6.095 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.437 4.792 -4.748 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.613 7.051 -4.793 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.685 7.542 -3.783 1.00 0.00 C ATOM 2108 C TYR A 132 -1.125 7.119 -2.384 1.00 0.00 C ATOM 2109 O TYR A 132 -2.126 7.611 -1.861 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.584 9.066 -3.856 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.439 9.602 -5.263 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -1.539 9.694 -6.108 1.00 0.00 C ATOM 2113 CD2 TYR A 132 0.795 10.017 -5.745 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -1.410 10.183 -7.394 1.00 0.00 C ATOM 2115 CE2 TYR A 132 0.932 10.508 -7.029 1.00 0.00 C ATOM 2116 CZ TYR A 132 -0.175 10.590 -7.849 1.00 0.00 C ATOM 2117 OH TYR A 132 -0.044 11.079 -9.128 1.00 0.00 O ATOM 0 H TYR A 132 -2.439 7.635 -4.924 1.00 0.00 H new ATOM 0 HA TYR A 132 0.294 7.106 -3.983 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.474 9.502 -3.401 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.270 9.393 -3.263 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -2.509 9.378 -5.754 1.00 0.00 H new ATOM 0 HD2 TYR A 132 1.663 9.955 -5.105 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.274 10.246 -8.040 1.00 0.00 H new ATOM 0 HE2 TYR A 132 1.899 10.826 -7.389 1.00 0.00 H new ATOM 0 HH TYR A 132 0.891 11.323 -9.291 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.370 6.206 -1.780 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.685 5.720 -0.442 1.00 0.00 C ATOM 2129 C LEU A 133 0.222 6.387 0.593 1.00 0.00 C ATOM 2130 O LEU A 133 1.438 6.401 0.439 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.505 4.201 -0.370 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.774 3.360 -0.551 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.519 1.929 -0.108 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -2.940 3.951 0.227 1.00 0.00 C ATOM 0 H LEU A 133 0.463 5.789 -2.196 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.724 5.969 -0.225 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.214 3.905 -1.133 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.065 3.953 0.596 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.037 3.365 -1.609 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.426 1.340 -0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.717 1.500 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.231 1.919 0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.826 3.333 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.691 3.982 1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.139 4.962 -0.128 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.373 6.933 1.641 1.00 0.00 N ATOM 2147 CA ASP A 134 0.397 7.594 2.696 1.00 0.00 C ATOM 2148 C ASP A 134 0.265 6.831 4.008 1.00 0.00 C ATOM 2149 O ASP A 134 -0.787 6.861 4.649 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.086 9.029 2.881 1.00 0.00 C ATOM 2151 CG ASP A 134 1.021 9.965 3.321 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.429 9.889 4.497 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.481 10.773 2.486 1.00 0.00 O ATOM 0 H ASP A 134 -1.382 6.935 1.789 1.00 0.00 H new ATOM 0 HA ASP A 134 1.446 7.607 2.400 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.510 9.389 1.944 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.887 9.046 3.621 1.00 0.00 H new ATOM 2158 N ILE A 135 1.325 6.135 4.397 1.00 0.00 N ATOM 2159 CA ILE A 135 1.319 5.356 5.630 1.00 0.00 C ATOM 2160 C ILE A 135 1.832 6.176 6.809 1.00 0.00 C ATOM 2161 O ILE A 135 2.679 7.058 6.652 1.00 0.00 O ATOM 2162 CB ILE A 135 2.174 4.078 5.488 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.577 3.151 4.427 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.289 3.353 6.827 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.576 2.707 3.383 1.00 0.00 C ATOM 0 H ILE A 135 2.201 6.093 3.877 1.00 0.00 H new ATOM 0 HA ILE A 135 0.284 5.073 5.820 1.00 0.00 H new ATOM 0 HB ILE A 135 3.175 4.370 5.170 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.161 2.271 4.917 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.750 3.662 3.933 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.895 2.456 6.704 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.759 4.011 7.558 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.295 3.074 7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.084 2.053 2.664 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.974 3.580 2.866 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.391 2.168 3.866 1.00 0.00 H new ATOM 2177 N ALA A 136 1.320 5.867 7.992 1.00 0.00 N ATOM 2178 CA ALA A 136 1.726 6.554 9.209 1.00 0.00 C ATOM 2179 C ALA A 136 2.172 5.547 10.260 1.00 0.00 C ATOM 2180 O ALA A 136 1.347 4.864 10.864 1.00 0.00 O ATOM 2181 CB ALA A 136 0.587 7.414 9.736 1.00 0.00 C ATOM 0 H ALA A 136 0.618 5.140 8.135 1.00 0.00 H new ATOM 0 HA ALA A 136 2.569 7.206 8.979 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.906 7.922 10.646 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.313 8.155 8.985 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.274 6.783 9.955 1.00 0.00 H new ATOM 2187 N ILE A 137 3.481 5.451 10.466 1.00 0.00 N ATOM 2188 CA ILE A 137 4.038 4.519 11.436 1.00 0.00 C ATOM 2189 C ILE A 137 4.158 5.148 12.819 1.00 0.00 C ATOM 2190 O ILE A 137 4.803 6.184 12.991 1.00 0.00 O ATOM 2191 CB ILE A 137 5.420 4.011 10.982 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.332 3.412 9.577 1.00 0.00 C ATOM 2193 CG2 ILE A 137 5.969 2.989 11.965 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.682 3.129 8.957 1.00 0.00 C ATOM 0 H ILE A 137 4.177 6.010 9.972 1.00 0.00 H new ATOM 0 HA ILE A 137 3.348 3.678 11.498 1.00 0.00 H new ATOM 0 HB ILE A 137 6.105 4.858 10.956 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.760 2.485 9.621 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.781 4.097 8.932 1.00 0.00 H new ATOM 0 HG21 ILE A 137 6.945 2.644 11.624 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.069 3.448 12.949 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.287 2.141 12.028 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.544 2.706 7.962 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.249 4.057 8.881 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.227 2.420 9.580 1.00 0.00 H new ATOM 2206 N THR A 138 3.535 4.507 13.804 1.00 0.00 N ATOM 2207 CA THR A 138 3.566 4.988 15.180 1.00 0.00 C ATOM 2208 C THR A 138 4.473 4.106 16.038 1.00 0.00 C ATOM 2209 O THR A 138 4.152 2.945 16.295 1.00 0.00 O ATOM 2210 CB THR A 138 2.154 5.003 15.767 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.184 5.096 14.739 1.00 0.00 O ATOM 2212 CG2 THR A 138 1.915 6.148 16.728 1.00 0.00 C ATOM 0 H THR A 138 3.000 3.649 13.672 1.00 0.00 H new ATOM 0 HA THR A 138 3.963 6.003 15.178 1.00 0.00 H new ATOM 0 HB THR A 138 2.061 4.065 16.315 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.912 4.196 14.463 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.894 6.098 17.107 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.615 6.076 17.561 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.064 7.095 16.210 1.00 0.00 H new ATOM 2220 N PRO A 139 5.622 4.637 16.495 1.00 0.00 N ATOM 2221 CA PRO A 139 6.565 3.877 17.324 1.00 0.00 C ATOM 2222 C PRO A 139 5.919 3.354 18.604 1.00 0.00 C ATOM 2223 O PRO A 139 4.926 3.907 19.078 1.00 0.00 O ATOM 2224 CB PRO A 139 7.672 4.888 17.652 1.00 0.00 C ATOM 2225 CG PRO A 139 7.085 6.227 17.354 1.00 0.00 C ATOM 2226 CD PRO A 139 6.097 6.008 16.246 1.00 0.00 C ATOM 0 HA PRO A 139 6.931 2.991 16.806 1.00 0.00 H new ATOM 0 HB2 PRO A 139 7.974 4.815 18.697 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.562 4.706 17.049 1.00 0.00 H new ATOM 0 HG2 PRO A 139 6.597 6.644 18.235 1.00 0.00 H new ATOM 0 HG3 PRO A 139 7.858 6.934 17.053 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.282 6.731 16.283 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.563 6.102 15.265 1.00 0.00 H new ATOM 2234 N PRO A 140 6.478 2.276 19.182 1.00 0.00 N ATOM 2235 CA PRO A 140 5.950 1.677 20.414 1.00 0.00 C ATOM 2236 C PRO A 140 6.249 2.515 21.655 1.00 0.00 C ATOM 2237 O PRO A 140 5.799 2.191 22.754 1.00 0.00 O ATOM 2238 CB PRO A 140 6.677 0.334 20.487 1.00 0.00 C ATOM 2239 CG PRO A 140 7.964 0.564 19.773 1.00 0.00 C ATOM 2240 CD PRO A 140 7.663 1.556 18.680 1.00 0.00 C ATOM 0 HA PRO A 140 4.863 1.594 20.392 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.846 0.030 21.520 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.096 -0.457 20.013 1.00 0.00 H new ATOM 0 HG2 PRO A 140 8.723 0.951 20.453 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.352 -0.367 19.359 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.501 2.232 18.510 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.458 1.058 17.732 1.00 0.00 H new ATOM 2248 N ASN A 141 7.006 3.592 21.476 1.00 0.00 N ATOM 2249 CA ASN A 141 7.355 4.473 22.584 1.00 0.00 C ATOM 2250 C ASN A 141 6.415 5.674 22.627 1.00 0.00 C ATOM 2251 O ASN A 141 6.851 6.818 22.761 1.00 0.00 O ATOM 2252 CB ASN A 141 8.808 4.947 22.465 1.00 0.00 C ATOM 2253 CG ASN A 141 9.206 5.262 21.036 1.00 0.00 C ATOM 2254 OD1 ASN A 141 9.564 4.229 20.282 1.00 0.00 O flip ATOM 2255 ND2 ASN A 141 9.193 6.418 20.616 1.00 0.00 N flip ATOM 0 H ASN A 141 7.389 3.876 20.574 1.00 0.00 H new ATOM 0 HA ASN A 141 7.249 3.909 23.511 1.00 0.00 H new ATOM 0 HB2 ASN A 141 8.948 5.835 23.081 1.00 0.00 H new ATOM 0 HB3 ASN A 141 9.470 4.177 22.861 1.00 0.00 H new ATOM 0 HD21 ASN A 141 8.911 7.181 21.231 1.00 0.00 H new ATOM 0 HD22 ASN A 141 9.465 6.614 19.652 1.00 0.00 H new ATOM 2262 N ARG A 142 5.120 5.401 22.510 1.00 0.00 N ATOM 2263 CA ARG A 142 4.109 6.451 22.531 1.00 0.00 C ATOM 2264 C ARG A 142 2.715 5.861 22.726 1.00 0.00 C ATOM 2265 O ARG A 142 1.897 6.409 23.464 1.00 0.00 O ATOM 2266 CB ARG A 142 4.159 7.258 21.232 1.00 0.00 C ATOM 2267 CG ARG A 142 3.840 8.732 21.419 1.00 0.00 C ATOM 2268 CD ARG A 142 2.498 9.096 20.804 1.00 0.00 C ATOM 2269 NE ARG A 142 1.757 10.046 21.632 1.00 0.00 N ATOM 2270 CZ ARG A 142 0.431 10.054 21.753 1.00 0.00 C ATOM 2271 NH1 ARG A 142 -0.313 9.171 21.097 1.00 0.00 N ATOM 2272 NH2 ARG A 142 -0.155 10.953 22.535 1.00 0.00 N ATOM 0 H ARG A 142 4.745 4.459 22.399 1.00 0.00 H new ATOM 0 HA ARG A 142 4.323 7.112 23.371 1.00 0.00 H new ATOM 0 HB2 ARG A 142 5.152 7.163 20.793 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.453 6.829 20.520 1.00 0.00 H new ATOM 0 HG2 ARG A 142 3.830 8.971 22.482 1.00 0.00 H new ATOM 0 HG3 ARG A 142 4.625 9.336 20.964 1.00 0.00 H new ATOM 0 HD2 ARG A 142 2.657 9.524 19.814 1.00 0.00 H new ATOM 0 HD3 ARG A 142 1.904 8.192 20.669 1.00 0.00 H new ATOM 0 HE ARG A 142 2.289 10.746 22.149 1.00 0.00 H new ATOM 0 HH11 ARG A 142 0.131 8.478 20.494 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -1.328 9.185 21.196 1.00 0.00 H new ATOM 0 HH21 ARG A 142 0.410 11.635 23.041 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -1.171 10.962 22.630 1.00 0.00 H new ATOM 2286 N ALA A 143 2.451 4.740 22.060 1.00 0.00 N ATOM 2287 CA ALA A 143 1.157 4.075 22.159 1.00 0.00 C ATOM 2288 C ALA A 143 0.819 3.755 23.618 1.00 0.00 C ATOM 2289 O ALA A 143 1.548 4.154 24.526 1.00 0.00 O ATOM 2290 CB ALA A 143 1.180 2.809 21.315 1.00 0.00 C ATOM 0 H ALA A 143 3.118 4.273 21.445 1.00 0.00 H new ATOM 0 HA ALA A 143 0.380 4.741 21.783 1.00 0.00 H new ATOM 0 HB1 ALA A 143 0.215 2.307 21.385 1.00 0.00 H new ATOM 0 HB2 ALA A 143 1.379 3.068 20.275 1.00 0.00 H new ATOM 0 HB3 ALA A 143 1.962 2.143 21.679 1.00 0.00 H new ATOM 2296 N PRO A 144 -0.290 3.030 23.876 1.00 0.00 N ATOM 2297 CA PRO A 144 -0.693 2.679 25.239 1.00 0.00 C ATOM 2298 C PRO A 144 0.084 1.482 25.785 1.00 0.00 C ATOM 2299 O PRO A 144 0.237 0.469 25.102 1.00 0.00 O ATOM 2300 CB PRO A 144 -2.171 2.330 25.079 1.00 0.00 C ATOM 2301 CG PRO A 144 -2.282 1.792 23.694 1.00 0.00 C ATOM 2302 CD PRO A 144 -1.244 2.513 22.871 1.00 0.00 C ATOM 0 HA PRO A 144 -0.501 3.485 25.947 1.00 0.00 H new ATOM 0 HB2 PRO A 144 -2.486 1.593 25.817 1.00 0.00 H new ATOM 0 HB3 PRO A 144 -2.803 3.208 25.215 1.00 0.00 H new ATOM 0 HG2 PRO A 144 -2.109 0.716 23.681 1.00 0.00 H new ATOM 0 HG3 PRO A 144 -3.281 1.959 23.292 1.00 0.00 H new ATOM 0 HD2 PRO A 144 -0.756 1.841 22.165 1.00 0.00 H new ATOM 0 HD3 PRO A 144 -1.687 3.320 22.288 1.00 0.00 H new ATOM 2310 N PRO A 145 0.589 1.579 27.029 1.00 0.00 N ATOM 2311 CA PRO A 145 1.351 0.498 27.657 1.00 0.00 C ATOM 2312 C PRO A 145 0.453 -0.625 28.168 1.00 0.00 C ATOM 2313 O PRO A 145 -0.744 -0.430 28.374 1.00 0.00 O ATOM 2314 CB PRO A 145 2.046 1.199 28.823 1.00 0.00 C ATOM 2315 CG PRO A 145 1.121 2.305 29.198 1.00 0.00 C ATOM 2316 CD PRO A 145 0.458 2.751 27.920 1.00 0.00 C ATOM 0 HA PRO A 145 2.034 0.016 26.958 1.00 0.00 H new ATOM 0 HB2 PRO A 145 2.207 0.516 29.657 1.00 0.00 H new ATOM 0 HB3 PRO A 145 3.024 1.581 28.530 1.00 0.00 H new ATOM 0 HG2 PRO A 145 0.381 1.965 29.922 1.00 0.00 H new ATOM 0 HG3 PRO A 145 1.666 3.128 29.662 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -0.587 3.016 28.082 1.00 0.00 H new ATOM 0 HD3 PRO A 145 0.948 3.630 27.500 1.00 0.00 H new ATOM 2324 N PRO A 146 1.024 -1.823 28.383 1.00 0.00 N ATOM 2325 CA PRO A 146 0.270 -2.980 28.874 1.00 0.00 C ATOM 2326 C PRO A 146 -0.131 -2.831 30.337 1.00 0.00 C ATOM 2327 O PRO A 146 -1.123 -3.412 30.783 1.00 0.00 O ATOM 2328 CB PRO A 146 1.252 -4.142 28.705 1.00 0.00 C ATOM 2329 CG PRO A 146 2.598 -3.509 28.774 1.00 0.00 C ATOM 2330 CD PRO A 146 2.448 -2.143 28.164 1.00 0.00 C ATOM 0 HA PRO A 146 -0.667 -3.114 28.334 1.00 0.00 H new ATOM 0 HB2 PRO A 146 1.124 -4.887 29.490 1.00 0.00 H new ATOM 0 HB3 PRO A 146 1.102 -4.652 27.754 1.00 0.00 H new ATOM 0 HG2 PRO A 146 2.944 -3.439 29.805 1.00 0.00 H new ATOM 0 HG3 PRO A 146 3.335 -4.100 28.230 1.00 0.00 H new ATOM 0 HD2 PRO A 146 3.102 -1.415 28.644 1.00 0.00 H new ATOM 0 HD3 PRO A 146 2.700 -2.147 27.104 1.00 0.00 H new ATOM 2338 N SER A 147 0.643 -2.049 31.083 1.00 0.00 N ATOM 2339 CA SER A 147 0.367 -1.824 32.497 1.00 0.00 C ATOM 2340 C SER A 147 -0.926 -1.036 32.681 1.00 0.00 C ATOM 2341 O SER A 147 -1.246 -0.153 31.886 1.00 0.00 O ATOM 2342 CB SER A 147 1.530 -1.075 33.151 1.00 0.00 C ATOM 2343 OG SER A 147 2.547 -1.972 33.565 1.00 0.00 O ATOM 0 H SER A 147 1.466 -1.560 30.731 1.00 0.00 H new ATOM 0 HA SER A 147 0.251 -2.795 32.978 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.943 -0.352 32.447 1.00 0.00 H new ATOM 0 HB3 SER A 147 1.166 -0.511 34.010 1.00 0.00 H new ATOM 0 HG SER A 147 3.279 -1.468 33.978 1.00 0.00 H new ATOM 2349 N GLY A 148 -1.665 -1.363 33.736 1.00 0.00 N ATOM 2350 CA GLY A 148 -2.915 -0.677 34.006 1.00 0.00 C ATOM 2351 C GLY A 148 -4.127 -1.525 33.671 1.00 0.00 C ATOM 2352 O GLY A 148 -4.790 -2.052 34.565 1.00 0.00 O ATOM 0 H GLY A 148 -1.421 -2.090 34.408 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -2.952 -0.396 35.059 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -2.951 0.247 33.428 1.00 0.00 H new ATOM 2356 N ARG A 149 -4.415 -1.658 32.381 1.00 0.00 N ATOM 2357 CA ARG A 149 -5.556 -2.448 31.930 1.00 0.00 C ATOM 2358 C ARG A 149 -5.100 -3.793 31.375 1.00 0.00 C ATOM 2359 O ARG A 149 -5.678 -4.824 31.774 1.00 0.00 O ATOM 2360 CB ARG A 149 -6.343 -1.682 30.865 1.00 0.00 C ATOM 2361 CG ARG A 149 -7.445 -0.805 31.437 1.00 0.00 C ATOM 2362 CD ARG A 149 -8.821 -1.271 30.989 1.00 0.00 C ATOM 2363 NE ARG A 149 -9.335 -2.348 31.836 1.00 0.00 N ATOM 2364 CZ ARG A 149 -9.896 -2.150 33.028 1.00 0.00 C ATOM 2365 NH1 ARG A 149 -10.015 -0.923 33.518 1.00 0.00 N ATOM 2366 NH2 ARG A 149 -10.336 -3.184 33.730 1.00 0.00 N ATOM 2367 OXT ARG A 149 -4.167 -3.804 30.543 1.00 0.00 O ATOM 0 H ARG A 149 -3.875 -1.230 31.629 1.00 0.00 H new ATOM 0 HA ARG A 149 -6.203 -2.631 32.788 1.00 0.00 H new ATOM 0 HB2 ARG A 149 -5.654 -1.060 30.294 1.00 0.00 H new ATOM 0 HB3 ARG A 149 -6.782 -2.395 30.167 1.00 0.00 H new ATOM 0 HG2 ARG A 149 -7.393 -0.818 32.526 1.00 0.00 H new ATOM 0 HG3 ARG A 149 -7.290 0.227 31.122 1.00 0.00 H new ATOM 0 HD2 ARG A 149 -9.514 -0.430 31.011 1.00 0.00 H new ATOM 0 HD3 ARG A 149 -8.769 -1.615 29.956 1.00 0.00 H new ATOM 0 HE ARG A 149 -9.259 -3.306 31.494 1.00 0.00 H new ATOM 0 HH11 ARG A 149 -9.676 -0.124 32.981 1.00 0.00 H new ATOM 0 HH12 ARG A 149 -10.446 -0.778 34.431 1.00 0.00 H new ATOM 0 HH21 ARG A 149 -10.245 -4.129 33.358 1.00 0.00 H new ATOM 0 HH22 ARG A 149 -10.766 -3.035 34.643 1.00 0.00 H new TER 2381 ARG A 149