USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 896 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 54 GLN : amide:sc= -7.1! C(o=-4.3!,f=-7.2!) USER MOD Set 1.2: A 64 TYR OH : rot -114:sc= 1.2 USER MOD Set 1.3: A 80 THR OG1 : rot -93:sc= 1.55 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 180:sc= -0.559 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.0325 K(o=-0.033,f=-1.3!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 26:sc= 0.807 USER MOD Single : A 18 GLN : amide:sc= -0.0111 K(o=-0.011,f=-0.55) USER MOD Single : A 20 GLN : amide:sc= -0.0175 K(o=-0.018,f=-1.4!) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 23 CYS SG : rot 22:sc= 0.0479 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc=-0.00837 X(o=-0.0084,f=0) USER MOD Single : A 34 SER OG : rot 180:sc=-0.00444 USER MOD Single : A 36 GLN : amide:sc= -0.321 X(o=-0.32,f=-0.32) USER MOD Single : A 56 GLN : amide:sc= -0.0824 K(o=-0.082,f=-2.4!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -2.57! C(o=-2.6!,f=-4.4!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -155:sc= -0.657 (180deg=-0.977) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -4.13! C(o=-4.1!,f=-5.4!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -5.31! K(o=-5.3!,f=-4.4) USER MOD Single : A 90 TYR OH : rot 180:sc= -0.231 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 153:sc= 1.25 USER MOD Single : A 99 SER OG : rot 70:sc= -0.905 USER MOD Single : A 104 ASN : amide:sc= -2.51 K(o=-2.5,f=-8.9!) USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.124 USER MOD Single : A 108 HIS : no HE2:sc= -0.666 K(o=-0.67,f=-2.5) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0563 USER MOD Single : A 121 SER OG : rot 180:sc= -0.276 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -47.196 26.406 -23.771 1.00 0.00 N ATOM 2 CA GLY A 1 -47.389 26.690 -22.361 1.00 0.00 C ATOM 3 C GLY A 1 -46.248 27.494 -21.770 1.00 0.00 C ATOM 4 O GLY A 1 -45.370 26.943 -21.105 1.00 0.00 O ATOM 0 H1 GLY A 1 -48.003 25.855 -24.128 1.00 0.00 H new ATOM 0 H2 GLY A 1 -47.127 27.299 -24.299 1.00 0.00 H new ATOM 0 H3 GLY A 1 -46.320 25.860 -23.898 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -48.322 27.238 -22.228 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -47.489 25.752 -21.815 1.00 0.00 H new ATOM 8 N SER A 2 -46.257 28.800 -22.015 1.00 0.00 N ATOM 9 CA SER A 2 -45.212 29.681 -21.507 1.00 0.00 C ATOM 10 C SER A 2 -43.829 29.114 -21.813 1.00 0.00 C ATOM 11 O SER A 2 -42.933 29.144 -20.969 1.00 0.00 O ATOM 12 CB SER A 2 -45.372 29.880 -19.998 1.00 0.00 C ATOM 13 OG SER A 2 -46.373 30.841 -19.714 1.00 0.00 O ATOM 0 H SER A 2 -46.977 29.272 -22.562 1.00 0.00 H new ATOM 0 HA SER A 2 -45.309 30.646 -22.005 1.00 0.00 H new ATOM 0 HB2 SER A 2 -45.631 28.931 -19.528 1.00 0.00 H new ATOM 0 HB3 SER A 2 -44.423 30.200 -19.568 1.00 0.00 H new ATOM 0 HG SER A 2 -46.457 30.949 -18.744 1.00 0.00 H new ATOM 19 N SER A 3 -43.662 28.599 -23.027 1.00 0.00 N ATOM 20 CA SER A 3 -42.390 28.022 -23.444 1.00 0.00 C ATOM 21 C SER A 3 -41.259 29.035 -23.295 1.00 0.00 C ATOM 22 O SER A 3 -41.480 30.243 -23.363 1.00 0.00 O ATOM 23 CB SER A 3 -42.474 27.545 -24.896 1.00 0.00 C ATOM 24 OG SER A 3 -43.469 26.547 -25.048 1.00 0.00 O ATOM 0 H SER A 3 -44.392 28.570 -23.739 1.00 0.00 H new ATOM 0 HA SER A 3 -42.178 27.169 -22.800 1.00 0.00 H new ATOM 0 HB2 SER A 3 -42.699 28.390 -25.547 1.00 0.00 H new ATOM 0 HB3 SER A 3 -41.507 27.150 -25.209 1.00 0.00 H new ATOM 0 HG SER A 3 -43.504 26.260 -25.984 1.00 0.00 H new ATOM 30 N GLY A 4 -40.045 28.532 -23.090 1.00 0.00 N ATOM 31 CA GLY A 4 -38.897 29.405 -22.934 1.00 0.00 C ATOM 32 C GLY A 4 -37.672 28.889 -23.663 1.00 0.00 C ATOM 33 O GLY A 4 -37.703 27.810 -24.255 1.00 0.00 O ATOM 0 H GLY A 4 -39.837 27.535 -23.029 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -39.146 30.398 -23.307 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -38.667 29.511 -21.874 1.00 0.00 H new ATOM 37 N SER A 5 -36.591 29.661 -23.622 1.00 0.00 N ATOM 38 CA SER A 5 -35.352 29.278 -24.288 1.00 0.00 C ATOM 39 C SER A 5 -34.146 29.903 -23.594 1.00 0.00 C ATOM 40 O SER A 5 -34.206 31.039 -23.124 1.00 0.00 O ATOM 41 CB SER A 5 -35.386 29.704 -25.757 1.00 0.00 C ATOM 42 OG SER A 5 -34.396 29.022 -26.509 1.00 0.00 O ATOM 0 H SER A 5 -36.548 30.556 -23.134 1.00 0.00 H new ATOM 0 HA SER A 5 -35.259 28.193 -24.233 1.00 0.00 H new ATOM 0 HB2 SER A 5 -36.371 29.498 -26.176 1.00 0.00 H new ATOM 0 HB3 SER A 5 -35.226 30.780 -25.831 1.00 0.00 H new ATOM 0 HG SER A 5 -34.439 29.310 -27.445 1.00 0.00 H new ATOM 48 N SER A 6 -33.051 29.151 -23.533 1.00 0.00 N ATOM 49 CA SER A 6 -31.831 29.629 -22.892 1.00 0.00 C ATOM 50 C SER A 6 -30.597 29.148 -23.649 1.00 0.00 C ATOM 51 O SER A 6 -30.564 28.028 -24.158 1.00 0.00 O ATOM 52 CB SER A 6 -31.772 29.150 -21.440 1.00 0.00 C ATOM 53 OG SER A 6 -32.702 29.852 -20.634 1.00 0.00 O ATOM 0 H SER A 6 -32.984 28.209 -23.919 1.00 0.00 H new ATOM 0 HA SER A 6 -31.844 30.719 -22.907 1.00 0.00 H new ATOM 0 HB2 SER A 6 -31.983 28.081 -21.397 1.00 0.00 H new ATOM 0 HB3 SER A 6 -30.765 29.292 -21.047 1.00 0.00 H new ATOM 0 HG SER A 6 -32.646 29.527 -19.711 1.00 0.00 H new ATOM 59 N GLY A 7 -29.582 30.004 -23.719 1.00 0.00 N ATOM 60 CA GLY A 7 -28.359 29.650 -24.415 1.00 0.00 C ATOM 61 C GLY A 7 -27.245 29.255 -23.466 1.00 0.00 C ATOM 62 O GLY A 7 -27.448 28.440 -22.565 1.00 0.00 O ATOM 0 H GLY A 7 -29.585 30.937 -23.306 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -28.559 28.825 -25.098 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -28.033 30.495 -25.022 1.00 0.00 H new ATOM 66 N CYS A 8 -26.066 29.832 -23.667 1.00 0.00 N ATOM 67 CA CYS A 8 -24.915 29.534 -22.823 1.00 0.00 C ATOM 68 C CYS A 8 -24.242 30.817 -22.347 1.00 0.00 C ATOM 69 O CYS A 8 -23.924 30.961 -21.167 1.00 0.00 O ATOM 70 CB CYS A 8 -23.909 28.669 -23.584 1.00 0.00 C ATOM 71 SG CYS A 8 -23.302 29.416 -25.114 1.00 0.00 S ATOM 0 H CYS A 8 -25.882 30.509 -24.407 1.00 0.00 H new ATOM 0 HA CYS A 8 -25.269 28.986 -21.950 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -23.060 28.460 -22.933 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -24.374 27.712 -23.819 1.00 0.00 H new ATOM 0 HG CYS A 8 -22.456 28.611 -25.684 1.00 0.00 H new ATOM 77 N GLU A 9 -24.027 31.746 -23.274 1.00 0.00 N ATOM 78 CA GLU A 9 -23.390 33.016 -22.948 1.00 0.00 C ATOM 79 C GLU A 9 -21.988 32.794 -22.389 1.00 0.00 C ATOM 80 O GLU A 9 -21.651 33.287 -21.313 1.00 0.00 O ATOM 81 CB GLU A 9 -24.237 33.793 -21.938 1.00 0.00 C ATOM 82 CG GLU A 9 -24.027 35.297 -21.997 1.00 0.00 C ATOM 83 CD GLU A 9 -24.306 35.871 -23.373 1.00 0.00 C ATOM 84 OE1 GLU A 9 -25.485 36.154 -23.671 1.00 0.00 O ATOM 85 OE2 GLU A 9 -23.343 36.038 -24.151 1.00 0.00 O ATOM 0 H GLU A 9 -24.285 31.643 -24.256 1.00 0.00 H new ATOM 0 HA GLU A 9 -23.308 33.598 -23.866 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -25.290 33.574 -22.115 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -24.003 33.441 -20.933 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -24.677 35.780 -21.267 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -23.001 35.528 -21.712 1.00 0.00 H new ATOM 92 N GLY A 10 -21.174 32.046 -23.127 1.00 0.00 N ATOM 93 CA GLY A 10 -19.818 31.770 -22.689 1.00 0.00 C ATOM 94 C GLY A 10 -18.805 32.711 -23.310 1.00 0.00 C ATOM 95 O GLY A 10 -18.642 32.743 -24.529 1.00 0.00 O ATOM 0 H GLY A 10 -21.429 31.626 -24.021 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -19.767 31.851 -21.603 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -19.559 30.742 -22.944 1.00 0.00 H new ATOM 99 N GLY A 11 -18.122 33.482 -22.469 1.00 0.00 N ATOM 100 CA GLY A 11 -17.130 34.420 -22.961 1.00 0.00 C ATOM 101 C GLY A 11 -15.943 34.550 -22.028 1.00 0.00 C ATOM 102 O GLY A 11 -15.909 35.436 -21.174 1.00 0.00 O ATOM 0 H GLY A 11 -18.238 33.474 -21.456 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -16.783 34.096 -23.942 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -17.593 35.398 -23.093 1.00 0.00 H new ATOM 106 N VAL A 12 -14.965 33.664 -22.189 1.00 0.00 N ATOM 107 CA VAL A 12 -13.770 33.684 -21.354 1.00 0.00 C ATOM 108 C VAL A 12 -12.659 34.502 -22.002 1.00 0.00 C ATOM 109 O VAL A 12 -11.842 33.972 -22.755 1.00 0.00 O ATOM 110 CB VAL A 12 -13.251 32.259 -21.083 1.00 0.00 C ATOM 111 CG1 VAL A 12 -12.197 32.274 -19.987 1.00 0.00 C ATOM 112 CG2 VAL A 12 -14.402 31.334 -20.715 1.00 0.00 C ATOM 0 H VAL A 12 -14.977 32.923 -22.890 1.00 0.00 H new ATOM 0 HA VAL A 12 -14.053 34.146 -20.408 1.00 0.00 H new ATOM 0 HB VAL A 12 -12.788 31.880 -21.994 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -11.842 31.259 -19.809 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -11.361 32.902 -20.295 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -12.631 32.672 -19.070 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -14.017 30.332 -20.527 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.896 31.707 -19.818 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.118 31.300 -21.536 1.00 0.00 H new ATOM 122 N ASP A 13 -12.636 35.797 -21.705 1.00 0.00 N ATOM 123 CA ASP A 13 -11.624 36.690 -22.258 1.00 0.00 C ATOM 124 C ASP A 13 -10.358 36.669 -21.407 1.00 0.00 C ATOM 125 O ASP A 13 -10.422 36.736 -20.180 1.00 0.00 O ATOM 126 CB ASP A 13 -12.168 38.116 -22.350 1.00 0.00 C ATOM 127 CG ASP A 13 -11.422 38.956 -23.369 1.00 0.00 C ATOM 128 OD1 ASP A 13 -11.828 38.953 -24.550 1.00 0.00 O ATOM 129 OD2 ASP A 13 -10.432 39.614 -22.986 1.00 0.00 O ATOM 0 H ASP A 13 -13.306 36.252 -21.085 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.373 36.340 -23.259 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -13.225 38.082 -22.615 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -12.100 38.592 -21.372 1.00 0.00 H new ATOM 134 N MET A 14 -9.209 36.575 -22.068 1.00 0.00 N ATOM 135 CA MET A 14 -7.928 36.545 -21.373 1.00 0.00 C ATOM 136 C MET A 14 -6.991 37.621 -21.912 1.00 0.00 C ATOM 137 O MET A 14 -7.242 38.201 -22.968 1.00 0.00 O ATOM 138 CB MET A 14 -7.277 35.167 -21.515 1.00 0.00 C ATOM 139 CG MET A 14 -7.822 34.134 -20.542 1.00 0.00 C ATOM 140 SD MET A 14 -7.194 34.360 -18.867 1.00 0.00 S ATOM 141 CE MET A 14 -7.242 32.676 -18.258 1.00 0.00 C ATOM 0 H MET A 14 -9.139 36.518 -23.084 1.00 0.00 H new ATOM 0 HA MET A 14 -8.112 36.744 -20.317 1.00 0.00 H new ATOM 0 HB2 MET A 14 -7.424 34.808 -22.534 1.00 0.00 H new ATOM 0 HB3 MET A 14 -6.202 35.265 -21.364 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.910 34.191 -20.529 1.00 0.00 H new ATOM 0 HG3 MET A 14 -7.560 33.136 -20.893 1.00 0.00 H new ATOM 0 HE1 MET A 14 -6.882 32.651 -17.229 1.00 0.00 H new ATOM 0 HE2 MET A 14 -8.266 32.305 -18.293 1.00 0.00 H new ATOM 0 HE3 MET A 14 -6.607 32.046 -18.880 1.00 0.00 H new ATOM 151 N GLN A 15 -5.912 37.881 -21.181 1.00 0.00 N ATOM 152 CA GLN A 15 -4.939 38.889 -21.587 1.00 0.00 C ATOM 153 C GLN A 15 -3.573 38.258 -21.833 1.00 0.00 C ATOM 154 O GLN A 15 -3.375 37.069 -21.585 1.00 0.00 O ATOM 155 CB GLN A 15 -4.826 39.978 -20.519 1.00 0.00 C ATOM 156 CG GLN A 15 -5.911 41.039 -20.616 1.00 0.00 C ATOM 157 CD GLN A 15 -5.623 42.073 -21.687 1.00 0.00 C ATOM 158 OE1 GLN A 15 -4.465 42.367 -21.987 1.00 0.00 O ATOM 159 NE2 GLN A 15 -6.677 42.631 -22.270 1.00 0.00 N ATOM 0 H GLN A 15 -5.689 37.408 -20.305 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.285 39.338 -22.518 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.869 39.515 -19.533 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.851 40.458 -20.603 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -6.866 40.558 -20.828 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -6.013 41.538 -19.652 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -7.619 42.357 -21.990 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -6.545 43.333 -22.998 1.00 0.00 H new ATOM 168 N GLN A 16 -2.634 39.062 -22.322 1.00 0.00 N ATOM 169 CA GLN A 16 -1.287 38.581 -22.602 1.00 0.00 C ATOM 170 C GLN A 16 -0.422 38.623 -21.347 1.00 0.00 C ATOM 171 O GLN A 16 0.252 39.617 -21.078 1.00 0.00 O ATOM 172 CB GLN A 16 -0.643 39.420 -23.708 1.00 0.00 C ATOM 173 CG GLN A 16 -1.098 39.035 -25.106 1.00 0.00 C ATOM 174 CD GLN A 16 -0.100 39.433 -26.175 1.00 0.00 C ATOM 175 OE1 GLN A 16 0.295 40.596 -26.270 1.00 0.00 O ATOM 176 NE2 GLN A 16 0.315 38.468 -26.987 1.00 0.00 N ATOM 0 H GLN A 16 -2.782 40.049 -22.532 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.360 37.546 -22.936 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -0.874 40.471 -23.536 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.440 39.317 -23.646 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.259 37.958 -25.148 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.057 39.509 -25.315 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -0.038 37.518 -26.873 1.00 0.00 H new ATOM 0 HE22 GLN A 16 0.987 38.677 -27.725 1.00 0.00 H new ATOM 185 N SER A 17 -0.446 37.536 -20.581 1.00 0.00 N ATOM 186 CA SER A 17 0.333 37.450 -19.352 1.00 0.00 C ATOM 187 C SER A 17 1.150 36.162 -19.315 1.00 0.00 C ATOM 188 O SER A 17 0.599 35.069 -19.188 1.00 0.00 O ATOM 189 CB SER A 17 -0.589 37.518 -18.133 1.00 0.00 C ATOM 190 OG SER A 17 -1.461 36.401 -18.091 1.00 0.00 O ATOM 0 H SER A 17 -0.997 36.703 -20.790 1.00 0.00 H new ATOM 0 HA SER A 17 1.020 38.296 -19.327 1.00 0.00 H new ATOM 0 HB2 SER A 17 0.009 37.551 -17.222 1.00 0.00 H new ATOM 0 HB3 SER A 17 -1.173 38.438 -18.165 1.00 0.00 H new ATOM 0 HG SER A 17 -1.048 35.646 -18.559 1.00 0.00 H new ATOM 196 N GLN A 18 2.467 36.301 -19.427 1.00 0.00 N ATOM 197 CA GLN A 18 3.360 35.149 -19.408 1.00 0.00 C ATOM 198 C GLN A 18 3.879 34.886 -17.998 1.00 0.00 C ATOM 199 O GLN A 18 5.071 34.653 -17.797 1.00 0.00 O ATOM 200 CB GLN A 18 4.535 35.371 -20.363 1.00 0.00 C ATOM 201 CG GLN A 18 4.192 35.105 -21.820 1.00 0.00 C ATOM 202 CD GLN A 18 5.423 35.004 -22.699 1.00 0.00 C ATOM 203 OE1 GLN A 18 6.422 34.390 -22.322 1.00 0.00 O ATOM 204 NE2 GLN A 18 5.358 35.608 -23.880 1.00 0.00 N ATOM 0 H GLN A 18 2.939 37.199 -19.532 1.00 0.00 H new ATOM 0 HA GLN A 18 2.794 34.277 -19.736 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.885 36.398 -20.262 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.360 34.722 -20.068 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.622 34.179 -21.892 1.00 0.00 H new ATOM 0 HG3 GLN A 18 3.550 35.904 -22.190 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.510 36.106 -24.152 1.00 0.00 H new ATOM 0 HE22 GLN A 18 6.156 35.574 -24.515 1.00 0.00 H new ATOM 213 N VAL A 19 2.976 34.925 -17.023 1.00 0.00 N ATOM 214 CA VAL A 19 3.342 34.690 -15.632 1.00 0.00 C ATOM 215 C VAL A 19 3.617 33.212 -15.377 1.00 0.00 C ATOM 216 O VAL A 19 3.143 32.348 -16.114 1.00 0.00 O ATOM 217 CB VAL A 19 2.236 35.168 -14.672 1.00 0.00 C ATOM 218 CG1 VAL A 19 0.942 34.410 -14.929 1.00 0.00 C ATOM 219 CG2 VAL A 19 2.679 35.007 -13.226 1.00 0.00 C ATOM 0 H VAL A 19 1.985 35.117 -17.171 1.00 0.00 H new ATOM 0 HA VAL A 19 4.250 35.263 -15.443 1.00 0.00 H new ATOM 0 HB VAL A 19 2.052 36.227 -14.856 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.172 34.761 -14.242 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.618 34.581 -15.955 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.108 33.344 -14.774 1.00 0.00 H new ATOM 0 HG21 VAL A 19 1.885 35.350 -12.562 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.892 33.957 -13.025 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.578 35.599 -13.053 1.00 0.00 H new ATOM 229 N GLN A 20 4.384 32.931 -14.330 1.00 0.00 N ATOM 230 CA GLN A 20 4.722 31.556 -13.979 1.00 0.00 C ATOM 231 C GLN A 20 4.115 31.173 -12.633 1.00 0.00 C ATOM 232 O GLN A 20 4.730 31.369 -11.584 1.00 0.00 O ATOM 233 CB GLN A 20 6.241 31.377 -13.935 1.00 0.00 C ATOM 234 CG GLN A 20 6.898 31.421 -15.305 1.00 0.00 C ATOM 235 CD GLN A 20 8.333 30.934 -15.280 1.00 0.00 C ATOM 236 OE1 GLN A 20 8.719 30.147 -14.416 1.00 0.00 O ATOM 237 NE2 GLN A 20 9.134 31.402 -16.231 1.00 0.00 N ATOM 0 H GLN A 20 4.783 33.636 -13.710 1.00 0.00 H new ATOM 0 HA GLN A 20 4.307 30.900 -14.745 1.00 0.00 H new ATOM 0 HB2 GLN A 20 6.673 32.158 -13.309 1.00 0.00 H new ATOM 0 HB3 GLN A 20 6.473 30.423 -13.460 1.00 0.00 H new ATOM 0 HG2 GLN A 20 6.323 30.809 -15.999 1.00 0.00 H new ATOM 0 HG3 GLN A 20 6.872 32.443 -15.684 1.00 0.00 H new ATOM 0 HE21 GLN A 20 8.772 32.053 -16.928 1.00 0.00 H new ATOM 0 HE22 GLN A 20 10.111 31.110 -16.264 1.00 0.00 H new ATOM 246 N LEU A 21 2.905 30.626 -12.670 1.00 0.00 N ATOM 247 CA LEU A 21 2.213 30.215 -11.454 1.00 0.00 C ATOM 248 C LEU A 21 2.716 28.858 -10.973 1.00 0.00 C ATOM 249 O LEU A 21 2.623 27.862 -11.691 1.00 0.00 O ATOM 250 CB LEU A 21 0.704 30.156 -11.696 1.00 0.00 C ATOM 251 CG LEU A 21 -0.004 31.502 -11.852 1.00 0.00 C ATOM 252 CD1 LEU A 21 -1.323 31.330 -12.589 1.00 0.00 C ATOM 253 CD2 LEU A 21 -0.231 32.146 -10.492 1.00 0.00 C ATOM 0 H LEU A 21 2.383 30.457 -13.530 1.00 0.00 H new ATOM 0 HA LEU A 21 2.421 30.954 -10.680 1.00 0.00 H new ATOM 0 HB2 LEU A 21 0.523 29.567 -12.595 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.244 29.620 -10.866 1.00 0.00 H new ATOM 0 HG LEU A 21 0.634 32.160 -12.442 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.812 32.299 -12.690 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.135 30.913 -13.578 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.968 30.655 -12.027 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -0.736 33.103 -10.622 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -0.848 31.491 -9.878 1.00 0.00 H new ATOM 0 HD23 LEU A 21 0.729 32.306 -10.000 1.00 0.00 H new ATOM 265 N GLN A 22 3.247 28.826 -9.755 1.00 0.00 N ATOM 266 CA GLN A 22 3.763 27.590 -9.179 1.00 0.00 C ATOM 267 C GLN A 22 2.917 27.150 -7.988 1.00 0.00 C ATOM 268 O GLN A 22 2.612 27.949 -7.102 1.00 0.00 O ATOM 269 CB GLN A 22 5.218 27.772 -8.747 1.00 0.00 C ATOM 270 CG GLN A 22 6.132 28.241 -9.868 1.00 0.00 C ATOM 271 CD GLN A 22 7.306 29.055 -9.362 1.00 0.00 C ATOM 272 OE1 GLN A 22 7.860 28.773 -8.300 1.00 0.00 O ATOM 273 NE2 GLN A 22 7.692 30.073 -10.123 1.00 0.00 N ATOM 0 H GLN A 22 3.331 29.642 -9.148 1.00 0.00 H new ATOM 0 HA GLN A 22 3.713 26.814 -9.943 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.258 28.493 -7.931 1.00 0.00 H new ATOM 0 HB3 GLN A 22 5.593 26.826 -8.355 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.504 27.375 -10.415 1.00 0.00 H new ATOM 0 HG3 GLN A 22 5.557 28.840 -10.574 1.00 0.00 H new ATOM 0 HE21 GLN A 22 7.204 30.271 -10.996 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.477 30.657 -9.834 1.00 0.00 H new ATOM 282 N CYS A 23 2.542 25.876 -7.974 1.00 0.00 N ATOM 283 CA CYS A 23 1.731 25.330 -6.892 1.00 0.00 C ATOM 284 C CYS A 23 2.565 24.425 -5.990 1.00 0.00 C ATOM 285 O CYS A 23 3.459 23.710 -6.443 1.00 0.00 O ATOM 286 CB CYS A 23 0.544 24.550 -7.459 1.00 0.00 C ATOM 287 SG CYS A 23 1.010 23.088 -8.415 1.00 0.00 S ATOM 0 H CYS A 23 2.786 25.202 -8.699 1.00 0.00 H new ATOM 0 HA CYS A 23 1.358 26.163 -6.296 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -0.101 24.242 -6.636 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -0.043 25.214 -8.093 1.00 0.00 H new ATOM 0 HG CYS A 23 2.202 22.704 -8.067 1.00 0.00 H new ATOM 293 N PRO A 24 2.267 24.456 -4.683 1.00 0.00 N ATOM 294 CA PRO A 24 2.979 23.645 -3.690 1.00 0.00 C ATOM 295 C PRO A 24 2.668 22.159 -3.825 1.00 0.00 C ATOM 296 O PRO A 24 2.027 21.733 -4.787 1.00 0.00 O ATOM 297 CB PRO A 24 2.457 24.181 -2.354 1.00 0.00 C ATOM 298 CG PRO A 24 1.116 24.747 -2.672 1.00 0.00 C ATOM 299 CD PRO A 24 1.214 25.284 -4.073 1.00 0.00 C ATOM 0 HA PRO A 24 4.061 23.720 -3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 24 2.386 23.388 -1.610 1.00 0.00 H new ATOM 0 HB3 PRO A 24 3.122 24.942 -1.946 1.00 0.00 H new ATOM 0 HG2 PRO A 24 0.343 23.982 -2.601 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.849 25.536 -1.969 1.00 0.00 H new ATOM 0 HD2 PRO A 24 0.268 25.189 -4.607 1.00 0.00 H new ATOM 0 HD3 PRO A 24 1.479 26.341 -4.080 1.00 0.00 H new ATOM 307 N LEU A 25 3.126 21.373 -2.857 1.00 0.00 N ATOM 308 CA LEU A 25 2.896 19.932 -2.867 1.00 0.00 C ATOM 309 C LEU A 25 1.410 19.617 -2.733 1.00 0.00 C ATOM 310 O LEU A 25 0.591 20.511 -2.520 1.00 0.00 O ATOM 311 CB LEU A 25 3.676 19.263 -1.734 1.00 0.00 C ATOM 312 CG LEU A 25 3.671 19.996 -0.392 1.00 0.00 C ATOM 313 CD1 LEU A 25 2.246 20.289 0.051 1.00 0.00 C ATOM 314 CD2 LEU A 25 4.403 19.180 0.664 1.00 0.00 C ATOM 0 H LEU A 25 3.659 21.709 -2.055 1.00 0.00 H new ATOM 0 HA LEU A 25 3.247 19.540 -3.822 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.270 18.263 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.711 19.141 -2.055 1.00 0.00 H new ATOM 0 HG LEU A 25 4.193 20.945 -0.516 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.262 20.811 1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.754 20.914 -0.695 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.698 19.353 0.158 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.390 19.717 1.613 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.909 18.216 0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.435 19.022 0.351 1.00 0.00 H new ATOM 326 N THR A 26 1.068 18.338 -2.857 1.00 0.00 N ATOM 327 CA THR A 26 -0.319 17.904 -2.749 1.00 0.00 C ATOM 328 C THR A 26 -0.432 16.627 -1.924 1.00 0.00 C ATOM 329 O THR A 26 0.420 15.741 -1.987 1.00 0.00 O ATOM 330 CB THR A 26 -0.942 17.662 -4.137 1.00 0.00 C ATOM 331 OG1 THR A 26 0.064 17.225 -5.056 1.00 0.00 O ATOM 332 CG2 THR A 26 -1.600 18.930 -4.662 1.00 0.00 C ATOM 0 H THR A 26 1.733 17.585 -3.032 1.00 0.00 H new ATOM 0 HA THR A 26 -0.863 18.706 -2.250 1.00 0.00 H new ATOM 0 HB THR A 26 -1.704 16.889 -4.040 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.341 17.072 -5.935 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.033 18.736 -5.643 1.00 0.00 H new ATOM 0 HG22 THR A 26 -2.385 19.244 -3.974 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.853 19.720 -4.745 1.00 0.00 H new ATOM 340 N PRO A 27 -1.510 16.527 -1.132 1.00 0.00 N ATOM 341 CA PRO A 27 -1.761 15.360 -0.280 1.00 0.00 C ATOM 342 C PRO A 27 -2.119 14.118 -1.089 1.00 0.00 C ATOM 343 O PRO A 27 -2.529 14.199 -2.247 1.00 0.00 O ATOM 344 CB PRO A 27 -2.948 15.798 0.581 1.00 0.00 C ATOM 345 CG PRO A 27 -3.643 16.835 -0.232 1.00 0.00 C ATOM 346 CD PRO A 27 -2.567 17.544 -1.007 1.00 0.00 C ATOM 0 HA PRO A 27 -0.880 15.079 0.296 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.608 14.959 0.801 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -2.616 16.202 1.537 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -4.372 16.381 -0.903 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -4.187 17.531 0.406 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.925 17.873 -1.982 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.211 18.431 -0.482 1.00 0.00 H new ATOM 354 N PRO A 28 -1.961 12.940 -0.467 1.00 0.00 N ATOM 355 CA PRO A 28 -2.264 11.658 -1.111 1.00 0.00 C ATOM 356 C PRO A 28 -3.760 11.456 -1.326 1.00 0.00 C ATOM 357 O PRO A 28 -4.546 11.513 -0.380 1.00 0.00 O ATOM 358 CB PRO A 28 -1.722 10.626 -0.119 1.00 0.00 C ATOM 359 CG PRO A 28 -1.750 11.318 1.200 1.00 0.00 C ATOM 360 CD PRO A 28 -1.477 12.769 0.913 1.00 0.00 C ATOM 0 HA PRO A 28 -1.822 11.587 -2.105 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -2.338 9.727 -0.107 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.711 10.317 -0.382 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.717 11.192 1.686 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.999 10.905 1.873 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.005 13.422 1.608 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.416 13.003 0.999 1.00 0.00 H new ATOM 368 N ARG A 29 -4.147 11.220 -2.575 1.00 0.00 N ATOM 369 CA ARG A 29 -5.549 11.010 -2.914 1.00 0.00 C ATOM 370 C ARG A 29 -5.705 9.850 -3.893 1.00 0.00 C ATOM 371 O ARG A 29 -4.887 9.673 -4.795 1.00 0.00 O ATOM 372 CB ARG A 29 -6.147 12.283 -3.516 1.00 0.00 C ATOM 373 CG ARG A 29 -6.746 13.222 -2.482 1.00 0.00 C ATOM 374 CD ARG A 29 -8.101 12.728 -2.000 1.00 0.00 C ATOM 375 NE ARG A 29 -8.405 13.195 -0.650 1.00 0.00 N ATOM 376 CZ ARG A 29 -9.605 13.092 -0.089 1.00 0.00 C ATOM 377 NH1 ARG A 29 -10.608 12.541 -0.759 1.00 0.00 N ATOM 378 NH2 ARG A 29 -9.804 13.540 1.144 1.00 0.00 N ATOM 0 H ARG A 29 -3.509 11.169 -3.369 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.084 10.763 -1.997 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.371 12.812 -4.069 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.919 12.007 -4.234 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -6.067 13.312 -1.634 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.852 14.218 -2.912 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -8.876 13.070 -2.685 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.117 11.638 -2.019 1.00 0.00 H new ATOM 0 HE ARG A 29 -7.655 13.624 -0.108 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -10.459 12.195 -1.707 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -11.528 12.463 -0.326 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -9.035 13.964 1.663 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -10.726 13.460 1.573 1.00 0.00 H new ATOM 392 N GLY A 30 -6.760 9.063 -3.708 1.00 0.00 N ATOM 393 CA GLY A 30 -7.003 7.930 -4.582 1.00 0.00 C ATOM 394 C GLY A 30 -6.009 6.806 -4.364 1.00 0.00 C ATOM 395 O GLY A 30 -5.751 6.011 -5.269 1.00 0.00 O ATOM 0 H GLY A 30 -7.451 9.190 -2.968 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.013 7.556 -4.414 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.953 8.259 -5.620 1.00 0.00 H new ATOM 399 N LEU A 31 -5.448 6.740 -3.162 1.00 0.00 N ATOM 400 CA LEU A 31 -4.474 5.706 -2.828 1.00 0.00 C ATOM 401 C LEU A 31 -5.167 4.376 -2.548 1.00 0.00 C ATOM 402 O LEU A 31 -5.932 4.254 -1.591 1.00 0.00 O ATOM 403 CB LEU A 31 -3.647 6.129 -1.613 1.00 0.00 C ATOM 404 CG LEU A 31 -2.461 5.230 -1.262 1.00 0.00 C ATOM 405 CD1 LEU A 31 -2.945 3.892 -0.726 1.00 0.00 C ATOM 406 CD2 LEU A 31 -1.567 5.028 -2.477 1.00 0.00 C ATOM 0 H LEU A 31 -5.650 7.390 -2.402 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.811 5.577 -3.683 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.273 7.138 -1.787 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.308 6.178 -0.748 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.877 5.720 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.087 3.266 -0.482 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.543 4.054 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.553 3.395 -1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.728 4.386 -2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.141 4.560 -3.277 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.191 5.993 -2.817 1.00 0.00 H new ATOM 418 N GLN A 32 -4.892 3.383 -3.387 1.00 0.00 N ATOM 419 CA GLN A 32 -5.488 2.062 -3.228 1.00 0.00 C ATOM 420 C GLN A 32 -4.661 1.001 -3.947 1.00 0.00 C ATOM 421 O GLN A 32 -4.015 1.282 -4.956 1.00 0.00 O ATOM 422 CB GLN A 32 -6.921 2.058 -3.763 1.00 0.00 C ATOM 423 CG GLN A 32 -7.739 0.861 -3.304 1.00 0.00 C ATOM 424 CD GLN A 32 -9.220 1.170 -3.205 1.00 0.00 C ATOM 425 OE1 GLN A 32 -10.028 0.644 -3.971 1.00 0.00 O ATOM 426 NE2 GLN A 32 -9.584 2.027 -2.258 1.00 0.00 N ATOM 0 H GLN A 32 -4.261 3.468 -4.184 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.504 1.824 -2.164 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.421 2.973 -3.445 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -6.893 2.072 -4.853 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -7.590 0.035 -4.000 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -7.375 0.528 -2.332 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.880 2.439 -1.645 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -10.567 2.273 -2.143 1.00 0.00 H new ATOM 435 N VAL A 33 -4.686 -0.219 -3.420 1.00 0.00 N ATOM 436 CA VAL A 33 -3.939 -1.323 -4.012 1.00 0.00 C ATOM 437 C VAL A 33 -4.840 -2.192 -4.882 1.00 0.00 C ATOM 438 O VAL A 33 -6.038 -2.314 -4.625 1.00 0.00 O ATOM 439 CB VAL A 33 -3.284 -2.202 -2.930 1.00 0.00 C ATOM 440 CG1 VAL A 33 -2.152 -1.452 -2.246 1.00 0.00 C ATOM 441 CG2 VAL A 33 -4.322 -2.658 -1.916 1.00 0.00 C ATOM 0 H VAL A 33 -5.215 -0.468 -2.584 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.158 -0.881 -4.631 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.864 -3.086 -3.409 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.701 -2.089 -1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.398 -1.180 -2.984 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.544 -0.549 -1.778 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.843 -3.278 -1.158 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.773 -1.787 -1.440 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.095 -3.236 -2.422 1.00 0.00 H new ATOM 451 N SER A 34 -4.256 -2.796 -5.911 1.00 0.00 N ATOM 452 CA SER A 34 -5.006 -3.653 -6.822 1.00 0.00 C ATOM 453 C SER A 34 -4.196 -4.890 -7.196 1.00 0.00 C ATOM 454 O SER A 34 -2.985 -4.942 -6.978 1.00 0.00 O ATOM 455 CB SER A 34 -5.389 -2.879 -8.085 1.00 0.00 C ATOM 456 OG SER A 34 -6.343 -3.594 -8.851 1.00 0.00 O ATOM 0 H SER A 34 -3.265 -2.708 -6.135 1.00 0.00 H new ATOM 0 HA SER A 34 -5.914 -3.976 -6.313 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.795 -1.905 -7.810 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.499 -2.695 -8.687 1.00 0.00 H new ATOM 0 HG SER A 34 -6.573 -3.078 -9.652 1.00 0.00 H new ATOM 462 N ILE A 35 -4.873 -5.885 -7.759 1.00 0.00 N ATOM 463 CA ILE A 35 -4.217 -7.122 -8.164 1.00 0.00 C ATOM 464 C ILE A 35 -4.195 -7.261 -9.683 1.00 0.00 C ATOM 465 O ILE A 35 -5.236 -7.202 -10.336 1.00 0.00 O ATOM 466 CB ILE A 35 -4.914 -8.354 -7.558 1.00 0.00 C ATOM 467 CG1 ILE A 35 -4.938 -8.253 -6.031 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.212 -9.630 -7.998 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.886 -9.233 -5.376 1.00 0.00 C ATOM 0 H ILE A 35 -5.876 -5.859 -7.945 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.194 -7.073 -7.791 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.942 -8.385 -7.918 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.932 -8.422 -5.648 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.222 -7.240 -5.746 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.716 -10.492 -7.561 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.241 -9.705 -9.085 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.175 -9.609 -7.663 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.851 -9.105 -4.294 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.900 -9.050 -5.731 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.590 -10.251 -5.631 1.00 0.00 H new ATOM 481 N GLN A 36 -3.001 -7.447 -10.237 1.00 0.00 N ATOM 482 CA GLN A 36 -2.844 -7.595 -11.679 1.00 0.00 C ATOM 483 C GLN A 36 -4.032 -8.337 -12.283 1.00 0.00 C ATOM 484 O GLN A 36 -4.053 -9.566 -12.325 1.00 0.00 O ATOM 485 CB GLN A 36 -1.547 -8.340 -11.998 1.00 0.00 C ATOM 486 CG GLN A 36 -1.158 -8.283 -13.467 1.00 0.00 C ATOM 487 CD GLN A 36 -1.222 -6.878 -14.033 1.00 0.00 C ATOM 488 OE1 GLN A 36 -2.087 -6.565 -14.852 1.00 0.00 O ATOM 489 NE2 GLN A 36 -0.304 -6.022 -13.600 1.00 0.00 N ATOM 0 H GLN A 36 -2.129 -7.499 -9.710 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.800 -6.598 -12.118 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -0.739 -7.918 -11.400 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.654 -9.383 -11.699 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -0.147 -8.673 -13.587 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.820 -8.932 -14.040 1.00 0.00 H new ATOM 0 HE21 GLN A 36 0.394 -6.324 -12.921 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -0.297 -5.063 -13.947 1.00 0.00 H new ATOM 498 N GLY A 37 -5.022 -7.580 -12.749 1.00 0.00 N ATOM 499 CA GLY A 37 -6.200 -8.183 -13.343 1.00 0.00 C ATOM 500 C GLY A 37 -7.193 -8.664 -12.303 1.00 0.00 C ATOM 501 O GLY A 37 -6.807 -9.056 -11.203 1.00 0.00 O ATOM 0 H GLY A 37 -5.028 -6.560 -12.725 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.685 -7.458 -13.996 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.898 -9.023 -13.968 1.00 0.00 H new ATOM 505 N GLU A 38 -8.475 -8.631 -12.652 1.00 0.00 N ATOM 506 CA GLU A 38 -9.526 -9.064 -11.738 1.00 0.00 C ATOM 507 C GLU A 38 -9.287 -10.499 -11.276 1.00 0.00 C ATOM 508 O GLU A 38 -9.302 -11.432 -12.079 1.00 0.00 O ATOM 509 CB GLU A 38 -10.895 -8.955 -12.412 1.00 0.00 C ATOM 510 CG GLU A 38 -10.911 -9.460 -13.845 1.00 0.00 C ATOM 511 CD GLU A 38 -10.605 -8.368 -14.852 1.00 0.00 C ATOM 512 OE1 GLU A 38 -11.074 -7.228 -14.650 1.00 0.00 O ATOM 513 OE2 GLU A 38 -9.898 -8.653 -15.841 1.00 0.00 O ATOM 0 H GLU A 38 -8.811 -8.309 -13.560 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.506 -8.411 -10.865 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.623 -9.519 -11.829 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.215 -7.913 -12.399 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.181 -10.262 -13.952 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.889 -9.888 -14.065 1.00 0.00 H new ATOM 520 N ALA A 39 -9.066 -10.667 -9.976 1.00 0.00 N ATOM 521 CA ALA A 39 -8.826 -11.986 -9.406 1.00 0.00 C ATOM 522 C ALA A 39 -10.001 -12.434 -8.544 1.00 0.00 C ATOM 523 O ALA A 39 -10.768 -11.611 -8.046 1.00 0.00 O ATOM 524 CB ALA A 39 -7.541 -11.983 -8.591 1.00 0.00 C ATOM 0 H ALA A 39 -9.048 -9.905 -9.298 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.721 -12.696 -10.227 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.374 -12.975 -8.171 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.703 -11.716 -9.234 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.624 -11.256 -7.783 1.00 0.00 H new ATOM 530 N VAL A 40 -10.137 -13.746 -8.372 1.00 0.00 N ATOM 531 CA VAL A 40 -11.219 -14.303 -7.570 1.00 0.00 C ATOM 532 C VAL A 40 -10.677 -15.208 -6.469 1.00 0.00 C ATOM 533 O VAL A 40 -10.949 -14.997 -5.288 1.00 0.00 O ATOM 534 CB VAL A 40 -12.206 -15.105 -8.438 1.00 0.00 C ATOM 535 CG1 VAL A 40 -13.342 -15.654 -7.588 1.00 0.00 C ATOM 536 CG2 VAL A 40 -12.745 -14.240 -9.568 1.00 0.00 C ATOM 0 H VAL A 40 -9.511 -14.442 -8.778 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.744 -13.461 -7.119 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.674 -15.948 -8.878 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -14.029 -16.218 -8.219 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.936 -16.310 -6.818 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -13.876 -14.829 -7.117 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.441 -14.822 -10.172 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -13.262 -13.376 -9.150 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -11.919 -13.901 -10.193 1.00 0.00 H new ATOM 546 N ALA A 41 -9.908 -16.217 -6.866 1.00 0.00 N ATOM 547 CA ALA A 41 -9.325 -17.153 -5.913 1.00 0.00 C ATOM 548 C ALA A 41 -7.875 -17.466 -6.267 1.00 0.00 C ATOM 549 O ALA A 41 -7.573 -17.867 -7.391 1.00 0.00 O ATOM 550 CB ALA A 41 -10.145 -18.433 -5.861 1.00 0.00 C ATOM 0 H ALA A 41 -9.675 -16.407 -7.841 1.00 0.00 H new ATOM 0 HA ALA A 41 -9.338 -16.685 -4.928 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -9.698 -19.123 -5.145 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.164 -18.200 -5.552 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.162 -18.895 -6.848 1.00 0.00 H new ATOM 556 N VAL A 42 -6.981 -17.279 -5.301 1.00 0.00 N ATOM 557 CA VAL A 42 -5.562 -17.542 -5.512 1.00 0.00 C ATOM 558 C VAL A 42 -5.159 -18.889 -4.922 1.00 0.00 C ATOM 559 O VAL A 42 -5.811 -19.399 -4.011 1.00 0.00 O ATOM 560 CB VAL A 42 -4.688 -16.438 -4.887 1.00 0.00 C ATOM 561 CG1 VAL A 42 -3.326 -16.992 -4.496 1.00 0.00 C ATOM 562 CG2 VAL A 42 -4.541 -15.268 -5.847 1.00 0.00 C ATOM 0 H VAL A 42 -7.214 -16.947 -4.365 1.00 0.00 H new ATOM 0 HA VAL A 42 -5.400 -17.558 -6.590 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.180 -16.077 -3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.723 -16.198 -4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -3.454 -17.794 -3.770 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.824 -17.381 -5.382 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -3.921 -14.497 -5.389 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.072 -15.611 -6.769 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -5.525 -14.856 -6.072 1.00 0.00 H new ATOM 572 N ARG A 43 -4.081 -19.460 -5.448 1.00 0.00 N ATOM 573 CA ARG A 43 -3.591 -20.749 -4.975 1.00 0.00 C ATOM 574 C ARG A 43 -2.617 -20.567 -3.814 1.00 0.00 C ATOM 575 O ARG A 43 -1.810 -19.638 -3.788 1.00 0.00 O ATOM 576 CB ARG A 43 -2.907 -21.508 -6.113 1.00 0.00 C ATOM 577 CG ARG A 43 -3.881 -22.144 -7.092 1.00 0.00 C ATOM 578 CD ARG A 43 -4.427 -21.122 -8.077 1.00 0.00 C ATOM 579 NE ARG A 43 -5.534 -21.658 -8.864 1.00 0.00 N ATOM 580 CZ ARG A 43 -5.999 -21.081 -9.967 1.00 0.00 C ATOM 581 NH1 ARG A 43 -5.454 -19.956 -10.410 1.00 0.00 N ATOM 582 NH2 ARG A 43 -7.010 -21.629 -10.629 1.00 0.00 N ATOM 0 H ARG A 43 -3.530 -19.050 -6.202 1.00 0.00 H new ATOM 0 HA ARG A 43 -4.446 -21.327 -4.624 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -2.255 -20.823 -6.655 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -2.271 -22.285 -5.689 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -3.381 -22.945 -7.637 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -4.706 -22.599 -6.543 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -4.763 -20.238 -7.534 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -3.629 -20.801 -8.746 1.00 0.00 H new ATOM 0 HE ARG A 43 -5.974 -22.523 -8.550 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -4.676 -19.532 -9.904 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -5.812 -19.515 -11.257 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -7.431 -22.494 -10.291 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -7.366 -21.185 -11.475 1.00 0.00 H new ATOM 596 N PRO A 44 -2.694 -21.474 -2.829 1.00 0.00 N ATOM 597 CA PRO A 44 -1.828 -21.435 -1.647 1.00 0.00 C ATOM 598 C PRO A 44 -0.379 -21.775 -1.979 1.00 0.00 C ATOM 599 O PRO A 44 0.043 -22.924 -1.860 1.00 0.00 O ATOM 600 CB PRO A 44 -2.430 -22.503 -0.730 1.00 0.00 C ATOM 601 CG PRO A 44 -3.126 -23.445 -1.651 1.00 0.00 C ATOM 602 CD PRO A 44 -3.633 -22.608 -2.793 1.00 0.00 C ATOM 0 HA PRO A 44 -1.793 -20.441 -1.201 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.657 -23.011 -0.154 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.125 -22.064 -0.014 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -2.445 -24.218 -2.006 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -3.947 -23.952 -1.144 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -3.628 -23.163 -3.731 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -4.657 -22.276 -2.624 1.00 0.00 H new ATOM 610 N GLY A 45 0.380 -20.766 -2.397 1.00 0.00 N ATOM 611 CA GLY A 45 1.774 -20.978 -2.739 1.00 0.00 C ATOM 612 C GLY A 45 2.184 -20.231 -3.993 1.00 0.00 C ATOM 613 O GLY A 45 3.372 -20.036 -4.246 1.00 0.00 O ATOM 0 H GLY A 45 0.054 -19.806 -2.505 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.402 -20.657 -1.907 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.952 -22.044 -2.880 1.00 0.00 H new ATOM 617 N GLU A 46 1.197 -19.812 -4.779 1.00 0.00 N ATOM 618 CA GLU A 46 1.462 -19.085 -6.015 1.00 0.00 C ATOM 619 C GLU A 46 1.812 -17.628 -5.724 1.00 0.00 C ATOM 620 O GLU A 46 1.319 -17.041 -4.760 1.00 0.00 O ATOM 621 CB GLU A 46 0.249 -19.153 -6.944 1.00 0.00 C ATOM 622 CG GLU A 46 -0.918 -18.294 -6.486 1.00 0.00 C ATOM 623 CD GLU A 46 -1.755 -17.783 -7.642 1.00 0.00 C ATOM 624 OE1 GLU A 46 -2.090 -18.589 -8.535 1.00 0.00 O ATOM 625 OE2 GLU A 46 -2.075 -16.576 -7.654 1.00 0.00 O ATOM 0 H GLU A 46 0.208 -19.963 -4.582 1.00 0.00 H new ATOM 0 HA GLU A 46 2.314 -19.555 -6.507 1.00 0.00 H new ATOM 0 HB2 GLU A 46 0.550 -18.839 -7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.081 -20.189 -7.021 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.550 -18.875 -5.814 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -0.539 -17.447 -5.915 1.00 0.00 H new ATOM 632 N ASP A 47 2.666 -17.052 -6.563 1.00 0.00 N ATOM 633 CA ASP A 47 3.082 -15.664 -6.397 1.00 0.00 C ATOM 634 C ASP A 47 2.058 -14.713 -7.008 1.00 0.00 C ATOM 635 O ASP A 47 1.825 -14.728 -8.216 1.00 0.00 O ATOM 636 CB ASP A 47 4.452 -15.440 -7.039 1.00 0.00 C ATOM 637 CG ASP A 47 5.390 -16.612 -6.827 1.00 0.00 C ATOM 638 OD1 ASP A 47 5.174 -17.667 -7.460 1.00 0.00 O ATOM 639 OD2 ASP A 47 6.340 -16.474 -6.029 1.00 0.00 O ATOM 0 H ASP A 47 3.084 -17.525 -7.365 1.00 0.00 H new ATOM 0 HA ASP A 47 3.152 -15.456 -5.329 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.325 -15.269 -8.108 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.902 -14.539 -6.623 1.00 0.00 H new ATOM 644 N VAL A 48 1.448 -13.887 -6.164 1.00 0.00 N ATOM 645 CA VAL A 48 0.448 -12.929 -6.620 1.00 0.00 C ATOM 646 C VAL A 48 1.058 -11.543 -6.802 1.00 0.00 C ATOM 647 O VAL A 48 1.842 -11.084 -5.971 1.00 0.00 O ATOM 648 CB VAL A 48 -0.730 -12.833 -5.633 1.00 0.00 C ATOM 649 CG1 VAL A 48 -0.372 -11.935 -4.458 1.00 0.00 C ATOM 650 CG2 VAL A 48 -1.978 -12.327 -6.340 1.00 0.00 C ATOM 0 H VAL A 48 1.629 -13.862 -5.160 1.00 0.00 H new ATOM 0 HA VAL A 48 0.079 -13.290 -7.580 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.938 -13.831 -5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.217 -11.880 -3.772 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.493 -12.345 -3.937 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.135 -10.936 -4.823 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.800 -12.266 -5.627 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.785 -11.339 -6.757 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.245 -13.014 -7.143 1.00 0.00 H new ATOM 660 N LEU A 49 0.692 -10.881 -7.894 1.00 0.00 N ATOM 661 CA LEU A 49 1.203 -9.546 -8.186 1.00 0.00 C ATOM 662 C LEU A 49 0.225 -8.474 -7.715 1.00 0.00 C ATOM 663 O LEU A 49 -0.969 -8.537 -8.006 1.00 0.00 O ATOM 664 CB LEU A 49 1.460 -9.394 -9.687 1.00 0.00 C ATOM 665 CG LEU A 49 2.677 -10.137 -10.238 1.00 0.00 C ATOM 666 CD1 LEU A 49 3.952 -9.360 -9.948 1.00 0.00 C ATOM 667 CD2 LEU A 49 2.758 -11.538 -9.650 1.00 0.00 C ATOM 0 H LEU A 49 0.044 -11.246 -8.592 1.00 0.00 H new ATOM 0 HA LEU A 49 2.142 -9.417 -7.648 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.576 -9.738 -10.223 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.575 -8.333 -9.910 1.00 0.00 H new ATOM 0 HG LEU A 49 2.567 -10.225 -11.319 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.808 -9.904 -10.347 1.00 0.00 H new ATOM 0 HD12 LEU A 49 3.894 -8.378 -10.418 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.068 -9.241 -8.871 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.630 -12.052 -10.054 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.845 -11.473 -8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.857 -12.094 -9.909 1.00 0.00 H new ATOM 679 N PHE A 50 0.741 -7.489 -6.986 1.00 0.00 N ATOM 680 CA PHE A 50 -0.086 -6.402 -6.475 1.00 0.00 C ATOM 681 C PHE A 50 0.259 -5.086 -7.165 1.00 0.00 C ATOM 682 O PHE A 50 1.355 -4.551 -6.994 1.00 0.00 O ATOM 683 CB PHE A 50 0.096 -6.262 -4.963 1.00 0.00 C ATOM 684 CG PHE A 50 -0.800 -7.164 -4.165 1.00 0.00 C ATOM 685 CD1 PHE A 50 -2.105 -6.793 -3.883 1.00 0.00 C ATOM 686 CD2 PHE A 50 -0.338 -8.383 -3.695 1.00 0.00 C ATOM 687 CE1 PHE A 50 -2.933 -7.622 -3.149 1.00 0.00 C ATOM 688 CE2 PHE A 50 -1.162 -9.216 -2.961 1.00 0.00 C ATOM 689 CZ PHE A 50 -2.461 -8.834 -2.686 1.00 0.00 C ATOM 0 H PHE A 50 1.728 -7.422 -6.736 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.128 -6.641 -6.687 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.134 -6.477 -4.709 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.095 -5.228 -4.676 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.480 -5.845 -4.241 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.677 -8.686 -3.904 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.949 -7.322 -2.938 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.790 -10.165 -2.603 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.105 -9.482 -2.110 1.00 0.00 H new ATOM 699 N VAL A 51 -0.684 -4.568 -7.946 1.00 0.00 N ATOM 700 CA VAL A 51 -0.481 -3.314 -8.662 1.00 0.00 C ATOM 701 C VAL A 51 -0.763 -2.116 -7.762 1.00 0.00 C ATOM 702 O VAL A 51 -1.778 -2.074 -7.067 1.00 0.00 O ATOM 703 CB VAL A 51 -1.379 -3.229 -9.910 1.00 0.00 C ATOM 704 CG1 VAL A 51 -1.169 -1.905 -10.629 1.00 0.00 C ATOM 705 CG2 VAL A 51 -1.109 -4.400 -10.842 1.00 0.00 C ATOM 0 H VAL A 51 -1.596 -4.998 -8.099 1.00 0.00 H new ATOM 0 HA VAL A 51 0.563 -3.292 -8.974 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.420 -3.281 -9.591 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.812 -1.863 -11.508 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.418 -1.083 -9.958 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -0.127 -1.819 -10.937 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.753 -4.323 -11.718 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -0.065 -4.382 -11.156 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.315 -5.335 -10.321 1.00 0.00 H new ATOM 715 N VAL A 52 0.141 -1.143 -7.781 1.00 0.00 N ATOM 716 CA VAL A 52 -0.011 0.058 -6.969 1.00 0.00 C ATOM 717 C VAL A 52 0.004 1.313 -7.834 1.00 0.00 C ATOM 718 O VAL A 52 0.854 1.464 -8.712 1.00 0.00 O ATOM 719 CB VAL A 52 1.103 0.165 -5.910 1.00 0.00 C ATOM 720 CG1 VAL A 52 2.376 0.722 -6.529 1.00 0.00 C ATOM 721 CG2 VAL A 52 0.647 1.026 -4.742 1.00 0.00 C ATOM 0 H VAL A 52 0.987 -1.163 -8.350 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.975 -0.021 -6.466 1.00 0.00 H new ATOM 0 HB VAL A 52 1.318 -0.834 -5.532 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.152 0.791 -5.766 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.711 0.061 -7.329 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.179 1.714 -6.936 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.446 1.091 -4.004 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.403 2.026 -5.101 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.235 0.579 -4.283 1.00 0.00 H new ATOM 731 N ARG A 53 -0.942 2.211 -7.581 1.00 0.00 N ATOM 732 CA ARG A 53 -1.039 3.453 -8.338 1.00 0.00 C ATOM 733 C ARG A 53 -1.734 4.537 -7.518 1.00 0.00 C ATOM 734 O ARG A 53 -2.507 4.239 -6.608 1.00 0.00 O ATOM 735 CB ARG A 53 -1.799 3.222 -9.645 1.00 0.00 C ATOM 736 CG ARG A 53 -1.794 4.425 -10.574 1.00 0.00 C ATOM 737 CD ARG A 53 -2.782 4.250 -11.716 1.00 0.00 C ATOM 738 NE ARG A 53 -2.472 5.121 -12.847 1.00 0.00 N ATOM 739 CZ ARG A 53 -3.108 5.068 -14.012 1.00 0.00 C ATOM 740 NH1 ARG A 53 -4.084 4.191 -14.199 1.00 0.00 N ATOM 741 NH2 ARG A 53 -2.767 5.894 -14.993 1.00 0.00 N ATOM 0 H ARG A 53 -1.652 2.102 -6.857 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.028 3.788 -8.569 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.360 2.370 -10.165 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.831 2.957 -9.413 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.044 5.323 -10.009 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -0.792 4.571 -10.977 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -2.774 3.211 -12.046 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -3.790 4.464 -11.359 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.726 5.808 -12.736 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -4.349 3.554 -13.447 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.571 4.153 -15.095 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -2.016 6.570 -14.853 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -3.256 5.853 -15.887 1.00 0.00 H new ATOM 755 N GLN A 54 -1.453 5.793 -7.848 1.00 0.00 N ATOM 756 CA GLN A 54 -2.051 6.920 -7.142 1.00 0.00 C ATOM 757 C GLN A 54 -2.819 7.820 -8.104 1.00 0.00 C ATOM 758 O GLN A 54 -2.603 7.777 -9.314 1.00 0.00 O ATOM 759 CB GLN A 54 -0.970 7.728 -6.421 1.00 0.00 C ATOM 760 CG GLN A 54 -0.745 7.295 -4.981 1.00 0.00 C ATOM 761 CD GLN A 54 0.661 7.588 -4.497 1.00 0.00 C ATOM 762 OE1 GLN A 54 1.527 6.712 -4.503 1.00 0.00 O ATOM 763 NE2 GLN A 54 0.897 8.824 -4.073 1.00 0.00 N ATOM 0 H GLN A 54 -0.815 6.056 -8.599 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.752 6.525 -6.406 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -0.033 7.636 -6.970 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.246 8.782 -6.436 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.461 7.805 -4.336 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.941 6.226 -4.892 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.150 9.519 -4.085 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.825 9.079 -3.735 1.00 0.00 H new ATOM 772 N GLU A 55 -3.716 8.634 -7.556 1.00 0.00 N ATOM 773 CA GLU A 55 -4.517 9.543 -8.368 1.00 0.00 C ATOM 774 C GLU A 55 -3.952 10.960 -8.315 1.00 0.00 C ATOM 775 O GLU A 55 -4.184 11.765 -9.216 1.00 0.00 O ATOM 776 CB GLU A 55 -5.970 9.544 -7.889 1.00 0.00 C ATOM 777 CG GLU A 55 -6.786 10.710 -8.421 1.00 0.00 C ATOM 778 CD GLU A 55 -7.034 10.615 -9.914 1.00 0.00 C ATOM 779 OE1 GLU A 55 -7.479 9.543 -10.374 1.00 0.00 O ATOM 780 OE2 GLU A 55 -6.782 11.612 -10.622 1.00 0.00 O ATOM 0 H GLU A 55 -3.906 8.683 -6.555 1.00 0.00 H new ATOM 0 HA GLU A 55 -4.482 9.194 -9.400 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -6.444 8.611 -8.193 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -5.984 9.569 -6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.742 10.747 -7.899 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.266 11.643 -8.201 1.00 0.00 H new ATOM 787 N GLN A 56 -3.211 11.256 -7.252 1.00 0.00 N ATOM 788 CA GLN A 56 -2.615 12.576 -7.080 1.00 0.00 C ATOM 789 C GLN A 56 -1.094 12.482 -7.017 1.00 0.00 C ATOM 790 O GLN A 56 -0.388 13.406 -7.416 1.00 0.00 O ATOM 791 CB GLN A 56 -3.150 13.240 -5.810 1.00 0.00 C ATOM 792 CG GLN A 56 -3.179 14.758 -5.883 1.00 0.00 C ATOM 793 CD GLN A 56 -4.273 15.362 -5.025 1.00 0.00 C ATOM 794 OE1 GLN A 56 -4.002 15.968 -3.988 1.00 0.00 O ATOM 795 NE2 GLN A 56 -5.519 15.202 -5.455 1.00 0.00 N ATOM 0 H GLN A 56 -3.009 10.600 -6.497 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.888 13.185 -7.942 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.158 12.875 -5.616 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.533 12.937 -4.964 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -2.214 15.152 -5.565 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -3.323 15.066 -6.919 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -5.698 14.693 -6.320 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -6.297 15.589 -4.920 1.00 0.00 H new ATOM 804 N GLY A 57 -0.596 11.357 -6.512 1.00 0.00 N ATOM 805 CA GLY A 57 0.838 11.164 -6.405 1.00 0.00 C ATOM 806 C GLY A 57 1.481 10.844 -7.740 1.00 0.00 C ATOM 807 O GLY A 57 1.452 9.699 -8.193 1.00 0.00 O ATOM 0 H GLY A 57 -1.160 10.577 -6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.293 12.065 -5.993 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.041 10.355 -5.704 1.00 0.00 H new ATOM 811 N ASP A 58 2.062 11.857 -8.373 1.00 0.00 N ATOM 812 CA ASP A 58 2.714 11.679 -9.665 1.00 0.00 C ATOM 813 C ASP A 58 4.228 11.586 -9.501 1.00 0.00 C ATOM 814 O ASP A 58 4.884 10.766 -10.144 1.00 0.00 O ATOM 815 CB ASP A 58 2.361 12.834 -10.602 1.00 0.00 C ATOM 816 CG ASP A 58 2.855 12.604 -12.017 1.00 0.00 C ATOM 817 OD1 ASP A 58 2.206 11.833 -12.755 1.00 0.00 O ATOM 818 OD2 ASP A 58 3.891 13.195 -12.386 1.00 0.00 O ATOM 0 H ASP A 58 2.095 12.810 -8.012 1.00 0.00 H new ATOM 0 HA ASP A 58 2.355 10.746 -10.100 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.280 12.969 -10.615 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.793 13.757 -10.215 1.00 0.00 H new ATOM 823 N VAL A 59 4.778 12.432 -8.636 1.00 0.00 N ATOM 824 CA VAL A 59 6.214 12.446 -8.387 1.00 0.00 C ATOM 825 C VAL A 59 6.514 12.414 -6.892 1.00 0.00 C ATOM 826 O VAL A 59 7.299 11.589 -6.422 1.00 0.00 O ATOM 827 CB VAL A 59 6.880 13.689 -9.006 1.00 0.00 C ATOM 828 CG1 VAL A 59 6.267 14.961 -8.439 1.00 0.00 C ATOM 829 CG2 VAL A 59 8.382 13.661 -8.772 1.00 0.00 C ATOM 0 H VAL A 59 4.250 13.117 -8.096 1.00 0.00 H new ATOM 0 HA VAL A 59 6.624 11.552 -8.856 1.00 0.00 H new ATOM 0 HB VAL A 59 6.703 13.677 -10.082 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.750 15.829 -8.888 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.201 14.982 -8.664 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.411 14.984 -7.359 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.836 14.547 -9.216 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.583 13.648 -7.701 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.805 12.768 -9.231 1.00 0.00 H new ATOM 839 N LEU A 60 5.883 13.317 -6.149 1.00 0.00 N ATOM 840 CA LEU A 60 6.081 13.392 -4.706 1.00 0.00 C ATOM 841 C LEU A 60 6.286 12.003 -4.110 1.00 0.00 C ATOM 842 O LEU A 60 5.432 11.125 -4.246 1.00 0.00 O ATOM 843 CB LEU A 60 4.882 14.072 -4.042 1.00 0.00 C ATOM 844 CG LEU A 60 4.859 15.600 -4.103 1.00 0.00 C ATOM 845 CD1 LEU A 60 3.447 16.121 -3.881 1.00 0.00 C ATOM 846 CD2 LEU A 60 5.815 16.189 -3.076 1.00 0.00 C ATOM 0 H LEU A 60 5.231 14.007 -6.522 1.00 0.00 H new ATOM 0 HA LEU A 60 6.977 13.983 -4.518 1.00 0.00 H new ATOM 0 HB2 LEU A 60 3.972 13.696 -4.509 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.852 13.769 -2.995 1.00 0.00 H new ATOM 0 HG LEU A 60 5.187 15.911 -5.095 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.449 17.210 -3.928 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.788 15.726 -4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.091 15.801 -2.902 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.786 17.277 -3.134 1.00 0.00 H new ATOM 0 HD22 LEU A 60 5.517 15.870 -2.077 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.828 15.842 -3.281 1.00 0.00 H new ATOM 858 N THR A 61 7.422 11.810 -3.449 1.00 0.00 N ATOM 859 CA THR A 61 7.739 10.528 -2.832 1.00 0.00 C ATOM 860 C THR A 61 7.034 10.375 -1.489 1.00 0.00 C ATOM 861 O THR A 61 7.170 11.220 -0.604 1.00 0.00 O ATOM 862 CB THR A 61 9.256 10.365 -2.623 1.00 0.00 C ATOM 863 OG1 THR A 61 9.533 9.102 -2.007 1.00 0.00 O ATOM 864 CG2 THR A 61 9.808 11.488 -1.757 1.00 0.00 C ATOM 0 H THR A 61 8.139 12.525 -3.327 1.00 0.00 H new ATOM 0 HA THR A 61 7.388 9.754 -3.514 1.00 0.00 H new ATOM 0 HB THR A 61 9.741 10.408 -3.598 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.500 9.005 -1.879 1.00 0.00 H new ATOM 0 HG21 THR A 61 10.881 11.351 -1.624 1.00 0.00 H new ATOM 0 HG22 THR A 61 9.622 12.446 -2.242 1.00 0.00 H new ATOM 0 HG23 THR A 61 9.317 11.472 -0.784 1.00 0.00 H new ATOM 872 N THR A 62 6.279 9.290 -1.342 1.00 0.00 N ATOM 873 CA THR A 62 5.551 9.026 -0.108 1.00 0.00 C ATOM 874 C THR A 62 5.774 7.595 0.367 1.00 0.00 C ATOM 875 O THR A 62 5.794 6.660 -0.434 1.00 0.00 O ATOM 876 CB THR A 62 4.040 9.267 -0.284 1.00 0.00 C ATOM 877 OG1 THR A 62 3.806 10.607 -0.732 1.00 0.00 O ATOM 878 CG2 THR A 62 3.298 9.028 1.023 1.00 0.00 C ATOM 0 H THR A 62 6.156 8.580 -2.064 1.00 0.00 H new ATOM 0 HA THR A 62 5.937 9.718 0.640 1.00 0.00 H new ATOM 0 HB THR A 62 3.667 8.565 -1.030 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.843 10.751 -0.843 1.00 0.00 H new ATOM 0 HG21 THR A 62 2.233 9.204 0.874 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.454 7.999 1.347 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.675 9.709 1.785 1.00 0.00 H new ATOM 886 N LYS A 63 5.942 7.430 1.675 1.00 0.00 N ATOM 887 CA LYS A 63 6.162 6.112 2.258 1.00 0.00 C ATOM 888 C LYS A 63 4.880 5.286 2.236 1.00 0.00 C ATOM 889 O LYS A 63 3.837 5.728 2.718 1.00 0.00 O ATOM 890 CB LYS A 63 6.671 6.246 3.695 1.00 0.00 C ATOM 891 CG LYS A 63 7.526 5.075 4.149 1.00 0.00 C ATOM 892 CD LYS A 63 8.281 5.400 5.428 1.00 0.00 C ATOM 893 CE LYS A 63 9.317 6.490 5.201 1.00 0.00 C ATOM 894 NZ LYS A 63 10.377 6.474 6.247 1.00 0.00 N ATOM 0 H LYS A 63 5.930 8.193 2.351 1.00 0.00 H new ATOM 0 HA LYS A 63 6.914 5.598 1.659 1.00 0.00 H new ATOM 0 HB2 LYS A 63 7.252 7.164 3.782 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.818 6.344 4.366 1.00 0.00 H new ATOM 0 HG2 LYS A 63 6.893 4.202 4.310 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.235 4.814 3.363 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.577 5.720 6.196 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.772 4.501 5.800 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.773 6.359 4.220 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.826 7.463 5.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.064 7.232 6.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.945 6.624 7.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.863 5.555 6.234 1.00 0.00 H new ATOM 908 N TYR A 64 4.965 4.085 1.675 1.00 0.00 N ATOM 909 CA TYR A 64 3.811 3.198 1.590 1.00 0.00 C ATOM 910 C TYR A 64 4.081 1.882 2.313 1.00 0.00 C ATOM 911 O TYR A 64 5.109 1.241 2.095 1.00 0.00 O ATOM 912 CB TYR A 64 3.458 2.925 0.127 1.00 0.00 C ATOM 913 CG TYR A 64 3.514 4.157 -0.749 1.00 0.00 C ATOM 914 CD1 TYR A 64 2.636 5.215 -0.550 1.00 0.00 C ATOM 915 CD2 TYR A 64 4.443 4.262 -1.776 1.00 0.00 C ATOM 916 CE1 TYR A 64 2.682 6.342 -1.348 1.00 0.00 C ATOM 917 CE2 TYR A 64 4.498 5.385 -2.578 1.00 0.00 C ATOM 918 CZ TYR A 64 3.615 6.422 -2.360 1.00 0.00 C ATOM 919 OH TYR A 64 3.666 7.543 -3.158 1.00 0.00 O ATOM 0 H TYR A 64 5.821 3.703 1.272 1.00 0.00 H new ATOM 0 HA TYR A 64 2.969 3.692 2.074 1.00 0.00 H new ATOM 0 HB2 TYR A 64 4.143 2.176 -0.270 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.456 2.499 0.077 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.905 5.156 0.242 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.135 3.451 -1.951 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.991 7.155 -1.180 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.228 5.451 -3.371 1.00 0.00 H new ATOM 0 HH TYR A 64 3.419 7.303 -4.075 1.00 0.00 H new ATOM 929 N GLN A 65 3.149 1.486 3.174 1.00 0.00 N ATOM 930 CA GLN A 65 3.285 0.247 3.930 1.00 0.00 C ATOM 931 C GLN A 65 2.612 -0.912 3.202 1.00 0.00 C ATOM 932 O GLN A 65 1.564 -0.742 2.578 1.00 0.00 O ATOM 933 CB GLN A 65 2.682 0.407 5.327 1.00 0.00 C ATOM 934 CG GLN A 65 3.652 0.982 6.346 1.00 0.00 C ATOM 935 CD GLN A 65 4.544 -0.077 6.964 1.00 0.00 C ATOM 936 OE1 GLN A 65 4.418 -1.265 6.663 1.00 0.00 O ATOM 937 NE2 GLN A 65 5.454 0.348 7.833 1.00 0.00 N ATOM 0 H GLN A 65 2.292 2.005 3.365 1.00 0.00 H new ATOM 0 HA GLN A 65 4.348 0.024 4.025 1.00 0.00 H new ATOM 0 HB2 GLN A 65 1.808 1.055 5.264 1.00 0.00 H new ATOM 0 HB3 GLN A 65 2.334 -0.565 5.677 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.272 1.739 5.865 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.090 1.484 7.134 1.00 0.00 H new ATOM 0 HE21 GLN A 65 5.524 1.341 8.053 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.083 -0.319 8.280 1.00 0.00 H new ATOM 946 N VAL A 66 3.220 -2.091 3.286 1.00 0.00 N ATOM 947 CA VAL A 66 2.679 -3.278 2.636 1.00 0.00 C ATOM 948 C VAL A 66 2.335 -4.356 3.658 1.00 0.00 C ATOM 949 O VAL A 66 3.221 -5.020 4.197 1.00 0.00 O ATOM 950 CB VAL A 66 3.670 -3.857 1.609 1.00 0.00 C ATOM 951 CG1 VAL A 66 3.109 -5.123 0.979 1.00 0.00 C ATOM 952 CG2 VAL A 66 3.998 -2.822 0.543 1.00 0.00 C ATOM 0 H VAL A 66 4.088 -2.249 3.798 1.00 0.00 H new ATOM 0 HA VAL A 66 1.771 -2.969 2.119 1.00 0.00 H new ATOM 0 HB VAL A 66 4.593 -4.116 2.128 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.823 -5.517 0.256 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.930 -5.867 1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.171 -4.893 0.474 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.699 -3.248 -0.174 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.084 -2.529 0.027 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.446 -1.946 1.012 1.00 0.00 H new ATOM 962 N ASP A 67 1.044 -4.525 3.919 1.00 0.00 N ATOM 963 CA ASP A 67 0.582 -5.524 4.876 1.00 0.00 C ATOM 964 C ASP A 67 -0.195 -6.632 4.172 1.00 0.00 C ATOM 965 O ASP A 67 -1.306 -6.414 3.686 1.00 0.00 O ATOM 966 CB ASP A 67 -0.293 -4.870 5.946 1.00 0.00 C ATOM 967 CG ASP A 67 0.342 -3.625 6.532 1.00 0.00 C ATOM 968 OD1 ASP A 67 0.104 -2.525 5.989 1.00 0.00 O ATOM 969 OD2 ASP A 67 1.076 -3.749 7.534 1.00 0.00 O ATOM 0 H ASP A 67 0.298 -3.983 3.482 1.00 0.00 H new ATOM 0 HA ASP A 67 1.456 -5.966 5.354 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.259 -4.612 5.513 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.483 -5.588 6.744 1.00 0.00 H new ATOM 974 N LEU A 68 0.395 -7.821 4.121 1.00 0.00 N ATOM 975 CA LEU A 68 -0.242 -8.964 3.475 1.00 0.00 C ATOM 976 C LEU A 68 -1.389 -9.500 4.326 1.00 0.00 C ATOM 977 O LEU A 68 -2.517 -9.632 3.852 1.00 0.00 O ATOM 978 CB LEU A 68 0.784 -10.071 3.227 1.00 0.00 C ATOM 979 CG LEU A 68 1.640 -9.923 1.968 1.00 0.00 C ATOM 980 CD1 LEU A 68 0.804 -10.169 0.722 1.00 0.00 C ATOM 981 CD2 LEU A 68 2.280 -8.543 1.918 1.00 0.00 C ATOM 0 H LEU A 68 1.313 -8.019 4.519 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.647 -8.631 2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.448 -10.123 4.090 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.256 -11.023 3.173 1.00 0.00 H new ATOM 0 HG LEU A 68 2.434 -10.670 2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.430 -10.059 -0.164 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.393 -11.178 0.753 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.011 -9.446 0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.885 -8.455 1.016 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.501 -7.781 1.908 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.913 -8.403 2.795 1.00 0.00 H new ATOM 993 N GLY A 69 -1.093 -9.806 5.585 1.00 0.00 N ATOM 994 CA GLY A 69 -2.110 -10.322 6.482 1.00 0.00 C ATOM 995 C GLY A 69 -1.520 -11.098 7.643 1.00 0.00 C ATOM 996 O GLY A 69 -1.296 -10.544 8.719 1.00 0.00 O ATOM 0 H GLY A 69 -0.167 -9.706 6.000 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -2.704 -9.493 6.867 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -2.788 -10.968 5.924 1.00 0.00 H new ATOM 1000 N ASP A 70 -1.270 -12.384 7.426 1.00 0.00 N ATOM 1001 CA ASP A 70 -0.703 -13.238 8.464 1.00 0.00 C ATOM 1002 C ASP A 70 0.421 -14.103 7.901 1.00 0.00 C ATOM 1003 O ASP A 70 0.224 -15.282 7.609 1.00 0.00 O ATOM 1004 CB ASP A 70 -1.789 -14.125 9.074 1.00 0.00 C ATOM 1005 CG ASP A 70 -1.503 -14.479 10.520 1.00 0.00 C ATOM 1006 OD1 ASP A 70 -0.565 -15.266 10.765 1.00 0.00 O ATOM 1007 OD2 ASP A 70 -2.217 -13.967 11.408 1.00 0.00 O ATOM 0 H ASP A 70 -1.451 -12.858 6.541 1.00 0.00 H new ATOM 0 HA ASP A 70 -0.289 -12.597 9.242 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -2.749 -13.613 9.011 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.877 -15.041 8.489 1.00 0.00 H new ATOM 1012 N GLY A 71 1.600 -13.508 7.751 1.00 0.00 N ATOM 1013 CA GLY A 71 2.738 -14.239 7.223 1.00 0.00 C ATOM 1014 C GLY A 71 3.850 -13.321 6.756 1.00 0.00 C ATOM 1015 O GLY A 71 5.011 -13.503 7.123 1.00 0.00 O ATOM 0 H GLY A 71 1.788 -12.533 7.985 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.123 -14.910 7.991 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.411 -14.862 6.390 1.00 0.00 H new ATOM 1019 N PHE A 72 3.496 -12.332 5.942 1.00 0.00 N ATOM 1020 CA PHE A 72 4.473 -11.384 5.421 1.00 0.00 C ATOM 1021 C PHE A 72 4.115 -9.956 5.824 1.00 0.00 C ATOM 1022 O PHE A 72 2.999 -9.493 5.587 1.00 0.00 O ATOM 1023 CB PHE A 72 4.556 -11.489 3.897 1.00 0.00 C ATOM 1024 CG PHE A 72 5.863 -11.009 3.332 1.00 0.00 C ATOM 1025 CD1 PHE A 72 7.057 -11.593 3.721 1.00 0.00 C ATOM 1026 CD2 PHE A 72 5.896 -9.973 2.413 1.00 0.00 C ATOM 1027 CE1 PHE A 72 8.261 -11.152 3.204 1.00 0.00 C ATOM 1028 CE2 PHE A 72 7.096 -9.528 1.892 1.00 0.00 C ATOM 1029 CZ PHE A 72 8.280 -10.119 2.288 1.00 0.00 C ATOM 0 H PHE A 72 2.539 -12.166 5.629 1.00 0.00 H new ATOM 0 HA PHE A 72 5.444 -11.631 5.849 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.402 -12.527 3.604 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.745 -10.910 3.456 1.00 0.00 H new ATOM 0 HD1 PHE A 72 7.047 -12.402 4.436 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.973 -9.508 2.100 1.00 0.00 H new ATOM 0 HE1 PHE A 72 9.185 -11.615 3.516 1.00 0.00 H new ATOM 0 HE2 PHE A 72 7.108 -8.719 1.176 1.00 0.00 H new ATOM 0 HZ PHE A 72 9.219 -9.774 1.882 1.00 0.00 H new ATOM 1039 N LYS A 73 5.069 -9.263 6.436 1.00 0.00 N ATOM 1040 CA LYS A 73 4.857 -7.888 6.873 1.00 0.00 C ATOM 1041 C LYS A 73 6.071 -7.022 6.554 1.00 0.00 C ATOM 1042 O LYS A 73 7.131 -7.176 7.160 1.00 0.00 O ATOM 1043 CB LYS A 73 4.568 -7.848 8.375 1.00 0.00 C ATOM 1044 CG LYS A 73 3.282 -8.553 8.767 1.00 0.00 C ATOM 1045 CD LYS A 73 3.289 -8.952 10.233 1.00 0.00 C ATOM 1046 CE LYS A 73 2.852 -7.801 11.126 1.00 0.00 C ATOM 1047 NZ LYS A 73 2.406 -8.276 12.465 1.00 0.00 N ATOM 0 H LYS A 73 5.998 -9.631 6.641 1.00 0.00 H new ATOM 0 HA LYS A 73 3.998 -7.490 6.333 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.401 -8.306 8.909 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.515 -6.808 8.699 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.433 -7.898 8.571 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.149 -9.440 8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.624 -9.803 10.383 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.290 -9.276 10.518 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.678 -7.100 11.246 1.00 0.00 H new ATOM 0 HE3 LYS A 73 2.040 -7.256 10.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 2.116 -7.462 13.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 1.601 -8.925 12.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 3.189 -8.774 12.935 1.00 0.00 H new ATOM 1061 N ALA A 74 5.908 -6.112 5.599 1.00 0.00 N ATOM 1062 CA ALA A 74 6.990 -5.219 5.203 1.00 0.00 C ATOM 1063 C ALA A 74 6.445 -3.899 4.668 1.00 0.00 C ATOM 1064 O ALA A 74 5.242 -3.755 4.455 1.00 0.00 O ATOM 1065 CB ALA A 74 7.872 -5.890 4.160 1.00 0.00 C ATOM 0 H ALA A 74 5.038 -5.974 5.086 1.00 0.00 H new ATOM 0 HA ALA A 74 7.591 -5.002 6.086 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.676 -5.212 3.873 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.298 -6.803 4.577 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.274 -6.136 3.282 1.00 0.00 H new ATOM 1071 N MET A 75 7.338 -2.939 4.453 1.00 0.00 N ATOM 1072 CA MET A 75 6.946 -1.631 3.942 1.00 0.00 C ATOM 1073 C MET A 75 7.692 -1.304 2.653 1.00 0.00 C ATOM 1074 O MET A 75 8.920 -1.369 2.602 1.00 0.00 O ATOM 1075 CB MET A 75 7.215 -0.549 4.989 1.00 0.00 C ATOM 1076 CG MET A 75 7.097 0.866 4.446 1.00 0.00 C ATOM 1077 SD MET A 75 7.846 2.093 5.534 1.00 0.00 S ATOM 1078 CE MET A 75 9.490 2.209 4.833 1.00 0.00 C ATOM 0 H MET A 75 8.338 -3.042 4.625 1.00 0.00 H new ATOM 0 HA MET A 75 5.878 -1.659 3.725 1.00 0.00 H new ATOM 0 HB2 MET A 75 6.514 -0.672 5.815 1.00 0.00 H new ATOM 0 HB3 MET A 75 8.216 -0.690 5.397 1.00 0.00 H new ATOM 0 HG2 MET A 75 7.573 0.916 3.467 1.00 0.00 H new ATOM 0 HG3 MET A 75 6.044 1.109 4.301 1.00 0.00 H new ATOM 0 HE1 MET A 75 10.188 2.549 5.598 1.00 0.00 H new ATOM 0 HE2 MET A 75 9.800 1.230 4.468 1.00 0.00 H new ATOM 0 HE3 MET A 75 9.484 2.919 4.006 1.00 0.00 H new ATOM 1088 N TYR A 76 6.942 -0.954 1.613 1.00 0.00 N ATOM 1089 CA TYR A 76 7.533 -0.620 0.323 1.00 0.00 C ATOM 1090 C TYR A 76 7.530 0.888 0.096 1.00 0.00 C ATOM 1091 O TYR A 76 6.475 1.522 0.069 1.00 0.00 O ATOM 1092 CB TYR A 76 6.773 -1.319 -0.806 1.00 0.00 C ATOM 1093 CG TYR A 76 7.004 -2.812 -0.858 1.00 0.00 C ATOM 1094 CD1 TYR A 76 6.843 -3.600 0.275 1.00 0.00 C ATOM 1095 CD2 TYR A 76 7.384 -3.435 -2.041 1.00 0.00 C ATOM 1096 CE1 TYR A 76 7.054 -4.964 0.232 1.00 0.00 C ATOM 1097 CE2 TYR A 76 7.595 -4.799 -2.093 1.00 0.00 C ATOM 1098 CZ TYR A 76 7.429 -5.559 -0.954 1.00 0.00 C ATOM 1099 OH TYR A 76 7.640 -6.918 -1.002 1.00 0.00 O ATOM 0 H TYR A 76 5.924 -0.894 1.639 1.00 0.00 H new ATOM 0 HA TYR A 76 8.567 -0.966 0.325 1.00 0.00 H new ATOM 0 HB2 TYR A 76 5.706 -1.129 -0.687 1.00 0.00 H new ATOM 0 HB3 TYR A 76 7.070 -0.880 -1.759 1.00 0.00 H new ATOM 0 HD1 TYR A 76 6.548 -3.138 1.205 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.516 -2.843 -2.934 1.00 0.00 H new ATOM 0 HE1 TYR A 76 6.926 -5.562 1.122 1.00 0.00 H new ATOM 0 HE2 TYR A 76 7.888 -5.268 -3.021 1.00 0.00 H new ATOM 0 HH TYR A 76 7.897 -7.177 -1.911 1.00 0.00 H new ATOM 1109 N VAL A 77 8.720 1.458 -0.067 1.00 0.00 N ATOM 1110 CA VAL A 77 8.856 2.892 -0.293 1.00 0.00 C ATOM 1111 C VAL A 77 9.324 3.182 -1.715 1.00 0.00 C ATOM 1112 O VAL A 77 10.158 2.463 -2.263 1.00 0.00 O ATOM 1113 CB VAL A 77 9.848 3.525 0.701 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.231 2.916 0.537 1.00 0.00 C ATOM 1115 CG2 VAL A 77 9.896 5.035 0.516 1.00 0.00 C ATOM 0 H VAL A 77 9.603 0.949 -0.047 1.00 0.00 H new ATOM 0 HA VAL A 77 7.870 3.332 -0.141 1.00 0.00 H new ATOM 0 HB VAL A 77 9.504 3.316 1.714 1.00 0.00 H new ATOM 0 HG11 VAL A 77 11.918 3.376 1.248 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.181 1.843 0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 77 11.588 3.092 -0.478 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.602 5.466 1.226 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.216 5.267 -0.500 1.00 0.00 H new ATOM 0 HG23 VAL A 77 8.905 5.454 0.689 1.00 0.00 H new ATOM 1125 N ASN A 78 8.781 4.241 -2.306 1.00 0.00 N ATOM 1126 CA ASN A 78 9.143 4.627 -3.665 1.00 0.00 C ATOM 1127 C ASN A 78 8.540 3.663 -4.683 1.00 0.00 C ATOM 1128 O ASN A 78 9.057 3.509 -5.790 1.00 0.00 O ATOM 1129 CB ASN A 78 10.665 4.663 -3.820 1.00 0.00 C ATOM 1130 CG ASN A 78 11.118 5.687 -4.842 1.00 0.00 C ATOM 1131 OD1 ASN A 78 11.038 5.455 -6.048 1.00 0.00 O ATOM 1132 ND2 ASN A 78 11.598 6.829 -4.362 1.00 0.00 N ATOM 0 H ASN A 78 8.089 4.847 -1.865 1.00 0.00 H new ATOM 0 HA ASN A 78 8.742 5.623 -3.852 1.00 0.00 H new ATOM 0 HB2 ASN A 78 11.120 4.890 -2.856 1.00 0.00 H new ATOM 0 HB3 ASN A 78 11.021 3.676 -4.116 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.919 7.556 -5.001 1.00 0.00 H new ATOM 0 HD22 ASN A 78 11.646 6.979 -3.354 1.00 0.00 H new ATOM 1139 N LEU A 79 7.444 3.017 -4.301 1.00 0.00 N ATOM 1140 CA LEU A 79 6.769 2.068 -5.180 1.00 0.00 C ATOM 1141 C LEU A 79 6.107 2.787 -6.351 1.00 0.00 C ATOM 1142 O LEU A 79 6.381 2.488 -7.513 1.00 0.00 O ATOM 1143 CB LEU A 79 5.723 1.273 -4.397 1.00 0.00 C ATOM 1144 CG LEU A 79 5.458 -0.151 -4.886 1.00 0.00 C ATOM 1145 CD1 LEU A 79 6.731 -0.982 -4.825 1.00 0.00 C ATOM 1146 CD2 LEU A 79 4.355 -0.801 -4.064 1.00 0.00 C ATOM 0 H LEU A 79 7.004 3.133 -3.388 1.00 0.00 H new ATOM 0 HA LEU A 79 7.517 1.381 -5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.038 1.225 -3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.783 1.825 -4.421 1.00 0.00 H new ATOM 0 HG LEU A 79 5.129 -0.103 -5.924 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.523 -1.992 -5.177 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.493 -0.527 -5.458 1.00 0.00 H new ATOM 0 HD13 LEU A 79 7.090 -1.023 -3.797 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.180 -1.814 -4.426 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.655 -0.837 -3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.439 -0.218 -4.159 1.00 0.00 H new ATOM 1158 N THR A 80 5.233 3.739 -6.037 1.00 0.00 N ATOM 1159 CA THR A 80 4.532 4.502 -7.062 1.00 0.00 C ATOM 1160 C THR A 80 5.509 5.301 -7.917 1.00 0.00 C ATOM 1161 O THR A 80 5.124 5.902 -8.921 1.00 0.00 O ATOM 1162 CB THR A 80 3.504 5.465 -6.441 1.00 0.00 C ATOM 1163 OG1 THR A 80 4.011 5.999 -5.213 1.00 0.00 O ATOM 1164 CG2 THR A 80 2.183 4.755 -6.183 1.00 0.00 C ATOM 0 H THR A 80 4.994 4.000 -5.080 1.00 0.00 H new ATOM 0 HA THR A 80 4.009 3.781 -7.690 1.00 0.00 H new ATOM 0 HB THR A 80 3.330 6.278 -7.146 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.708 5.443 -4.465 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.473 5.456 -5.744 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.784 4.376 -7.124 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.345 3.924 -5.496 1.00 0.00 H new ATOM 1172 N LEU A 81 6.775 5.305 -7.513 1.00 0.00 N ATOM 1173 CA LEU A 81 7.808 6.031 -8.243 1.00 0.00 C ATOM 1174 C LEU A 81 8.498 5.124 -9.258 1.00 0.00 C ATOM 1175 O LEU A 81 9.172 5.597 -10.173 1.00 0.00 O ATOM 1176 CB LEU A 81 8.841 6.604 -7.271 1.00 0.00 C ATOM 1177 CG LEU A 81 8.535 7.993 -6.709 1.00 0.00 C ATOM 1178 CD1 LEU A 81 7.747 7.884 -5.413 1.00 0.00 C ATOM 1179 CD2 LEU A 81 9.822 8.774 -6.489 1.00 0.00 C ATOM 0 H LEU A 81 7.110 4.814 -6.684 1.00 0.00 H new ATOM 0 HA LEU A 81 7.330 6.850 -8.780 1.00 0.00 H new ATOM 0 HB2 LEU A 81 8.948 5.912 -6.436 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.805 6.643 -7.778 1.00 0.00 H new ATOM 0 HG LEU A 81 7.926 8.531 -7.435 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.539 8.883 -5.029 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.807 7.364 -5.601 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.329 7.327 -4.679 1.00 0.00 H new ATOM 0 HD21 LEU A 81 9.585 9.760 -6.089 1.00 0.00 H new ATOM 0 HD22 LEU A 81 10.456 8.238 -5.783 1.00 0.00 H new ATOM 0 HD23 LEU A 81 10.348 8.884 -7.438 1.00 0.00 H new ATOM 1191 N THR A 82 8.322 3.817 -9.090 1.00 0.00 N ATOM 1192 CA THR A 82 8.926 2.843 -9.991 1.00 0.00 C ATOM 1193 C THR A 82 7.862 1.987 -10.668 1.00 0.00 C ATOM 1194 O THR A 82 8.126 1.332 -11.676 1.00 0.00 O ATOM 1195 CB THR A 82 9.911 1.923 -9.246 1.00 0.00 C ATOM 1196 OG1 THR A 82 9.191 0.927 -8.512 1.00 0.00 O ATOM 1197 CG2 THR A 82 10.788 2.726 -8.296 1.00 0.00 C ATOM 0 H THR A 82 7.766 3.409 -8.338 1.00 0.00 H new ATOM 0 HA THR A 82 9.470 3.408 -10.748 1.00 0.00 H new ATOM 0 HB THR A 82 10.551 1.438 -9.984 1.00 0.00 H new ATOM 0 HG1 THR A 82 9.824 0.345 -8.042 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.476 2.055 -7.781 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.357 3.464 -8.862 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.161 3.235 -7.564 1.00 0.00 H new ATOM 1205 N GLY A 83 6.656 1.996 -10.108 1.00 0.00 N ATOM 1206 CA GLY A 83 5.570 1.216 -10.672 1.00 0.00 C ATOM 1207 C GLY A 83 5.644 -0.247 -10.283 1.00 0.00 C ATOM 1208 O GLY A 83 4.623 -0.871 -9.996 1.00 0.00 O ATOM 0 H GLY A 83 6.412 2.530 -9.274 1.00 0.00 H new ATOM 0 HA2 GLY A 83 4.618 1.630 -10.338 1.00 0.00 H new ATOM 0 HA3 GLY A 83 5.591 1.301 -11.758 1.00 0.00 H new ATOM 1212 N GLU A 84 6.855 -0.795 -10.275 1.00 0.00 N ATOM 1213 CA GLU A 84 7.057 -2.195 -9.921 1.00 0.00 C ATOM 1214 C GLU A 84 6.062 -2.635 -8.851 1.00 0.00 C ATOM 1215 O GLU A 84 5.993 -2.066 -7.761 1.00 0.00 O ATOM 1216 CB GLU A 84 8.487 -2.419 -9.427 1.00 0.00 C ATOM 1217 CG GLU A 84 9.515 -2.479 -10.544 1.00 0.00 C ATOM 1218 CD GLU A 84 9.668 -3.872 -11.122 1.00 0.00 C ATOM 1219 OE1 GLU A 84 8.643 -4.464 -11.521 1.00 0.00 O ATOM 1220 OE2 GLU A 84 10.811 -4.371 -11.175 1.00 0.00 O ATOM 0 H GLU A 84 7.710 -0.291 -10.509 1.00 0.00 H new ATOM 0 HA GLU A 84 6.892 -2.796 -10.815 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.755 -1.616 -8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.525 -3.349 -8.860 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.224 -1.790 -11.337 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.479 -2.139 -10.164 1.00 0.00 H new ATOM 1227 N PRO A 85 5.272 -3.671 -9.167 1.00 0.00 N ATOM 1228 CA PRO A 85 4.267 -4.210 -8.246 1.00 0.00 C ATOM 1229 C PRO A 85 4.896 -4.927 -7.056 1.00 0.00 C ATOM 1230 O PRO A 85 6.111 -4.878 -6.862 1.00 0.00 O ATOM 1231 CB PRO A 85 3.485 -5.200 -9.114 1.00 0.00 C ATOM 1232 CG PRO A 85 4.441 -5.603 -10.183 1.00 0.00 C ATOM 1233 CD PRO A 85 5.299 -4.397 -10.448 1.00 0.00 C ATOM 0 HA PRO A 85 3.650 -3.424 -7.811 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.155 -6.061 -8.533 1.00 0.00 H new ATOM 0 HB3 PRO A 85 2.592 -4.738 -9.535 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.047 -6.451 -9.865 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.911 -5.911 -11.085 1.00 0.00 H new ATOM 0 HD2 PRO A 85 6.314 -4.680 -10.728 1.00 0.00 H new ATOM 0 HD3 PRO A 85 4.900 -3.791 -11.262 1.00 0.00 H new ATOM 1241 N ILE A 86 4.062 -5.591 -6.263 1.00 0.00 N ATOM 1242 CA ILE A 86 4.537 -6.318 -5.093 1.00 0.00 C ATOM 1243 C ILE A 86 4.224 -7.807 -5.207 1.00 0.00 C ATOM 1244 O ILE A 86 3.093 -8.233 -4.976 1.00 0.00 O ATOM 1245 CB ILE A 86 3.911 -5.771 -3.797 1.00 0.00 C ATOM 1246 CG1 ILE A 86 4.468 -4.381 -3.483 1.00 0.00 C ATOM 1247 CG2 ILE A 86 4.170 -6.725 -2.640 1.00 0.00 C ATOM 1248 CD1 ILE A 86 3.514 -3.512 -2.694 1.00 0.00 C ATOM 0 H ILE A 86 3.054 -5.640 -6.410 1.00 0.00 H new ATOM 0 HA ILE A 86 5.617 -6.178 -5.052 1.00 0.00 H new ATOM 0 HB ILE A 86 2.834 -5.687 -3.939 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.397 -4.489 -2.923 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.716 -3.878 -4.418 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.721 -6.325 -1.731 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.730 -7.697 -2.864 1.00 0.00 H new ATOM 0 HG23 ILE A 86 5.244 -6.838 -2.495 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.975 -2.542 -2.508 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.594 -3.374 -3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 86 3.285 -3.993 -1.743 1.00 0.00 H new ATOM 1260 N ARG A 87 5.236 -8.593 -5.561 1.00 0.00 N ATOM 1261 CA ARG A 87 5.069 -10.034 -5.705 1.00 0.00 C ATOM 1262 C ARG A 87 5.201 -10.734 -4.355 1.00 0.00 C ATOM 1263 O ARG A 87 6.128 -10.462 -3.592 1.00 0.00 O ATOM 1264 CB ARG A 87 6.102 -10.593 -6.685 1.00 0.00 C ATOM 1265 CG ARG A 87 5.917 -12.072 -6.986 1.00 0.00 C ATOM 1266 CD ARG A 87 7.115 -12.642 -7.730 1.00 0.00 C ATOM 1267 NE ARG A 87 8.347 -12.528 -6.954 1.00 0.00 N ATOM 1268 CZ ARG A 87 9.499 -13.079 -7.319 1.00 0.00 C ATOM 1269 NH1 ARG A 87 9.576 -13.778 -8.443 1.00 0.00 N ATOM 1270 NH2 ARG A 87 10.577 -12.931 -6.560 1.00 0.00 N ATOM 0 H ARG A 87 6.179 -8.256 -5.753 1.00 0.00 H new ATOM 0 HA ARG A 87 4.069 -10.222 -6.096 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.047 -10.031 -7.618 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.100 -10.436 -6.277 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.772 -12.619 -6.054 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.016 -12.213 -7.582 1.00 0.00 H new ATOM 0 HD2 ARG A 87 6.930 -13.690 -7.965 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.235 -12.119 -8.679 1.00 0.00 H new ATOM 0 HE ARG A 87 8.321 -11.996 -6.084 1.00 0.00 H new ATOM 0 HH11 ARG A 87 8.749 -13.893 -9.029 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.462 -14.200 -8.721 1.00 0.00 H new ATOM 0 HH21 ARG A 87 10.522 -12.394 -5.695 1.00 0.00 H new ATOM 0 HH22 ARG A 87 11.461 -13.355 -6.842 1.00 0.00 H new ATOM 1284 N HIS A 88 4.268 -11.635 -4.067 1.00 0.00 N ATOM 1285 CA HIS A 88 4.280 -12.374 -2.810 1.00 0.00 C ATOM 1286 C HIS A 88 3.376 -13.600 -2.891 1.00 0.00 C ATOM 1287 O HIS A 88 2.294 -13.548 -3.476 1.00 0.00 O ATOM 1288 CB HIS A 88 3.834 -11.472 -1.659 1.00 0.00 C ATOM 1289 CG HIS A 88 3.195 -12.216 -0.527 1.00 0.00 C ATOM 1290 ND1 HIS A 88 3.884 -12.602 0.603 1.00 0.00 N ATOM 1291 CD2 HIS A 88 1.923 -12.644 -0.355 1.00 0.00 C ATOM 1292 CE1 HIS A 88 3.064 -13.237 1.421 1.00 0.00 C ATOM 1293 NE2 HIS A 88 1.867 -13.275 0.863 1.00 0.00 N ATOM 0 H HIS A 88 3.494 -11.871 -4.687 1.00 0.00 H new ATOM 0 HA HIS A 88 5.300 -12.709 -2.624 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.698 -10.925 -1.281 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.130 -10.732 -2.040 1.00 0.00 H new ATOM 0 HD2 HIS A 88 1.104 -12.514 -1.047 1.00 0.00 H new ATOM 0 HE1 HIS A 88 3.327 -13.654 2.382 1.00 0.00 H new ATOM 0 HE2 HIS A 88 1.036 -13.704 1.271 1.00 0.00 H new ATOM 1302 N ARG A 89 3.827 -14.702 -2.301 1.00 0.00 N ATOM 1303 CA ARG A 89 3.059 -15.942 -2.308 1.00 0.00 C ATOM 1304 C ARG A 89 2.581 -16.293 -0.903 1.00 0.00 C ATOM 1305 O ARG A 89 3.171 -15.866 0.090 1.00 0.00 O ATOM 1306 CB ARG A 89 3.903 -17.086 -2.872 1.00 0.00 C ATOM 1307 CG ARG A 89 5.331 -17.104 -2.351 1.00 0.00 C ATOM 1308 CD ARG A 89 5.930 -18.500 -2.416 1.00 0.00 C ATOM 1309 NE ARG A 89 6.396 -18.833 -3.760 1.00 0.00 N ATOM 1310 CZ ARG A 89 6.777 -20.053 -4.125 1.00 0.00 C ATOM 1311 NH1 ARG A 89 6.746 -21.049 -3.251 1.00 0.00 N ATOM 1312 NH2 ARG A 89 7.188 -20.277 -5.366 1.00 0.00 N ATOM 0 H ARG A 89 4.720 -14.762 -1.812 1.00 0.00 H new ATOM 0 HA ARG A 89 2.186 -15.796 -2.944 1.00 0.00 H new ATOM 0 HB2 ARG A 89 3.424 -18.034 -2.628 1.00 0.00 H new ATOM 0 HB3 ARG A 89 3.923 -17.010 -3.959 1.00 0.00 H new ATOM 0 HG2 ARG A 89 5.942 -16.417 -2.937 1.00 0.00 H new ATOM 0 HG3 ARG A 89 5.348 -16.747 -1.321 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.762 -18.570 -1.716 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.185 -19.230 -2.099 1.00 0.00 H new ATOM 0 HE ARG A 89 6.431 -18.089 -4.456 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.429 -20.880 -2.296 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.039 -21.984 -3.533 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.212 -19.513 -6.041 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.480 -21.213 -5.645 1.00 0.00 H new ATOM 1326 N TYR A 90 1.508 -17.073 -0.826 1.00 0.00 N ATOM 1327 CA TYR A 90 0.949 -17.480 0.457 1.00 0.00 C ATOM 1328 C TYR A 90 1.345 -18.914 0.795 1.00 0.00 C ATOM 1329 O TYR A 90 1.562 -19.735 -0.096 1.00 0.00 O ATOM 1330 CB TYR A 90 -0.576 -17.352 0.436 1.00 0.00 C ATOM 1331 CG TYR A 90 -1.073 -15.973 0.808 1.00 0.00 C ATOM 1332 CD1 TYR A 90 -0.681 -15.369 1.996 1.00 0.00 C ATOM 1333 CD2 TYR A 90 -1.933 -15.274 -0.030 1.00 0.00 C ATOM 1334 CE1 TYR A 90 -1.134 -14.110 2.341 1.00 0.00 C ATOM 1335 CE2 TYR A 90 -2.390 -14.014 0.306 1.00 0.00 C ATOM 1336 CZ TYR A 90 -1.988 -13.437 1.492 1.00 0.00 C ATOM 1337 OH TYR A 90 -2.440 -12.182 1.830 1.00 0.00 O ATOM 0 H TYR A 90 1.008 -17.436 -1.638 1.00 0.00 H new ATOM 0 HA TYR A 90 1.353 -16.821 1.225 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.940 -17.604 -0.560 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.003 -18.081 1.125 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.011 -15.893 2.661 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.250 -15.723 -0.960 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.821 -13.656 3.270 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.058 -13.484 -0.357 1.00 0.00 H new ATOM 0 HH TYR A 90 -3.032 -11.847 1.125 1.00 0.00 H new ATOM 1347 N GLU A 91 1.438 -19.206 2.088 1.00 0.00 N ATOM 1348 CA GLU A 91 1.809 -20.541 2.544 1.00 0.00 C ATOM 1349 C GLU A 91 0.569 -21.365 2.879 1.00 0.00 C ATOM 1350 O GLU A 91 0.459 -22.528 2.489 1.00 0.00 O ATOM 1351 CB GLU A 91 2.721 -20.450 3.769 1.00 0.00 C ATOM 1352 CG GLU A 91 3.273 -21.793 4.217 1.00 0.00 C ATOM 1353 CD GLU A 91 3.833 -21.752 5.626 1.00 0.00 C ATOM 1354 OE1 GLU A 91 3.032 -21.762 6.584 1.00 0.00 O ATOM 1355 OE2 GLU A 91 5.073 -21.712 5.770 1.00 0.00 O ATOM 0 H GLU A 91 1.262 -18.537 2.838 1.00 0.00 H new ATOM 0 HA GLU A 91 2.347 -21.037 1.736 1.00 0.00 H new ATOM 0 HB2 GLU A 91 3.552 -19.782 3.544 1.00 0.00 H new ATOM 0 HB3 GLU A 91 2.165 -20.002 4.593 1.00 0.00 H new ATOM 0 HG2 GLU A 91 2.483 -22.542 4.166 1.00 0.00 H new ATOM 0 HG3 GLU A 91 4.056 -22.108 3.528 1.00 0.00 H new ATOM 1362 N SER A 92 -0.362 -20.755 3.605 1.00 0.00 N ATOM 1363 CA SER A 92 -1.592 -21.433 3.997 1.00 0.00 C ATOM 1364 C SER A 92 -2.814 -20.704 3.444 1.00 0.00 C ATOM 1365 O SER A 92 -2.819 -19.484 3.280 1.00 0.00 O ATOM 1366 CB SER A 92 -1.686 -21.524 5.521 1.00 0.00 C ATOM 1367 OG SER A 92 -0.599 -22.261 6.055 1.00 0.00 O ATOM 0 H SER A 92 -0.288 -19.792 3.934 1.00 0.00 H new ATOM 0 HA SER A 92 -1.571 -22.440 3.580 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.695 -20.521 5.949 1.00 0.00 H new ATOM 0 HB3 SER A 92 -2.625 -21.999 5.803 1.00 0.00 H new ATOM 0 HG SER A 92 -0.681 -22.304 7.031 1.00 0.00 H new ATOM 1373 N PRO A 93 -3.875 -21.470 3.150 1.00 0.00 N ATOM 1374 CA PRO A 93 -5.123 -20.920 2.611 1.00 0.00 C ATOM 1375 C PRO A 93 -5.883 -20.091 3.641 1.00 0.00 C ATOM 1376 O PRO A 93 -5.560 -20.110 4.828 1.00 0.00 O ATOM 1377 CB PRO A 93 -5.925 -22.167 2.231 1.00 0.00 C ATOM 1378 CG PRO A 93 -5.396 -23.242 3.116 1.00 0.00 C ATOM 1379 CD PRO A 93 -3.939 -22.931 3.320 1.00 0.00 C ATOM 0 HA PRO A 93 -4.943 -20.242 1.777 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -6.993 -22.014 2.389 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.791 -22.419 1.179 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.928 -23.261 4.067 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.525 -24.223 2.659 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -3.598 -23.236 4.309 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -3.312 -23.448 2.593 1.00 0.00 H new ATOM 1387 N GLY A 94 -6.896 -19.364 3.178 1.00 0.00 N ATOM 1388 CA GLY A 94 -7.686 -18.539 4.073 1.00 0.00 C ATOM 1389 C GLY A 94 -7.638 -17.071 3.701 1.00 0.00 C ATOM 1390 O GLY A 94 -6.585 -16.551 3.331 1.00 0.00 O ATOM 0 H GLY A 94 -7.183 -19.332 2.200 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -8.721 -18.881 4.059 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.323 -18.664 5.093 1.00 0.00 H new ATOM 1394 N ILE A 95 -8.782 -16.400 3.798 1.00 0.00 N ATOM 1395 CA ILE A 95 -8.865 -14.983 3.468 1.00 0.00 C ATOM 1396 C ILE A 95 -7.886 -14.165 4.303 1.00 0.00 C ATOM 1397 O ILE A 95 -7.868 -14.263 5.530 1.00 0.00 O ATOM 1398 CB ILE A 95 -10.289 -14.437 3.687 1.00 0.00 C ATOM 1399 CG1 ILE A 95 -11.232 -14.962 2.602 1.00 0.00 C ATOM 1400 CG2 ILE A 95 -10.278 -12.916 3.695 1.00 0.00 C ATOM 1401 CD1 ILE A 95 -11.709 -16.377 2.849 1.00 0.00 C ATOM 0 H ILE A 95 -9.663 -16.815 4.102 1.00 0.00 H new ATOM 0 HA ILE A 95 -8.606 -14.889 2.413 1.00 0.00 H new ATOM 0 HB ILE A 95 -10.650 -14.783 4.655 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.097 -14.302 2.533 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.723 -14.922 1.639 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.291 -12.546 3.851 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.634 -12.561 4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -9.901 -12.550 2.740 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -12.373 -16.683 2.041 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -10.851 -17.049 2.888 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.247 -16.420 3.796 1.00 0.00 H new ATOM 1413 N TYR A 96 -7.074 -13.357 3.630 1.00 0.00 N ATOM 1414 CA TYR A 96 -6.091 -12.522 4.310 1.00 0.00 C ATOM 1415 C TYR A 96 -6.510 -11.056 4.284 1.00 0.00 C ATOM 1416 O TYR A 96 -7.280 -10.634 3.420 1.00 0.00 O ATOM 1417 CB TYR A 96 -4.716 -12.683 3.658 1.00 0.00 C ATOM 1418 CG TYR A 96 -4.045 -13.999 3.977 1.00 0.00 C ATOM 1419 CD1 TYR A 96 -3.256 -14.142 5.112 1.00 0.00 C ATOM 1420 CD2 TYR A 96 -4.198 -15.100 3.144 1.00 0.00 C ATOM 1421 CE1 TYR A 96 -2.639 -15.342 5.407 1.00 0.00 C ATOM 1422 CE2 TYR A 96 -3.587 -16.305 3.432 1.00 0.00 C ATOM 1423 CZ TYR A 96 -2.809 -16.421 4.565 1.00 0.00 C ATOM 1424 OH TYR A 96 -2.197 -17.619 4.855 1.00 0.00 O ATOM 0 H TYR A 96 -7.077 -13.263 2.614 1.00 0.00 H new ATOM 0 HA TYR A 96 -6.033 -12.846 5.349 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -4.823 -12.592 2.577 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -4.071 -11.867 3.984 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -3.123 -13.300 5.775 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -4.805 -15.012 2.255 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -2.027 -15.435 6.292 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -3.718 -17.151 2.774 1.00 0.00 H new ATOM 0 HH TYR A 96 -2.715 -18.354 4.464 1.00 0.00 H new ATOM 1434 N ARG A 97 -5.998 -10.283 5.236 1.00 0.00 N ATOM 1435 CA ARG A 97 -6.319 -8.864 5.324 1.00 0.00 C ATOM 1436 C ARG A 97 -5.183 -8.014 4.762 1.00 0.00 C ATOM 1437 O ARG A 97 -4.127 -7.882 5.381 1.00 0.00 O ATOM 1438 CB ARG A 97 -6.594 -8.471 6.777 1.00 0.00 C ATOM 1439 CG ARG A 97 -7.583 -7.326 6.921 1.00 0.00 C ATOM 1440 CD ARG A 97 -7.635 -6.810 8.350 1.00 0.00 C ATOM 1441 NE ARG A 97 -6.628 -5.781 8.598 1.00 0.00 N ATOM 1442 CZ ARG A 97 -6.618 -4.602 7.986 1.00 0.00 C ATOM 1443 NH1 ARG A 97 -7.555 -4.304 7.097 1.00 0.00 N ATOM 1444 NH2 ARG A 97 -5.669 -3.718 8.265 1.00 0.00 N ATOM 0 H ARG A 97 -5.359 -10.616 5.958 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.214 -8.682 4.730 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.976 -9.340 7.313 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -5.654 -8.190 7.253 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.301 -6.514 6.250 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.575 -7.661 6.618 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.626 -6.404 8.553 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -7.483 -7.640 9.041 1.00 0.00 H new ATOM 0 HE ARG A 97 -5.893 -5.978 9.277 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -8.287 -4.981 6.881 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -7.544 -3.398 6.629 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -4.947 -3.944 8.949 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -5.661 -2.813 7.795 1.00 0.00 H new ATOM 1458 N VAL A 98 -5.408 -7.440 3.584 1.00 0.00 N ATOM 1459 CA VAL A 98 -4.405 -6.602 2.938 1.00 0.00 C ATOM 1460 C VAL A 98 -4.735 -5.123 3.102 1.00 0.00 C ATOM 1461 O VAL A 98 -5.882 -4.709 2.928 1.00 0.00 O ATOM 1462 CB VAL A 98 -4.284 -6.926 1.438 1.00 0.00 C ATOM 1463 CG1 VAL A 98 -3.115 -6.174 0.820 1.00 0.00 C ATOM 1464 CG2 VAL A 98 -4.134 -8.426 1.227 1.00 0.00 C ATOM 0 H VAL A 98 -6.276 -7.540 3.058 1.00 0.00 H new ATOM 0 HA VAL A 98 -3.454 -6.815 3.426 1.00 0.00 H new ATOM 0 HB VAL A 98 -5.198 -6.601 0.940 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -3.046 -6.416 -0.240 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -3.269 -5.101 0.938 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -2.191 -6.465 1.319 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -4.050 -8.637 0.161 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -3.238 -8.778 1.738 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -5.007 -8.939 1.631 1.00 0.00 H new ATOM 1474 N SER A 99 -3.723 -4.329 3.439 1.00 0.00 N ATOM 1475 CA SER A 99 -3.907 -2.895 3.630 1.00 0.00 C ATOM 1476 C SER A 99 -2.676 -2.124 3.165 1.00 0.00 C ATOM 1477 O SER A 99 -1.665 -2.715 2.784 1.00 0.00 O ATOM 1478 CB SER A 99 -4.190 -2.588 5.101 1.00 0.00 C ATOM 1479 OG SER A 99 -5.582 -2.608 5.368 1.00 0.00 O ATOM 0 H SER A 99 -2.768 -4.655 3.585 1.00 0.00 H new ATOM 0 HA SER A 99 -4.760 -2.579 3.030 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.685 -3.319 5.732 1.00 0.00 H new ATOM 0 HB3 SER A 99 -3.782 -1.610 5.357 1.00 0.00 H new ATOM 0 HG SER A 99 -5.913 -3.529 5.311 1.00 0.00 H new ATOM 1485 N VAL A 100 -2.769 -0.798 3.198 1.00 0.00 N ATOM 1486 CA VAL A 100 -1.663 0.057 2.782 1.00 0.00 C ATOM 1487 C VAL A 100 -1.723 1.412 3.478 1.00 0.00 C ATOM 1488 O VAL A 100 -2.656 2.187 3.270 1.00 0.00 O ATOM 1489 CB VAL A 100 -1.667 0.275 1.257 1.00 0.00 C ATOM 1490 CG1 VAL A 100 -3.035 0.744 0.787 1.00 0.00 C ATOM 1491 CG2 VAL A 100 -0.588 1.271 0.859 1.00 0.00 C ATOM 0 H VAL A 100 -3.599 -0.293 3.509 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.743 -0.454 3.067 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.450 -0.676 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.018 0.892 -0.293 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.783 -0.008 1.038 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.286 1.684 1.278 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.605 1.413 -0.222 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.773 2.225 1.353 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.388 0.890 1.160 1.00 0.00 H new ATOM 1501 N ARG A 101 -0.722 1.690 4.306 1.00 0.00 N ATOM 1502 CA ARG A 101 -0.661 2.951 5.035 1.00 0.00 C ATOM 1503 C ARG A 101 0.323 3.913 4.375 1.00 0.00 C ATOM 1504 O ARG A 101 1.379 3.503 3.894 1.00 0.00 O ATOM 1505 CB ARG A 101 -0.254 2.706 6.489 1.00 0.00 C ATOM 1506 CG ARG A 101 0.053 3.980 7.259 1.00 0.00 C ATOM 1507 CD ARG A 101 0.891 3.695 8.495 1.00 0.00 C ATOM 1508 NE ARG A 101 0.774 4.756 9.492 1.00 0.00 N ATOM 1509 CZ ARG A 101 -0.322 4.971 10.211 1.00 0.00 C ATOM 1510 NH1 ARG A 101 -1.389 4.202 10.045 1.00 0.00 N ATOM 1511 NH2 ARG A 101 -0.352 5.956 11.099 1.00 0.00 N ATOM 0 H ARG A 101 0.058 1.059 4.489 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.653 3.402 5.014 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -1.056 2.169 6.996 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.624 2.060 6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.583 4.679 6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.879 4.462 7.553 1.00 0.00 H new ATOM 0 HD2 ARG A 101 0.578 2.748 8.935 1.00 0.00 H new ATOM 0 HD3 ARG A 101 1.936 3.582 8.206 1.00 0.00 H new ATOM 0 HE ARG A 101 1.578 5.365 9.644 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.370 3.443 9.364 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -2.229 4.369 10.598 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.467 6.549 11.230 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -1.194 6.120 11.650 1.00 0.00 H new ATOM 1525 N ALA A 102 -0.031 5.194 4.357 1.00 0.00 N ATOM 1526 CA ALA A 102 0.821 6.213 3.758 1.00 0.00 C ATOM 1527 C ALA A 102 0.677 7.546 4.486 1.00 0.00 C ATOM 1528 O ALA A 102 -0.425 7.937 4.868 1.00 0.00 O ATOM 1529 CB ALA A 102 0.490 6.378 2.282 1.00 0.00 C ATOM 0 H ALA A 102 -0.902 5.550 4.750 1.00 0.00 H new ATOM 0 HA ALA A 102 1.857 5.886 3.852 1.00 0.00 H new ATOM 0 HB1 ALA A 102 1.134 7.142 1.848 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.650 5.432 1.765 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.552 6.678 2.174 1.00 0.00 H new ATOM 1535 N GLU A 103 1.797 8.236 4.674 1.00 0.00 N ATOM 1536 CA GLU A 103 1.794 9.524 5.357 1.00 0.00 C ATOM 1537 C GLU A 103 2.981 10.376 4.918 1.00 0.00 C ATOM 1538 O GLU A 103 4.127 10.087 5.260 1.00 0.00 O ATOM 1539 CB GLU A 103 1.831 9.322 6.874 1.00 0.00 C ATOM 1540 CG GLU A 103 1.991 10.614 7.656 1.00 0.00 C ATOM 1541 CD GLU A 103 1.379 10.536 9.042 1.00 0.00 C ATOM 1542 OE1 GLU A 103 1.866 9.730 9.862 1.00 0.00 O ATOM 1543 OE2 GLU A 103 0.413 11.282 9.305 1.00 0.00 O ATOM 0 H GLU A 103 2.717 7.925 4.363 1.00 0.00 H new ATOM 0 HA GLU A 103 0.875 10.046 5.089 1.00 0.00 H new ATOM 0 HB2 GLU A 103 0.912 8.828 7.189 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.654 8.652 7.123 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.051 10.853 7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.525 11.430 7.103 1.00 0.00 H new ATOM 1550 N ASN A 104 2.697 11.428 4.156 1.00 0.00 N ATOM 1551 CA ASN A 104 3.740 12.322 3.668 1.00 0.00 C ATOM 1552 C ASN A 104 3.577 13.721 4.256 1.00 0.00 C ATOM 1553 O ASN A 104 2.560 14.032 4.876 1.00 0.00 O ATOM 1554 CB ASN A 104 3.708 12.392 2.140 1.00 0.00 C ATOM 1555 CG ASN A 104 2.308 12.621 1.602 1.00 0.00 C ATOM 1556 OD1 ASN A 104 1.416 11.794 1.792 1.00 0.00 O ATOM 1557 ND2 ASN A 104 2.111 13.746 0.925 1.00 0.00 N ATOM 0 H ASN A 104 1.753 11.682 3.864 1.00 0.00 H new ATOM 0 HA ASN A 104 4.703 11.923 3.986 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.361 13.197 1.802 1.00 0.00 H new ATOM 0 HB3 ASN A 104 4.106 11.465 1.728 1.00 0.00 H new ATOM 0 HD21 ASN A 104 1.191 13.954 0.538 1.00 0.00 H new ATOM 0 HD22 ASN A 104 2.880 14.403 0.792 1.00 0.00 H new ATOM 1564 N THR A 105 4.587 14.562 4.057 1.00 0.00 N ATOM 1565 CA THR A 105 4.557 15.927 4.567 1.00 0.00 C ATOM 1566 C THR A 105 3.228 16.604 4.248 1.00 0.00 C ATOM 1567 O THR A 105 2.534 17.082 5.144 1.00 0.00 O ATOM 1568 CB THR A 105 5.704 16.772 3.980 1.00 0.00 C ATOM 1569 OG1 THR A 105 5.676 16.710 2.550 1.00 0.00 O ATOM 1570 CG2 THR A 105 7.051 16.281 4.488 1.00 0.00 C ATOM 0 H THR A 105 5.436 14.321 3.546 1.00 0.00 H new ATOM 0 HA THR A 105 4.679 15.863 5.648 1.00 0.00 H new ATOM 0 HB THR A 105 5.567 17.805 4.301 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.407 17.251 2.185 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.846 16.892 4.061 1.00 0.00 H new ATOM 0 HG22 THR A 105 7.080 16.357 5.575 1.00 0.00 H new ATOM 0 HG23 THR A 105 7.194 15.241 4.193 1.00 0.00 H new ATOM 1578 N ALA A 106 2.880 16.639 2.966 1.00 0.00 N ATOM 1579 CA ALA A 106 1.633 17.255 2.530 1.00 0.00 C ATOM 1580 C ALA A 106 0.444 16.694 3.302 1.00 0.00 C ATOM 1581 O ALA A 106 -0.230 17.418 4.034 1.00 0.00 O ATOM 1582 CB ALA A 106 1.438 17.050 1.035 1.00 0.00 C ATOM 0 H ALA A 106 3.444 16.248 2.211 1.00 0.00 H new ATOM 0 HA ALA A 106 1.694 18.324 2.735 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.503 17.515 0.723 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.268 17.505 0.494 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.403 15.983 0.816 1.00 0.00 H new ATOM 1588 N GLY A 107 0.192 15.400 3.134 1.00 0.00 N ATOM 1589 CA GLY A 107 -0.916 14.764 3.822 1.00 0.00 C ATOM 1590 C GLY A 107 -0.674 13.289 4.073 1.00 0.00 C ATOM 1591 O GLY A 107 0.472 12.845 4.151 1.00 0.00 O ATOM 0 H GLY A 107 0.736 14.780 2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -1.086 15.268 4.773 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -1.824 14.884 3.231 1.00 0.00 H new ATOM 1595 N HIS A 108 -1.756 12.527 4.201 1.00 0.00 N ATOM 1596 CA HIS A 108 -1.655 11.093 4.446 1.00 0.00 C ATOM 1597 C HIS A 108 -2.926 10.375 4.001 1.00 0.00 C ATOM 1598 O HIS A 108 -4.022 10.931 4.074 1.00 0.00 O ATOM 1599 CB HIS A 108 -1.397 10.824 5.929 1.00 0.00 C ATOM 1600 CG HIS A 108 -2.404 11.461 6.837 1.00 0.00 C ATOM 1601 ND1 HIS A 108 -3.748 11.158 6.801 1.00 0.00 N ATOM 1602 CD2 HIS A 108 -2.255 12.388 7.812 1.00 0.00 C ATOM 1603 CE1 HIS A 108 -4.383 11.872 7.713 1.00 0.00 C ATOM 1604 NE2 HIS A 108 -3.499 12.627 8.340 1.00 0.00 N ATOM 0 H HIS A 108 -2.712 12.878 4.139 1.00 0.00 H new ATOM 0 HA HIS A 108 -0.818 10.708 3.864 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -1.396 9.747 6.100 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -0.403 11.189 6.189 1.00 0.00 H new ATOM 0 HD1 HIS A 108 -4.184 10.487 6.169 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -1.329 12.853 8.118 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -5.444 11.843 7.912 1.00 0.00 H new ATOM 1613 N ASP A 109 -2.771 9.139 3.539 1.00 0.00 N ATOM 1614 CA ASP A 109 -3.906 8.346 3.082 1.00 0.00 C ATOM 1615 C ASP A 109 -3.688 6.865 3.377 1.00 0.00 C ATOM 1616 O ASP A 109 -2.577 6.444 3.698 1.00 0.00 O ATOM 1617 CB ASP A 109 -4.129 8.553 1.583 1.00 0.00 C ATOM 1618 CG ASP A 109 -5.550 8.234 1.159 1.00 0.00 C ATOM 1619 OD1 ASP A 109 -5.932 7.046 1.214 1.00 0.00 O ATOM 1620 OD2 ASP A 109 -6.278 9.171 0.773 1.00 0.00 O ATOM 0 H ASP A 109 -1.871 8.665 3.471 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.792 8.679 3.623 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.899 9.586 1.324 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.436 7.923 1.025 1.00 0.00 H new ATOM 1625 N GLU A 110 -4.756 6.081 3.266 1.00 0.00 N ATOM 1626 CA GLU A 110 -4.680 4.648 3.524 1.00 0.00 C ATOM 1627 C GLU A 110 -5.777 3.901 2.769 1.00 0.00 C ATOM 1628 O GLU A 110 -6.869 4.428 2.559 1.00 0.00 O ATOM 1629 CB GLU A 110 -4.797 4.370 5.024 1.00 0.00 C ATOM 1630 CG GLU A 110 -4.763 2.891 5.373 1.00 0.00 C ATOM 1631 CD GLU A 110 -5.336 2.603 6.747 1.00 0.00 C ATOM 1632 OE1 GLU A 110 -6.410 3.153 7.068 1.00 0.00 O ATOM 1633 OE2 GLU A 110 -4.711 1.828 7.500 1.00 0.00 O ATOM 0 H GLU A 110 -5.683 6.414 3.000 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.712 4.292 3.171 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.983 4.876 5.543 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.728 4.801 5.393 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.325 2.332 4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.734 2.535 5.331 1.00 0.00 H new ATOM 1640 N ALA A 111 -5.476 2.672 2.365 1.00 0.00 N ATOM 1641 CA ALA A 111 -6.436 1.852 1.635 1.00 0.00 C ATOM 1642 C ALA A 111 -6.501 0.441 2.210 1.00 0.00 C ATOM 1643 O ALA A 111 -5.700 0.072 3.069 1.00 0.00 O ATOM 1644 CB ALA A 111 -6.076 1.806 0.158 1.00 0.00 C ATOM 0 H ALA A 111 -4.576 2.222 2.530 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.421 2.306 1.743 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.801 1.190 -0.374 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.088 2.816 -0.251 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -5.080 1.378 0.039 1.00 0.00 H new ATOM 1650 N VAL A 112 -7.459 -0.345 1.730 1.00 0.00 N ATOM 1651 CA VAL A 112 -7.628 -1.716 2.196 1.00 0.00 C ATOM 1652 C VAL A 112 -8.093 -2.628 1.065 1.00 0.00 C ATOM 1653 O VAL A 112 -8.686 -2.170 0.088 1.00 0.00 O ATOM 1654 CB VAL A 112 -8.642 -1.795 3.353 1.00 0.00 C ATOM 1655 CG1 VAL A 112 -8.786 -3.229 3.840 1.00 0.00 C ATOM 1656 CG2 VAL A 112 -8.224 -0.876 4.491 1.00 0.00 C ATOM 0 H VAL A 112 -8.130 -0.056 1.018 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.654 -2.051 2.552 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.613 -1.462 2.986 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -9.506 -3.265 4.657 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.135 -3.858 3.021 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -7.820 -3.593 4.191 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -8.952 -0.944 5.300 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.243 -1.176 4.859 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.178 0.152 4.131 1.00 0.00 H new ATOM 1666 N LEU A 113 -7.819 -3.920 1.204 1.00 0.00 N ATOM 1667 CA LEU A 113 -8.209 -4.898 0.194 1.00 0.00 C ATOM 1668 C LEU A 113 -8.222 -6.307 0.777 1.00 0.00 C ATOM 1669 O LEU A 113 -7.314 -6.694 1.514 1.00 0.00 O ATOM 1670 CB LEU A 113 -7.254 -4.836 -0.999 1.00 0.00 C ATOM 1671 CG LEU A 113 -7.852 -5.208 -2.357 1.00 0.00 C ATOM 1672 CD1 LEU A 113 -7.046 -4.582 -3.485 1.00 0.00 C ATOM 1673 CD2 LEU A 113 -7.911 -6.720 -2.517 1.00 0.00 C ATOM 0 H LEU A 113 -7.328 -4.315 2.006 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.217 -4.655 -0.142 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.853 -3.825 -1.066 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.413 -5.500 -0.801 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.868 -4.817 -2.404 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -7.486 -4.858 -4.443 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -7.055 -3.497 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.018 -4.942 -3.441 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -8.339 -6.967 -3.489 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.904 -7.133 -2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.532 -7.145 -1.729 1.00 0.00 H new ATOM 1685 N PHE A 114 -9.255 -7.072 0.440 1.00 0.00 N ATOM 1686 CA PHE A 114 -9.386 -8.439 0.929 1.00 0.00 C ATOM 1687 C PHE A 114 -9.031 -9.444 -0.164 1.00 0.00 C ATOM 1688 O PHE A 114 -9.438 -9.294 -1.316 1.00 0.00 O ATOM 1689 CB PHE A 114 -10.810 -8.692 1.427 1.00 0.00 C ATOM 1690 CG PHE A 114 -11.094 -8.079 2.768 1.00 0.00 C ATOM 1691 CD1 PHE A 114 -11.319 -6.717 2.889 1.00 0.00 C ATOM 1692 CD2 PHE A 114 -11.136 -8.864 3.909 1.00 0.00 C ATOM 1693 CE1 PHE A 114 -11.581 -6.149 4.121 1.00 0.00 C ATOM 1694 CE2 PHE A 114 -11.398 -8.302 5.144 1.00 0.00 C ATOM 1695 CZ PHE A 114 -11.619 -6.943 5.251 1.00 0.00 C ATOM 0 H PHE A 114 -10.014 -6.768 -0.170 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.691 -8.569 1.758 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -11.517 -8.296 0.698 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -10.981 -9.767 1.484 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -11.289 -6.092 2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -10.962 -9.927 3.832 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.756 -5.086 4.201 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -11.430 -8.925 6.025 1.00 0.00 H new ATOM 0 HZ PHE A 114 -11.821 -6.502 6.216 1.00 0.00 H new ATOM 1705 N VAL A 115 -8.269 -10.468 0.207 1.00 0.00 N ATOM 1706 CA VAL A 115 -7.859 -11.498 -0.740 1.00 0.00 C ATOM 1707 C VAL A 115 -8.392 -12.866 -0.329 1.00 0.00 C ATOM 1708 O VAL A 115 -8.461 -13.184 0.858 1.00 0.00 O ATOM 1709 CB VAL A 115 -6.325 -11.571 -0.861 1.00 0.00 C ATOM 1710 CG1 VAL A 115 -5.902 -12.889 -1.492 1.00 0.00 C ATOM 1711 CG2 VAL A 115 -5.797 -10.392 -1.664 1.00 0.00 C ATOM 0 H VAL A 115 -7.923 -10.606 1.157 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.279 -11.224 -1.708 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.896 -11.520 0.140 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.815 -12.923 -1.570 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.248 -13.717 -0.872 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.340 -12.973 -2.487 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.712 -10.460 -1.739 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -6.232 -10.409 -2.663 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -6.069 -9.461 -1.166 1.00 0.00 H new ATOM 1721 N GLN A 116 -8.766 -13.671 -1.318 1.00 0.00 N ATOM 1722 CA GLN A 116 -9.293 -15.005 -1.058 1.00 0.00 C ATOM 1723 C GLN A 116 -8.384 -16.075 -1.654 1.00 0.00 C ATOM 1724 O GLN A 116 -8.246 -16.178 -2.873 1.00 0.00 O ATOM 1725 CB GLN A 116 -10.704 -15.140 -1.633 1.00 0.00 C ATOM 1726 CG GLN A 116 -11.159 -16.581 -1.797 1.00 0.00 C ATOM 1727 CD GLN A 116 -12.664 -16.734 -1.694 1.00 0.00 C ATOM 1728 OE1 GLN A 116 -13.418 -16.043 -2.381 1.00 0.00 O ATOM 1729 NE2 GLN A 116 -13.110 -17.641 -0.834 1.00 0.00 N ATOM 0 H GLN A 116 -8.714 -13.423 -2.306 1.00 0.00 H new ATOM 0 HA GLN A 116 -9.333 -15.148 0.022 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -11.405 -14.619 -0.981 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -10.741 -14.643 -2.603 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -10.825 -16.955 -2.765 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -10.682 -17.197 -1.035 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -12.450 -18.191 -0.285 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -14.113 -17.788 -0.722 1.00 0.00 H new ATOM 1738 N VAL A 117 -7.765 -16.869 -0.787 1.00 0.00 N ATOM 1739 CA VAL A 117 -6.870 -17.932 -1.227 1.00 0.00 C ATOM 1740 C VAL A 117 -7.500 -19.304 -1.018 1.00 0.00 C ATOM 1741 O VAL A 117 -7.584 -19.795 0.107 1.00 0.00 O ATOM 1742 CB VAL A 117 -5.524 -17.878 -0.479 1.00 0.00 C ATOM 1743 CG1 VAL A 117 -5.742 -17.541 0.988 1.00 0.00 C ATOM 1744 CG2 VAL A 117 -4.780 -19.196 -0.627 1.00 0.00 C ATOM 0 H VAL A 117 -7.867 -16.796 0.225 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.693 -17.776 -2.291 1.00 0.00 H new ATOM 0 HB VAL A 117 -4.913 -17.091 -0.921 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.781 -17.507 1.500 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.231 -16.570 1.070 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.371 -18.304 1.447 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -3.832 -19.140 -0.093 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.384 -20.003 -0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.591 -19.390 -1.683 1.00 0.00 H new ATOM 1754 N SER A 118 -7.943 -19.919 -2.111 1.00 0.00 N ATOM 1755 CA SER A 118 -8.569 -21.234 -2.047 1.00 0.00 C ATOM 1756 C SER A 118 -7.736 -22.192 -1.201 1.00 0.00 C ATOM 1757 O SER A 118 -6.589 -21.903 -0.863 1.00 0.00 O ATOM 1758 CB SER A 118 -8.750 -21.804 -3.455 1.00 0.00 C ATOM 1759 OG SER A 118 -9.566 -22.963 -3.435 1.00 0.00 O ATOM 0 H SER A 118 -7.880 -19.527 -3.051 1.00 0.00 H new ATOM 0 HA SER A 118 -9.547 -21.122 -1.579 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.200 -21.050 -4.101 1.00 0.00 H new ATOM 0 HB3 SER A 118 -7.776 -22.048 -3.880 1.00 0.00 H new ATOM 0 HG SER A 118 -9.668 -23.307 -4.347 1.00 0.00 H new ATOM 1765 N GLY A 119 -8.323 -23.337 -0.863 1.00 0.00 N ATOM 1766 CA GLY A 119 -7.622 -24.321 -0.060 1.00 0.00 C ATOM 1767 C GLY A 119 -8.498 -25.504 0.303 1.00 0.00 C ATOM 1768 O GLY A 119 -9.720 -25.463 0.167 1.00 0.00 O ATOM 0 H GLY A 119 -9.271 -23.600 -1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.747 -24.675 -0.606 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -7.259 -23.848 0.853 1.00 0.00 H new ATOM 1772 N PRO A 120 -7.867 -26.589 0.775 1.00 0.00 N ATOM 1773 CA PRO A 120 -8.578 -27.810 1.167 1.00 0.00 C ATOM 1774 C PRO A 120 -9.404 -27.618 2.434 1.00 0.00 C ATOM 1775 O PRO A 120 -10.025 -28.558 2.930 1.00 0.00 O ATOM 1776 CB PRO A 120 -7.449 -28.814 1.412 1.00 0.00 C ATOM 1777 CG PRO A 120 -6.265 -27.978 1.756 1.00 0.00 C ATOM 1778 CD PRO A 120 -6.411 -26.708 0.964 1.00 0.00 C ATOM 0 HA PRO A 120 -9.292 -28.128 0.407 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -7.698 -29.500 2.222 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -7.261 -29.421 0.527 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -6.232 -27.769 2.825 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -5.338 -28.492 1.503 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.004 -25.851 1.501 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.885 -26.766 0.011 1.00 0.00 H new ATOM 1786 N SER A 121 -9.409 -26.394 2.953 1.00 0.00 N ATOM 1787 CA SER A 121 -10.157 -26.080 4.164 1.00 0.00 C ATOM 1788 C SER A 121 -9.457 -26.644 5.397 1.00 0.00 C ATOM 1789 O SER A 121 -10.060 -27.365 6.192 1.00 0.00 O ATOM 1790 CB SER A 121 -11.578 -26.638 4.071 1.00 0.00 C ATOM 1791 OG SER A 121 -12.063 -26.579 2.740 1.00 0.00 O ATOM 0 H SER A 121 -8.903 -25.604 2.553 1.00 0.00 H new ATOM 0 HA SER A 121 -10.206 -24.995 4.259 1.00 0.00 H new ATOM 0 HB2 SER A 121 -11.590 -27.670 4.420 1.00 0.00 H new ATOM 0 HB3 SER A 121 -12.238 -26.071 4.728 1.00 0.00 H new ATOM 0 HG SER A 121 -12.972 -26.943 2.707 1.00 0.00 H new ATOM 1797 N SER A 122 -8.179 -26.311 5.548 1.00 0.00 N ATOM 1798 CA SER A 122 -7.394 -26.786 6.681 1.00 0.00 C ATOM 1799 C SER A 122 -7.269 -25.704 7.749 1.00 0.00 C ATOM 1800 O SER A 122 -6.679 -24.650 7.515 1.00 0.00 O ATOM 1801 CB SER A 122 -6.003 -27.224 6.218 1.00 0.00 C ATOM 1802 OG SER A 122 -6.007 -28.578 5.802 1.00 0.00 O ATOM 0 H SER A 122 -7.665 -25.714 4.900 1.00 0.00 H new ATOM 0 HA SER A 122 -7.911 -27.642 7.115 1.00 0.00 H new ATOM 0 HB2 SER A 122 -5.673 -26.589 5.396 1.00 0.00 H new ATOM 0 HB3 SER A 122 -5.288 -27.092 7.030 1.00 0.00 H new ATOM 0 HG SER A 122 -5.107 -28.833 5.509 1.00 0.00 H new ATOM 1808 N GLY A 123 -7.831 -25.972 8.924 1.00 0.00 N ATOM 1809 CA GLY A 123 -7.773 -25.012 10.011 1.00 0.00 C ATOM 1810 C GLY A 123 -9.103 -24.326 10.250 1.00 0.00 C ATOM 1811 O GLY A 123 -9.684 -23.747 9.333 1.00 0.00 O ATOM 0 H GLY A 123 -8.325 -26.837 9.142 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -7.460 -25.520 10.924 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -7.015 -24.261 9.788 1.00 0.00 H new TER 1815 GLY A 123