USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -139:sc= -0.0769 (180deg=-0.878) USER MOD Single : A 2 SER OG : rot 14:sc= 0.893 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 128:sc= -0.231 (180deg=-1.36!) USER MOD Single : A 38 HIS : no HD1:sc= -4.08! C(o=-4.1!,f=-9.2!) USER MOD Single : A 39 THR OG1 : rot 142:sc= -1.62! USER MOD Single : A 49 ASN : amide:sc= -4.22! C(o=-4.2!,f=-3.7!) USER MOD Single : A 54 GLN : amide:sc= -9.34! C(o=-9.3!,f=-4.8!) USER MOD Single : A 60 TYR OH : rot 109:sc= 1.11 USER MOD Single : A 64 HIS : no HD1:sc= -2.19! C(o=-2.2!,f=-4.8!) USER MOD Single : A 72 HIS : no HD1:sc= -12.4! C(o=-12!,f=-24!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 HIS : no HD1:sc= -0.378 K(o=-0.38,f=-1.4) USER MOD Single : A 99 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.15) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -7.06! C(o=-7.1!,f=-11!) USER MOD Single : A 113 ASN : amide:sc= -0.251 K(o=-0.25,f=-1.3) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.036 USER MOD Single : A 125 TYR OH : rot 162:sc= -1.26! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.942 23.839 -21.077 1.00 1.00 N ATOM 2 CA MET A 1 77.080 22.909 -22.231 1.00 1.00 C ATOM 3 C MET A 1 76.059 21.786 -22.079 1.00 1.00 C ATOM 4 O MET A 1 75.044 21.950 -21.404 1.00 1.00 O ATOM 5 CB MET A 1 78.493 22.326 -22.243 1.00 1.00 C ATOM 6 CG MET A 1 79.511 23.459 -22.363 1.00 1.00 C ATOM 7 SD MET A 1 81.184 22.771 -22.319 1.00 1.00 S ATOM 8 CE MET A 1 82.011 24.239 -21.659 1.00 1.00 C ATOM 0 H1 MET A 1 77.026 24.821 -21.410 1.00 1.00 H new ATOM 0 H2 MET A 1 76.012 23.703 -20.631 1.00 1.00 H new ATOM 0 H3 MET A 1 77.691 23.644 -20.382 1.00 1.00 H new ATOM 0 HA MET A 1 76.905 23.441 -23.166 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.671 21.758 -21.330 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.605 21.633 -23.077 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.355 24.006 -23.293 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.377 24.171 -21.548 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.076 24.037 -21.548 1.00 1.00 H new ATOM 0 HE2 MET A 1 81.870 25.075 -22.344 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.586 24.490 -20.687 1.00 1.00 H new ATOM 18 N SER A 2 76.347 20.638 -22.692 1.00 1.00 N ATOM 19 CA SER A 2 75.463 19.472 -22.607 1.00 1.00 C ATOM 20 C SER A 2 76.095 18.382 -21.749 1.00 1.00 C ATOM 21 O SER A 2 75.483 17.340 -21.502 1.00 1.00 O ATOM 22 CB SER A 2 75.189 18.931 -24.006 1.00 1.00 C ATOM 23 OG SER A 2 76.419 18.569 -24.621 1.00 1.00 O ATOM 0 H SER A 2 77.185 20.489 -23.253 1.00 1.00 H new ATOM 0 HA SER A 2 74.525 19.779 -22.145 1.00 1.00 H new ATOM 0 HB2 SER A 2 74.529 18.065 -23.950 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.678 19.684 -24.606 1.00 1.00 H new ATOM 0 HG SER A 2 77.125 18.530 -23.942 1.00 1.00 H new ATOM 29 N ASP A 3 77.325 18.622 -21.304 1.00 1.00 N ATOM 30 CA ASP A 3 78.024 17.641 -20.479 1.00 1.00 C ATOM 31 C ASP A 3 79.361 18.175 -19.975 1.00 1.00 C ATOM 32 O ASP A 3 80.386 18.030 -20.640 1.00 1.00 O ATOM 33 CB ASP A 3 78.269 16.366 -21.285 1.00 1.00 C ATOM 34 CG ASP A 3 78.883 16.714 -22.638 1.00 1.00 C ATOM 35 OD1 ASP A 3 78.319 17.549 -23.325 1.00 1.00 O ATOM 36 OD2 ASP A 3 79.909 16.140 -22.966 1.00 1.00 O ATOM 0 H ASP A 3 77.852 19.474 -21.497 1.00 1.00 H new ATOM 0 HA ASP A 3 77.392 17.429 -19.616 1.00 1.00 H new ATOM 0 HB2 ASP A 3 78.934 15.700 -20.735 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.330 15.831 -21.429 1.00 1.00 H new ATOM 41 N PHE A 4 79.352 18.779 -18.792 1.00 1.00 N ATOM 42 CA PHE A 4 80.574 19.312 -18.203 1.00 1.00 C ATOM 43 C PHE A 4 80.469 19.256 -16.685 1.00 1.00 C ATOM 44 O PHE A 4 79.392 19.446 -16.121 1.00 1.00 O ATOM 45 CB PHE A 4 80.804 20.751 -18.673 1.00 1.00 C ATOM 46 CG PHE A 4 82.158 21.216 -18.196 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.288 21.807 -16.936 1.00 1.00 C ATOM 48 CD2 PHE A 4 83.285 21.051 -19.014 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.545 22.239 -16.493 1.00 1.00 C ATOM 50 CE2 PHE A 4 84.541 21.483 -18.570 1.00 1.00 C ATOM 51 CZ PHE A 4 84.671 22.076 -17.310 1.00 1.00 C ATOM 0 H PHE A 4 78.515 18.911 -18.224 1.00 1.00 H new ATOM 0 HA PHE A 4 81.424 18.709 -18.524 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.750 20.805 -19.760 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.023 21.404 -18.282 1.00 1.00 H new ATOM 0 HD1 PHE A 4 81.420 21.930 -16.305 1.00 1.00 H new ATOM 0 HD2 PHE A 4 83.184 20.591 -19.986 1.00 1.00 H new ATOM 0 HE1 PHE A 4 83.646 22.698 -15.521 1.00 1.00 H new ATOM 0 HE2 PHE A 4 85.409 21.358 -19.200 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.640 22.408 -16.967 1.00 1.00 H new ATOM 61 N ASP A 5 81.589 18.986 -16.024 1.00 1.00 N ATOM 62 CA ASP A 5 81.606 18.892 -14.573 1.00 1.00 C ATOM 63 C ASP A 5 82.981 19.298 -14.036 1.00 1.00 C ATOM 64 O ASP A 5 83.996 19.057 -14.687 1.00 1.00 O ATOM 65 CB ASP A 5 81.266 17.450 -14.169 1.00 1.00 C ATOM 66 CG ASP A 5 81.245 17.326 -12.675 1.00 1.00 C ATOM 67 OD1 ASP A 5 82.017 18.014 -12.061 1.00 1.00 O ATOM 68 OD2 ASP A 5 80.457 16.547 -12.166 1.00 1.00 O ATOM 0 H ASP A 5 82.493 18.829 -16.470 1.00 1.00 H new ATOM 0 HA ASP A 5 80.866 19.569 -14.146 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.296 17.168 -14.579 1.00 1.00 H new ATOM 0 HB3 ASP A 5 82.001 16.763 -14.589 1.00 1.00 H new ATOM 73 N THR A 6 83.011 19.917 -12.841 1.00 1.00 N ATOM 74 CA THR A 6 84.265 20.349 -12.227 1.00 1.00 C ATOM 75 C THR A 6 84.707 19.366 -11.153 1.00 1.00 C ATOM 76 O THR A 6 84.033 18.417 -10.867 1.00 1.00 O ATOM 77 CB THR A 6 84.096 21.751 -11.634 1.00 1.00 C ATOM 78 OG1 THR A 6 82.986 22.369 -12.260 1.00 1.00 O ATOM 79 CG2 THR A 6 85.356 22.571 -11.898 1.00 1.00 C ATOM 0 H THR A 6 82.179 20.125 -12.288 1.00 1.00 H new ATOM 0 HA THR A 6 85.038 20.379 -12.995 1.00 1.00 H new ATOM 0 HB THR A 6 83.933 21.689 -10.558 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.861 23.268 -11.891 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.236 23.569 -11.476 1.00 1.00 H new ATOM 0 HG22 THR A 6 86.212 22.082 -11.434 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.521 22.649 -12.973 1.00 1.00 H new ATOM 87 N GLU A 7 85.797 19.665 -10.505 1.00 1.00 N ATOM 88 CA GLU A 7 86.319 18.823 -9.445 1.00 1.00 C ATOM 89 C GLU A 7 85.278 18.577 -8.366 1.00 1.00 C ATOM 90 O GLU A 7 85.136 17.462 -7.910 1.00 1.00 O ATOM 91 CB GLU A 7 87.580 19.458 -8.826 1.00 1.00 C ATOM 92 CG GLU A 7 88.355 18.404 -8.013 1.00 1.00 C ATOM 93 CD GLU A 7 89.714 18.963 -7.590 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.757 19.687 -6.611 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.691 18.650 -8.252 1.00 1.00 O ATOM 0 H GLU A 7 86.355 20.498 -10.690 1.00 1.00 H new ATOM 0 HA GLU A 7 86.582 17.862 -9.886 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.217 19.863 -9.612 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.299 20.292 -8.182 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.780 18.118 -7.132 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.493 17.502 -8.610 1.00 1.00 H new ATOM 102 N ARG A 8 84.522 19.583 -7.991 1.00 1.00 N ATOM 103 CA ARG A 8 83.498 19.352 -6.969 1.00 1.00 C ATOM 104 C ARG A 8 82.386 18.469 -7.526 1.00 1.00 C ATOM 105 O ARG A 8 82.201 17.318 -7.159 1.00 1.00 O ATOM 106 CB ARG A 8 82.929 20.724 -6.578 1.00 1.00 C ATOM 107 CG ARG A 8 83.986 21.499 -5.780 1.00 1.00 C ATOM 108 CD ARG A 8 83.549 22.953 -5.635 1.00 1.00 C ATOM 109 NE ARG A 8 82.128 23.025 -5.262 1.00 1.00 N ATOM 110 CZ ARG A 8 81.238 23.741 -5.960 1.00 1.00 C ATOM 111 NH1 ARG A 8 81.604 24.412 -7.018 1.00 1.00 N ATOM 112 NH2 ARG A 8 79.987 23.769 -5.581 1.00 1.00 N ATOM 0 H ARG A 8 84.581 20.535 -8.353 1.00 1.00 H new ATOM 0 HA ARG A 8 83.927 18.847 -6.104 1.00 1.00 H new ATOM 0 HB2 ARG A 8 82.648 21.283 -7.471 1.00 1.00 H new ATOM 0 HB3 ARG A 8 82.025 20.600 -5.982 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.118 21.048 -4.796 1.00 1.00 H new ATOM 0 HG3 ARG A 8 84.950 21.447 -6.286 1.00 1.00 H new ATOM 0 HD2 ARG A 8 84.156 23.448 -4.877 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.713 23.484 -6.573 1.00 1.00 H new ATOM 0 HE ARG A 8 81.809 22.510 -4.441 1.00 1.00 H new ATOM 0 HH11 ARG A 8 82.578 24.395 -7.321 1.00 1.00 H new ATOM 0 HH12 ARG A 8 80.916 24.954 -7.541 1.00 1.00 H new ATOM 0 HH21 ARG A 8 79.692 23.246 -4.756 1.00 1.00 H new ATOM 0 HH22 ARG A 8 79.306 24.313 -6.110 1.00 1.00 H new ATOM 126 N VAL A 9 81.727 18.992 -8.493 1.00 1.00 N ATOM 127 CA VAL A 9 80.666 18.213 -9.121 1.00 1.00 C ATOM 128 C VAL A 9 81.255 16.892 -9.654 1.00 1.00 C ATOM 129 O VAL A 9 80.688 15.832 -9.502 1.00 1.00 O ATOM 130 CB VAL A 9 79.916 18.987 -10.227 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.626 18.236 -10.661 1.00 1.00 C ATOM 132 CG2 VAL A 9 79.554 20.360 -9.695 1.00 1.00 C ATOM 0 H VAL A 9 81.878 19.926 -8.875 1.00 1.00 H new ATOM 0 HA VAL A 9 79.915 17.998 -8.361 1.00 1.00 H new ATOM 0 HB VAL A 9 80.562 19.074 -11.100 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.119 18.804 -11.441 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.890 17.250 -11.044 1.00 1.00 H new ATOM 0 HG13 VAL A 9 77.963 18.126 -9.803 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.023 20.920 -10.465 1.00 1.00 H new ATOM 0 HG22 VAL A 9 78.915 20.254 -8.818 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.463 20.895 -9.419 1.00 1.00 H new ATOM 142 N SER A 10 82.398 16.965 -10.280 1.00 1.00 N ATOM 143 CA SER A 10 83.003 15.748 -10.831 1.00 1.00 C ATOM 144 C SER A 10 83.465 14.818 -9.731 1.00 1.00 C ATOM 145 O SER A 10 82.953 13.735 -9.572 1.00 1.00 O ATOM 146 CB SER A 10 84.237 16.108 -11.683 1.00 1.00 C ATOM 147 OG SER A 10 84.687 14.979 -12.400 1.00 1.00 O ATOM 0 H SER A 10 82.930 17.823 -10.427 1.00 1.00 H new ATOM 0 HA SER A 10 82.242 15.255 -11.436 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.986 16.911 -12.376 1.00 1.00 H new ATOM 0 HB3 SER A 10 85.035 16.480 -11.040 1.00 1.00 H new ATOM 0 HG SER A 10 85.469 15.223 -12.937 1.00 1.00 H new ATOM 153 N ARG A 11 84.450 15.252 -8.978 1.00 1.00 N ATOM 154 CA ARG A 11 85.008 14.415 -7.923 1.00 1.00 C ATOM 155 C ARG A 11 83.950 14.076 -6.899 1.00 1.00 C ATOM 156 O ARG A 11 83.865 12.945 -6.447 1.00 1.00 O ATOM 157 CB ARG A 11 86.202 15.106 -7.211 1.00 1.00 C ATOM 158 CG ARG A 11 86.864 14.173 -6.185 1.00 1.00 C ATOM 159 CD ARG A 11 87.687 13.091 -6.881 1.00 1.00 C ATOM 160 NE ARG A 11 88.672 13.700 -7.761 1.00 1.00 N ATOM 161 CZ ARG A 11 89.407 12.956 -8.573 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.240 11.662 -8.598 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.293 13.515 -9.350 1.00 1.00 N ATOM 0 H ARG A 11 84.883 16.171 -9.069 1.00 1.00 H new ATOM 0 HA ARG A 11 85.369 13.502 -8.397 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.939 15.415 -7.952 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.855 16.010 -6.711 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.506 14.753 -5.522 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.099 13.709 -5.563 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.187 12.469 -6.138 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.031 12.437 -7.455 1.00 1.00 H new ATOM 0 HE ARG A 11 88.798 14.712 -7.752 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.544 11.226 -7.993 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.805 11.087 -9.223 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.421 14.527 -9.333 1.00 1.00 H new ATOM 0 HH22 ARG A 11 90.858 12.940 -9.975 1.00 1.00 H new ATOM 177 N ALA A 12 83.143 15.053 -6.534 1.00 1.00 N ATOM 178 CA ALA A 12 82.100 14.783 -5.534 1.00 1.00 C ATOM 179 C ALA A 12 81.020 13.879 -6.099 1.00 1.00 C ATOM 180 O ALA A 12 80.784 12.768 -5.626 1.00 1.00 O ATOM 181 CB ALA A 12 81.462 16.095 -5.083 1.00 1.00 C ATOM 0 H ALA A 12 83.175 16.008 -6.891 1.00 1.00 H new ATOM 0 HA ALA A 12 82.570 14.283 -4.687 1.00 1.00 H new ATOM 0 HB1 ALA A 12 80.690 15.888 -4.342 1.00 1.00 H new ATOM 0 HB2 ALA A 12 82.224 16.738 -4.643 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.016 16.597 -5.942 1.00 1.00 H new ATOM 187 N VAL A 13 80.381 14.364 -7.129 1.00 1.00 N ATOM 188 CA VAL A 13 79.337 13.581 -7.740 1.00 1.00 C ATOM 189 C VAL A 13 79.965 12.256 -8.139 1.00 1.00 C ATOM 190 O VAL A 13 79.458 11.220 -7.860 1.00 1.00 O ATOM 191 CB VAL A 13 78.688 14.284 -8.986 1.00 1.00 C ATOM 192 CG1 VAL A 13 79.255 13.724 -10.322 1.00 1.00 C ATOM 193 CG2 VAL A 13 77.154 14.123 -9.011 1.00 1.00 C ATOM 0 H VAL A 13 80.557 15.274 -7.556 1.00 1.00 H new ATOM 0 HA VAL A 13 78.522 13.447 -7.029 1.00 1.00 H new ATOM 0 HB VAL A 13 78.939 15.340 -8.891 1.00 1.00 H new ATOM 0 HG11 VAL A 13 78.782 14.235 -11.161 1.00 1.00 H new ATOM 0 HG12 VAL A 13 80.332 13.889 -10.358 1.00 1.00 H new ATOM 0 HG13 VAL A 13 79.049 12.656 -10.385 1.00 1.00 H new ATOM 0 HG21 VAL A 13 76.750 14.625 -9.890 1.00 1.00 H new ATOM 0 HG22 VAL A 13 76.900 13.064 -9.049 1.00 1.00 H new ATOM 0 HG23 VAL A 13 76.727 14.566 -8.111 1.00 1.00 H new ATOM 203 N ALA A 14 81.121 12.286 -8.748 1.00 1.00 N ATOM 204 CA ALA A 14 81.690 11.016 -9.145 1.00 1.00 C ATOM 205 C ALA A 14 82.072 10.160 -7.973 1.00 1.00 C ATOM 206 O ALA A 14 81.437 9.151 -7.733 1.00 1.00 O ATOM 207 CB ALA A 14 82.920 11.248 -10.003 1.00 1.00 C ATOM 0 H ALA A 14 81.664 13.120 -8.972 1.00 1.00 H new ATOM 0 HA ALA A 14 80.919 10.488 -9.707 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.344 10.288 -10.299 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.641 11.811 -10.894 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.660 11.811 -9.434 1.00 1.00 H new ATOM 213 N ALA A 15 83.046 10.609 -7.204 1.00 1.00 N ATOM 214 CA ALA A 15 83.482 9.845 -6.042 1.00 1.00 C ATOM 215 C ALA A 15 82.252 9.480 -5.229 1.00 1.00 C ATOM 216 O ALA A 15 82.006 8.324 -4.930 1.00 1.00 O ATOM 217 CB ALA A 15 84.484 10.668 -5.204 1.00 1.00 C ATOM 0 H ALA A 15 83.546 11.485 -7.356 1.00 1.00 H new ATOM 0 HA ALA A 15 83.994 8.935 -6.355 1.00 1.00 H new ATOM 0 HB1 ALA A 15 84.801 10.085 -4.340 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.353 10.914 -5.814 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.006 11.588 -4.866 1.00 1.00 H new ATOM 223 N ALA A 16 81.471 10.460 -4.892 1.00 1.00 N ATOM 224 CA ALA A 16 80.277 10.155 -4.123 1.00 1.00 C ATOM 225 C ALA A 16 79.273 9.319 -4.948 1.00 1.00 C ATOM 226 O ALA A 16 78.888 8.206 -4.570 1.00 1.00 O ATOM 227 CB ALA A 16 79.590 11.469 -3.705 1.00 1.00 C ATOM 0 H ALA A 16 81.618 11.443 -5.120 1.00 1.00 H new ATOM 0 HA ALA A 16 80.579 9.579 -3.249 1.00 1.00 H new ATOM 0 HB1 ALA A 16 78.693 11.243 -3.128 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.274 12.060 -3.096 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.315 12.035 -4.595 1.00 1.00 H new ATOM 233 N LEU A 17 78.848 9.898 -6.050 1.00 1.00 N ATOM 234 CA LEU A 17 77.830 9.223 -6.888 1.00 1.00 C ATOM 235 C LEU A 17 78.336 7.837 -7.243 1.00 1.00 C ATOM 236 O LEU A 17 77.671 6.836 -6.980 1.00 1.00 O ATOM 237 CB LEU A 17 77.522 10.017 -8.176 1.00 1.00 C ATOM 238 CG LEU A 17 76.265 9.526 -8.896 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.745 10.679 -9.777 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.594 8.302 -9.771 1.00 1.00 C ATOM 0 H LEU A 17 79.166 10.804 -6.395 1.00 1.00 H new ATOM 0 HA LEU A 17 76.902 9.159 -6.320 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.402 11.071 -7.926 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.373 9.945 -8.853 1.00 1.00 H new ATOM 0 HG LEU A 17 75.508 9.229 -8.170 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.847 10.358 -10.304 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.509 11.539 -9.150 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.511 10.957 -10.501 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.690 7.963 -10.277 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.344 8.576 -10.513 1.00 1.00 H new ATOM 0 HD23 LEU A 17 76.981 7.499 -9.143 1.00 1.00 H new ATOM 252 N VAL A 18 79.515 7.782 -7.836 1.00 1.00 N ATOM 253 CA VAL A 18 80.104 6.501 -8.215 1.00 1.00 C ATOM 254 C VAL A 18 80.558 5.724 -6.972 1.00 1.00 C ATOM 255 O VAL A 18 80.128 4.585 -6.745 1.00 1.00 O ATOM 256 CB VAL A 18 81.293 6.718 -9.209 1.00 1.00 C ATOM 257 CG1 VAL A 18 80.934 7.839 -10.229 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.624 7.065 -8.462 1.00 1.00 C ATOM 0 H VAL A 18 80.082 8.598 -8.066 1.00 1.00 H new ATOM 0 HA VAL A 18 79.344 5.907 -8.721 1.00 1.00 H new ATOM 0 HB VAL A 18 81.456 5.782 -9.743 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.766 7.984 -10.918 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.045 7.550 -10.790 1.00 1.00 H new ATOM 0 HG13 VAL A 18 80.739 8.769 -9.694 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.423 7.207 -9.190 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.490 7.981 -7.886 1.00 1.00 H new ATOM 0 HG23 VAL A 18 82.887 6.249 -7.789 1.00 1.00 H new ATOM 268 N GLY A 19 81.470 6.329 -6.195 1.00 1.00 N ATOM 269 CA GLY A 19 82.028 5.688 -5.037 1.00 1.00 C ATOM 270 C GLY A 19 80.933 5.262 -4.127 1.00 1.00 C ATOM 271 O GLY A 19 79.762 5.310 -4.495 1.00 1.00 O ATOM 0 H GLY A 19 81.827 7.269 -6.366 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.622 4.825 -5.337 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.700 6.372 -4.519 1.00 1.00 H new ATOM 275 N PRO A 20 81.290 4.822 -2.973 1.00 1.00 N ATOM 276 CA PRO A 20 80.320 4.321 -2.000 1.00 1.00 C ATOM 277 C PRO A 20 79.639 5.404 -1.204 1.00 1.00 C ATOM 278 O PRO A 20 78.527 5.192 -0.774 1.00 1.00 O ATOM 279 CB PRO A 20 81.159 3.445 -1.087 1.00 1.00 C ATOM 280 CG PRO A 20 82.529 4.057 -1.107 1.00 1.00 C ATOM 281 CD PRO A 20 82.666 4.781 -2.453 1.00 1.00 C ATOM 0 HA PRO A 20 79.501 3.802 -2.498 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.751 3.425 -0.076 1.00 1.00 H new ATOM 0 HB3 PRO A 20 81.182 2.415 -1.442 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.654 4.753 -0.278 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.297 3.291 -0.999 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.076 5.783 -2.328 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.333 4.246 -3.129 1.00 1.00 H new ATOM 289 N GLY A 21 80.306 6.553 -1.031 1.00 1.00 N ATOM 290 CA GLY A 21 79.716 7.650 -0.244 1.00 1.00 C ATOM 291 C GLY A 21 78.390 8.121 -0.850 1.00 1.00 C ATOM 292 O GLY A 21 77.361 8.116 -0.191 1.00 1.00 O ATOM 0 H GLY A 21 81.231 6.747 -1.414 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.552 7.317 0.781 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.415 8.485 -0.200 1.00 1.00 H new ATOM 296 N GLY A 22 78.398 8.571 -2.091 1.00 1.00 N ATOM 297 CA GLY A 22 77.125 9.062 -2.632 1.00 1.00 C ATOM 298 C GLY A 22 76.119 7.957 -2.497 1.00 1.00 C ATOM 299 O GLY A 22 75.079 8.096 -1.852 1.00 1.00 O ATOM 0 H GLY A 22 79.205 8.611 -2.714 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.795 9.949 -2.090 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.239 9.351 -3.677 1.00 1.00 H new ATOM 303 N VAL A 23 76.471 6.842 -3.087 1.00 1.00 N ATOM 304 CA VAL A 23 75.604 5.669 -3.013 1.00 1.00 C ATOM 305 C VAL A 23 75.311 5.385 -1.543 1.00 1.00 C ATOM 306 O VAL A 23 74.260 4.839 -1.206 1.00 1.00 O ATOM 307 CB VAL A 23 76.217 4.428 -3.665 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.269 3.221 -3.525 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.458 4.704 -5.147 1.00 1.00 C ATOM 0 H VAL A 23 77.333 6.711 -3.617 1.00 1.00 H new ATOM 0 HA VAL A 23 74.691 5.890 -3.567 1.00 1.00 H new ATOM 0 HB VAL A 23 77.159 4.199 -3.167 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.721 2.347 -3.994 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.094 3.016 -2.469 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.320 3.445 -4.013 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.895 3.822 -5.615 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.511 4.941 -5.632 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.141 5.547 -5.254 1.00 1.00 H new ATOM 319 N ALA A 24 76.273 5.748 -0.666 1.00 1.00 N ATOM 320 CA ALA A 24 76.081 5.489 0.765 1.00 1.00 C ATOM 321 C ALA A 24 74.900 6.270 1.313 1.00 1.00 C ATOM 322 O ALA A 24 73.915 5.688 1.717 1.00 1.00 O ATOM 323 CB ALA A 24 77.318 5.913 1.571 1.00 1.00 C ATOM 0 H ALA A 24 77.152 6.202 -0.915 1.00 1.00 H new ATOM 0 HA ALA A 24 75.906 4.418 0.865 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.150 5.711 2.629 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.186 5.351 1.227 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.497 6.979 1.430 1.00 1.00 H new ATOM 329 N LEU A 25 74.985 7.578 1.331 1.00 1.00 N ATOM 330 CA LEU A 25 73.886 8.361 1.864 1.00 1.00 C ATOM 331 C LEU A 25 72.593 8.078 1.109 1.00 1.00 C ATOM 332 O LEU A 25 71.530 7.912 1.714 1.00 1.00 O ATOM 333 CB LEU A 25 74.234 9.875 1.736 1.00 1.00 C ATOM 334 CG LEU A 25 72.990 10.732 1.352 1.00 1.00 C ATOM 335 CD1 LEU A 25 71.953 10.709 2.476 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.402 12.162 1.040 1.00 1.00 C ATOM 0 H LEU A 25 75.782 8.117 0.992 1.00 1.00 H new ATOM 0 HA LEU A 25 73.740 8.089 2.909 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.643 10.234 2.681 1.00 1.00 H new ATOM 0 HB3 LEU A 25 75.010 10.006 0.982 1.00 1.00 H new ATOM 0 HG LEU A 25 72.540 10.300 0.458 1.00 1.00 H new ATOM 0 HD11 LEU A 25 71.092 11.313 2.189 1.00 1.00 H new ATOM 0 HD12 LEU A 25 71.633 9.683 2.655 1.00 1.00 H new ATOM 0 HD13 LEU A 25 72.394 11.115 3.386 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.520 12.745 0.774 1.00 1.00 H new ATOM 0 HD22 LEU A 25 73.878 12.603 1.916 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.104 12.165 0.206 1.00 1.00 H new ATOM 348 N VAL A 26 72.674 8.118 -0.213 1.00 1.00 N ATOM 349 CA VAL A 26 71.470 7.982 -1.006 1.00 1.00 C ATOM 350 C VAL A 26 70.784 6.680 -0.701 1.00 1.00 C ATOM 351 O VAL A 26 69.642 6.663 -0.250 1.00 1.00 O ATOM 352 CB VAL A 26 71.860 8.012 -2.483 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.635 7.738 -3.349 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.453 9.379 -2.849 1.00 1.00 C ATOM 0 H VAL A 26 73.537 8.240 -0.744 1.00 1.00 H new ATOM 0 HA VAL A 26 70.787 8.798 -0.772 1.00 1.00 H new ATOM 0 HB VAL A 26 72.609 7.241 -2.662 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.920 7.761 -4.401 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.229 6.757 -3.105 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.879 8.500 -3.162 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.726 9.386 -3.904 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.715 10.158 -2.660 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.340 9.565 -2.243 1.00 1.00 H new ATOM 364 N VAL A 27 71.470 5.590 -0.960 1.00 1.00 N ATOM 365 CA VAL A 27 70.886 4.296 -0.721 1.00 1.00 C ATOM 366 C VAL A 27 70.448 4.194 0.729 1.00 1.00 C ATOM 367 O VAL A 27 69.457 3.555 1.040 1.00 1.00 O ATOM 368 CB VAL A 27 71.907 3.180 -1.061 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.861 2.945 0.123 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.180 1.867 -1.379 1.00 1.00 C ATOM 0 H VAL A 27 72.420 5.575 -1.331 1.00 1.00 H new ATOM 0 HA VAL A 27 70.013 4.170 -1.362 1.00 1.00 H new ATOM 0 HB VAL A 27 72.478 3.502 -1.932 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.571 2.159 -0.132 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.402 3.865 0.342 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.286 2.644 0.999 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.911 1.094 -1.616 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.592 1.558 -0.515 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.519 2.015 -2.233 1.00 1.00 H new ATOM 380 N LYS A 28 71.227 4.785 1.613 1.00 1.00 N ATOM 381 CA LYS A 28 70.913 4.674 3.034 1.00 1.00 C ATOM 382 C LYS A 28 69.640 5.418 3.393 1.00 1.00 C ATOM 383 O LYS A 28 68.685 4.849 3.925 1.00 1.00 O ATOM 384 CB LYS A 28 72.078 5.242 3.860 1.00 1.00 C ATOM 385 CG LYS A 28 73.197 4.200 3.998 1.00 1.00 C ATOM 386 CD LYS A 28 74.364 4.791 4.827 1.00 1.00 C ATOM 387 CE LYS A 28 74.112 4.525 6.317 1.00 1.00 C ATOM 388 NZ LYS A 28 74.083 3.053 6.548 1.00 1.00 N ATOM 0 H LYS A 28 72.058 5.332 1.389 1.00 1.00 H new ATOM 0 HA LYS A 28 70.762 3.618 3.259 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.467 6.141 3.381 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.722 5.535 4.848 1.00 1.00 H new ATOM 0 HG2 LYS A 28 72.813 3.302 4.482 1.00 1.00 H new ATOM 0 HG3 LYS A 28 73.553 3.903 3.012 1.00 1.00 H new ATOM 0 HD2 LYS A 28 75.308 4.341 4.520 1.00 1.00 H new ATOM 0 HD3 LYS A 28 74.448 5.863 4.646 1.00 1.00 H new ATOM 0 HE2 LYS A 28 74.895 4.985 6.919 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.167 4.973 6.625 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 74.737 2.810 7.319 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.119 2.761 6.807 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 74.373 2.560 5.680 1.00 1.00 H new ATOM 402 N VAL A 29 69.667 6.695 3.129 1.00 1.00 N ATOM 403 CA VAL A 29 68.530 7.542 3.469 1.00 1.00 C ATOM 404 C VAL A 29 67.298 7.096 2.705 1.00 1.00 C ATOM 405 O VAL A 29 66.226 6.935 3.288 1.00 1.00 O ATOM 406 CB VAL A 29 68.821 9.025 3.143 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.504 9.794 2.900 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.563 9.693 4.314 1.00 1.00 C ATOM 0 H VAL A 29 70.448 7.179 2.685 1.00 1.00 H new ATOM 0 HA VAL A 29 68.354 7.447 4.540 1.00 1.00 H new ATOM 0 HB VAL A 29 69.437 9.055 2.245 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.728 10.836 2.672 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.970 9.346 2.062 1.00 1.00 H new ATOM 0 HG13 VAL A 29 66.883 9.744 3.794 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.762 10.737 4.071 1.00 1.00 H new ATOM 0 HG22 VAL A 29 68.948 9.640 5.212 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.506 9.176 4.490 1.00 1.00 H new ATOM 418 N CYS A 30 67.440 6.936 1.397 1.00 1.00 N ATOM 419 CA CYS A 30 66.294 6.564 0.605 1.00 1.00 C ATOM 420 C CYS A 30 65.799 5.186 1.002 1.00 1.00 C ATOM 421 O CYS A 30 64.656 5.026 1.427 1.00 1.00 O ATOM 422 CB CYS A 30 66.712 6.552 -0.865 1.00 1.00 C ATOM 423 SG CYS A 30 65.390 5.857 -1.880 1.00 1.00 S ATOM 0 H CYS A 30 68.312 7.055 0.881 1.00 1.00 H new ATOM 0 HA CYS A 30 65.488 7.279 0.769 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.940 7.566 -1.195 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.622 5.965 -0.988 1.00 1.00 H new ATOM 428 N ALA A 31 66.641 4.185 0.817 1.00 1.00 N ATOM 429 CA ALA A 31 66.246 2.813 1.100 1.00 1.00 C ATOM 430 C ALA A 31 65.783 2.693 2.524 1.00 1.00 C ATOM 431 O ALA A 31 64.735 2.115 2.814 1.00 1.00 O ATOM 432 CB ALA A 31 67.421 1.858 0.860 1.00 1.00 C ATOM 0 H ALA A 31 67.596 4.293 0.475 1.00 1.00 H new ATOM 0 HA ALA A 31 65.428 2.544 0.431 1.00 1.00 H new ATOM 0 HB1 ALA A 31 67.109 0.836 1.076 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.740 1.928 -0.180 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.250 2.130 1.513 1.00 1.00 H new ATOM 438 N GLY A 32 66.585 3.237 3.409 1.00 1.00 N ATOM 439 CA GLY A 32 66.264 3.187 4.813 1.00 1.00 C ATOM 440 C GLY A 32 66.559 1.824 5.355 1.00 1.00 C ATOM 441 O GLY A 32 65.638 1.089 5.670 1.00 1.00 O ATOM 0 H GLY A 32 67.457 3.715 3.183 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.842 3.936 5.354 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.212 3.428 4.963 1.00 1.00 H new ATOM 445 N LEU A 33 67.844 1.499 5.410 1.00 1.00 N ATOM 446 CA LEU A 33 68.329 0.199 5.895 1.00 1.00 C ATOM 447 C LEU A 33 68.336 -0.835 4.748 1.00 1.00 C ATOM 448 O LEU A 33 67.309 -1.065 4.115 1.00 1.00 O ATOM 449 CB LEU A 33 67.488 -0.329 7.110 1.00 1.00 C ATOM 450 CG LEU A 33 68.195 0.032 8.410 1.00 1.00 C ATOM 451 CD1 LEU A 33 67.189 -0.087 9.555 1.00 1.00 C ATOM 452 CD2 LEU A 33 69.413 -0.897 8.638 1.00 1.00 C ATOM 0 H LEU A 33 68.590 2.130 5.119 1.00 1.00 H new ATOM 0 HA LEU A 33 69.350 0.343 6.249 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.490 0.108 7.093 1.00 1.00 H new ATOM 0 HB3 LEU A 33 67.364 -1.410 7.038 1.00 1.00 H new ATOM 0 HG LEU A 33 68.570 1.054 8.362 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.677 0.168 10.496 1.00 1.00 H new ATOM 0 HD12 LEU A 33 66.357 0.596 9.381 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.815 -1.109 9.606 1.00 1.00 H new ATOM 0 HD21 LEU A 33 69.908 -0.626 9.571 1.00 1.00 H new ATOM 0 HD22 LEU A 33 69.076 -1.932 8.693 1.00 1.00 H new ATOM 0 HD23 LEU A 33 70.114 -0.787 7.811 1.00 1.00 H new ATOM 464 N PRO A 34 69.469 -1.447 4.452 1.00 1.00 N ATOM 465 CA PRO A 34 69.571 -2.432 3.335 1.00 1.00 C ATOM 466 C PRO A 34 68.820 -3.729 3.617 1.00 1.00 C ATOM 467 O PRO A 34 68.552 -4.504 2.701 1.00 1.00 O ATOM 468 CB PRO A 34 71.087 -2.694 3.212 1.00 1.00 C ATOM 469 CG PRO A 34 71.647 -2.383 4.562 1.00 1.00 C ATOM 470 CD PRO A 34 70.768 -1.281 5.139 1.00 1.00 C ATOM 0 HA PRO A 34 69.120 -2.046 2.421 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.287 -3.728 2.931 1.00 1.00 H new ATOM 0 HB3 PRO A 34 71.535 -2.063 2.444 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.636 -3.266 5.202 1.00 1.00 H new ATOM 0 HG3 PRO A 34 72.684 -2.056 4.488 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.662 -1.382 6.219 1.00 1.00 H new ATOM 0 HD3 PRO A 34 71.193 -0.295 4.952 1.00 1.00 H new ATOM 478 N GLY A 35 68.506 -3.981 4.877 1.00 1.00 N ATOM 479 CA GLY A 35 67.828 -5.227 5.186 1.00 1.00 C ATOM 480 C GLY A 35 66.460 -5.293 4.511 1.00 1.00 C ATOM 481 O GLY A 35 66.220 -6.155 3.667 1.00 1.00 O ATOM 0 H GLY A 35 68.699 -3.370 5.670 1.00 1.00 H new ATOM 0 HA2 GLY A 35 68.439 -6.068 4.858 1.00 1.00 H new ATOM 0 HA3 GLY A 35 67.709 -5.321 6.265 1.00 1.00 H new ATOM 485 N VAL A 36 65.558 -4.387 4.890 1.00 1.00 N ATOM 486 CA VAL A 36 64.225 -4.379 4.306 1.00 1.00 C ATOM 487 C VAL A 36 64.336 -3.760 2.954 1.00 1.00 C ATOM 488 O VAL A 36 65.400 -3.821 2.377 1.00 1.00 O ATOM 489 CB VAL A 36 63.240 -3.578 5.185 1.00 1.00 C ATOM 490 CG1 VAL A 36 63.466 -2.044 5.011 1.00 1.00 C ATOM 491 CG2 VAL A 36 61.769 -3.972 4.829 1.00 1.00 C ATOM 0 H VAL A 36 65.726 -3.662 5.588 1.00 1.00 H new ATOM 0 HA VAL A 36 63.839 -5.396 4.236 1.00 1.00 H new ATOM 0 HB VAL A 36 63.422 -3.823 6.231 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.762 -1.499 5.639 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.485 -1.791 5.304 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.310 -1.769 3.968 1.00 1.00 H new ATOM 0 HG21 VAL A 36 61.079 -3.403 5.453 1.00 1.00 H new ATOM 0 HG22 VAL A 36 61.577 -3.750 3.779 1.00 1.00 H new ATOM 0 HG23 VAL A 36 61.625 -5.038 5.007 1.00 1.00 H new ATOM 501 N ILE A 37 63.248 -3.154 2.490 1.00 1.00 N ATOM 502 CA ILE A 37 63.206 -2.463 1.199 1.00 1.00 C ATOM 503 C ILE A 37 63.138 -3.458 0.028 1.00 1.00 C ATOM 504 O ILE A 37 64.106 -3.702 -0.670 1.00 1.00 O ATOM 505 CB ILE A 37 64.420 -1.480 1.071 1.00 1.00 C ATOM 506 CG1 ILE A 37 64.008 -0.249 0.247 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.671 -2.117 0.398 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.388 -0.695 -1.085 1.00 1.00 C ATOM 0 H ILE A 37 62.364 -3.126 2.999 1.00 1.00 H new ATOM 0 HA ILE A 37 62.292 -1.871 1.153 1.00 1.00 H new ATOM 0 HB ILE A 37 64.695 -1.209 2.090 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.292 0.352 0.808 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.877 0.382 0.060 1.00 1.00 H new ATOM 0 HG21 ILE A 37 66.471 -1.378 0.344 1.00 1.00 H new ATOM 0 HG22 ILE A 37 66.006 -2.971 0.987 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.414 -2.448 -0.608 1.00 1.00 H new ATOM 0 HD11 ILE A 37 63.099 0.182 -1.663 1.00 1.00 H new ATOM 0 HD12 ILE A 37 64.117 -1.277 -1.649 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.508 -1.307 -0.890 1.00 1.00 H new ATOM 520 N HIS A 38 61.993 -4.047 -0.232 1.00 1.00 N ATOM 521 CA HIS A 38 61.926 -4.982 -1.339 1.00 1.00 C ATOM 522 C HIS A 38 60.657 -4.723 -2.070 1.00 1.00 C ATOM 523 O HIS A 38 59.607 -4.555 -1.451 1.00 1.00 O ATOM 524 CB HIS A 38 62.008 -6.416 -0.793 1.00 1.00 C ATOM 525 CG HIS A 38 63.452 -6.831 -0.646 1.00 1.00 C ATOM 526 ND1 HIS A 38 64.420 -5.994 -0.107 1.00 1.00 N ATOM 527 CD2 HIS A 38 64.108 -7.988 -0.982 1.00 1.00 C ATOM 528 CE1 HIS A 38 65.593 -6.652 -0.141 1.00 1.00 C ATOM 529 NE2 HIS A 38 65.459 -7.874 -0.662 1.00 1.00 N ATOM 0 H HIS A 38 61.124 -3.906 0.284 1.00 1.00 H new ATOM 0 HA HIS A 38 62.758 -4.856 -2.031 1.00 1.00 H new ATOM 0 HB2 HIS A 38 61.504 -6.476 0.172 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.491 -7.100 -1.466 1.00 1.00 H new ATOM 0 HD2 HIS A 38 63.646 -8.857 -1.428 1.00 1.00 H new ATOM 0 HE1 HIS A 38 66.528 -6.242 0.210 1.00 1.00 H new ATOM 0 HE2 HIS A 38 66.189 -8.574 -0.797 1.00 1.00 H new ATOM 537 N THR A 39 60.751 -4.661 -3.390 1.00 1.00 N ATOM 538 CA THR A 39 59.583 -4.391 -4.210 1.00 1.00 C ATOM 539 C THR A 39 59.146 -5.661 -4.963 1.00 1.00 C ATOM 540 O THR A 39 59.932 -6.240 -5.720 1.00 1.00 O ATOM 541 CB THR A 39 59.880 -3.275 -5.227 1.00 1.00 C ATOM 542 OG1 THR A 39 59.464 -3.678 -6.514 1.00 1.00 O ATOM 543 CG2 THR A 39 61.367 -2.974 -5.245 1.00 1.00 C ATOM 0 H THR A 39 61.618 -4.793 -3.912 1.00 1.00 H new ATOM 0 HA THR A 39 58.778 -4.069 -3.549 1.00 1.00 H new ATOM 0 HB THR A 39 59.336 -2.377 -4.936 1.00 1.00 H new ATOM 0 HG1 THR A 39 59.075 -2.913 -6.987 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.569 -2.183 -5.967 1.00 1.00 H new ATOM 0 HG22 THR A 39 61.685 -2.650 -4.254 1.00 1.00 H new ATOM 0 HG23 THR A 39 61.917 -3.872 -5.527 1.00 1.00 H new ATOM 551 N PRO A 40 57.924 -6.105 -4.793 1.00 1.00 N ATOM 552 CA PRO A 40 57.398 -7.304 -5.514 1.00 1.00 C ATOM 553 C PRO A 40 57.386 -7.111 -7.041 1.00 1.00 C ATOM 554 O PRO A 40 57.436 -8.083 -7.793 1.00 1.00 O ATOM 555 CB PRO A 40 55.946 -7.441 -4.989 1.00 1.00 C ATOM 556 CG PRO A 40 55.901 -6.659 -3.724 1.00 1.00 C ATOM 557 CD PRO A 40 56.907 -5.540 -3.890 1.00 1.00 C ATOM 0 HA PRO A 40 58.018 -8.182 -5.335 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.229 -7.055 -5.714 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.690 -8.486 -4.813 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.902 -6.262 -3.546 1.00 1.00 H new ATOM 0 HG3 PRO A 40 56.152 -7.286 -2.868 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.446 -4.649 -4.316 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.341 -5.248 -2.933 1.00 1.00 H new ATOM 565 N ALA A 41 57.352 -5.846 -7.493 1.00 1.00 N ATOM 566 CA ALA A 41 57.374 -5.520 -8.931 1.00 1.00 C ATOM 567 C ALA A 41 58.473 -4.500 -9.230 1.00 1.00 C ATOM 568 O ALA A 41 58.563 -3.488 -8.544 1.00 1.00 O ATOM 569 CB ALA A 41 56.005 -5.028 -9.358 1.00 1.00 C ATOM 0 H ALA A 41 57.309 -5.030 -6.882 1.00 1.00 H new ATOM 0 HA ALA A 41 57.605 -6.415 -9.509 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.020 -4.787 -10.421 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.265 -5.806 -9.173 1.00 1.00 H new ATOM 0 HB3 ALA A 41 55.744 -4.137 -8.787 1.00 1.00 H new ATOM 575 N ARG A 42 59.282 -4.738 -10.260 1.00 1.00 N ATOM 576 CA ARG A 42 60.353 -3.802 -10.609 1.00 1.00 C ATOM 577 C ARG A 42 61.098 -4.268 -11.858 1.00 1.00 C ATOM 578 O ARG A 42 60.768 -5.300 -12.440 1.00 1.00 O ATOM 579 CB ARG A 42 61.349 -3.700 -9.456 1.00 1.00 C ATOM 580 CG ARG A 42 61.956 -5.110 -9.174 1.00 1.00 C ATOM 581 CD ARG A 42 61.324 -5.766 -7.937 1.00 1.00 C ATOM 582 NE ARG A 42 61.319 -7.210 -8.094 1.00 1.00 N ATOM 583 CZ ARG A 42 62.442 -7.901 -8.069 1.00 1.00 C ATOM 584 NH1 ARG A 42 63.580 -7.283 -7.924 1.00 1.00 N ATOM 585 NH2 ARG A 42 62.406 -9.194 -8.197 1.00 1.00 N ATOM 0 H ARG A 42 59.220 -5.559 -10.862 1.00 1.00 H new ATOM 0 HA ARG A 42 59.900 -2.830 -10.803 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.141 -2.994 -9.705 1.00 1.00 H new ATOM 0 HB3 ARG A 42 60.852 -3.320 -8.563 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.805 -5.751 -10.043 1.00 1.00 H new ATOM 0 HG3 ARG A 42 63.032 -5.020 -9.028 1.00 1.00 H new ATOM 0 HD2 ARG A 42 61.883 -5.490 -7.043 1.00 1.00 H new ATOM 0 HD3 ARG A 42 60.305 -5.402 -7.802 1.00 1.00 H new ATOM 0 HE ARG A 42 60.433 -7.697 -8.226 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.601 -6.268 -7.830 1.00 1.00 H new ATOM 0 HH12 ARG A 42 64.450 -7.815 -7.904 1.00 1.00 H new ATOM 0 HH21 ARG A 42 61.512 -9.670 -8.316 1.00 1.00 H new ATOM 0 HH22 ARG A 42 63.272 -9.733 -8.178 1.00 1.00 H new ATOM 599 N ARG A 43 62.127 -3.517 -12.239 1.00 1.00 N ATOM 600 CA ARG A 43 62.918 -3.920 -13.394 1.00 1.00 C ATOM 601 C ARG A 43 63.456 -5.334 -13.128 1.00 1.00 C ATOM 602 O ARG A 43 63.372 -6.210 -13.990 1.00 1.00 O ATOM 603 CB ARG A 43 64.084 -2.938 -13.587 1.00 1.00 C ATOM 604 CG ARG A 43 64.913 -3.357 -14.795 1.00 1.00 C ATOM 605 CD ARG A 43 65.942 -2.274 -15.098 1.00 1.00 C ATOM 606 NE ARG A 43 66.757 -2.662 -16.241 1.00 1.00 N ATOM 607 CZ ARG A 43 67.654 -1.830 -16.759 1.00 1.00 C ATOM 608 NH1 ARG A 43 67.818 -0.644 -16.241 1.00 1.00 N ATOM 609 NH2 ARG A 43 68.369 -2.200 -17.784 1.00 1.00 N ATOM 0 H ARG A 43 62.425 -2.655 -11.782 1.00 1.00 H new ATOM 0 HA ARG A 43 62.309 -3.915 -14.298 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.701 -1.927 -13.729 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.708 -2.920 -12.694 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.413 -4.305 -14.597 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.266 -3.512 -15.658 1.00 1.00 H new ATOM 0 HD2 ARG A 43 65.438 -1.330 -15.305 1.00 1.00 H new ATOM 0 HD3 ARG A 43 66.577 -2.111 -14.227 1.00 1.00 H new ATOM 0 HE ARG A 43 66.637 -3.588 -16.651 1.00 1.00 H new ATOM 0 HH11 ARG A 43 67.258 -0.356 -15.439 1.00 1.00 H new ATOM 0 HH12 ARG A 43 68.506 -0.005 -16.638 1.00 1.00 H new ATOM 0 HH21 ARG A 43 68.240 -3.128 -18.188 1.00 1.00 H new ATOM 0 HH22 ARG A 43 69.058 -1.562 -18.182 1.00 1.00 H new ATOM 623 N GLY A 44 63.994 -5.561 -11.919 1.00 1.00 N ATOM 624 CA GLY A 44 64.524 -6.880 -11.530 1.00 1.00 C ATOM 625 C GLY A 44 66.021 -6.844 -11.216 1.00 1.00 C ATOM 626 O GLY A 44 66.511 -7.681 -10.472 1.00 1.00 O ATOM 0 H GLY A 44 64.074 -4.849 -11.193 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.982 -7.242 -10.656 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.343 -7.592 -12.335 1.00 1.00 H new ATOM 630 N PHE A 45 66.742 -5.907 -11.778 1.00 1.00 N ATOM 631 CA PHE A 45 68.182 -5.835 -11.526 1.00 1.00 C ATOM 632 C PHE A 45 68.610 -4.449 -11.849 1.00 1.00 C ATOM 633 O PHE A 45 67.824 -3.748 -12.455 1.00 1.00 O ATOM 634 CB PHE A 45 68.951 -6.825 -12.438 1.00 1.00 C ATOM 635 CG PHE A 45 68.006 -7.875 -12.949 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.227 -7.619 -14.086 1.00 1.00 C ATOM 637 CD2 PHE A 45 67.891 -9.089 -12.276 1.00 1.00 C ATOM 638 CE1 PHE A 45 66.334 -8.589 -14.551 1.00 1.00 C ATOM 639 CE2 PHE A 45 66.998 -10.058 -12.738 1.00 1.00 C ATOM 640 CZ PHE A 45 66.219 -9.809 -13.876 1.00 1.00 C ATOM 0 H PHE A 45 66.376 -5.190 -12.404 1.00 1.00 H new ATOM 0 HA PHE A 45 68.394 -6.095 -10.489 1.00 1.00 H new ATOM 0 HB2 PHE A 45 69.403 -6.290 -13.273 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.764 -7.292 -11.882 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.317 -6.674 -14.602 1.00 1.00 H new ATOM 0 HD2 PHE A 45 68.491 -9.280 -11.399 1.00 1.00 H new ATOM 0 HE1 PHE A 45 65.735 -8.397 -15.429 1.00 1.00 H new ATOM 0 HE2 PHE A 45 66.908 -11.000 -12.218 1.00 1.00 H new ATOM 0 HZ PHE A 45 65.529 -10.560 -14.232 1.00 1.00 H new ATOM 650 N PHE A 46 69.833 -4.085 -11.424 1.00 1.00 N ATOM 651 CA PHE A 46 70.422 -2.741 -11.662 1.00 1.00 C ATOM 652 C PHE A 46 70.376 -1.913 -10.406 1.00 1.00 C ATOM 653 O PHE A 46 69.293 -1.609 -9.926 1.00 1.00 O ATOM 654 CB PHE A 46 69.714 -1.947 -12.806 1.00 1.00 C ATOM 655 CG PHE A 46 70.273 -2.374 -14.131 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.744 -3.467 -14.840 1.00 1.00 C ATOM 657 CD2 PHE A 46 71.339 -1.652 -14.650 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.298 -3.822 -16.071 1.00 1.00 C ATOM 659 CE2 PHE A 46 71.891 -2.006 -15.873 1.00 1.00 C ATOM 660 CZ PHE A 46 71.371 -3.089 -16.588 1.00 1.00 C ATOM 0 H PHE A 46 70.448 -4.711 -10.904 1.00 1.00 H new ATOM 0 HA PHE A 46 71.452 -2.922 -11.969 1.00 1.00 H new ATOM 0 HB2 PHE A 46 68.639 -2.127 -12.777 1.00 1.00 H new ATOM 0 HB3 PHE A 46 69.861 -0.876 -12.665 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.915 -4.028 -14.435 1.00 1.00 H new ATOM 0 HD2 PHE A 46 71.740 -0.813 -14.101 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.899 -4.660 -16.623 1.00 1.00 H new ATOM 0 HE2 PHE A 46 72.723 -1.445 -16.273 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.799 -3.360 -17.542 1.00 1.00 H new ATOM 670 N ARG A 47 71.568 -1.546 -9.894 1.00 1.00 N ATOM 671 CA ARG A 47 71.683 -0.726 -8.681 1.00 1.00 C ATOM 672 C ARG A 47 71.679 -1.611 -7.434 1.00 1.00 C ATOM 673 O ARG A 47 71.246 -2.757 -7.494 1.00 1.00 O ATOM 674 CB ARG A 47 70.507 0.302 -8.618 1.00 1.00 C ATOM 675 CG ARG A 47 69.283 -0.242 -7.796 1.00 1.00 C ATOM 676 CD ARG A 47 69.317 0.345 -6.396 1.00 1.00 C ATOM 677 NE ARG A 47 69.040 1.769 -6.448 1.00 1.00 N ATOM 678 CZ ARG A 47 69.956 2.696 -6.140 1.00 1.00 C ATOM 679 NH1 ARG A 47 71.159 2.354 -5.762 1.00 1.00 N ATOM 680 NH2 ARG A 47 69.643 3.959 -6.221 1.00 1.00 N ATOM 0 H ARG A 47 72.464 -1.807 -10.306 1.00 1.00 H new ATOM 0 HA ARG A 47 72.627 -0.183 -8.715 1.00 1.00 H new ATOM 0 HB2 ARG A 47 70.861 1.229 -8.167 1.00 1.00 H new ATOM 0 HB3 ARG A 47 70.184 0.543 -9.631 1.00 1.00 H new ATOM 0 HG2 ARG A 47 68.350 0.025 -8.292 1.00 1.00 H new ATOM 0 HG3 ARG A 47 69.318 -1.330 -7.747 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.581 -0.154 -5.765 1.00 1.00 H new ATOM 0 HD3 ARG A 47 70.294 0.172 -5.944 1.00 1.00 H new ATOM 0 HE ARG A 47 68.109 2.076 -6.731 1.00 1.00 H new ATOM 0 HH11 ARG A 47 71.412 1.368 -5.698 1.00 1.00 H new ATOM 0 HH12 ARG A 47 71.845 3.073 -5.531 1.00 1.00 H new ATOM 0 HH21 ARG A 47 68.707 4.234 -6.517 1.00 1.00 H new ATOM 0 HH22 ARG A 47 70.335 4.672 -5.988 1.00 1.00 H new ATOM 694 N CYS A 48 72.152 -1.063 -6.320 1.00 1.00 N ATOM 695 CA CYS A 48 72.167 -1.799 -5.055 1.00 1.00 C ATOM 696 C CYS A 48 73.034 -3.023 -5.192 1.00 1.00 C ATOM 697 O CYS A 48 72.550 -4.150 -5.141 1.00 1.00 O ATOM 698 CB CYS A 48 70.734 -2.233 -4.652 1.00 1.00 C ATOM 699 SG CYS A 48 70.799 -3.245 -3.155 1.00 1.00 S ATOM 0 H CYS A 48 72.529 -0.117 -6.264 1.00 1.00 H new ATOM 0 HA CYS A 48 72.566 -1.143 -4.281 1.00 1.00 H new ATOM 0 HB2 CYS A 48 70.112 -1.354 -4.481 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.273 -2.796 -5.463 1.00 1.00 H new ATOM 704 N ASN A 49 74.324 -2.799 -5.355 1.00 1.00 N ATOM 705 CA ASN A 49 75.254 -3.908 -5.477 1.00 1.00 C ATOM 706 C ASN A 49 76.607 -3.488 -4.944 1.00 1.00 C ATOM 707 O ASN A 49 76.873 -2.298 -4.913 1.00 1.00 O ATOM 708 CB ASN A 49 75.356 -4.342 -6.948 1.00 1.00 C ATOM 709 CG ASN A 49 74.359 -5.460 -7.219 1.00 1.00 C ATOM 710 OD1 ASN A 49 74.502 -6.560 -6.685 1.00 1.00 O ATOM 711 ND2 ASN A 49 73.346 -5.237 -8.002 1.00 1.00 N ATOM 0 H ASN A 49 74.749 -1.873 -5.406 1.00 1.00 H new ATOM 0 HA ASN A 49 74.896 -4.757 -4.894 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.155 -3.494 -7.603 1.00 1.00 H new ATOM 0 HB3 ASN A 49 76.368 -4.682 -7.168 1.00 1.00 H new ATOM 0 HD21 ASN A 49 72.664 -5.975 -8.177 1.00 1.00 H new ATOM 0 HD22 ASN A 49 73.233 -4.324 -8.442 1.00 1.00 H new ATOM 718 N PRO A 50 77.446 -4.437 -4.548 1.00 1.00 N ATOM 719 CA PRO A 50 78.836 -4.165 -4.035 1.00 1.00 C ATOM 720 C PRO A 50 79.605 -3.154 -4.907 1.00 1.00 C ATOM 721 O PRO A 50 80.716 -3.435 -5.326 1.00 1.00 O ATOM 722 CB PRO A 50 79.523 -5.549 -4.099 1.00 1.00 C ATOM 723 CG PRO A 50 78.423 -6.571 -4.033 1.00 1.00 C ATOM 724 CD PRO A 50 77.133 -5.882 -4.514 1.00 1.00 C ATOM 0 HA PRO A 50 78.814 -3.724 -3.038 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.098 -5.655 -5.019 1.00 1.00 H new ATOM 0 HB3 PRO A 50 80.221 -5.675 -3.271 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.658 -7.430 -4.661 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.304 -6.943 -3.015 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.839 -6.243 -5.500 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.303 -6.088 -3.838 1.00 1.00 H new ATOM 732 N GLU A 51 79.017 -1.981 -5.124 1.00 1.00 N ATOM 733 CA GLU A 51 79.622 -0.914 -5.916 1.00 1.00 C ATOM 734 C GLU A 51 80.173 -1.438 -7.235 1.00 1.00 C ATOM 735 O GLU A 51 81.352 -1.257 -7.536 1.00 1.00 O ATOM 736 CB GLU A 51 80.737 -0.266 -5.121 1.00 1.00 C ATOM 737 CG GLU A 51 80.206 0.154 -3.714 1.00 1.00 C ATOM 738 CD GLU A 51 81.023 -0.513 -2.609 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.248 -1.708 -2.708 1.00 1.00 O ATOM 740 OE2 GLU A 51 81.426 0.180 -1.690 1.00 1.00 O ATOM 0 H GLU A 51 78.098 -1.742 -4.751 1.00 1.00 H new ATOM 0 HA GLU A 51 78.848 -0.181 -6.143 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.571 -0.960 -5.013 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.116 0.607 -5.653 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.258 1.238 -3.608 1.00 1.00 H new ATOM 0 HG3 GLU A 51 79.157 -0.126 -3.617 1.00 1.00 H new ATOM 747 N ARG A 52 79.321 -2.108 -8.009 1.00 1.00 N ATOM 748 CA ARG A 52 79.736 -2.680 -9.297 1.00 1.00 C ATOM 749 C ARG A 52 78.558 -2.767 -10.251 1.00 1.00 C ATOM 750 O ARG A 52 77.410 -2.633 -9.834 1.00 1.00 O ATOM 751 CB ARG A 52 80.261 -4.102 -9.105 1.00 1.00 C ATOM 752 CG ARG A 52 81.457 -4.114 -8.150 1.00 1.00 C ATOM 753 CD ARG A 52 81.855 -5.543 -7.826 1.00 1.00 C ATOM 754 NE ARG A 52 80.668 -6.292 -7.380 1.00 1.00 N ATOM 755 CZ ARG A 52 80.216 -7.360 -8.030 1.00 1.00 C ATOM 756 NH1 ARG A 52 80.815 -7.771 -9.103 1.00 1.00 N ATOM 757 NH2 ARG A 52 79.159 -7.997 -7.590 1.00 1.00 N ATOM 0 H ARG A 52 78.342 -2.270 -7.772 1.00 1.00 H new ATOM 0 HA ARG A 52 80.512 -2.030 -9.703 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.468 -4.737 -8.710 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.554 -4.520 -10.068 1.00 1.00 H new ATOM 0 HG2 ARG A 52 82.298 -3.588 -8.602 1.00 1.00 H new ATOM 0 HG3 ARG A 52 81.205 -3.582 -7.233 1.00 1.00 H new ATOM 0 HD2 ARG A 52 82.290 -6.019 -8.705 1.00 1.00 H new ATOM 0 HD3 ARG A 52 82.618 -5.552 -7.048 1.00 1.00 H new ATOM 0 HE ARG A 52 80.175 -5.980 -6.543 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.635 -7.275 -9.451 1.00 1.00 H new ATOM 0 HH12 ARG A 52 80.466 -8.591 -9.600 1.00 1.00 H new ATOM 0 HH21 ARG A 52 78.682 -7.674 -6.748 1.00 1.00 H new ATOM 0 HH22 ARG A 52 78.813 -8.816 -8.089 1.00 1.00 H new ATOM 771 N ILE A 53 78.850 -3.018 -11.528 1.00 1.00 N ATOM 772 CA ILE A 53 77.818 -3.158 -12.540 1.00 1.00 C ATOM 773 C ILE A 53 77.294 -4.586 -12.502 1.00 1.00 C ATOM 774 O ILE A 53 77.886 -5.422 -11.828 1.00 1.00 O ATOM 775 CB ILE A 53 78.363 -2.828 -13.950 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.201 -2.308 -14.833 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.983 -4.087 -14.586 1.00 1.00 C ATOM 778 CD1 ILE A 53 77.025 -0.802 -14.626 1.00 1.00 C ATOM 0 H ILE A 53 79.801 -3.128 -11.881 1.00 1.00 H new ATOM 0 HA ILE A 53 77.013 -2.454 -12.328 1.00 1.00 H new ATOM 0 HB ILE A 53 79.135 -2.062 -13.871 1.00 1.00 H new ATOM 0 HG12 ILE A 53 77.408 -2.518 -15.882 1.00 1.00 H new ATOM 0 HG13 ILE A 53 76.278 -2.829 -14.579 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.363 -3.844 -15.578 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.801 -4.445 -13.961 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.223 -4.864 -14.669 1.00 1.00 H new ATOM 0 HD11 ILE A 53 76.207 -0.442 -15.250 1.00 1.00 H new ATOM 0 HD12 ILE A 53 76.798 -0.603 -13.579 1.00 1.00 H new ATOM 0 HD13 ILE A 53 77.945 -0.287 -14.902 1.00 1.00 H new ATOM 790 N GLN A 54 76.192 -4.882 -13.201 1.00 1.00 N ATOM 791 CA GLN A 54 75.619 -6.231 -13.204 1.00 1.00 C ATOM 792 C GLN A 54 75.248 -6.620 -14.638 1.00 1.00 C ATOM 793 O GLN A 54 74.615 -5.844 -15.355 1.00 1.00 O ATOM 794 CB GLN A 54 74.349 -6.241 -12.327 1.00 1.00 C ATOM 795 CG GLN A 54 73.992 -4.802 -11.912 1.00 1.00 C ATOM 796 CD GLN A 54 74.959 -4.325 -10.829 1.00 1.00 C ATOM 797 OE1 GLN A 54 74.894 -3.172 -10.402 1.00 1.00 O ATOM 798 NE2 GLN A 54 75.861 -5.148 -10.356 1.00 1.00 N ATOM 0 H GLN A 54 75.681 -4.207 -13.770 1.00 1.00 H new ATOM 0 HA GLN A 54 76.345 -6.942 -12.810 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.520 -6.687 -12.876 1.00 1.00 H new ATOM 0 HB3 GLN A 54 74.512 -6.855 -11.441 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.044 -4.140 -12.777 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.968 -4.763 -11.542 1.00 1.00 H new ATOM 0 HE21 GLN A 54 75.915 -6.103 -10.709 1.00 1.00 H new ATOM 0 HE22 GLN A 54 76.509 -4.834 -9.634 1.00 1.00 H new ATOM 807 N ILE A 55 75.643 -7.818 -15.053 1.00 1.00 N ATOM 808 CA ILE A 55 75.344 -8.302 -16.394 1.00 1.00 C ATOM 809 C ILE A 55 75.103 -9.807 -16.370 1.00 1.00 C ATOM 810 O ILE A 55 75.618 -10.490 -15.486 1.00 1.00 O ATOM 811 CB ILE A 55 76.513 -7.966 -17.334 1.00 1.00 C ATOM 812 CG1 ILE A 55 77.827 -8.646 -16.849 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.695 -6.432 -17.417 1.00 1.00 C ATOM 814 CD1 ILE A 55 78.540 -7.796 -15.782 1.00 1.00 C ATOM 0 H ILE A 55 76.173 -8.473 -14.478 1.00 1.00 H new ATOM 0 HA ILE A 55 74.440 -7.813 -16.758 1.00 1.00 H new ATOM 0 HB ILE A 55 76.283 -8.350 -18.328 1.00 1.00 H new ATOM 0 HG12 ILE A 55 77.599 -9.630 -16.439 1.00 1.00 H new ATOM 0 HG13 ILE A 55 78.493 -8.800 -17.698 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.525 -6.200 -18.084 1.00 1.00 H new ATOM 0 HG22 ILE A 55 75.782 -5.978 -17.801 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.907 -6.036 -16.424 1.00 1.00 H new ATOM 0 HD11 ILE A 55 79.453 -8.300 -15.466 1.00 1.00 H new ATOM 0 HD12 ILE A 55 78.790 -6.821 -16.201 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.882 -7.664 -14.923 1.00 1.00 H new ATOM 826 N GLY A 56 74.342 -10.343 -17.327 1.00 1.00 N ATOM 827 CA GLY A 56 74.084 -11.773 -17.366 1.00 1.00 C ATOM 828 C GLY A 56 72.716 -12.066 -16.798 1.00 1.00 C ATOM 829 O GLY A 56 72.326 -13.229 -16.652 1.00 1.00 O ATOM 0 H GLY A 56 73.900 -9.809 -18.076 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.146 -12.134 -18.393 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.845 -12.304 -16.795 1.00 1.00 H new ATOM 833 N ASP A 57 71.986 -10.991 -16.471 1.00 1.00 N ATOM 834 CA ASP A 57 70.646 -11.119 -15.904 1.00 1.00 C ATOM 835 C ASP A 57 69.530 -11.026 -16.963 1.00 1.00 C ATOM 836 O ASP A 57 69.315 -10.006 -17.619 1.00 1.00 O ATOM 837 CB ASP A 57 70.407 -10.040 -14.857 1.00 1.00 C ATOM 838 CG ASP A 57 71.383 -10.169 -13.695 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.639 -11.290 -13.278 1.00 1.00 O ATOM 840 OD2 ASP A 57 71.861 -9.146 -13.244 1.00 1.00 O ATOM 0 H ASP A 57 72.303 -10.029 -16.590 1.00 1.00 H new ATOM 0 HA ASP A 57 70.604 -12.111 -15.455 1.00 1.00 H new ATOM 0 HB2 ASP A 57 70.512 -9.057 -15.315 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.385 -10.111 -14.485 1.00 1.00 H new ATOM 845 N TRP A 58 68.832 -12.130 -17.061 1.00 1.00 N ATOM 846 CA TRP A 58 67.679 -12.272 -17.983 1.00 1.00 C ATOM 847 C TRP A 58 66.445 -11.615 -17.385 1.00 1.00 C ATOM 848 O TRP A 58 66.517 -11.106 -16.277 1.00 1.00 O ATOM 849 CB TRP A 58 67.386 -13.705 -18.414 1.00 1.00 C ATOM 850 CG TRP A 58 68.658 -14.353 -18.847 1.00 1.00 C ATOM 851 CD1 TRP A 58 69.803 -13.715 -19.206 1.00 1.00 C ATOM 852 CD2 TRP A 58 68.923 -15.769 -18.987 1.00 1.00 C ATOM 853 NE1 TRP A 58 70.746 -14.661 -19.548 1.00 1.00 N ATOM 854 CE2 TRP A 58 70.250 -15.942 -19.432 1.00 1.00 C ATOM 855 CE3 TRP A 58 68.140 -16.911 -18.767 1.00 1.00 C ATOM 856 CZ2 TRP A 58 70.784 -17.202 -19.654 1.00 1.00 C ATOM 857 CZ3 TRP A 58 68.672 -18.188 -18.991 1.00 1.00 C ATOM 858 CH2 TRP A 58 69.993 -18.333 -19.435 1.00 1.00 C ATOM 0 H TRP A 58 69.029 -12.968 -16.514 1.00 1.00 H new ATOM 0 HA TRP A 58 67.962 -11.756 -18.900 1.00 1.00 H new ATOM 0 HB2 TRP A 58 66.941 -14.262 -17.590 1.00 1.00 H new ATOM 0 HB3 TRP A 58 66.663 -13.712 -19.230 1.00 1.00 H new ATOM 0 HD1 TRP A 58 69.950 -12.645 -19.221 1.00 1.00 H new ATOM 0 HE1 TRP A 58 71.695 -14.440 -19.850 1.00 1.00 H new ATOM 0 HE3 TRP A 58 67.122 -16.806 -18.423 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 71.804 -17.309 -19.994 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 68.062 -19.063 -18.821 1.00 1.00 H new ATOM 0 HH2 TRP A 58 70.400 -19.318 -19.608 1.00 1.00 H new ATOM 869 N ARG A 59 65.310 -11.637 -18.087 1.00 1.00 N ATOM 870 CA ARG A 59 64.078 -11.052 -17.564 1.00 1.00 C ATOM 871 C ARG A 59 63.225 -12.112 -16.835 1.00 1.00 C ATOM 872 O ARG A 59 62.900 -11.966 -15.657 1.00 1.00 O ATOM 873 CB ARG A 59 63.304 -10.453 -18.744 1.00 1.00 C ATOM 874 CG ARG A 59 63.252 -11.451 -19.965 1.00 1.00 C ATOM 875 CD ARG A 59 63.854 -10.825 -21.232 1.00 1.00 C ATOM 876 NE ARG A 59 65.307 -10.996 -21.220 1.00 1.00 N ATOM 877 CZ ARG A 59 65.878 -12.079 -21.744 1.00 1.00 C ATOM 878 NH1 ARG A 59 65.136 -13.019 -22.260 1.00 1.00 N ATOM 879 NH2 ARG A 59 67.178 -12.208 -21.731 1.00 1.00 N ATOM 0 H ARG A 59 65.220 -12.052 -19.014 1.00 1.00 H new ATOM 0 HA ARG A 59 64.316 -10.277 -16.835 1.00 1.00 H new ATOM 0 HB2 ARG A 59 62.290 -10.208 -18.429 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.775 -9.520 -19.054 1.00 1.00 H new ATOM 0 HG2 ARG A 59 63.796 -12.362 -19.715 1.00 1.00 H new ATOM 0 HG3 ARG A 59 62.218 -11.739 -20.157 1.00 1.00 H new ATOM 0 HD2 ARG A 59 63.430 -11.295 -22.119 1.00 1.00 H new ATOM 0 HD3 ARG A 59 63.603 -9.766 -21.281 1.00 1.00 H new ATOM 0 HE ARG A 59 65.893 -10.273 -20.803 1.00 1.00 H new ATOM 0 HH11 ARG A 59 64.120 -12.924 -22.262 1.00 1.00 H new ATOM 0 HH12 ARG A 59 65.571 -13.849 -22.662 1.00 1.00 H new ATOM 0 HH21 ARG A 59 67.759 -11.478 -21.319 1.00 1.00 H new ATOM 0 HH22 ARG A 59 67.612 -13.039 -22.133 1.00 1.00 H new ATOM 893 N TYR A 60 62.912 -13.183 -17.554 1.00 1.00 N ATOM 894 CA TYR A 60 62.137 -14.315 -17.047 1.00 1.00 C ATOM 895 C TYR A 60 62.981 -15.076 -16.039 1.00 1.00 C ATOM 896 O TYR A 60 62.571 -16.103 -15.480 1.00 1.00 O ATOM 897 CB TYR A 60 61.669 -15.254 -18.168 1.00 1.00 C ATOM 898 CG TYR A 60 62.837 -16.049 -18.692 1.00 1.00 C ATOM 899 CD1 TYR A 60 63.608 -15.545 -19.739 1.00 1.00 C ATOM 900 CD2 TYR A 60 63.151 -17.286 -18.116 1.00 1.00 C ATOM 901 CE1 TYR A 60 64.697 -16.278 -20.217 1.00 1.00 C ATOM 902 CE2 TYR A 60 64.239 -18.020 -18.594 1.00 1.00 C ATOM 903 CZ TYR A 60 65.011 -17.516 -19.646 1.00 1.00 C ATOM 904 OH TYR A 60 66.089 -18.237 -20.118 1.00 1.00 O ATOM 0 H TYR A 60 63.195 -13.294 -18.528 1.00 1.00 H new ATOM 0 HA TYR A 60 61.237 -13.925 -16.571 1.00 1.00 H new ATOM 0 HB2 TYR A 60 60.899 -15.928 -17.792 1.00 1.00 H new ATOM 0 HB3 TYR A 60 61.220 -14.675 -18.975 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.364 -14.590 -20.180 1.00 1.00 H new ATOM 0 HD2 TYR A 60 62.553 -17.672 -17.304 1.00 1.00 H new ATOM 0 HE1 TYR A 60 65.296 -15.889 -21.027 1.00 1.00 H new ATOM 0 HE2 TYR A 60 64.484 -18.975 -18.152 1.00 1.00 H new ATOM 0 HH TYR A 60 66.809 -18.222 -19.453 1.00 1.00 H new ATOM 914 N GLU A 61 64.186 -14.579 -15.820 1.00 1.00 N ATOM 915 CA GLU A 61 65.093 -15.223 -14.907 1.00 1.00 C ATOM 916 C GLU A 61 64.549 -15.271 -13.482 1.00 1.00 C ATOM 917 O GLU A 61 65.073 -15.975 -12.649 1.00 1.00 O ATOM 918 CB GLU A 61 66.460 -14.494 -14.891 1.00 1.00 C ATOM 919 CG GLU A 61 67.593 -15.465 -15.270 1.00 1.00 C ATOM 920 CD GLU A 61 68.914 -14.717 -15.337 1.00 1.00 C ATOM 921 OE1 GLU A 61 68.953 -13.602 -14.859 1.00 1.00 O ATOM 922 OE2 GLU A 61 69.868 -15.279 -15.853 1.00 1.00 O ATOM 0 H GLU A 61 64.551 -13.736 -16.263 1.00 1.00 H new ATOM 0 HA GLU A 61 65.213 -16.246 -15.264 1.00 1.00 H new ATOM 0 HB2 GLU A 61 66.441 -13.658 -15.590 1.00 1.00 H new ATOM 0 HB3 GLU A 61 66.645 -14.078 -13.901 1.00 1.00 H new ATOM 0 HG2 GLU A 61 67.657 -16.268 -14.536 1.00 1.00 H new ATOM 0 HG3 GLU A 61 67.379 -15.930 -16.232 1.00 1.00 H new ATOM 929 N VAL A 62 63.575 -14.458 -13.181 1.00 1.00 N ATOM 930 CA VAL A 62 63.084 -14.369 -11.808 1.00 1.00 C ATOM 931 C VAL A 62 62.884 -15.764 -11.257 1.00 1.00 C ATOM 932 O VAL A 62 63.469 -16.126 -10.234 1.00 1.00 O ATOM 933 CB VAL A 62 61.756 -13.587 -11.820 1.00 1.00 C ATOM 934 CG1 VAL A 62 62.021 -12.111 -12.183 1.00 1.00 C ATOM 935 CG2 VAL A 62 60.805 -14.215 -12.865 1.00 1.00 C ATOM 0 H VAL A 62 63.102 -13.849 -13.849 1.00 1.00 H new ATOM 0 HA VAL A 62 63.801 -13.851 -11.172 1.00 1.00 H new ATOM 0 HB VAL A 62 61.298 -13.634 -10.832 1.00 1.00 H new ATOM 0 HG11 VAL A 62 61.079 -11.563 -12.190 1.00 1.00 H new ATOM 0 HG12 VAL A 62 62.692 -11.670 -11.446 1.00 1.00 H new ATOM 0 HG13 VAL A 62 62.480 -12.056 -13.170 1.00 1.00 H new ATOM 0 HG21 VAL A 62 59.864 -13.665 -12.877 1.00 1.00 H new ATOM 0 HG22 VAL A 62 61.266 -14.167 -13.852 1.00 1.00 H new ATOM 0 HG23 VAL A 62 60.614 -15.256 -12.604 1.00 1.00 H new ATOM 945 N ALA A 63 62.087 -16.553 -11.942 1.00 1.00 N ATOM 946 CA ALA A 63 61.851 -17.893 -11.525 1.00 1.00 C ATOM 947 C ALA A 63 63.172 -18.637 -11.527 1.00 1.00 C ATOM 948 O ALA A 63 63.566 -19.239 -10.519 1.00 1.00 O ATOM 949 CB ALA A 63 60.869 -18.562 -12.507 1.00 1.00 C ATOM 0 H ALA A 63 61.595 -16.277 -12.792 1.00 1.00 H new ATOM 0 HA ALA A 63 61.421 -17.911 -10.524 1.00 1.00 H new ATOM 0 HB1 ALA A 63 60.684 -19.589 -12.193 1.00 1.00 H new ATOM 0 HB2 ALA A 63 59.929 -18.010 -12.514 1.00 1.00 H new ATOM 0 HB3 ALA A 63 61.299 -18.561 -13.509 1.00 1.00 H new ATOM 955 N HIS A 64 63.887 -18.548 -12.658 1.00 1.00 N ATOM 956 CA HIS A 64 65.178 -19.240 -12.763 1.00 1.00 C ATOM 957 C HIS A 64 66.172 -18.803 -11.659 1.00 1.00 C ATOM 958 O HIS A 64 66.655 -19.610 -10.864 1.00 1.00 O ATOM 959 CB HIS A 64 65.804 -18.962 -14.130 1.00 1.00 C ATOM 960 CG HIS A 64 67.188 -19.538 -14.189 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.236 -18.981 -13.479 1.00 1.00 N ATOM 962 CD2 HIS A 64 67.716 -20.601 -14.872 1.00 1.00 C ATOM 963 CE1 HIS A 64 69.336 -19.705 -13.741 1.00 1.00 C ATOM 964 NE2 HIS A 64 69.075 -20.706 -14.586 1.00 1.00 N ATOM 0 H HIS A 64 63.606 -18.023 -13.486 1.00 1.00 H new ATOM 0 HA HIS A 64 64.982 -20.305 -12.638 1.00 1.00 H new ATOM 0 HB2 HIS A 64 65.187 -19.396 -14.917 1.00 1.00 H new ATOM 0 HB3 HIS A 64 65.841 -17.888 -14.310 1.00 1.00 H new ATOM 0 HD2 HIS A 64 67.164 -21.256 -15.530 1.00 1.00 H new ATOM 0 HE1 HIS A 64 70.310 -19.503 -13.321 1.00 1.00 H new ATOM 0 HE2 HIS A 64 69.731 -21.399 -14.945 1.00 1.00 H new ATOM 972 N ASP A 65 66.507 -17.535 -11.630 1.00 1.00 N ATOM 973 CA ASP A 65 67.447 -17.030 -10.640 1.00 1.00 C ATOM 974 C ASP A 65 66.840 -17.120 -9.240 1.00 1.00 C ATOM 975 O ASP A 65 67.436 -17.681 -8.301 1.00 1.00 O ATOM 976 CB ASP A 65 67.759 -15.575 -10.953 1.00 1.00 C ATOM 977 CG ASP A 65 68.819 -15.066 -9.997 1.00 1.00 C ATOM 978 OD1 ASP A 65 69.976 -15.401 -10.190 1.00 1.00 O ATOM 979 OD2 ASP A 65 68.460 -14.355 -9.071 1.00 1.00 O ATOM 0 H ASP A 65 66.148 -16.831 -12.275 1.00 1.00 H new ATOM 0 HA ASP A 65 68.357 -17.629 -10.673 1.00 1.00 H new ATOM 0 HB2 ASP A 65 68.107 -15.480 -11.982 1.00 1.00 H new ATOM 0 HB3 ASP A 65 66.855 -14.972 -10.865 1.00 1.00 H new ATOM 984 N GLY A 66 65.652 -16.551 -9.090 1.00 1.00 N ATOM 985 CA GLY A 66 64.936 -16.529 -7.816 1.00 1.00 C ATOM 986 C GLY A 66 64.615 -17.930 -7.299 1.00 1.00 C ATOM 987 O GLY A 66 63.657 -18.121 -6.557 1.00 1.00 O ATOM 0 H GLY A 66 65.153 -16.089 -9.850 1.00 1.00 H new ATOM 0 HA2 GLY A 66 65.536 -16.001 -7.075 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.009 -15.968 -7.934 1.00 1.00 H new ATOM 991 N ARG A 67 65.466 -18.885 -7.627 1.00 1.00 N ATOM 992 CA ARG A 67 65.338 -20.241 -7.132 1.00 1.00 C ATOM 993 C ARG A 67 65.946 -20.392 -5.729 1.00 1.00 C ATOM 994 O ARG A 67 65.842 -21.455 -5.126 1.00 1.00 O ATOM 995 CB ARG A 67 65.987 -21.219 -8.077 1.00 1.00 C ATOM 996 CG ARG A 67 65.171 -21.351 -9.318 1.00 1.00 C ATOM 997 CD ARG A 67 65.885 -22.297 -10.284 1.00 1.00 C ATOM 998 NE ARG A 67 65.149 -22.379 -11.536 1.00 1.00 N ATOM 999 CZ ARG A 67 64.100 -23.176 -11.672 1.00 1.00 C ATOM 1000 NH1 ARG A 67 63.722 -23.926 -10.677 1.00 1.00 N ATOM 1001 NH2 ARG A 67 63.448 -23.209 -12.802 1.00 1.00 N ATOM 0 H ARG A 67 66.265 -18.741 -8.244 1.00 1.00 H new ATOM 0 HA ARG A 67 64.272 -20.461 -7.067 1.00 1.00 H new ATOM 0 HB2 ARG A 67 66.993 -20.881 -8.328 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.088 -22.191 -7.594 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.180 -21.736 -9.078 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.030 -20.375 -9.782 1.00 1.00 H new ATOM 0 HD2 ARG A 67 66.898 -21.942 -10.471 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.972 -23.288 -9.838 1.00 1.00 H new ATOM 0 HE ARG A 67 65.448 -21.809 -12.328 1.00 1.00 H new ATOM 0 HH11 ARG A 67 64.233 -23.899 -9.795 1.00 1.00 H new ATOM 0 HH12 ARG A 67 62.914 -24.541 -10.780 1.00 1.00 H new ATOM 0 HH21 ARG A 67 63.746 -22.621 -13.580 1.00 1.00 H new ATOM 0 HH22 ARG A 67 62.640 -23.823 -12.907 1.00 1.00 H new ATOM 1015 N LEU A 68 66.575 -19.322 -5.236 1.00 1.00 N ATOM 1016 CA LEU A 68 67.182 -19.344 -3.876 1.00 1.00 C ATOM 1017 C LEU A 68 66.223 -20.156 -2.961 1.00 1.00 C ATOM 1018 O LEU A 68 66.606 -20.815 -1.998 1.00 1.00 O ATOM 1019 CB LEU A 68 67.381 -17.909 -3.339 1.00 1.00 C ATOM 1020 CG LEU A 68 66.242 -16.981 -3.856 1.00 1.00 C ATOM 1021 CD1 LEU A 68 65.457 -16.419 -2.685 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.843 -15.841 -4.684 1.00 1.00 C ATOM 0 H LEU A 68 66.683 -18.440 -5.736 1.00 1.00 H new ATOM 0 HA LEU A 68 68.168 -19.808 -3.901 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.387 -17.918 -2.249 1.00 1.00 H new ATOM 0 HB3 LEU A 68 68.349 -17.523 -3.660 1.00 1.00 H new ATOM 0 HG LEU A 68 65.565 -17.560 -4.484 1.00 1.00 H new ATOM 0 HD11 LEU A 68 64.663 -15.771 -3.057 1.00 1.00 H new ATOM 0 HD12 LEU A 68 65.020 -17.238 -2.113 1.00 1.00 H new ATOM 0 HD13 LEU A 68 66.124 -15.844 -2.043 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.044 -15.193 -5.045 1.00 1.00 H new ATOM 0 HD22 LEU A 68 67.527 -15.262 -4.064 1.00 1.00 H new ATOM 0 HD23 LEU A 68 67.386 -16.255 -5.534 1.00 1.00 H new ATOM 1034 N LEU A 69 64.946 -20.133 -3.289 1.00 1.00 N ATOM 1035 CA LEU A 69 64.034 -20.953 -2.518 1.00 1.00 C ATOM 1036 C LEU A 69 64.435 -22.423 -2.811 1.00 1.00 C ATOM 1037 O LEU A 69 64.886 -23.137 -1.911 1.00 1.00 O ATOM 1038 CB LEU A 69 62.580 -20.678 -2.968 1.00 1.00 C ATOM 1039 CG LEU A 69 62.492 -20.751 -4.530 1.00 1.00 C ATOM 1040 CD1 LEU A 69 61.764 -22.031 -4.998 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.767 -19.516 -5.070 1.00 1.00 C ATOM 0 H LEU A 69 64.532 -19.586 -4.044 1.00 1.00 H new ATOM 0 HA LEU A 69 64.089 -20.738 -1.451 1.00 1.00 H new ATOM 0 HB2 LEU A 69 61.906 -21.408 -2.521 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.261 -19.695 -2.621 1.00 1.00 H new ATOM 0 HG LEU A 69 63.509 -20.780 -4.921 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.722 -22.048 -6.087 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.305 -22.908 -4.642 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.751 -22.041 -4.595 1.00 1.00 H new ATOM 0 HD21 LEU A 69 61.710 -19.574 -6.157 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.760 -19.475 -4.655 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.314 -18.618 -4.783 1.00 1.00 H new ATOM 1053 N ALA A 70 64.291 -22.867 -4.093 1.00 1.00 N ATOM 1054 CA ALA A 70 64.676 -24.246 -4.466 1.00 1.00 C ATOM 1055 C ALA A 70 66.176 -24.279 -4.587 1.00 1.00 C ATOM 1056 O ALA A 70 66.845 -24.832 -3.716 1.00 1.00 O ATOM 1057 CB ALA A 70 64.049 -24.604 -5.819 1.00 1.00 C ATOM 0 H ALA A 70 63.922 -22.304 -4.859 1.00 1.00 H new ATOM 0 HA ALA A 70 64.331 -24.959 -3.717 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.333 -25.620 -6.094 1.00 1.00 H new ATOM 0 HB2 ALA A 70 62.963 -24.537 -5.746 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.405 -23.909 -6.580 1.00 1.00 H new ATOM 1063 N ALA A 71 66.701 -23.675 -5.676 1.00 1.00 N ATOM 1064 CA ALA A 71 68.135 -23.557 -5.956 1.00 1.00 C ATOM 1065 C ALA A 71 68.874 -23.011 -4.751 1.00 1.00 C ATOM 1066 O ALA A 71 70.045 -22.653 -4.883 1.00 1.00 O ATOM 1067 CB ALA A 71 68.412 -22.669 -7.166 1.00 1.00 C ATOM 0 H ALA A 71 66.119 -23.248 -6.397 1.00 1.00 H new ATOM 0 HA ALA A 71 68.495 -24.561 -6.181 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.487 -22.610 -7.336 1.00 1.00 H new ATOM 0 HB2 ALA A 71 67.928 -23.092 -8.046 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.019 -21.669 -6.981 1.00 1.00 H new ATOM 1073 N HIS A 72 68.170 -22.872 -3.603 1.00 1.00 N ATOM 1074 CA HIS A 72 68.720 -22.278 -2.383 1.00 1.00 C ATOM 1075 C HIS A 72 70.211 -22.244 -2.424 1.00 1.00 C ATOM 1076 O HIS A 72 70.785 -21.160 -2.474 1.00 1.00 O ATOM 1077 CB HIS A 72 68.235 -23.144 -1.188 1.00 1.00 C ATOM 1078 CG HIS A 72 68.256 -24.616 -1.568 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.918 -25.082 -2.697 1.00 1.00 N ATOM 1080 CD2 HIS A 72 67.702 -25.735 -0.980 1.00 1.00 C ATOM 1081 CE1 HIS A 72 68.751 -26.418 -2.751 1.00 1.00 C ATOM 1082 NE2 HIS A 72 68.019 -26.867 -1.731 1.00 1.00 N ATOM 0 H HIS A 72 67.200 -23.173 -3.507 1.00 1.00 H new ATOM 0 HA HIS A 72 68.379 -21.248 -2.283 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.875 -22.975 -0.322 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.226 -22.849 -0.901 1.00 1.00 H new ATOM 0 HD2 HIS A 72 67.112 -25.734 -0.075 1.00 1.00 H new ATOM 0 HE1 HIS A 72 69.160 -27.049 -3.526 1.00 1.00 H new ATOM 0 HE2 HIS A 72 67.749 -27.832 -1.541 1.00 1.00 H new ATOM 1090 N MET A 73 70.830 -23.378 -2.434 1.00 1.00 N ATOM 1091 CA MET A 73 72.272 -23.420 -2.511 1.00 1.00 C ATOM 1092 C MET A 73 72.739 -23.148 -3.942 1.00 1.00 C ATOM 1093 O MET A 73 73.683 -22.388 -4.152 1.00 1.00 O ATOM 1094 CB MET A 73 72.788 -24.783 -2.042 1.00 1.00 C ATOM 1095 CG MET A 73 71.664 -25.812 -2.160 1.00 1.00 C ATOM 1096 SD MET A 73 72.320 -27.461 -1.820 1.00 1.00 S ATOM 1097 CE MET A 73 71.717 -27.601 -0.120 1.00 1.00 C ATOM 0 H MET A 73 70.373 -24.289 -2.390 1.00 1.00 H new ATOM 0 HA MET A 73 72.675 -22.646 -1.858 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.643 -25.089 -2.645 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.133 -24.720 -1.010 1.00 1.00 H new ATOM 0 HG2 MET A 73 70.864 -25.575 -1.458 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.231 -25.780 -3.160 1.00 1.00 H new ATOM 0 HE1 MET A 73 72.015 -28.564 0.294 1.00 1.00 H new ATOM 0 HE2 MET A 73 72.142 -26.799 0.484 1.00 1.00 H new ATOM 0 HE3 MET A 73 70.630 -27.524 -0.112 1.00 1.00 H new ATOM 1107 N VAL A 74 72.131 -23.846 -4.918 1.00 1.00 N ATOM 1108 CA VAL A 74 72.586 -23.741 -6.303 1.00 1.00 C ATOM 1109 C VAL A 74 72.890 -22.292 -6.624 1.00 1.00 C ATOM 1110 O VAL A 74 73.908 -22.053 -7.255 1.00 1.00 O ATOM 1111 CB VAL A 74 71.501 -24.232 -7.220 1.00 1.00 C ATOM 1112 CG1 VAL A 74 71.859 -23.998 -8.693 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.205 -25.704 -6.978 1.00 1.00 C ATOM 0 H VAL A 74 71.341 -24.474 -4.772 1.00 1.00 H new ATOM 0 HA VAL A 74 73.484 -24.343 -6.439 1.00 1.00 H new ATOM 0 HB VAL A 74 70.604 -23.656 -6.995 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.052 -24.365 -9.326 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.001 -22.932 -8.868 1.00 1.00 H new ATOM 0 HG13 VAL A 74 72.779 -24.531 -8.933 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.416 -26.033 -7.655 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.106 -26.291 -7.158 1.00 1.00 H new ATOM 0 HG23 VAL A 74 70.880 -25.845 -5.947 1.00 1.00 H new ATOM 1123 N ASN A 75 72.022 -21.332 -6.228 1.00 1.00 N ATOM 1124 CA ASN A 75 72.272 -19.898 -6.500 1.00 1.00 C ATOM 1125 C ASN A 75 73.786 -19.573 -6.376 1.00 1.00 C ATOM 1126 O ASN A 75 74.331 -18.615 -6.959 1.00 1.00 O ATOM 1127 CB ASN A 75 71.461 -19.108 -5.464 1.00 1.00 C ATOM 1128 CG ASN A 75 71.602 -17.624 -5.722 1.00 1.00 C ATOM 1129 OD1 ASN A 75 72.418 -16.964 -5.079 1.00 1.00 O ATOM 1130 ND2 ASN A 75 70.863 -17.060 -6.632 1.00 1.00 N ATOM 0 H ASN A 75 71.154 -21.521 -5.726 1.00 1.00 H new ATOM 0 HA ASN A 75 71.972 -19.634 -7.514 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.411 -19.397 -5.514 1.00 1.00 H new ATOM 0 HB3 ASN A 75 71.809 -19.346 -4.459 1.00 1.00 H new ATOM 0 HD21 ASN A 75 70.957 -16.062 -6.818 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.190 -17.616 -7.159 1.00 1.00 H new ATOM 1137 N GLY A 76 74.459 -20.464 -5.694 1.00 1.00 N ATOM 1138 CA GLY A 76 75.890 -20.399 -5.560 1.00 1.00 C ATOM 1139 C GLY A 76 76.508 -20.193 -6.959 1.00 1.00 C ATOM 1140 O GLY A 76 77.620 -19.752 -7.110 1.00 1.00 O ATOM 0 H GLY A 76 74.029 -21.256 -5.216 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.171 -19.580 -4.898 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.270 -21.316 -5.110 1.00 1.00 H new ATOM 1144 N ILE A 77 75.765 -20.534 -7.997 1.00 1.00 N ATOM 1145 CA ILE A 77 76.276 -20.394 -9.360 1.00 1.00 C ATOM 1146 C ILE A 77 76.925 -19.036 -9.619 1.00 1.00 C ATOM 1147 O ILE A 77 78.035 -18.984 -10.130 1.00 1.00 O ATOM 1148 CB ILE A 77 75.139 -20.569 -10.370 1.00 1.00 C ATOM 1149 CG1 ILE A 77 73.891 -19.851 -9.841 1.00 1.00 C ATOM 1150 CG2 ILE A 77 74.832 -22.047 -10.588 1.00 1.00 C ATOM 1151 CD1 ILE A 77 72.762 -19.954 -10.854 1.00 1.00 C ATOM 0 H ILE A 77 74.817 -20.906 -7.931 1.00 1.00 H new ATOM 0 HA ILE A 77 77.035 -21.167 -9.477 1.00 1.00 H new ATOM 0 HB ILE A 77 75.441 -20.140 -11.326 1.00 1.00 H new ATOM 0 HG12 ILE A 77 73.582 -20.293 -8.894 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.120 -18.804 -9.645 1.00 1.00 H new ATOM 0 HG21 ILE A 77 74.021 -22.148 -11.309 1.00 1.00 H new ATOM 0 HG22 ILE A 77 75.721 -22.551 -10.968 1.00 1.00 H new ATOM 0 HG23 ILE A 77 74.535 -22.500 -9.642 1.00 1.00 H new ATOM 0 HD11 ILE A 77 71.880 -19.441 -10.470 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.071 -19.491 -11.791 1.00 1.00 H new ATOM 0 HD13 ILE A 77 72.524 -21.003 -11.028 1.00 1.00 H new ATOM 1163 N VAL A 78 76.233 -17.944 -9.280 1.00 1.00 N ATOM 1164 CA VAL A 78 76.742 -16.611 -9.523 1.00 1.00 C ATOM 1165 C VAL A 78 78.100 -16.428 -8.902 1.00 1.00 C ATOM 1166 O VAL A 78 78.867 -15.562 -9.311 1.00 1.00 O ATOM 1167 CB VAL A 78 75.764 -15.606 -8.941 1.00 1.00 C ATOM 1168 CG1 VAL A 78 75.731 -15.733 -7.413 1.00 1.00 C ATOM 1169 CG2 VAL A 78 76.205 -14.204 -9.333 1.00 1.00 C ATOM 0 H VAL A 78 75.316 -17.968 -8.835 1.00 1.00 H new ATOM 0 HA VAL A 78 76.846 -16.458 -10.597 1.00 1.00 H new ATOM 0 HB VAL A 78 74.764 -15.800 -9.330 1.00 1.00 H new ATOM 0 HG11 VAL A 78 75.027 -15.009 -7.003 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.417 -16.740 -7.138 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.725 -15.541 -7.010 1.00 1.00 H new ATOM 0 HG21 VAL A 78 75.509 -13.475 -8.920 1.00 1.00 H new ATOM 0 HG22 VAL A 78 77.204 -14.014 -8.941 1.00 1.00 H new ATOM 0 HG23 VAL A 78 76.219 -14.117 -10.419 1.00 1.00 H new ATOM 1179 N ILE A 79 78.406 -17.243 -7.915 1.00 1.00 N ATOM 1180 CA ILE A 79 79.711 -17.134 -7.256 1.00 1.00 C ATOM 1181 C ILE A 79 80.783 -17.892 -8.041 1.00 1.00 C ATOM 1182 O ILE A 79 81.876 -17.384 -8.261 1.00 1.00 O ATOM 1183 CB ILE A 79 79.626 -17.666 -5.802 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.950 -19.190 -5.747 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.208 -17.388 -5.273 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.593 -19.772 -4.395 1.00 1.00 C ATOM 0 H ILE A 79 77.794 -17.974 -7.551 1.00 1.00 H new ATOM 0 HA ILE A 79 79.993 -16.081 -7.227 1.00 1.00 H new ATOM 0 HB ILE A 79 80.362 -17.159 -5.178 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.398 -19.711 -6.529 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.010 -19.348 -5.946 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.123 -17.754 -4.250 1.00 1.00 H new ATOM 0 HG22 ILE A 79 78.017 -16.315 -5.292 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.478 -17.898 -5.902 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.829 -20.836 -4.383 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.165 -19.265 -3.618 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.528 -19.634 -4.209 1.00 1.00 H new ATOM 1198 N ALA A 80 80.447 -19.106 -8.442 1.00 1.00 N ATOM 1199 CA ALA A 80 81.380 -19.956 -9.178 1.00 1.00 C ATOM 1200 C ALA A 80 81.484 -19.522 -10.625 1.00 1.00 C ATOM 1201 O ALA A 80 82.466 -19.826 -11.306 1.00 1.00 O ATOM 1202 CB ALA A 80 80.938 -21.426 -9.103 1.00 1.00 C ATOM 0 H ALA A 80 79.535 -19.530 -8.272 1.00 1.00 H new ATOM 0 HA ALA A 80 82.362 -19.855 -8.716 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.643 -22.047 -9.656 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.913 -21.746 -8.061 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.944 -21.530 -9.538 1.00 1.00 H new ATOM 1208 N GLU A 81 80.463 -18.817 -11.096 1.00 1.00 N ATOM 1209 CA GLU A 81 80.439 -18.350 -12.471 1.00 1.00 C ATOM 1210 C GLU A 81 81.227 -17.050 -12.624 1.00 1.00 C ATOM 1211 O GLU A 81 82.272 -17.027 -13.275 1.00 1.00 O ATOM 1212 CB GLU A 81 78.970 -18.107 -12.907 1.00 1.00 C ATOM 1213 CG GLU A 81 78.474 -19.264 -13.770 1.00 1.00 C ATOM 1214 CD GLU A 81 78.506 -20.566 -12.978 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.978 -20.542 -11.854 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.062 -21.568 -13.510 1.00 1.00 O ATOM 0 H GLU A 81 79.644 -18.558 -10.546 1.00 1.00 H new ATOM 0 HA GLU A 81 80.900 -19.112 -13.099 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.335 -18.003 -12.027 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.899 -17.173 -13.464 1.00 1.00 H new ATOM 0 HG2 GLU A 81 77.459 -19.063 -14.111 1.00 1.00 H new ATOM 0 HG3 GLU A 81 79.097 -19.356 -14.660 1.00 1.00 H new ATOM 1223 N ASP A 82 80.699 -15.966 -12.055 1.00 1.00 N ATOM 1224 CA ASP A 82 81.349 -14.677 -12.191 1.00 1.00 C ATOM 1225 C ASP A 82 82.725 -14.723 -11.605 1.00 1.00 C ATOM 1226 O ASP A 82 83.675 -14.485 -12.344 1.00 1.00 O ATOM 1227 CB ASP A 82 80.545 -13.600 -11.485 1.00 1.00 C ATOM 1228 CG ASP A 82 79.204 -13.428 -12.180 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.096 -13.831 -13.327 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.302 -12.899 -11.554 1.00 1.00 O ATOM 0 H ASP A 82 79.839 -15.960 -11.507 1.00 1.00 H new ATOM 0 HA ASP A 82 81.414 -14.442 -13.253 1.00 1.00 H new ATOM 0 HB2 ASP A 82 80.393 -13.871 -10.440 1.00 1.00 H new ATOM 0 HB3 ASP A 82 81.094 -12.658 -11.493 1.00 1.00 H new ATOM 1235 N ALA A 83 82.810 -15.014 -10.277 1.00 1.00 N ATOM 1236 CA ALA A 83 84.114 -15.091 -9.551 1.00 1.00 C ATOM 1237 C ALA A 83 85.263 -14.781 -10.496 1.00 1.00 C ATOM 1238 O ALA A 83 85.984 -13.808 -10.313 1.00 1.00 O ATOM 1239 CB ALA A 83 84.301 -16.490 -8.943 1.00 1.00 C ATOM 0 H ALA A 83 81.997 -15.198 -9.689 1.00 1.00 H new ATOM 0 HA ALA A 83 84.108 -14.353 -8.749 1.00 1.00 H new ATOM 0 HB1 ALA A 83 85.255 -16.534 -8.417 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.491 -16.694 -8.243 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.291 -17.236 -9.737 1.00 1.00 H new ATOM 1245 N LEU A 84 85.460 -15.667 -11.469 1.00 1.00 N ATOM 1246 CA LEU A 84 86.575 -15.550 -12.424 1.00 1.00 C ATOM 1247 C LEU A 84 87.005 -14.094 -12.539 1.00 1.00 C ATOM 1248 O LEU A 84 88.184 -13.778 -12.387 1.00 1.00 O ATOM 1249 CB LEU A 84 86.076 -16.025 -13.809 1.00 1.00 C ATOM 1250 CG LEU A 84 86.191 -17.547 -13.937 1.00 1.00 C ATOM 1251 CD1 LEU A 84 87.678 -17.974 -13.962 1.00 1.00 C ATOM 1252 CD2 LEU A 84 85.460 -18.209 -12.758 1.00 1.00 C ATOM 0 H LEU A 84 84.863 -16.480 -11.623 1.00 1.00 H new ATOM 0 HA LEU A 84 87.417 -16.152 -12.083 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.039 -15.721 -13.950 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.659 -15.545 -14.595 1.00 1.00 H new ATOM 0 HG LEU A 84 85.731 -17.868 -14.872 1.00 1.00 H new ATOM 0 HD11 LEU A 84 87.744 -19.058 -14.053 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.176 -17.507 -14.812 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.163 -17.658 -13.039 1.00 1.00 H new ATOM 0 HD21 LEU A 84 85.538 -19.293 -12.844 1.00 1.00 H new ATOM 0 HD22 LEU A 84 85.913 -17.885 -11.821 1.00 1.00 H new ATOM 0 HD23 LEU A 84 84.409 -17.919 -12.772 1.00 1.00 H new ATOM 1264 N ILE A 85 86.055 -13.203 -12.753 1.00 1.00 N ATOM 1265 CA ILE A 85 86.366 -11.783 -12.812 1.00 1.00 C ATOM 1266 C ILE A 85 86.057 -11.138 -11.461 1.00 1.00 C ATOM 1267 O ILE A 85 86.884 -10.432 -10.892 1.00 1.00 O ATOM 1268 CB ILE A 85 85.550 -11.114 -13.909 1.00 1.00 C ATOM 1269 CG1 ILE A 85 85.913 -9.627 -13.968 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.052 -11.278 -13.624 1.00 1.00 C ATOM 1271 CD1 ILE A 85 85.168 -8.977 -15.129 1.00 1.00 C ATOM 0 H ILE A 85 85.070 -13.432 -12.888 1.00 1.00 H new ATOM 0 HA ILE A 85 87.425 -11.656 -13.038 1.00 1.00 H new ATOM 0 HB ILE A 85 85.775 -11.582 -14.867 1.00 1.00 H new ATOM 0 HG12 ILE A 85 85.648 -9.138 -13.031 1.00 1.00 H new ATOM 0 HG13 ILE A 85 86.989 -9.507 -14.097 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.476 -10.796 -14.414 1.00 1.00 H new ATOM 0 HG22 ILE A 85 83.802 -12.338 -13.588 1.00 1.00 H new ATOM 0 HG23 ILE A 85 83.811 -10.816 -12.667 1.00 1.00 H new ATOM 0 HD11 ILE A 85 85.422 -7.918 -15.177 1.00 1.00 H new ATOM 0 HD12 ILE A 85 85.455 -9.461 -16.062 1.00 1.00 H new ATOM 0 HD13 ILE A 85 84.094 -9.086 -14.979 1.00 1.00 H new ATOM 1283 N ALA A 86 84.845 -11.381 -10.960 1.00 1.00 N ATOM 1284 CA ALA A 86 84.423 -10.807 -9.684 1.00 1.00 C ATOM 1285 C ALA A 86 85.466 -11.064 -8.606 1.00 1.00 C ATOM 1286 O ALA A 86 85.859 -10.158 -7.883 1.00 1.00 O ATOM 1287 CB ALA A 86 83.073 -11.416 -9.254 1.00 1.00 C ATOM 0 H ALA A 86 84.144 -11.966 -11.415 1.00 1.00 H new ATOM 0 HA ALA A 86 84.312 -9.730 -9.812 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.765 -10.983 -8.302 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.319 -11.201 -10.011 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.179 -12.495 -9.144 1.00 1.00 H new ATOM 1293 N GLU A 87 85.935 -12.298 -8.523 1.00 1.00 N ATOM 1294 CA GLU A 87 86.940 -12.658 -7.538 1.00 1.00 C ATOM 1295 C GLU A 87 88.074 -11.641 -7.543 1.00 1.00 C ATOM 1296 O GLU A 87 88.849 -11.552 -6.592 1.00 1.00 O ATOM 1297 CB GLU A 87 87.502 -14.048 -7.861 1.00 1.00 C ATOM 1298 CG GLU A 87 88.194 -14.633 -6.623 1.00 1.00 C ATOM 1299 CD GLU A 87 87.151 -15.153 -5.638 1.00 1.00 C ATOM 1300 OE1 GLU A 87 85.977 -15.115 -5.971 1.00 1.00 O ATOM 1301 OE2 GLU A 87 87.541 -15.589 -4.567 1.00 1.00 O ATOM 0 H GLU A 87 85.636 -13.066 -9.125 1.00 1.00 H new ATOM 0 HA GLU A 87 86.477 -12.668 -6.551 1.00 1.00 H new ATOM 0 HB2 GLU A 87 86.698 -14.709 -8.185 1.00 1.00 H new ATOM 0 HB3 GLU A 87 88.211 -13.980 -8.686 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.862 -15.442 -6.918 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.809 -13.870 -6.145 1.00 1.00 H new ATOM 1308 N ALA A 88 88.160 -10.878 -8.627 1.00 1.00 N ATOM 1309 CA ALA A 88 89.201 -9.876 -8.754 1.00 1.00 C ATOM 1310 C ALA A 88 88.910 -8.697 -7.889 1.00 1.00 C ATOM 1311 O ALA A 88 89.614 -7.693 -7.995 1.00 1.00 O ATOM 1312 CB ALA A 88 89.355 -9.404 -10.187 1.00 1.00 C ATOM 0 H ALA A 88 87.525 -10.936 -9.423 1.00 1.00 H new ATOM 0 HA ALA A 88 90.131 -10.347 -8.436 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.144 -8.654 -10.240 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.615 -10.250 -10.823 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.417 -8.968 -10.529 1.00 1.00 H new ATOM 1318 N VAL A 89 87.853 -8.801 -7.071 1.00 1.00 N ATOM 1319 CA VAL A 89 87.450 -7.716 -6.171 1.00 1.00 C ATOM 1320 C VAL A 89 88.638 -7.173 -5.376 1.00 1.00 C ATOM 1321 O VAL A 89 88.435 -6.527 -4.366 1.00 1.00 O ATOM 1322 CB VAL A 89 86.388 -8.209 -5.183 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.051 -8.534 -5.916 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.932 -9.460 -4.479 1.00 1.00 C ATOM 0 H VAL A 89 87.261 -9.630 -7.016 1.00 1.00 H new ATOM 0 HA VAL A 89 87.045 -6.918 -6.793 1.00 1.00 H new ATOM 0 HB VAL A 89 86.177 -7.428 -4.452 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.314 -8.882 -5.192 1.00 1.00 H new ATOM 0 HG12 VAL A 89 84.679 -7.636 -6.409 1.00 1.00 H new ATOM 0 HG13 VAL A 89 85.224 -9.312 -6.660 1.00 1.00 H new ATOM 0 HG21 VAL A 89 86.191 -9.829 -3.770 1.00 1.00 H new ATOM 0 HG22 VAL A 89 87.142 -10.232 -5.219 1.00 1.00 H new ATOM 0 HG23 VAL A 89 87.850 -9.208 -3.947 1.00 1.00 H new ATOM 1334 N GLY A 90 89.867 -7.501 -5.831 1.00 1.00 N ATOM 1335 CA GLY A 90 91.116 -7.125 -5.167 1.00 1.00 C ATOM 1336 C GLY A 90 90.914 -5.765 -4.519 1.00 1.00 C ATOM 1337 O GLY A 90 91.116 -5.638 -3.310 1.00 1.00 O ATOM 0 H GLY A 90 90.012 -8.043 -6.683 1.00 1.00 H new ATOM 0 HA2 GLY A 90 91.387 -7.868 -4.417 1.00 1.00 H new ATOM 0 HA3 GLY A 90 91.933 -7.086 -5.887 1.00 1.00 H new ATOM 1341 N PRO A 91 90.422 -4.786 -5.238 1.00 1.00 N ATOM 1342 CA PRO A 91 90.052 -3.464 -4.647 1.00 1.00 C ATOM 1343 C PRO A 91 89.198 -3.614 -3.371 1.00 1.00 C ATOM 1344 O PRO A 91 88.755 -2.628 -2.793 1.00 1.00 O ATOM 1345 CB PRO A 91 89.243 -2.779 -5.746 1.00 1.00 C ATOM 1346 CG PRO A 91 89.746 -3.365 -7.027 1.00 1.00 C ATOM 1347 CD PRO A 91 90.202 -4.796 -6.711 1.00 1.00 C ATOM 0 HA PRO A 91 90.934 -2.901 -4.343 1.00 1.00 H new ATOM 0 HB2 PRO A 91 88.176 -2.962 -5.622 1.00 1.00 H new ATOM 0 HB3 PRO A 91 89.386 -1.699 -5.725 1.00 1.00 H new ATOM 0 HG2 PRO A 91 88.963 -3.367 -7.785 1.00 1.00 H new ATOM 0 HG3 PRO A 91 90.572 -2.775 -7.424 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.447 -5.528 -6.997 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.114 -5.052 -7.249 1.00 1.00 H new ATOM 1355 N HIS A 92 88.927 -4.857 -2.986 1.00 1.00 N ATOM 1356 CA HIS A 92 88.068 -5.131 -1.857 1.00 1.00 C ATOM 1357 C HIS A 92 88.513 -4.250 -0.714 1.00 1.00 C ATOM 1358 O HIS A 92 87.670 -3.732 0.008 1.00 1.00 O ATOM 1359 CB HIS A 92 88.208 -6.637 -1.459 1.00 1.00 C ATOM 1360 CG HIS A 92 88.590 -6.771 0.001 1.00 1.00 C ATOM 1361 ND1 HIS A 92 89.914 -6.752 0.419 1.00 1.00 N ATOM 1362 CD2 HIS A 92 87.839 -6.849 1.147 1.00 1.00 C ATOM 1363 CE1 HIS A 92 89.916 -6.811 1.766 1.00 1.00 C ATOM 1364 NE2 HIS A 92 88.677 -6.873 2.259 1.00 1.00 N ATOM 0 H HIS A 92 89.296 -5.689 -3.447 1.00 1.00 H new ATOM 0 HA HIS A 92 87.025 -4.929 -2.102 1.00 1.00 H new ATOM 0 HB2 HIS A 92 87.267 -7.156 -1.643 1.00 1.00 H new ATOM 0 HB3 HIS A 92 88.963 -7.115 -2.083 1.00 1.00 H new ATOM 0 HD2 HIS A 92 86.760 -6.886 1.181 1.00 1.00 H new ATOM 0 HE1 HIS A 92 90.810 -6.808 2.372 1.00 1.00 H new ATOM 0 HE2 HIS A 92 88.403 -6.926 3.240 1.00 1.00 H new ATOM 1372 N LEU A 93 89.819 -4.029 -0.567 1.00 1.00 N ATOM 1373 CA LEU A 93 90.297 -3.175 0.484 1.00 1.00 C ATOM 1374 C LEU A 93 89.763 -1.747 0.321 1.00 1.00 C ATOM 1375 O LEU A 93 89.422 -1.068 1.292 1.00 1.00 O ATOM 1376 CB LEU A 93 91.826 -3.136 0.408 1.00 1.00 C ATOM 1377 CG LEU A 93 92.284 -2.728 -1.034 1.00 1.00 C ATOM 1378 CD1 LEU A 93 92.734 -1.263 -1.050 1.00 1.00 C ATOM 1379 CD2 LEU A 93 93.444 -3.620 -1.488 1.00 1.00 C ATOM 0 H LEU A 93 90.545 -4.430 -1.161 1.00 1.00 H new ATOM 0 HA LEU A 93 89.955 -3.566 1.442 1.00 1.00 H new ATOM 0 HB2 LEU A 93 92.216 -2.425 1.136 1.00 1.00 H new ATOM 0 HB3 LEU A 93 92.236 -4.113 0.665 1.00 1.00 H new ATOM 0 HG LEU A 93 91.442 -2.854 -1.715 1.00 1.00 H new ATOM 0 HD11 LEU A 93 93.050 -0.990 -2.057 1.00 1.00 H new ATOM 0 HD12 LEU A 93 91.905 -0.624 -0.745 1.00 1.00 H new ATOM 0 HD13 LEU A 93 93.567 -1.131 -0.360 1.00 1.00 H new ATOM 0 HD21 LEU A 93 93.756 -3.329 -2.491 1.00 1.00 H new ATOM 0 HD22 LEU A 93 94.282 -3.505 -0.800 1.00 1.00 H new ATOM 0 HD23 LEU A 93 93.121 -4.661 -1.496 1.00 1.00 H new ATOM 1391 N ALA A 94 89.680 -1.292 -0.926 1.00 1.00 N ATOM 1392 CA ALA A 94 89.166 0.055 -1.174 1.00 1.00 C ATOM 1393 C ALA A 94 87.725 0.099 -0.690 1.00 1.00 C ATOM 1394 O ALA A 94 87.419 0.854 0.227 1.00 1.00 O ATOM 1395 CB ALA A 94 89.212 0.367 -2.664 1.00 1.00 C ATOM 0 H ALA A 94 89.952 -1.815 -1.758 1.00 1.00 H new ATOM 0 HA ALA A 94 89.773 0.792 -0.648 1.00 1.00 H new ATOM 0 HB1 ALA A 94 88.827 1.372 -2.837 1.00 1.00 H new ATOM 0 HB2 ALA A 94 90.242 0.307 -3.017 1.00 1.00 H new ATOM 0 HB3 ALA A 94 88.600 -0.354 -3.206 1.00 1.00 H new ATOM 1401 N ARG A 95 86.849 -0.709 -1.291 1.00 1.00 N ATOM 1402 CA ARG A 95 85.469 -0.732 -0.888 1.00 1.00 C ATOM 1403 C ARG A 95 85.383 -1.117 0.562 1.00 1.00 C ATOM 1404 O ARG A 95 84.451 -0.709 1.249 1.00 1.00 O ATOM 1405 CB ARG A 95 84.705 -1.742 -1.778 1.00 1.00 C ATOM 1406 CG ARG A 95 84.946 -1.425 -3.270 1.00 1.00 C ATOM 1407 CD ARG A 95 84.305 -0.086 -3.650 1.00 1.00 C ATOM 1408 NE ARG A 95 84.740 0.333 -4.976 1.00 1.00 N ATOM 1409 CZ ARG A 95 85.652 1.296 -5.142 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.198 1.885 -4.106 1.00 1.00 N ATOM 1411 NH2 ARG A 95 85.999 1.651 -6.341 1.00 1.00 N ATOM 0 H ARG A 95 87.083 -1.347 -2.052 1.00 1.00 H new ATOM 0 HA ARG A 95 85.018 0.253 -1.009 1.00 1.00 H new ATOM 0 HB2 ARG A 95 85.036 -2.757 -1.556 1.00 1.00 H new ATOM 0 HB3 ARG A 95 83.639 -1.699 -1.557 1.00 1.00 H new ATOM 0 HG2 ARG A 95 86.017 -1.391 -3.471 1.00 1.00 H new ATOM 0 HG3 ARG A 95 84.530 -2.221 -3.888 1.00 1.00 H new ATOM 0 HD2 ARG A 95 83.219 -0.178 -3.630 1.00 1.00 H new ATOM 0 HD3 ARG A 95 84.574 0.674 -2.916 1.00 1.00 H new ATOM 0 HE ARG A 95 84.339 -0.119 -5.797 1.00 1.00 H new ATOM 0 HH11 ARG A 95 85.928 1.610 -3.162 1.00 1.00 H new ATOM 0 HH12 ARG A 95 86.893 2.619 -4.244 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.576 1.196 -7.150 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.694 2.385 -6.474 1.00 1.00 H new ATOM 1425 N ALA A 96 86.355 -1.900 1.031 1.00 1.00 N ATOM 1426 CA ALA A 96 86.323 -2.303 2.431 1.00 1.00 C ATOM 1427 C ALA A 96 86.357 -1.052 3.250 1.00 1.00 C ATOM 1428 O ALA A 96 85.516 -0.844 4.094 1.00 1.00 O ATOM 1429 CB ALA A 96 87.509 -3.215 2.764 1.00 1.00 C ATOM 0 H ALA A 96 87.142 -2.254 0.487 1.00 1.00 H new ATOM 0 HA ALA A 96 85.420 -2.874 2.647 1.00 1.00 H new ATOM 0 HB1 ALA A 96 87.463 -3.502 3.814 1.00 1.00 H new ATOM 0 HB2 ALA A 96 87.467 -4.108 2.141 1.00 1.00 H new ATOM 0 HB3 ALA A 96 88.441 -2.683 2.574 1.00 1.00 H new ATOM 1435 N LEU A 97 87.357 -0.209 2.994 1.00 1.00 N ATOM 1436 CA LEU A 97 87.494 1.022 3.740 1.00 1.00 C ATOM 1437 C LEU A 97 86.071 1.594 4.000 1.00 1.00 C ATOM 1438 O LEU A 97 85.749 2.090 5.100 1.00 1.00 O ATOM 1439 CB LEU A 97 88.365 2.019 2.902 1.00 1.00 C ATOM 1440 CG LEU A 97 89.492 2.637 3.755 1.00 1.00 C ATOM 1441 CD1 LEU A 97 90.617 1.611 3.949 1.00 1.00 C ATOM 1442 CD2 LEU A 97 90.053 3.870 3.034 1.00 1.00 C ATOM 0 H LEU A 97 88.072 -0.361 2.283 1.00 1.00 H new ATOM 0 HA LEU A 97 87.986 0.856 4.698 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.797 1.497 2.048 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.732 2.812 2.504 1.00 1.00 H new ATOM 0 HG LEU A 97 89.093 2.925 4.727 1.00 1.00 H new ATOM 0 HD11 LEU A 97 91.411 2.051 4.552 1.00 1.00 H new ATOM 0 HD12 LEU A 97 90.223 0.730 4.456 1.00 1.00 H new ATOM 0 HD13 LEU A 97 91.017 1.322 2.977 1.00 1.00 H new ATOM 0 HD21 LEU A 97 90.850 4.310 3.633 1.00 1.00 H new ATOM 0 HD22 LEU A 97 90.450 3.574 2.063 1.00 1.00 H new ATOM 0 HD23 LEU A 97 89.258 4.602 2.893 1.00 1.00 H new ATOM 1454 N GLY A 98 85.157 1.350 3.053 1.00 1.00 N ATOM 1455 CA GLY A 98 83.770 1.727 3.266 1.00 1.00 C ATOM 1456 C GLY A 98 82.994 0.665 4.113 1.00 1.00 C ATOM 1457 O GLY A 98 82.386 0.933 5.179 1.00 1.00 O ATOM 0 H GLY A 98 85.353 0.904 2.157 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.731 2.692 3.771 1.00 1.00 H new ATOM 0 HA3 GLY A 98 83.277 1.852 2.302 1.00 1.00 H new ATOM 1461 N GLN A 99 83.076 -0.576 3.654 1.00 1.00 N ATOM 1462 CA GLN A 99 82.453 -1.702 4.301 1.00 1.00 C ATOM 1463 C GLN A 99 83.303 -2.086 5.489 1.00 1.00 C ATOM 1464 O GLN A 99 83.099 -3.144 6.075 1.00 1.00 O ATOM 1465 CB GLN A 99 82.269 -2.890 3.349 1.00 1.00 C ATOM 1466 CG GLN A 99 81.640 -2.421 2.030 1.00 1.00 C ATOM 1467 CD GLN A 99 80.335 -1.680 2.305 1.00 1.00 C ATOM 1468 OE1 GLN A 99 79.343 -2.291 2.706 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.283 -0.388 2.127 1.00 1.00 N ATOM 0 H GLN A 99 83.588 -0.823 2.807 1.00 1.00 H new ATOM 0 HA GLN A 99 81.452 -1.419 4.625 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.232 -3.361 3.153 1.00 1.00 H new ATOM 0 HB3 GLN A 99 81.634 -3.644 3.815 1.00 1.00 H new ATOM 0 HG2 GLN A 99 82.333 -1.768 1.500 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.451 -3.278 1.383 1.00 1.00 H new ATOM 0 HE21 GLN A 99 81.106 0.115 1.795 1.00 1.00 H new ATOM 0 HE22 GLN A 99 79.419 0.119 2.320 1.00 1.00 H new ATOM 1478 N ILE A 100 84.292 -1.234 5.818 1.00 1.00 N ATOM 1479 CA ILE A 100 85.192 -1.506 6.914 1.00 1.00 C ATOM 1480 C ILE A 100 84.413 -1.631 8.182 1.00 1.00 C ATOM 1481 O ILE A 100 84.503 -2.640 8.861 1.00 1.00 O ATOM 1482 CB ILE A 100 86.221 -0.383 7.044 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.203 -0.706 8.168 1.00 1.00 C ATOM 1484 CG2 ILE A 100 85.527 0.955 7.351 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.401 0.243 8.092 1.00 1.00 C ATOM 0 H ILE A 100 84.474 -0.357 5.331 1.00 1.00 H new ATOM 0 HA ILE A 100 85.717 -2.441 6.719 1.00 1.00 H new ATOM 0 HB ILE A 100 86.756 -0.298 6.098 1.00 1.00 H new ATOM 0 HG12 ILE A 100 86.709 -0.608 9.135 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.539 -1.740 8.085 1.00 1.00 H new ATOM 0 HG21 ILE A 100 86.276 1.742 7.440 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.837 1.201 6.544 1.00 1.00 H new ATOM 0 HG23 ILE A 100 84.975 0.872 8.287 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.101 0.011 8.895 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.900 0.123 7.130 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.057 1.272 8.197 1.00 1.00 H new ATOM 1497 N VAL A 101 83.628 -0.615 8.504 1.00 1.00 N ATOM 1498 CA VAL A 101 82.819 -0.704 9.726 1.00 1.00 C ATOM 1499 C VAL A 101 81.917 -1.925 9.613 1.00 1.00 C ATOM 1500 O VAL A 101 81.945 -2.822 10.466 1.00 1.00 O ATOM 1501 CB VAL A 101 81.960 0.565 9.887 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.143 0.810 8.597 1.00 1.00 C ATOM 1503 CG2 VAL A 101 80.998 0.417 11.083 1.00 1.00 C ATOM 0 H VAL A 101 83.529 0.248 7.969 1.00 1.00 H new ATOM 0 HA VAL A 101 83.469 -0.793 10.596 1.00 1.00 H new ATOM 0 HB VAL A 101 82.622 1.412 10.068 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.537 1.708 8.715 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.823 0.939 7.755 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.493 -0.045 8.410 1.00 1.00 H new ATOM 0 HG21 VAL A 101 80.399 1.322 11.182 1.00 1.00 H new ATOM 0 HG22 VAL A 101 80.341 -0.437 10.918 1.00 1.00 H new ATOM 0 HG23 VAL A 101 81.573 0.261 11.996 1.00 1.00 H new ATOM 1513 N CYS A 102 81.083 -1.940 8.571 1.00 1.00 N ATOM 1514 CA CYS A 102 80.148 -3.038 8.399 1.00 1.00 C ATOM 1515 C CYS A 102 80.861 -4.346 8.622 1.00 1.00 C ATOM 1516 O CYS A 102 80.253 -5.314 9.033 1.00 1.00 O ATOM 1517 CB CYS A 102 79.561 -2.996 6.981 1.00 1.00 C ATOM 1518 SG CYS A 102 78.641 -4.516 6.629 1.00 1.00 S ATOM 0 H CYS A 102 81.040 -1.218 7.851 1.00 1.00 H new ATOM 0 HA CYS A 102 79.339 -2.944 9.123 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.902 -2.134 6.879 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.363 -2.872 6.253 1.00 1.00 H new ATOM 1523 N ARG A 103 82.170 -4.330 8.374 1.00 1.00 N ATOM 1524 CA ARG A 103 83.020 -5.525 8.550 1.00 1.00 C ATOM 1525 C ARG A 103 83.603 -5.674 9.977 1.00 1.00 C ATOM 1526 O ARG A 103 83.619 -6.755 10.575 1.00 1.00 O ATOM 1527 CB ARG A 103 84.134 -5.483 7.504 1.00 1.00 C ATOM 1528 CG ARG A 103 85.139 -6.644 7.757 1.00 1.00 C ATOM 1529 CD ARG A 103 86.420 -6.158 8.474 1.00 1.00 C ATOM 1530 NE ARG A 103 87.585 -6.599 7.724 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.719 -5.912 7.763 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.788 -4.812 8.469 1.00 1.00 N ATOM 1533 NH2 ARG A 103 89.751 -6.321 7.090 1.00 1.00 N ATOM 0 H ARG A 103 82.674 -3.504 8.049 1.00 1.00 H new ATOM 0 HA ARG A 103 82.391 -6.404 8.410 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.710 -5.569 6.504 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.652 -4.525 7.549 1.00 1.00 H new ATOM 0 HG2 ARG A 103 84.658 -7.415 8.359 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.408 -7.104 6.806 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.415 -5.071 8.555 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.455 -6.554 9.489 1.00 1.00 H new ATOM 0 HE ARG A 103 87.530 -7.448 7.161 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.972 -4.486 8.986 1.00 1.00 H new ATOM 0 HH12 ARG A 103 89.658 -4.281 8.502 1.00 1.00 H new ATOM 0 HH21 ARG A 103 89.690 -7.172 6.530 1.00 1.00 H new ATOM 0 HH22 ARG A 103 90.622 -5.792 7.121 1.00 1.00 H new ATOM 1547 N TYR A 104 84.029 -4.553 10.486 1.00 1.00 N ATOM 1548 CA TYR A 104 84.599 -4.348 11.828 1.00 1.00 C ATOM 1549 C TYR A 104 83.470 -3.879 12.782 1.00 1.00 C ATOM 1550 O TYR A 104 83.710 -3.288 13.836 1.00 1.00 O ATOM 1551 CB TYR A 104 85.828 -3.396 11.818 1.00 1.00 C ATOM 1552 CG TYR A 104 85.935 -2.706 13.158 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.375 -3.419 14.288 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.526 -1.381 13.286 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.417 -2.788 15.538 1.00 1.00 C ATOM 1556 CE2 TYR A 104 85.558 -0.754 14.536 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.005 -1.456 15.661 1.00 1.00 C ATOM 1558 OH TYR A 104 86.032 -0.834 16.891 1.00 1.00 O ATOM 0 H TYR A 104 83.993 -3.684 9.953 1.00 1.00 H new ATOM 0 HA TYR A 104 84.995 -5.294 12.197 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.738 -3.960 11.613 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.724 -2.658 11.023 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.680 -4.451 14.192 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.183 -0.836 12.419 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.767 -3.328 16.405 1.00 1.00 H new ATOM 0 HE2 TYR A 104 85.237 0.273 14.633 1.00 1.00 H new ATOM 0 HH TYR A 104 85.715 0.088 16.798 1.00 1.00 H new ATOM 1568 N GLY A 105 82.224 -4.169 12.466 1.00 1.00 N ATOM 1569 CA GLY A 105 81.161 -3.779 13.359 1.00 1.00 C ATOM 1570 C GLY A 105 79.930 -4.570 12.994 1.00 1.00 C ATOM 1571 O GLY A 105 79.660 -5.625 13.559 1.00 1.00 O ATOM 0 H GLY A 105 81.931 -4.660 11.621 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.444 -3.971 14.394 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.966 -2.710 13.275 1.00 1.00 H new ATOM 1575 N ALA A 106 79.184 -4.044 12.040 1.00 1.00 N ATOM 1576 CA ALA A 106 77.970 -4.689 11.577 1.00 1.00 C ATOM 1577 C ALA A 106 76.893 -4.774 12.677 1.00 1.00 C ATOM 1578 O ALA A 106 76.543 -5.864 13.133 1.00 1.00 O ATOM 1579 CB ALA A 106 78.316 -6.084 11.071 1.00 1.00 C ATOM 0 H ALA A 106 79.400 -3.166 11.568 1.00 1.00 H new ATOM 0 HA ALA A 106 77.550 -4.085 10.773 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.410 -6.579 10.720 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.029 -6.007 10.250 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.757 -6.666 11.881 1.00 1.00 H new ATOM 1585 N THR A 107 76.366 -3.630 13.098 1.00 1.00 N ATOM 1586 CA THR A 107 75.322 -3.603 14.125 1.00 1.00 C ATOM 1587 C THR A 107 73.975 -3.194 13.510 1.00 1.00 C ATOM 1588 O THR A 107 72.938 -3.251 14.180 1.00 1.00 O ATOM 1589 CB THR A 107 75.707 -2.614 15.235 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.461 -3.233 16.491 1.00 1.00 O ATOM 1591 CG2 THR A 107 74.896 -1.303 15.151 1.00 1.00 C ATOM 0 H THR A 107 76.640 -2.712 12.749 1.00 1.00 H new ATOM 0 HA THR A 107 75.225 -4.602 14.549 1.00 1.00 H new ATOM 0 HB THR A 107 76.760 -2.359 15.117 1.00 1.00 H new ATOM 0 HG1 THR A 107 75.703 -2.616 17.213 1.00 1.00 H new ATOM 0 HG21 THR A 107 75.202 -0.634 15.955 1.00 1.00 H new ATOM 0 HG22 THR A 107 75.079 -0.823 14.190 1.00 1.00 H new ATOM 0 HG23 THR A 107 73.833 -1.526 15.248 1.00 1.00 H new ATOM 1599 N VAL A 108 74.010 -2.741 12.244 1.00 1.00 N ATOM 1600 CA VAL A 108 72.801 -2.243 11.566 1.00 1.00 C ATOM 1601 C VAL A 108 71.947 -3.336 10.975 1.00 1.00 C ATOM 1602 O VAL A 108 70.818 -3.522 11.392 1.00 1.00 O ATOM 1603 CB VAL A 108 73.190 -1.275 10.448 1.00 1.00 C ATOM 1604 CG1 VAL A 108 73.207 0.153 10.972 1.00 1.00 C ATOM 1605 CG2 VAL A 108 74.574 -1.650 9.918 1.00 1.00 C ATOM 0 H VAL A 108 74.855 -2.710 11.674 1.00 1.00 H new ATOM 0 HA VAL A 108 72.211 -1.744 12.335 1.00 1.00 H new ATOM 0 HB VAL A 108 72.458 -1.342 9.643 1.00 1.00 H new ATOM 0 HG11 VAL A 108 73.485 0.833 10.167 1.00 1.00 H new ATOM 0 HG12 VAL A 108 72.216 0.416 11.343 1.00 1.00 H new ATOM 0 HG13 VAL A 108 73.931 0.235 11.782 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.857 -0.963 9.120 1.00 1.00 H new ATOM 0 HG22 VAL A 108 75.303 -1.587 10.726 1.00 1.00 H new ATOM 0 HG23 VAL A 108 74.551 -2.668 9.529 1.00 1.00 H new ATOM 1615 N ILE A 109 72.491 -4.068 10.020 1.00 1.00 N ATOM 1616 CA ILE A 109 71.767 -5.147 9.379 1.00 1.00 C ATOM 1617 C ILE A 109 71.226 -6.158 10.389 1.00 1.00 C ATOM 1618 O ILE A 109 70.167 -6.728 10.165 1.00 1.00 O ATOM 1619 CB ILE A 109 72.727 -5.890 8.385 1.00 1.00 C ATOM 1620 CG1 ILE A 109 73.454 -7.158 9.021 1.00 1.00 C ATOM 1621 CG2 ILE A 109 73.824 -4.922 7.905 1.00 1.00 C ATOM 1622 CD1 ILE A 109 73.707 -8.210 7.981 1.00 1.00 C ATOM 0 H ILE A 109 73.439 -3.932 9.670 1.00 1.00 H new ATOM 0 HA ILE A 109 70.919 -4.710 8.853 1.00 1.00 H new ATOM 0 HB ILE A 109 72.096 -6.238 7.567 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.398 -6.852 9.472 1.00 1.00 H new ATOM 0 HG13 ILE A 109 72.839 -7.572 9.820 1.00 1.00 H new ATOM 0 HG21 ILE A 109 74.490 -5.440 7.215 1.00 1.00 H new ATOM 0 HG22 ILE A 109 73.364 -4.074 7.398 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.396 -4.566 8.762 1.00 1.00 H new ATOM 0 HD11 ILE A 109 74.204 -9.064 8.441 1.00 1.00 H new ATOM 0 HD12 ILE A 109 72.759 -8.531 7.550 1.00 1.00 H new ATOM 0 HD13 ILE A 109 74.342 -7.800 7.196 1.00 1.00 H new ATOM 1634 N PRO A 110 71.946 -6.439 11.463 1.00 1.00 N ATOM 1635 CA PRO A 110 71.549 -7.487 12.427 1.00 1.00 C ATOM 1636 C PRO A 110 70.081 -7.411 12.797 1.00 1.00 C ATOM 1637 O PRO A 110 69.451 -8.436 13.062 1.00 1.00 O ATOM 1638 CB PRO A 110 72.442 -7.223 13.636 1.00 1.00 C ATOM 1639 CG PRO A 110 73.662 -6.626 13.057 1.00 1.00 C ATOM 1640 CD PRO A 110 73.178 -5.787 11.903 1.00 1.00 C ATOM 0 HA PRO A 110 71.672 -8.488 12.014 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.964 -6.546 14.345 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.666 -8.143 14.175 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.191 -6.019 13.792 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.356 -7.396 12.721 1.00 1.00 H new ATOM 0 HD2 PRO A 110 72.993 -4.758 12.211 1.00 1.00 H new ATOM 0 HD3 PRO A 110 73.916 -5.752 11.102 1.00 1.00 H new ATOM 1648 N ASN A 111 69.536 -6.204 12.820 1.00 1.00 N ATOM 1649 CA ASN A 111 68.139 -6.054 13.172 1.00 1.00 C ATOM 1650 C ASN A 111 67.246 -6.801 12.157 1.00 1.00 C ATOM 1651 O ASN A 111 66.597 -7.803 12.485 1.00 1.00 O ATOM 1652 CB ASN A 111 67.793 -4.542 13.204 1.00 1.00 C ATOM 1653 CG ASN A 111 67.756 -3.970 11.786 1.00 1.00 C ATOM 1654 OD1 ASN A 111 68.698 -4.145 11.019 1.00 1.00 O ATOM 1655 ND2 ASN A 111 66.701 -3.331 11.368 1.00 1.00 N ATOM 0 H ASN A 111 70.028 -5.337 12.605 1.00 1.00 H new ATOM 0 HA ASN A 111 67.956 -6.487 14.155 1.00 1.00 H new ATOM 0 HB2 ASN A 111 66.827 -4.394 13.687 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.533 -4.006 13.799 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.663 -2.981 10.411 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.913 -3.181 11.998 1.00 1.00 H new ATOM 1662 N ILE A 112 67.196 -6.305 10.936 1.00 1.00 N ATOM 1663 CA ILE A 112 66.359 -6.901 9.913 1.00 1.00 C ATOM 1664 C ILE A 112 66.982 -8.189 9.419 1.00 1.00 C ATOM 1665 O ILE A 112 66.312 -9.073 8.896 1.00 1.00 O ATOM 1666 CB ILE A 112 66.171 -5.907 8.745 1.00 1.00 C ATOM 1667 CG1 ILE A 112 64.976 -4.965 9.024 1.00 1.00 C ATOM 1668 CG2 ILE A 112 65.895 -6.673 7.446 1.00 1.00 C ATOM 1669 CD1 ILE A 112 63.630 -5.733 9.017 1.00 1.00 C ATOM 0 H ILE A 112 67.726 -5.490 10.628 1.00 1.00 H new ATOM 0 HA ILE A 112 65.382 -7.130 10.338 1.00 1.00 H new ATOM 0 HB ILE A 112 67.084 -5.320 8.647 1.00 1.00 H new ATOM 0 HG12 ILE A 112 65.113 -4.479 9.990 1.00 1.00 H new ATOM 0 HG13 ILE A 112 64.950 -4.177 8.271 1.00 1.00 H new ATOM 0 HG21 ILE A 112 65.764 -5.965 6.627 1.00 1.00 H new ATOM 0 HG22 ILE A 112 66.736 -7.331 7.226 1.00 1.00 H new ATOM 0 HG23 ILE A 112 64.989 -7.268 7.560 1.00 1.00 H new ATOM 0 HD11 ILE A 112 62.814 -5.039 9.217 1.00 1.00 H new ATOM 0 HD12 ILE A 112 63.481 -6.197 8.042 1.00 1.00 H new ATOM 0 HD13 ILE A 112 63.647 -6.504 9.787 1.00 1.00 H new ATOM 1681 N ASN A 113 68.269 -8.251 9.576 1.00 1.00 N ATOM 1682 CA ASN A 113 69.001 -9.420 9.113 1.00 1.00 C ATOM 1683 C ASN A 113 68.364 -10.676 9.659 1.00 1.00 C ATOM 1684 O ASN A 113 67.925 -11.532 8.898 1.00 1.00 O ATOM 1685 CB ASN A 113 70.448 -9.356 9.556 1.00 1.00 C ATOM 1686 CG ASN A 113 71.163 -10.677 9.276 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.784 -11.414 8.370 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.195 -11.017 10.009 1.00 1.00 N ATOM 0 H ASN A 113 68.839 -7.526 10.012 1.00 1.00 H new ATOM 0 HA ASN A 113 68.967 -9.436 8.024 1.00 1.00 H new ATOM 0 HB2 ASN A 113 70.957 -8.545 9.035 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.497 -9.130 10.621 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.683 -11.894 9.827 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.510 -10.405 10.762 1.00 1.00 H new ATOM 1695 N ALA A 114 68.295 -10.772 10.986 1.00 1.00 N ATOM 1696 CA ALA A 114 67.696 -11.910 11.650 1.00 1.00 C ATOM 1697 C ALA A 114 66.206 -11.965 11.363 1.00 1.00 C ATOM 1698 O ALA A 114 65.588 -13.023 11.481 1.00 1.00 O ATOM 1699 CB ALA A 114 67.930 -11.840 13.155 1.00 1.00 C ATOM 0 H ALA A 114 68.654 -10.061 11.623 1.00 1.00 H new ATOM 0 HA ALA A 114 68.166 -12.815 11.264 1.00 1.00 H new ATOM 0 HB1 ALA A 114 67.472 -12.705 13.635 1.00 1.00 H new ATOM 0 HB2 ALA A 114 69.001 -11.838 13.357 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.485 -10.927 13.550 1.00 1.00 H new ATOM 1705 N ALA A 115 65.629 -10.835 10.941 1.00 1.00 N ATOM 1706 CA ALA A 115 64.222 -10.813 10.613 1.00 1.00 C ATOM 1707 C ALA A 115 63.953 -11.500 9.257 1.00 1.00 C ATOM 1708 O ALA A 115 63.229 -12.505 9.185 1.00 1.00 O ATOM 1709 CB ALA A 115 63.767 -9.356 10.548 1.00 1.00 C ATOM 0 H ALA A 115 66.114 -9.945 10.824 1.00 1.00 H new ATOM 0 HA ALA A 115 63.669 -11.357 11.378 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.706 -9.317 10.301 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.933 -8.880 11.514 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.337 -8.831 9.782 1.00 1.00 H new ATOM 1715 N ILE A 116 64.528 -10.985 8.166 1.00 1.00 N ATOM 1716 CA ILE A 116 64.284 -11.583 6.862 1.00 1.00 C ATOM 1717 C ILE A 116 64.902 -12.965 6.776 1.00 1.00 C ATOM 1718 O ILE A 116 64.361 -13.884 6.171 1.00 1.00 O ATOM 1719 CB ILE A 116 64.874 -10.669 5.788 1.00 1.00 C ATOM 1720 CG1 ILE A 116 64.500 -11.197 4.405 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.398 -10.629 5.930 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.020 -10.238 3.329 1.00 1.00 C ATOM 0 H ILE A 116 65.149 -10.176 8.163 1.00 1.00 H new ATOM 0 HA ILE A 116 63.210 -11.692 6.709 1.00 1.00 H new ATOM 0 HB ILE A 116 64.474 -9.662 5.909 1.00 1.00 H new ATOM 0 HG12 ILE A 116 64.925 -12.190 4.257 1.00 1.00 H new ATOM 0 HG13 ILE A 116 63.418 -11.298 4.324 1.00 1.00 H new ATOM 0 HG21 ILE A 116 66.818 -9.977 5.164 1.00 1.00 H new ATOM 0 HG22 ILE A 116 66.662 -10.247 6.916 1.00 1.00 H new ATOM 0 HG23 ILE A 116 66.801 -11.635 5.811 1.00 1.00 H new ATOM 0 HD11 ILE A 116 64.752 -10.617 2.343 1.00 1.00 H new ATOM 0 HD12 ILE A 116 64.574 -9.254 3.473 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.105 -10.160 3.405 1.00 1.00 H new ATOM 1734 N GLU A 117 66.062 -13.092 7.348 1.00 1.00 N ATOM 1735 CA GLU A 117 66.778 -14.362 7.302 1.00 1.00 C ATOM 1736 C GLU A 117 65.847 -15.509 7.644 1.00 1.00 C ATOM 1737 O GLU A 117 65.550 -16.369 6.791 1.00 1.00 O ATOM 1738 CB GLU A 117 67.952 -14.346 8.295 1.00 1.00 C ATOM 1739 CG GLU A 117 68.368 -15.794 8.751 1.00 1.00 C ATOM 1740 CD GLU A 117 67.908 -16.060 10.177 1.00 1.00 C ATOM 1741 OE1 GLU A 117 68.120 -15.202 11.015 1.00 1.00 O ATOM 1742 OE2 GLU A 117 67.340 -17.116 10.404 1.00 1.00 O ATOM 0 H GLU A 117 66.542 -12.346 7.852 1.00 1.00 H new ATOM 0 HA GLU A 117 67.160 -14.502 6.291 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.808 -13.853 7.834 1.00 1.00 H new ATOM 0 HB3 GLU A 117 67.677 -13.757 9.170 1.00 1.00 H new ATOM 0 HG2 GLU A 117 67.931 -16.532 8.079 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.450 -15.905 8.686 1.00 1.00 H new ATOM 1749 N VAL A 118 65.422 -15.531 8.922 1.00 1.00 N ATOM 1750 CA VAL A 118 64.556 -16.581 9.415 1.00 1.00 C ATOM 1751 C VAL A 118 63.422 -16.793 8.448 1.00 1.00 C ATOM 1752 O VAL A 118 62.734 -17.809 8.525 1.00 1.00 O ATOM 1753 CB VAL A 118 63.969 -16.200 10.779 1.00 1.00 C ATOM 1754 CG1 VAL A 118 62.965 -17.268 11.232 1.00 1.00 C ATOM 1755 CG2 VAL A 118 65.081 -16.085 11.821 1.00 1.00 C ATOM 0 H VAL A 118 65.672 -14.829 9.618 1.00 1.00 H new ATOM 0 HA VAL A 118 65.145 -17.493 9.517 1.00 1.00 H new ATOM 0 HB VAL A 118 63.465 -15.239 10.682 1.00 1.00 H new ATOM 0 HG11 VAL A 118 62.552 -16.991 12.202 1.00 1.00 H new ATOM 0 HG12 VAL A 118 62.159 -17.343 10.502 1.00 1.00 H new ATOM 0 HG13 VAL A 118 63.470 -18.230 11.314 1.00 1.00 H new ATOM 0 HG21 VAL A 118 64.650 -15.814 12.785 1.00 1.00 H new ATOM 0 HG22 VAL A 118 65.596 -17.041 11.910 1.00 1.00 H new ATOM 0 HG23 VAL A 118 65.791 -15.318 11.512 1.00 1.00 H new ATOM 1765 N LEU A 119 63.224 -15.857 7.516 1.00 1.00 N ATOM 1766 CA LEU A 119 62.156 -16.027 6.550 1.00 1.00 C ATOM 1767 C LEU A 119 62.565 -17.032 5.474 1.00 1.00 C ATOM 1768 O LEU A 119 61.903 -18.061 5.327 1.00 1.00 O ATOM 1769 CB LEU A 119 61.876 -14.675 5.896 1.00 1.00 C ATOM 1770 CG LEU A 119 60.386 -14.508 5.601 1.00 1.00 C ATOM 1771 CD1 LEU A 119 59.645 -14.139 6.904 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.199 -13.395 4.567 1.00 1.00 C ATOM 0 H LEU A 119 63.773 -15.003 7.417 1.00 1.00 H new ATOM 0 HA LEU A 119 61.266 -16.401 7.056 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.213 -13.873 6.553 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.445 -14.590 4.971 1.00 1.00 H new ATOM 0 HG LEU A 119 59.980 -15.440 5.208 1.00 1.00 H new ATOM 0 HD11 LEU A 119 58.582 -14.019 6.696 1.00 1.00 H new ATOM 0 HD12 LEU A 119 59.784 -14.932 7.639 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.045 -13.205 7.298 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.137 -13.272 4.353 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.600 -12.461 4.961 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.726 -13.658 3.650 1.00 1.00 H new ATOM 1784 N GLY A 120 63.642 -16.750 4.689 1.00 1.00 N ATOM 1785 CA GLY A 120 63.993 -17.704 3.645 1.00 1.00 C ATOM 1786 C GLY A 120 64.627 -18.968 4.235 1.00 1.00 C ATOM 1787 O GLY A 120 63.967 -19.997 4.387 1.00 1.00 O ATOM 0 H GLY A 120 64.235 -15.924 4.762 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.100 -17.972 3.080 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.687 -17.240 2.944 1.00 1.00 H new ATOM 1791 N THR A 121 65.912 -18.878 4.533 1.00 1.00 N ATOM 1792 CA THR A 121 66.650 -20.019 5.085 1.00 1.00 C ATOM 1793 C THR A 121 67.908 -19.543 5.820 1.00 1.00 C ATOM 1794 O THR A 121 68.478 -20.262 6.643 1.00 1.00 O ATOM 1795 CB THR A 121 67.015 -20.999 3.965 1.00 1.00 C ATOM 1796 OG1 THR A 121 67.985 -21.915 4.444 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.575 -20.244 2.761 1.00 1.00 C ATOM 0 H THR A 121 66.471 -18.034 4.406 1.00 1.00 H new ATOM 0 HA THR A 121 66.013 -20.534 5.804 1.00 1.00 H new ATOM 0 HB THR A 121 66.119 -21.537 3.656 1.00 1.00 H new ATOM 0 HG1 THR A 121 68.220 -22.545 3.731 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.830 -20.953 1.973 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.827 -19.544 2.390 1.00 1.00 H new ATOM 0 HG23 THR A 121 68.469 -19.696 3.059 1.00 1.00 H new ATOM 1805 N GLY A 122 68.314 -18.316 5.514 1.00 1.00 N ATOM 1806 CA GLY A 122 69.479 -17.639 6.107 1.00 1.00 C ATOM 1807 C GLY A 122 70.639 -17.524 5.147 1.00 1.00 C ATOM 1808 O GLY A 122 71.337 -16.520 5.189 1.00 1.00 O ATOM 0 H GLY A 122 67.831 -17.740 4.825 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.186 -16.642 6.437 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.800 -18.186 6.993 1.00 1.00 H new ATOM 1812 N THR A 123 70.889 -18.538 4.335 1.00 1.00 N ATOM 1813 CA THR A 123 72.035 -18.522 3.421 1.00 1.00 C ATOM 1814 C THR A 123 72.396 -17.103 2.959 1.00 1.00 C ATOM 1815 O THR A 123 71.745 -16.546 2.080 1.00 1.00 O ATOM 1816 CB THR A 123 71.652 -19.315 2.182 1.00 1.00 C ATOM 1817 OG1 THR A 123 71.032 -20.534 2.562 1.00 1.00 O ATOM 1818 CG2 THR A 123 72.889 -19.601 1.336 1.00 1.00 C ATOM 0 H THR A 123 70.320 -19.383 4.285 1.00 1.00 H new ATOM 0 HA THR A 123 72.891 -18.942 3.949 1.00 1.00 H new ATOM 0 HB THR A 123 70.951 -18.727 1.590 1.00 1.00 H new ATOM 0 HG1 THR A 123 70.786 -21.040 1.760 1.00 1.00 H new ATOM 0 HG21 THR A 123 72.601 -20.170 0.452 1.00 1.00 H new ATOM 0 HG22 THR A 123 73.346 -18.660 1.030 1.00 1.00 H new ATOM 0 HG23 THR A 123 73.605 -20.178 1.921 1.00 1.00 H new ATOM 1826 N ASP A 124 73.454 -16.543 3.544 1.00 1.00 N ATOM 1827 CA ASP A 124 73.928 -15.212 3.186 1.00 1.00 C ATOM 1828 C ASP A 124 75.450 -15.244 3.269 1.00 1.00 C ATOM 1829 O ASP A 124 76.019 -15.867 4.164 1.00 1.00 O ATOM 1830 CB ASP A 124 73.314 -14.148 4.120 1.00 1.00 C ATOM 1831 CG ASP A 124 73.574 -14.475 5.584 1.00 1.00 C ATOM 1832 OD1 ASP A 124 74.122 -15.530 5.841 1.00 1.00 O ATOM 1833 OD2 ASP A 124 73.207 -13.669 6.424 1.00 1.00 O ATOM 0 H ASP A 124 74.002 -16.998 4.274 1.00 1.00 H new ATOM 0 HA ASP A 124 73.621 -14.939 2.176 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.733 -13.170 3.884 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.240 -14.085 3.945 1.00 1.00 H new ATOM 1838 N TYR A 125 76.099 -14.598 2.318 1.00 1.00 N ATOM 1839 CA TYR A 125 77.551 -14.590 2.256 1.00 1.00 C ATOM 1840 C TYR A 125 78.039 -13.338 1.539 1.00 1.00 C ATOM 1841 O TYR A 125 77.372 -12.858 0.623 1.00 1.00 O ATOM 1842 CB TYR A 125 78.022 -15.838 1.477 1.00 1.00 C ATOM 1843 CG TYR A 125 78.867 -15.435 0.281 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.250 -15.003 -0.905 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.257 -15.463 0.374 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.033 -14.607 -1.997 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.039 -15.063 -0.715 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.428 -14.636 -1.900 1.00 1.00 C ATOM 1849 OH TYR A 125 81.200 -14.247 -2.971 1.00 1.00 O ATOM 0 H TYR A 125 75.642 -14.070 1.575 1.00 1.00 H new ATOM 0 HA TYR A 125 77.957 -14.599 3.268 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.600 -16.487 2.135 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.158 -16.412 1.142 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.173 -14.976 -0.975 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.731 -15.793 1.287 1.00 1.00 H new ATOM 0 HE1 TYR A 125 78.561 -14.280 -2.912 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.116 -15.084 -0.641 1.00 1.00 H new ATOM 0 HH TYR A 125 82.109 -14.048 -2.664 1.00 1.00 H new ATOM 1859 N ARG A 126 79.237 -12.890 1.916 1.00 1.00 N ATOM 1860 CA ARG A 126 79.872 -11.740 1.275 1.00 1.00 C ATOM 1861 C ARG A 126 81.406 -11.816 1.347 1.00 1.00 C ATOM 1862 O ARG A 126 81.970 -12.476 2.225 1.00 1.00 O ATOM 1863 CB ARG A 126 79.384 -10.462 1.947 1.00 1.00 C ATOM 1864 CG ARG A 126 78.039 -9.981 1.335 1.00 1.00 C ATOM 1865 CD ARG A 126 78.295 -8.886 0.312 1.00 1.00 C ATOM 1866 NE ARG A 126 79.253 -9.358 -0.689 1.00 1.00 N ATOM 1867 CZ ARG A 126 78.867 -10.107 -1.719 1.00 1.00 C ATOM 1868 NH1 ARG A 126 77.617 -10.456 -1.841 1.00 1.00 N ATOM 1869 NH2 ARG A 126 79.744 -10.498 -2.609 1.00 1.00 N ATOM 0 H ARG A 126 79.788 -13.309 2.665 1.00 1.00 H new ATOM 0 HA ARG A 126 79.595 -11.743 0.221 1.00 1.00 H new ATOM 0 HB2 ARG A 126 79.258 -10.636 3.016 1.00 1.00 H new ATOM 0 HB3 ARG A 126 80.136 -9.681 1.837 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.525 -10.818 0.863 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.384 -9.608 2.123 1.00 1.00 H new ATOM 0 HD2 ARG A 126 77.360 -8.601 -0.171 1.00 1.00 H new ATOM 0 HD3 ARG A 126 78.682 -7.996 0.808 1.00 1.00 H new ATOM 0 HE ARG A 126 80.237 -9.108 -0.595 1.00 1.00 H new ATOM 0 HH11 ARG A 126 76.933 -10.155 -1.146 1.00 1.00 H new ATOM 0 HH12 ARG A 126 77.323 -11.030 -2.631 1.00 1.00 H new ATOM 0 HH21 ARG A 126 80.723 -10.229 -2.513 1.00 1.00 H new ATOM 0 HH22 ARG A 126 79.448 -11.072 -3.398 1.00 1.00 H new ATOM 1883 N PHE A 127 82.071 -11.120 0.426 1.00 1.00 N ATOM 1884 CA PHE A 127 83.527 -11.097 0.410 1.00 1.00 C ATOM 1885 C PHE A 127 84.036 -10.042 -0.581 1.00 1.00 C ATOM 1886 O PHE A 127 85.240 -9.842 -0.638 1.00 1.00 O ATOM 1887 CB PHE A 127 84.069 -12.490 0.052 1.00 1.00 C ATOM 1888 CG PHE A 127 84.171 -12.627 -1.452 1.00 1.00 C ATOM 1889 CD1 PHE A 127 83.023 -12.507 -2.241 1.00 1.00 C ATOM 1890 CD2 PHE A 127 85.415 -12.852 -2.055 1.00 1.00 C ATOM 1891 CE1 PHE A 127 83.117 -12.613 -3.634 1.00 1.00 C ATOM 1892 CE2 PHE A 127 85.507 -12.961 -3.447 1.00 1.00 C ATOM 1893 CZ PHE A 127 84.358 -12.841 -4.236 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.215 -9.454 -1.268 1.00 1.00 O ATOM 0 H PHE A 127 81.628 -10.571 -0.310 1.00 1.00 H new ATOM 0 HA PHE A 127 83.888 -10.829 1.403 1.00 1.00 H new ATOM 0 HB2 PHE A 127 85.048 -12.638 0.507 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.411 -13.261 0.453 1.00 1.00 H new ATOM 0 HD1 PHE A 127 82.064 -12.333 -1.776 1.00 1.00 H new ATOM 0 HD2 PHE A 127 86.302 -12.941 -1.446 1.00 1.00 H new ATOM 0 HE1 PHE A 127 82.231 -12.519 -4.244 1.00 1.00 H new ATOM 0 HE2 PHE A 127 86.465 -13.138 -3.912 1.00 1.00 H new ATOM 0 HZ PHE A 127 84.430 -12.925 -5.310 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.216 5.421 -9.452 1.00 1.00 O HETATM 1906 N1 MTN A 128 65.901 4.914 -8.334 1.00 1.00 N HETATM 1907 C1 MTN A 128 65.795 3.469 -8.116 1.00 1.00 C HETATM 1908 C2 MTN A 128 65.432 3.442 -6.675 1.00 1.00 C HETATM 1909 C3 MTN A 128 65.318 4.642 -6.130 1.00 1.00 C HETATM 1910 C4 MTN A 128 64.931 4.916 -4.705 1.00 1.00 C HETATM 1911 S1 MTN A 128 66.300 5.399 -3.626 1.00 1.00 S HETATM 1912 C5 MTN A 128 65.603 5.749 -7.121 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.432 6.723 -7.266 1.00 1.00 C HETATM 1914 C7 MTN A 128 66.870 6.492 -6.716 1.00 1.00 C HETATM 1915 C8 MTN A 128 64.709 2.814 -8.962 1.00 1.00 C HETATM 1916 C9 MTN A 128 67.131 2.837 -8.368 1.00 1.00 C HETATM 0 H93 MTN A 128 67.437 3.032 -9.396 1.00 1.00 H new HETATM 0 H92 MTN A 128 67.868 3.258 -7.684 1.00 1.00 H new HETATM 0 H91 MTN A 128 67.061 1.761 -8.208 1.00 1.00 H new HETATM 0 H83 MTN A 128 63.743 3.256 -8.719 1.00 1.00 H new HETATM 0 H82 MTN A 128 64.925 2.973 -10.018 1.00 1.00 H new HETATM 0 H81 MTN A 128 64.682 1.744 -8.754 1.00 1.00 H new HETATM 0 H73 MTN A 128 67.656 5.773 -6.486 1.00 1.00 H new HETATM 0 H72 MTN A 128 67.194 7.133 -7.536 1.00 1.00 H new HETATM 0 H71 MTN A 128 66.668 7.103 -5.836 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.638 7.421 -8.077 1.00 1.00 H new HETATM 0 H62 MTN A 128 63.521 6.167 -7.488 1.00 1.00 H new HETATM 0 H61 MTN A 128 64.301 7.276 -6.336 1.00 1.00 H new HETATM 0 H42 MTN A 128 64.181 5.707 -4.693 1.00 1.00 H new HETATM 0 H41 MTN A 128 64.460 4.023 -4.293 1.00 1.00 H new HETATM 0 H2 MTN A 128 65.274 2.518 -6.118 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.557 -9.629 -5.180 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.943 -8.558 -4.897 1.00 1.00 N HETATM 1934 C1 MTN A 129 70.354 -7.674 -5.922 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.788 -6.619 -5.050 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.993 -6.825 -3.761 1.00 1.00 C HETATM 1937 C4 MTN A 129 69.532 -5.926 -2.663 1.00 1.00 C HETATM 1938 S1 MTN A 129 69.061 -4.271 -3.204 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.761 -8.095 -3.492 1.00 1.00 C HETATM 1940 C6 MTN A 129 72.052 -7.871 -2.714 1.00 1.00 C HETATM 1941 C7 MTN A 129 69.861 -9.090 -2.766 1.00 1.00 C HETATM 1942 C8 MTN A 129 71.392 -7.112 -6.888 1.00 1.00 C HETATM 1943 C9 MTN A 129 69.249 -8.406 -6.664 1.00 1.00 C HETATM 0 H93 MTN A 129 69.660 -9.292 -7.148 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.473 -8.705 -5.959 1.00 1.00 H new HETATM 0 H91 MTN A 129 68.819 -7.747 -7.419 1.00 1.00 H new HETATM 0 H83 MTN A 129 72.129 -6.532 -6.333 1.00 1.00 H new HETATM 0 H82 MTN A 129 71.890 -7.932 -7.404 1.00 1.00 H new HETATM 0 H81 MTN A 129 70.899 -6.470 -7.618 1.00 1.00 H new HETATM 0 H73 MTN A 129 68.895 -9.141 -3.268 1.00 1.00 H new HETATM 0 H72 MTN A 129 70.327 -10.075 -2.775 1.00 1.00 H new HETATM 0 H71 MTN A 129 69.717 -8.766 -1.735 1.00 1.00 H new HETATM 0 H63 MTN A 129 72.613 -8.804 -2.664 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.653 -7.113 -3.216 1.00 1.00 H new HETATM 0 H61 MTN A 129 71.815 -7.536 -1.704 1.00 1.00 H new HETATM 0 H42 MTN A 129 68.680 -6.388 -2.165 1.00 1.00 H new HETATM 0 H41 MTN A 129 70.327 -5.840 -1.922 1.00 1.00 H new HETATM 0 H2 MTN A 129 69.252 -5.752 -5.436 1.00 1.00 H new HETATM 1959 O1 MTN A 130 81.706 -10.837 5.702 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.305 -9.665 5.968 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.323 -9.366 7.034 1.00 1.00 C HETATM 1962 C2 MTN A 130 80.233 -7.892 6.894 1.00 1.00 C HETATM 1963 C3 MTN A 130 80.998 -7.401 5.937 1.00 1.00 C HETATM 1964 C4 MTN A 130 81.080 -5.960 5.552 1.00 1.00 C HETATM 1965 S1 MTN A 130 79.522 -5.252 4.961 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.792 -8.469 5.225 1.00 1.00 C HETATM 1967 C6 MTN A 130 81.543 -8.473 3.730 1.00 1.00 C HETATM 1968 C7 MTN A 130 83.270 -8.294 5.525 1.00 1.00 C HETATM 1969 C8 MTN A 130 78.967 -10.034 6.808 1.00 1.00 C HETATM 1970 C9 MTN A 130 80.902 -9.745 8.385 1.00 1.00 C HETATM 0 H93 MTN A 130 81.133 -10.810 8.396 1.00 1.00 H new HETATM 0 H92 MTN A 130 81.813 -9.174 8.563 1.00 1.00 H new HETATM 0 H91 MTN A 130 80.176 -9.523 9.167 1.00 1.00 H new HETATM 0 H83 MTN A 130 78.544 -9.689 5.865 1.00 1.00 H new HETATM 0 H82 MTN A 130 79.096 -11.116 6.773 1.00 1.00 H new HETATM 0 H81 MTN A 130 78.293 -9.775 7.625 1.00 1.00 H new HETATM 0 H73 MTN A 130 83.409 -8.152 6.597 1.00 1.00 H new HETATM 0 H72 MTN A 130 83.814 -9.182 5.203 1.00 1.00 H new HETATM 0 H71 MTN A 130 83.649 -7.423 4.991 1.00 1.00 H new HETATM 0 H63 MTN A 130 82.040 -9.333 3.281 1.00 1.00 H new HETATM 0 H62 MTN A 130 80.471 -8.533 3.540 1.00 1.00 H new HETATM 0 H61 MTN A 130 81.938 -7.556 3.293 1.00 1.00 H new HETATM 0 H42 MTN A 130 81.422 -5.386 6.413 1.00 1.00 H new HETATM 0 H41 MTN A 130 81.834 -5.847 4.773 1.00 1.00 H new HETATM 0 H2 MTN A 130 79.594 -7.272 7.523 1.00 1.00 H new