USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 THR OG1 : rot -131:sc= 0.51! USER MOD Set 1.2: A 123 THR OG1 : rot 180:sc= 0.877 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -126:sc= 0.0265 (180deg=-0.428) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0677 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 180:sc= -1.24! USER MOD Single : A 38 HIS : no HD1:sc= -1.05 K(o=-1,f=-0.22) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0558 USER MOD Single : A 48 CYS SG : rot 86:sc= -2.31! USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 54 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.14) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : A 72 HIS : no HD1:sc= -9.12! C(o=-9.1!,f=-3.2!) USER MOD Single : A 73 MET CE :methyl 161:sc= -0.0255 (180deg=-0.528) USER MOD Single : A 75 ASN : amide:sc= -4.4! C(o=-4.4!,f=-7.9!) USER MOD Single : A 92 HIS : no HD1:sc= -5.41! C(o=-5.4!,f=-14!) USER MOD Single : A 99 GLN : amide:sc= -0.243 K(o=-0.24,f=-0.94) USER MOD Single : A 102 CYS SG : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 55:sc= 1.08 USER MOD Single : A 111 ASN : amide:sc=-0.00507 X(o=-0.0051,f=0) USER MOD Single : A 113 ASN : amide:sc= -5.22! C(o=-5.2!,f=-3.4!) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 78.024 24.319 -22.236 1.00 1.00 N ATOM 2 CA MET A 1 78.418 22.888 -22.357 1.00 1.00 C ATOM 3 C MET A 1 77.178 22.015 -22.177 1.00 1.00 C ATOM 4 O MET A 1 76.160 22.465 -21.650 1.00 1.00 O ATOM 5 CB MET A 1 79.456 22.552 -21.284 1.00 1.00 C ATOM 6 CG MET A 1 80.754 23.317 -21.560 1.00 1.00 C ATOM 7 SD MET A 1 81.957 22.949 -20.257 1.00 1.00 S ATOM 8 CE MET A 1 83.107 24.303 -20.606 1.00 1.00 C ATOM 0 H1 MET A 1 78.345 24.840 -23.077 1.00 1.00 H new ATOM 0 H2 MET A 1 76.989 24.389 -22.160 1.00 1.00 H new ATOM 0 H3 MET A 1 78.462 24.729 -21.387 1.00 1.00 H new ATOM 0 HA MET A 1 78.853 22.703 -23.339 1.00 1.00 H new ATOM 0 HB2 MET A 1 79.071 22.814 -20.298 1.00 1.00 H new ATOM 0 HB3 MET A 1 79.650 21.479 -21.276 1.00 1.00 H new ATOM 0 HG2 MET A 1 81.156 23.034 -22.533 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.557 24.388 -21.596 1.00 1.00 H new ATOM 0 HE1 MET A 1 83.940 24.263 -19.904 1.00 1.00 H new ATOM 0 HE2 MET A 1 83.485 24.206 -21.624 1.00 1.00 H new ATOM 0 HE3 MET A 1 82.589 25.256 -20.500 1.00 1.00 H new ATOM 18 N SER A 2 77.270 20.766 -22.623 1.00 1.00 N ATOM 19 CA SER A 2 76.168 19.808 -22.528 1.00 1.00 C ATOM 20 C SER A 2 76.291 18.967 -21.256 1.00 1.00 C ATOM 21 O SER A 2 75.555 18.002 -21.075 1.00 1.00 O ATOM 22 CB SER A 2 76.171 18.895 -23.751 1.00 1.00 C ATOM 23 OG SER A 2 77.330 18.073 -23.719 1.00 1.00 O ATOM 0 H SER A 2 78.110 20.387 -23.061 1.00 1.00 H new ATOM 0 HA SER A 2 75.230 20.362 -22.489 1.00 1.00 H new ATOM 0 HB2 SER A 2 75.273 18.277 -23.761 1.00 1.00 H new ATOM 0 HB3 SER A 2 76.158 19.490 -24.664 1.00 1.00 H new ATOM 0 HG SER A 2 77.335 17.484 -24.502 1.00 1.00 H new ATOM 29 N ASP A 3 77.209 19.376 -20.378 1.00 1.00 N ATOM 30 CA ASP A 3 77.429 18.692 -19.094 1.00 1.00 C ATOM 31 C ASP A 3 78.835 18.993 -18.567 1.00 1.00 C ATOM 32 O ASP A 3 79.831 18.546 -19.137 1.00 1.00 O ATOM 33 CB ASP A 3 77.231 17.157 -19.231 1.00 1.00 C ATOM 34 CG ASP A 3 75.801 16.743 -18.850 1.00 1.00 C ATOM 35 OD1 ASP A 3 74.958 17.618 -18.728 1.00 1.00 O ATOM 36 OD2 ASP A 3 75.575 15.554 -18.689 1.00 1.00 O ATOM 0 H ASP A 3 77.817 20.181 -20.530 1.00 1.00 H new ATOM 0 HA ASP A 3 76.692 19.068 -18.385 1.00 1.00 H new ATOM 0 HB2 ASP A 3 77.440 16.851 -20.256 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.945 16.637 -18.592 1.00 1.00 H new ATOM 41 N PHE A 4 78.905 19.751 -17.474 1.00 1.00 N ATOM 42 CA PHE A 4 80.190 20.103 -16.874 1.00 1.00 C ATOM 43 C PHE A 4 80.032 20.379 -15.380 1.00 1.00 C ATOM 44 O PHE A 4 78.977 20.824 -14.934 1.00 1.00 O ATOM 45 CB PHE A 4 80.759 21.339 -17.562 1.00 1.00 C ATOM 46 CG PHE A 4 82.165 21.573 -17.071 1.00 1.00 C ATOM 47 CD1 PHE A 4 83.231 20.884 -17.662 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.403 22.472 -16.027 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.537 21.096 -17.208 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.709 22.684 -15.573 1.00 1.00 C ATOM 51 CZ PHE A 4 84.777 21.997 -16.164 1.00 1.00 C ATOM 0 H PHE A 4 78.092 20.131 -16.989 1.00 1.00 H new ATOM 0 HA PHE A 4 80.872 19.263 -17.004 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.756 21.202 -18.643 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.137 22.208 -17.349 1.00 1.00 H new ATOM 0 HD1 PHE A 4 83.045 20.189 -18.468 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.580 23.002 -15.572 1.00 1.00 H new ATOM 0 HE1 PHE A 4 85.360 20.565 -17.663 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.894 23.378 -14.766 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.785 22.162 -15.814 1.00 1.00 H new ATOM 61 N ASP A 5 81.080 20.090 -14.611 1.00 1.00 N ATOM 62 CA ASP A 5 81.041 20.292 -13.161 1.00 1.00 C ATOM 63 C ASP A 5 82.454 20.484 -12.598 1.00 1.00 C ATOM 64 O ASP A 5 83.424 19.965 -13.153 1.00 1.00 O ATOM 65 CB ASP A 5 80.370 19.066 -12.508 1.00 1.00 C ATOM 66 CG ASP A 5 80.585 17.825 -13.369 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.574 17.786 -14.080 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.756 16.932 -13.305 1.00 1.00 O ATOM 0 H ASP A 5 81.962 19.718 -14.963 1.00 1.00 H new ATOM 0 HA ASP A 5 80.469 21.192 -12.938 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.784 18.903 -11.513 1.00 1.00 H new ATOM 0 HB3 ASP A 5 79.303 19.250 -12.383 1.00 1.00 H new ATOM 73 N THR A 6 82.568 21.239 -11.500 1.00 1.00 N ATOM 74 CA THR A 6 83.878 21.488 -10.895 1.00 1.00 C ATOM 75 C THR A 6 84.521 20.175 -10.441 1.00 1.00 C ATOM 76 O THR A 6 84.173 19.115 -10.950 1.00 1.00 O ATOM 77 CB THR A 6 83.761 22.481 -9.724 1.00 1.00 C ATOM 78 OG1 THR A 6 82.659 23.349 -9.958 1.00 1.00 O ATOM 79 CG2 THR A 6 85.046 23.317 -9.608 1.00 1.00 C ATOM 0 H THR A 6 81.784 21.681 -11.020 1.00 1.00 H new ATOM 0 HA THR A 6 84.524 21.937 -11.650 1.00 1.00 H new ATOM 0 HB THR A 6 83.612 21.926 -8.798 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.578 23.983 -9.215 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.952 24.016 -8.777 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.895 22.657 -9.432 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.203 23.872 -10.533 1.00 1.00 H new ATOM 87 N GLU A 7 85.470 20.243 -9.501 1.00 1.00 N ATOM 88 CA GLU A 7 86.142 19.040 -9.036 1.00 1.00 C ATOM 89 C GLU A 7 85.226 18.250 -8.146 1.00 1.00 C ATOM 90 O GLU A 7 84.872 17.127 -8.480 1.00 1.00 O ATOM 91 CB GLU A 7 87.415 19.416 -8.269 1.00 1.00 C ATOM 92 CG GLU A 7 88.160 18.145 -7.838 1.00 1.00 C ATOM 93 CD GLU A 7 89.510 18.513 -7.230 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.528 18.937 -6.087 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.506 18.370 -7.920 1.00 1.00 O ATOM 0 H GLU A 7 85.782 21.107 -9.057 1.00 1.00 H new ATOM 0 HA GLU A 7 86.412 18.430 -9.899 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.060 20.031 -8.897 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.160 20.013 -7.393 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.563 17.592 -7.112 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.305 17.490 -8.697 1.00 1.00 H new ATOM 102 N ARG A 8 84.877 18.783 -6.971 1.00 1.00 N ATOM 103 CA ARG A 8 84.056 18.073 -6.030 1.00 1.00 C ATOM 104 C ARG A 8 82.783 17.563 -6.649 1.00 1.00 C ATOM 105 O ARG A 8 82.431 16.422 -6.463 1.00 1.00 O ATOM 106 CB ARG A 8 83.702 19.104 -4.950 1.00 1.00 C ATOM 107 CG ARG A 8 83.117 18.458 -3.694 1.00 1.00 C ATOM 108 CD ARG A 8 82.401 19.537 -2.858 1.00 1.00 C ATOM 109 NE ARG A 8 83.065 20.844 -3.019 1.00 1.00 N ATOM 110 CZ ARG A 8 82.552 21.815 -3.792 1.00 1.00 C ATOM 111 NH1 ARG A 8 81.467 21.609 -4.491 1.00 1.00 N ATOM 112 NH2 ARG A 8 83.151 22.974 -3.866 1.00 1.00 N ATOM 0 H ARG A 8 85.161 19.713 -6.662 1.00 1.00 H new ATOM 0 HA ARG A 8 84.588 17.202 -5.648 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.596 19.667 -4.682 1.00 1.00 H new ATOM 0 HB3 ARG A 8 82.985 19.818 -5.355 1.00 1.00 H new ATOM 0 HG2 ARG A 8 82.417 17.669 -3.968 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.909 17.992 -3.107 1.00 1.00 H new ATOM 0 HD2 ARG A 8 81.359 19.612 -3.167 1.00 1.00 H new ATOM 0 HD3 ARG A 8 82.402 19.250 -1.807 1.00 1.00 H new ATOM 0 HE ARG A 8 83.942 21.016 -2.527 1.00 1.00 H new ATOM 0 HH11 ARG A 8 81.000 20.703 -4.453 1.00 1.00 H new ATOM 0 HH12 ARG A 8 81.087 22.354 -5.074 1.00 1.00 H new ATOM 0 HH21 ARG A 8 84.007 23.140 -3.337 1.00 1.00 H new ATOM 0 HH22 ARG A 8 82.762 23.712 -4.453 1.00 1.00 H new ATOM 126 N VAL A 9 82.111 18.380 -7.421 1.00 1.00 N ATOM 127 CA VAL A 9 80.896 17.891 -8.031 1.00 1.00 C ATOM 128 C VAL A 9 81.241 16.760 -9.006 1.00 1.00 C ATOM 129 O VAL A 9 80.637 15.702 -8.941 1.00 1.00 O ATOM 130 CB VAL A 9 80.131 19.033 -8.690 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.895 18.483 -9.411 1.00 1.00 C ATOM 132 CG2 VAL A 9 79.681 20.007 -7.599 1.00 1.00 C ATOM 0 H VAL A 9 82.366 19.344 -7.637 1.00 1.00 H new ATOM 0 HA VAL A 9 80.232 17.480 -7.271 1.00 1.00 H new ATOM 0 HB VAL A 9 80.772 19.538 -9.413 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.352 19.304 -9.880 1.00 1.00 H new ATOM 0 HG12 VAL A 9 79.206 17.770 -10.175 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.246 17.983 -8.691 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.131 20.832 -8.052 1.00 1.00 H new ATOM 0 HG22 VAL A 9 79.036 19.487 -6.890 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.555 20.397 -7.076 1.00 1.00 H new ATOM 142 N SER A 10 82.193 16.993 -9.911 1.00 1.00 N ATOM 143 CA SER A 10 82.586 15.980 -10.907 1.00 1.00 C ATOM 144 C SER A 10 83.198 14.699 -10.304 1.00 1.00 C ATOM 145 O SER A 10 82.888 13.605 -10.769 1.00 1.00 O ATOM 146 CB SER A 10 83.587 16.574 -11.895 1.00 1.00 C ATOM 147 OG SER A 10 83.894 15.601 -12.887 1.00 1.00 O ATOM 0 H SER A 10 82.708 17.871 -9.979 1.00 1.00 H new ATOM 0 HA SER A 10 81.659 15.690 -11.402 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.171 17.468 -12.360 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.494 16.879 -11.374 1.00 1.00 H new ATOM 0 HG SER A 10 84.535 15.976 -13.526 1.00 1.00 H new ATOM 153 N ARG A 11 84.049 14.795 -9.282 1.00 1.00 N ATOM 154 CA ARG A 11 84.611 13.591 -8.664 1.00 1.00 C ATOM 155 C ARG A 11 83.590 12.983 -7.690 1.00 1.00 C ATOM 156 O ARG A 11 83.261 11.805 -7.727 1.00 1.00 O ATOM 157 CB ARG A 11 85.906 13.959 -7.929 1.00 1.00 C ATOM 158 CG ARG A 11 86.548 12.703 -7.323 1.00 1.00 C ATOM 159 CD ARG A 11 87.780 13.104 -6.505 1.00 1.00 C ATOM 160 NE ARG A 11 88.842 13.610 -7.372 1.00 1.00 N ATOM 161 CZ ARG A 11 89.576 12.783 -8.109 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.315 11.504 -8.105 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.559 13.246 -8.836 1.00 1.00 N ATOM 0 H ARG A 11 84.360 15.675 -8.870 1.00 1.00 H new ATOM 0 HA ARG A 11 84.837 12.851 -9.432 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.602 14.435 -8.620 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.693 14.683 -7.142 1.00 1.00 H new ATOM 0 HG2 ARG A 11 85.830 12.184 -6.688 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.833 12.009 -8.114 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.505 13.867 -5.777 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.143 12.244 -5.943 1.00 1.00 H new ATOM 0 HE ARG A 11 89.023 14.613 -7.412 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.549 11.142 -7.537 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.877 10.867 -8.670 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.765 14.245 -8.839 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.120 12.608 -9.400 1.00 1.00 H new ATOM 177 N ALA A 12 83.166 13.855 -6.769 1.00 1.00 N ATOM 178 CA ALA A 12 82.241 13.418 -5.695 1.00 1.00 C ATOM 179 C ALA A 12 81.164 12.608 -6.373 1.00 1.00 C ATOM 180 O ALA A 12 80.880 11.484 -5.985 1.00 1.00 O ATOM 181 CB ALA A 12 81.591 14.566 -4.910 1.00 1.00 C ATOM 0 H ALA A 12 83.433 14.839 -6.736 1.00 1.00 H new ATOM 0 HA ALA A 12 82.813 12.855 -4.958 1.00 1.00 H new ATOM 0 HB1 ALA A 12 80.931 14.156 -4.146 1.00 1.00 H new ATOM 0 HB2 ALA A 12 82.367 15.167 -4.435 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.013 15.191 -5.591 1.00 1.00 H new ATOM 187 N VAL A 13 80.611 13.142 -7.438 1.00 1.00 N ATOM 188 CA VAL A 13 79.626 12.339 -8.138 1.00 1.00 C ATOM 189 C VAL A 13 80.312 11.058 -8.616 1.00 1.00 C ATOM 190 O VAL A 13 79.859 9.995 -8.302 1.00 1.00 O ATOM 191 CB VAL A 13 78.954 13.052 -9.326 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.211 14.306 -8.831 1.00 1.00 C ATOM 193 CG2 VAL A 13 80.003 13.421 -10.375 1.00 1.00 C ATOM 0 H VAL A 13 80.806 14.067 -7.822 1.00 1.00 H new ATOM 0 HA VAL A 13 78.819 12.130 -7.436 1.00 1.00 H new ATOM 0 HB VAL A 13 78.229 12.381 -9.787 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.738 14.806 -9.676 1.00 1.00 H new ATOM 0 HG12 VAL A 13 77.449 14.016 -8.108 1.00 1.00 H new ATOM 0 HG13 VAL A 13 78.920 14.986 -8.358 1.00 1.00 H new ATOM 0 HG21 VAL A 13 79.519 13.925 -11.212 1.00 1.00 H new ATOM 0 HG22 VAL A 13 80.744 14.086 -9.931 1.00 1.00 H new ATOM 0 HG23 VAL A 13 80.495 12.516 -10.732 1.00 1.00 H new ATOM 203 N ALA A 14 81.437 11.135 -9.324 1.00 1.00 N ATOM 204 CA ALA A 14 82.073 9.884 -9.767 1.00 1.00 C ATOM 205 C ALA A 14 82.427 8.975 -8.581 1.00 1.00 C ATOM 206 O ALA A 14 81.910 7.878 -8.478 1.00 1.00 O ATOM 207 CB ALA A 14 83.351 10.210 -10.545 1.00 1.00 C ATOM 0 H ALA A 14 81.911 11.997 -9.595 1.00 1.00 H new ATOM 0 HA ALA A 14 81.362 9.355 -10.402 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.823 9.284 -10.874 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.102 10.819 -11.414 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.038 10.759 -9.902 1.00 1.00 H new ATOM 213 N ALA A 15 83.333 9.427 -7.731 1.00 1.00 N ATOM 214 CA ALA A 15 83.780 8.606 -6.590 1.00 1.00 C ATOM 215 C ALA A 15 82.575 8.132 -5.778 1.00 1.00 C ATOM 216 O ALA A 15 82.386 6.945 -5.538 1.00 1.00 O ATOM 217 CB ALA A 15 84.693 9.442 -5.682 1.00 1.00 C ATOM 0 H ALA A 15 83.776 10.344 -7.797 1.00 1.00 H new ATOM 0 HA ALA A 15 84.323 7.741 -6.972 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.023 8.835 -4.839 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.561 9.778 -6.249 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.144 10.308 -5.312 1.00 1.00 H new ATOM 223 N ALA A 16 81.796 9.094 -5.347 1.00 1.00 N ATOM 224 CA ALA A 16 80.624 8.774 -4.541 1.00 1.00 C ATOM 225 C ALA A 16 79.639 7.943 -5.391 1.00 1.00 C ATOM 226 O ALA A 16 79.185 6.874 -4.978 1.00 1.00 O ATOM 227 CB ALA A 16 79.967 10.060 -4.005 1.00 1.00 C ATOM 0 H ALA A 16 81.940 10.087 -5.531 1.00 1.00 H new ATOM 0 HA ALA A 16 80.923 8.183 -3.675 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.094 9.800 -3.406 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.682 10.604 -3.388 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.659 10.687 -4.842 1.00 1.00 H new ATOM 233 N LEU A 17 79.294 8.485 -6.552 1.00 1.00 N ATOM 234 CA LEU A 17 78.308 7.783 -7.410 1.00 1.00 C ATOM 235 C LEU A 17 78.830 6.371 -7.702 1.00 1.00 C ATOM 236 O LEU A 17 78.129 5.389 -7.454 1.00 1.00 O ATOM 237 CB LEU A 17 77.980 8.482 -8.745 1.00 1.00 C ATOM 238 CG LEU A 17 76.816 7.767 -9.450 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.512 7.923 -8.640 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.639 8.381 -10.843 1.00 1.00 C ATOM 0 H LEU A 17 79.653 9.365 -6.922 1.00 1.00 H new ATOM 0 HA LEU A 17 77.375 7.776 -6.847 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.719 9.524 -8.563 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.859 8.482 -9.389 1.00 1.00 H new ATOM 0 HG LEU A 17 77.040 6.703 -9.532 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.700 7.410 -9.155 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.645 7.488 -7.649 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.269 8.981 -8.542 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.816 7.885 -11.358 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.418 9.444 -10.747 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.557 8.252 -11.417 1.00 1.00 H new ATOM 252 N VAL A 18 80.061 6.267 -8.217 1.00 1.00 N ATOM 253 CA VAL A 18 80.620 4.941 -8.508 1.00 1.00 C ATOM 254 C VAL A 18 80.922 4.199 -7.199 1.00 1.00 C ATOM 255 O VAL A 18 80.417 3.101 -6.975 1.00 1.00 O ATOM 256 CB VAL A 18 81.874 5.006 -9.435 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.703 6.084 -10.549 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.164 5.273 -8.632 1.00 1.00 C ATOM 0 H VAL A 18 80.671 7.055 -8.435 1.00 1.00 H new ATOM 0 HA VAL A 18 79.868 4.381 -9.063 1.00 1.00 H new ATOM 0 HB VAL A 18 81.965 4.029 -9.910 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.594 6.103 -11.177 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.834 5.841 -11.160 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.562 7.062 -10.090 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.015 5.311 -9.312 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.076 6.224 -8.108 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.314 4.472 -7.908 1.00 1.00 H new ATOM 268 N GLY A 19 81.750 4.793 -6.341 1.00 1.00 N ATOM 269 CA GLY A 19 82.108 4.164 -5.073 1.00 1.00 C ATOM 270 C GLY A 19 80.886 4.034 -4.168 1.00 1.00 C ATOM 271 O GLY A 19 79.773 4.291 -4.608 1.00 1.00 O ATOM 0 H GLY A 19 82.183 5.703 -6.500 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.535 3.178 -5.259 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.875 4.755 -4.573 1.00 1.00 H new ATOM 275 N PRO A 20 81.072 3.619 -2.932 1.00 1.00 N ATOM 276 CA PRO A 20 79.954 3.415 -1.949 1.00 1.00 C ATOM 277 C PRO A 20 79.387 4.714 -1.341 1.00 1.00 C ATOM 278 O PRO A 20 78.282 4.712 -0.827 1.00 1.00 O ATOM 279 CB PRO A 20 80.585 2.524 -0.846 1.00 1.00 C ATOM 280 CG PRO A 20 81.992 2.232 -1.294 1.00 1.00 C ATOM 281 CD PRO A 20 82.362 3.302 -2.313 1.00 1.00 C ATOM 0 HA PRO A 20 79.092 2.970 -2.445 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.581 3.035 0.117 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.018 1.602 -0.719 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.679 2.251 -0.448 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.058 1.238 -1.736 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.809 4.176 -1.838 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.082 2.933 -3.044 1.00 1.00 H new ATOM 289 N GLY A 21 80.173 5.786 -1.342 1.00 1.00 N ATOM 290 CA GLY A 21 79.707 7.031 -0.703 1.00 1.00 C ATOM 291 C GLY A 21 78.421 7.552 -1.344 1.00 1.00 C ATOM 292 O GLY A 21 77.416 7.771 -0.668 1.00 1.00 O ATOM 0 H GLY A 21 81.103 5.830 -1.759 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.537 6.853 0.359 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.484 7.791 -0.779 1.00 1.00 H new ATOM 296 N GLY A 22 78.489 7.793 -2.637 1.00 1.00 N ATOM 297 CA GLY A 22 77.326 8.352 -3.329 1.00 1.00 C ATOM 298 C GLY A 22 76.167 7.409 -3.132 1.00 1.00 C ATOM 299 O GLY A 22 75.101 7.795 -2.652 1.00 1.00 O ATOM 0 H GLY A 22 79.306 7.620 -3.223 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.085 9.339 -2.933 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.539 8.477 -4.391 1.00 1.00 H new ATOM 303 N VAL A 23 76.389 6.175 -3.511 1.00 1.00 N ATOM 304 CA VAL A 23 75.350 5.165 -3.375 1.00 1.00 C ATOM 305 C VAL A 23 74.982 4.997 -1.901 1.00 1.00 C ATOM 306 O VAL A 23 73.825 4.773 -1.578 1.00 1.00 O ATOM 307 CB VAL A 23 75.771 3.814 -4.015 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.058 3.618 -5.363 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.277 3.818 -4.262 1.00 1.00 C ATOM 0 H VAL A 23 77.265 5.841 -3.912 1.00 1.00 H new ATOM 0 HA VAL A 23 74.468 5.504 -3.919 1.00 1.00 H new ATOM 0 HB VAL A 23 75.498 3.006 -3.336 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.362 2.667 -5.801 1.00 1.00 H new ATOM 0 HG12 VAL A 23 73.979 3.617 -5.207 1.00 1.00 H new ATOM 0 HG13 VAL A 23 75.326 4.431 -6.038 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.575 2.870 -4.711 1.00 1.00 H new ATOM 0 HG22 VAL A 23 77.533 4.635 -4.936 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.801 3.951 -3.315 1.00 1.00 H new ATOM 319 N ALA A 24 75.962 5.119 -1.008 1.00 1.00 N ATOM 320 CA ALA A 24 75.632 4.962 0.404 1.00 1.00 C ATOM 321 C ALA A 24 74.497 5.935 0.761 1.00 1.00 C ATOM 322 O ALA A 24 73.431 5.495 1.187 1.00 1.00 O ATOM 323 CB ALA A 24 76.855 5.208 1.296 1.00 1.00 C ATOM 0 H ALA A 24 76.940 5.315 -1.220 1.00 1.00 H new ATOM 0 HA ALA A 24 75.307 3.936 0.579 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.574 5.083 2.342 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.639 4.494 1.043 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.223 6.222 1.138 1.00 1.00 H new ATOM 329 N LEU A 25 74.713 7.250 0.609 1.00 1.00 N ATOM 330 CA LEU A 25 73.673 8.221 0.948 1.00 1.00 C ATOM 331 C LEU A 25 72.431 8.062 0.078 1.00 1.00 C ATOM 332 O LEU A 25 71.313 8.132 0.592 1.00 1.00 O ATOM 333 CB LEU A 25 74.223 9.656 0.787 1.00 1.00 C ATOM 334 CG LEU A 25 73.118 10.733 0.970 1.00 1.00 C ATOM 335 CD1 LEU A 25 72.819 10.947 2.457 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.589 12.057 0.357 1.00 1.00 C ATOM 0 H LEU A 25 75.582 7.656 0.260 1.00 1.00 H new ATOM 0 HA LEU A 25 73.385 8.038 1.983 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.015 9.823 1.517 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.672 9.763 -0.201 1.00 1.00 H new ATOM 0 HG LEU A 25 72.211 10.391 0.471 1.00 1.00 H new ATOM 0 HD11 LEU A 25 72.043 11.704 2.567 1.00 1.00 H new ATOM 0 HD12 LEU A 25 72.477 10.011 2.898 1.00 1.00 H new ATOM 0 HD13 LEU A 25 73.724 11.278 2.966 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.814 12.813 0.485 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.501 12.384 0.855 1.00 1.00 H new ATOM 0 HD23 LEU A 25 73.786 11.916 -0.706 1.00 1.00 H new ATOM 348 N VAL A 26 72.604 7.904 -1.232 1.00 1.00 N ATOM 349 CA VAL A 26 71.428 7.814 -2.086 1.00 1.00 C ATOM 350 C VAL A 26 70.568 6.623 -1.669 1.00 1.00 C ATOM 351 O VAL A 26 69.403 6.799 -1.324 1.00 1.00 O ATOM 352 CB VAL A 26 71.878 7.673 -3.546 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.674 7.443 -4.462 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.596 8.955 -3.978 1.00 1.00 C ATOM 0 H VAL A 26 73.504 7.838 -1.707 1.00 1.00 H new ATOM 0 HA VAL A 26 70.828 8.718 -1.983 1.00 1.00 H new ATOM 0 HB VAL A 26 72.549 6.818 -3.624 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.014 7.346 -5.493 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.158 6.531 -4.163 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.991 8.289 -4.384 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.918 8.860 -5.015 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.916 9.802 -3.885 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.466 9.117 -3.341 1.00 1.00 H new ATOM 364 N VAL A 27 71.119 5.414 -1.720 1.00 1.00 N ATOM 365 CA VAL A 27 70.358 4.211 -1.373 1.00 1.00 C ATOM 366 C VAL A 27 69.828 4.261 0.063 1.00 1.00 C ATOM 367 O VAL A 27 68.725 3.789 0.342 1.00 1.00 O ATOM 368 CB VAL A 27 71.256 2.966 -1.587 1.00 1.00 C ATOM 369 CG1 VAL A 27 70.822 1.808 -0.684 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.185 2.517 -3.047 1.00 1.00 C ATOM 0 H VAL A 27 72.085 5.238 -1.997 1.00 1.00 H new ATOM 0 HA VAL A 27 69.486 4.153 -2.025 1.00 1.00 H new ATOM 0 HB VAL A 27 72.279 3.243 -1.332 1.00 1.00 H new ATOM 0 HG11 VAL A 27 71.470 0.949 -0.857 1.00 1.00 H new ATOM 0 HG12 VAL A 27 70.895 2.114 0.360 1.00 1.00 H new ATOM 0 HG13 VAL A 27 69.791 1.536 -0.911 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.819 1.642 -3.190 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.155 2.265 -3.300 1.00 1.00 H new ATOM 0 HG23 VAL A 27 71.530 3.324 -3.693 1.00 1.00 H new ATOM 380 N LYS A 28 70.615 4.809 0.969 1.00 1.00 N ATOM 381 CA LYS A 28 70.186 4.875 2.362 1.00 1.00 C ATOM 382 C LYS A 28 68.974 5.785 2.471 1.00 1.00 C ATOM 383 O LYS A 28 67.935 5.411 3.018 1.00 1.00 O ATOM 384 CB LYS A 28 71.351 5.401 3.213 1.00 1.00 C ATOM 385 CG LYS A 28 70.891 5.767 4.627 1.00 1.00 C ATOM 386 CD LYS A 28 72.125 6.100 5.483 1.00 1.00 C ATOM 387 CE LYS A 28 71.716 6.881 6.742 1.00 1.00 C ATOM 388 NZ LYS A 28 71.805 8.343 6.456 1.00 1.00 N ATOM 0 H LYS A 28 71.534 5.208 0.778 1.00 1.00 H new ATOM 0 HA LYS A 28 69.905 3.886 2.725 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.134 4.644 3.268 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.788 6.277 2.733 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.214 6.621 4.594 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.338 4.939 5.070 1.00 1.00 H new ATOM 0 HD2 LYS A 28 72.635 5.180 5.769 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.832 6.688 4.898 1.00 1.00 H new ATOM 0 HE2 LYS A 28 70.701 6.616 7.036 1.00 1.00 H new ATOM 0 HE3 LYS A 28 72.368 6.620 7.576 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 71.530 8.880 7.303 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.781 8.587 6.194 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.166 8.583 5.671 1.00 1.00 H new ATOM 402 N VAL A 29 69.143 6.987 1.970 1.00 1.00 N ATOM 403 CA VAL A 29 68.069 7.968 2.044 1.00 1.00 C ATOM 404 C VAL A 29 66.856 7.497 1.248 1.00 1.00 C ATOM 405 O VAL A 29 65.734 7.563 1.750 1.00 1.00 O ATOM 406 CB VAL A 29 68.523 9.365 1.585 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.299 10.278 1.385 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.422 9.986 2.664 1.00 1.00 C ATOM 0 H VAL A 29 69.995 7.312 1.513 1.00 1.00 H new ATOM 0 HA VAL A 29 67.784 8.058 3.092 1.00 1.00 H new ATOM 0 HB VAL A 29 69.067 9.268 0.645 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.630 11.264 1.060 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.644 9.848 0.628 1.00 1.00 H new ATOM 0 HG13 VAL A 29 66.756 10.369 2.325 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.746 10.976 2.342 1.00 1.00 H new ATOM 0 HG22 VAL A 29 68.865 10.072 3.597 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.295 9.352 2.820 1.00 1.00 H new ATOM 418 N CYS A 30 67.052 7.024 0.015 1.00 1.00 N ATOM 419 CA CYS A 30 65.897 6.580 -0.749 1.00 1.00 C ATOM 420 C CYS A 30 65.295 5.322 -0.113 1.00 1.00 C ATOM 421 O CYS A 30 64.114 5.318 0.236 1.00 1.00 O ATOM 422 CB CYS A 30 66.295 6.356 -2.242 1.00 1.00 C ATOM 423 SG CYS A 30 65.927 4.667 -2.815 1.00 1.00 S ATOM 0 H CYS A 30 67.955 6.942 -0.453 1.00 1.00 H new ATOM 0 HA CYS A 30 65.128 7.352 -0.730 1.00 1.00 H new ATOM 0 HB2 CYS A 30 65.763 7.073 -2.868 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.360 6.554 -2.365 1.00 1.00 H new ATOM 0 HG CYS A 30 66.278 4.545 -4.061 1.00 1.00 H new ATOM 428 N ALA A 31 66.057 4.226 -0.028 1.00 1.00 N ATOM 429 CA ALA A 31 65.522 2.971 0.486 1.00 1.00 C ATOM 430 C ALA A 31 65.105 3.032 1.940 1.00 1.00 C ATOM 431 O ALA A 31 63.991 2.635 2.284 1.00 1.00 O ATOM 432 CB ALA A 31 66.581 1.868 0.316 1.00 1.00 C ATOM 0 H ALA A 31 67.037 4.187 -0.307 1.00 1.00 H new ATOM 0 HA ALA A 31 64.621 2.758 -0.089 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.189 0.925 0.698 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.825 1.758 -0.741 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.480 2.138 0.870 1.00 1.00 H new ATOM 438 N GLY A 32 66.008 3.461 2.808 1.00 1.00 N ATOM 439 CA GLY A 32 65.704 3.487 4.227 1.00 1.00 C ATOM 440 C GLY A 32 65.928 2.092 4.810 1.00 1.00 C ATOM 441 O GLY A 32 64.972 1.391 5.129 1.00 1.00 O ATOM 0 H GLY A 32 66.941 3.790 2.560 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.339 4.213 4.735 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.672 3.800 4.385 1.00 1.00 H new ATOM 445 N LEU A 33 67.212 1.718 4.928 1.00 1.00 N ATOM 446 CA LEU A 33 67.631 0.408 5.464 1.00 1.00 C ATOM 447 C LEU A 33 67.652 -0.666 4.368 1.00 1.00 C ATOM 448 O LEU A 33 66.677 -1.393 4.194 1.00 1.00 O ATOM 449 CB LEU A 33 66.715 -0.071 6.604 1.00 1.00 C ATOM 450 CG LEU A 33 66.547 1.037 7.678 1.00 1.00 C ATOM 451 CD1 LEU A 33 65.130 0.994 8.258 1.00 1.00 C ATOM 452 CD2 LEU A 33 67.556 0.818 8.813 1.00 1.00 C ATOM 0 H LEU A 33 67.992 2.315 4.654 1.00 1.00 H new ATOM 0 HA LEU A 33 68.638 0.552 5.856 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.740 -0.345 6.202 1.00 1.00 H new ATOM 0 HB3 LEU A 33 67.134 -0.967 7.062 1.00 1.00 H new ATOM 0 HG LEU A 33 66.722 2.006 7.211 1.00 1.00 H new ATOM 0 HD11 LEU A 33 65.021 1.775 9.011 1.00 1.00 H new ATOM 0 HD12 LEU A 33 64.405 1.156 7.460 1.00 1.00 H new ATOM 0 HD13 LEU A 33 64.954 0.021 8.717 1.00 1.00 H new ATOM 0 HD21 LEU A 33 67.434 1.598 9.564 1.00 1.00 H new ATOM 0 HD22 LEU A 33 67.383 -0.156 9.270 1.00 1.00 H new ATOM 0 HD23 LEU A 33 68.569 0.856 8.412 1.00 1.00 H new ATOM 464 N PRO A 34 68.739 -0.787 3.641 1.00 1.00 N ATOM 465 CA PRO A 34 68.894 -1.810 2.547 1.00 1.00 C ATOM 466 C PRO A 34 68.686 -3.252 3.024 1.00 1.00 C ATOM 467 O PRO A 34 68.309 -4.121 2.237 1.00 1.00 O ATOM 468 CB PRO A 34 70.343 -1.606 2.075 1.00 1.00 C ATOM 469 CG PRO A 34 70.652 -0.197 2.430 1.00 1.00 C ATOM 470 CD PRO A 34 69.945 0.050 3.756 1.00 1.00 C ATOM 0 HA PRO A 34 68.144 -1.673 1.768 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.023 -2.299 2.570 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.439 -1.776 1.003 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.727 -0.042 2.523 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.296 0.489 1.661 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.562 -0.244 4.605 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.696 1.102 3.892 1.00 1.00 H new ATOM 478 N GLY A 35 68.945 -3.503 4.305 1.00 1.00 N ATOM 479 CA GLY A 35 68.775 -4.867 4.803 1.00 1.00 C ATOM 480 C GLY A 35 67.358 -5.317 4.483 1.00 1.00 C ATOM 481 O GLY A 35 67.147 -6.307 3.783 1.00 1.00 O ATOM 0 H GLY A 35 69.259 -2.816 4.991 1.00 1.00 H new ATOM 0 HA2 GLY A 35 69.500 -5.535 4.338 1.00 1.00 H new ATOM 0 HA3 GLY A 35 68.952 -4.904 5.878 1.00 1.00 H new ATOM 485 N VAL A 36 66.389 -4.548 4.966 1.00 1.00 N ATOM 486 CA VAL A 36 64.980 -4.822 4.703 1.00 1.00 C ATOM 487 C VAL A 36 64.552 -3.943 3.532 1.00 1.00 C ATOM 488 O VAL A 36 65.271 -3.000 3.228 1.00 1.00 O ATOM 489 CB VAL A 36 64.140 -4.533 5.955 1.00 1.00 C ATOM 490 CG1 VAL A 36 64.204 -3.043 6.299 1.00 1.00 C ATOM 491 CG2 VAL A 36 62.687 -4.937 5.702 1.00 1.00 C ATOM 0 H VAL A 36 66.554 -3.725 5.545 1.00 1.00 H new ATOM 0 HA VAL A 36 64.828 -5.872 4.451 1.00 1.00 H new ATOM 0 HB VAL A 36 64.539 -5.109 6.790 1.00 1.00 H new ATOM 0 HG11 VAL A 36 63.605 -2.849 7.189 1.00 1.00 H new ATOM 0 HG12 VAL A 36 65.239 -2.758 6.489 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.814 -2.460 5.465 1.00 1.00 H new ATOM 0 HG21 VAL A 36 62.092 -4.731 6.592 1.00 1.00 H new ATOM 0 HG22 VAL A 36 62.292 -4.367 4.861 1.00 1.00 H new ATOM 0 HG23 VAL A 36 62.640 -6.001 5.472 1.00 1.00 H new ATOM 501 N ILE A 37 63.412 -4.269 2.891 1.00 1.00 N ATOM 502 CA ILE A 37 62.869 -3.525 1.727 1.00 1.00 C ATOM 503 C ILE A 37 62.721 -4.472 0.542 1.00 1.00 C ATOM 504 O ILE A 37 63.715 -4.988 0.026 1.00 1.00 O ATOM 505 CB ILE A 37 63.744 -2.324 1.289 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.623 -1.172 2.323 1.00 1.00 C ATOM 507 CG2 ILE A 37 63.312 -1.827 -0.103 1.00 1.00 C ATOM 508 CD1 ILE A 37 62.419 -0.270 2.010 1.00 1.00 C ATOM 0 H ILE A 37 62.834 -5.063 3.166 1.00 1.00 H new ATOM 0 HA ILE A 37 61.907 -3.124 2.046 1.00 1.00 H new ATOM 0 HB ILE A 37 64.783 -2.650 1.239 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.518 -1.588 3.325 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.537 -0.578 2.319 1.00 1.00 H new ATOM 0 HG21 ILE A 37 63.936 -0.983 -0.398 1.00 1.00 H new ATOM 0 HG22 ILE A 37 63.425 -2.633 -0.828 1.00 1.00 H new ATOM 0 HG23 ILE A 37 62.269 -1.513 -0.070 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.360 0.528 2.751 1.00 1.00 H new ATOM 0 HD12 ILE A 37 62.538 0.165 1.017 1.00 1.00 H new ATOM 0 HD13 ILE A 37 61.504 -0.861 2.040 1.00 1.00 H new ATOM 520 N HIS A 38 61.488 -4.681 0.091 1.00 1.00 N ATOM 521 CA HIS A 38 61.218 -5.545 -1.056 1.00 1.00 C ATOM 522 C HIS A 38 60.148 -4.858 -1.910 1.00 1.00 C ATOM 523 O HIS A 38 59.112 -4.443 -1.390 1.00 1.00 O ATOM 524 CB HIS A 38 60.741 -6.947 -0.581 1.00 1.00 C ATOM 525 CG HIS A 38 60.541 -6.949 0.915 1.00 1.00 C ATOM 526 ND1 HIS A 38 61.263 -7.785 1.757 1.00 1.00 N ATOM 527 CD2 HIS A 38 59.715 -6.219 1.734 1.00 1.00 C ATOM 528 CE1 HIS A 38 60.863 -7.535 3.018 1.00 1.00 C ATOM 529 NE2 HIS A 38 59.921 -6.589 3.060 1.00 1.00 N ATOM 0 H HIS A 38 60.655 -4.262 0.504 1.00 1.00 H new ATOM 0 HA HIS A 38 62.123 -5.698 -1.644 1.00 1.00 H new ATOM 0 HB2 HIS A 38 59.809 -7.211 -1.080 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.476 -7.703 -0.858 1.00 1.00 H new ATOM 0 HD2 HIS A 38 59.012 -5.471 1.400 1.00 1.00 H new ATOM 0 HE1 HIS A 38 61.256 -8.038 3.889 1.00 1.00 H new ATOM 0 HE2 HIS A 38 59.453 -6.217 3.887 1.00 1.00 H new ATOM 537 N THR A 39 60.399 -4.728 -3.214 1.00 1.00 N ATOM 538 CA THR A 39 59.436 -4.072 -4.105 1.00 1.00 C ATOM 539 C THR A 39 58.555 -5.124 -4.784 1.00 1.00 C ATOM 540 O THR A 39 58.963 -6.276 -4.930 1.00 1.00 O ATOM 541 CB THR A 39 60.180 -3.226 -5.164 1.00 1.00 C ATOM 542 OG1 THR A 39 61.478 -3.764 -5.363 1.00 1.00 O ATOM 543 CG2 THR A 39 60.305 -1.771 -4.692 1.00 1.00 C ATOM 0 H THR A 39 61.247 -5.062 -3.673 1.00 1.00 H new ATOM 0 HA THR A 39 58.801 -3.409 -3.517 1.00 1.00 H new ATOM 0 HB THR A 39 59.616 -3.250 -6.097 1.00 1.00 H new ATOM 0 HG1 THR A 39 61.953 -3.232 -6.035 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.831 -1.187 -5.448 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.311 -1.352 -4.537 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.862 -1.739 -3.756 1.00 1.00 H new ATOM 551 N PRO A 40 57.359 -4.761 -5.181 1.00 1.00 N ATOM 552 CA PRO A 40 56.416 -5.711 -5.834 1.00 1.00 C ATOM 553 C PRO A 40 56.739 -5.989 -7.304 1.00 1.00 C ATOM 554 O PRO A 40 56.685 -7.137 -7.746 1.00 1.00 O ATOM 555 CB PRO A 40 55.068 -4.988 -5.709 1.00 1.00 C ATOM 556 CG PRO A 40 55.423 -3.542 -5.791 1.00 1.00 C ATOM 557 CD PRO A 40 56.762 -3.410 -5.061 1.00 1.00 C ATOM 0 HA PRO A 40 56.452 -6.695 -5.367 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.385 -5.277 -6.508 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.574 -5.225 -4.766 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.507 -3.216 -6.828 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.658 -2.922 -5.323 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.395 -2.650 -5.519 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.624 -3.124 -4.018 1.00 1.00 H new ATOM 565 N ALA A 41 57.092 -4.946 -8.058 1.00 1.00 N ATOM 566 CA ALA A 41 57.438 -5.093 -9.475 1.00 1.00 C ATOM 567 C ALA A 41 58.813 -4.506 -9.750 1.00 1.00 C ATOM 568 O ALA A 41 59.077 -3.370 -9.363 1.00 1.00 O ATOM 569 CB ALA A 41 56.405 -4.375 -10.343 1.00 1.00 C ATOM 0 H ALA A 41 57.146 -3.988 -7.711 1.00 1.00 H new ATOM 0 HA ALA A 41 57.446 -6.156 -9.717 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.670 -4.490 -11.394 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.420 -4.807 -10.168 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.387 -3.316 -10.087 1.00 1.00 H new ATOM 575 N ARG A 42 59.682 -5.231 -10.441 1.00 1.00 N ATOM 576 CA ARG A 42 60.988 -4.682 -10.757 1.00 1.00 C ATOM 577 C ARG A 42 61.685 -5.538 -11.811 1.00 1.00 C ATOM 578 O ARG A 42 61.288 -6.675 -12.072 1.00 1.00 O ATOM 579 CB ARG A 42 61.844 -4.555 -9.493 1.00 1.00 C ATOM 580 CG ARG A 42 61.975 -5.916 -8.797 1.00 1.00 C ATOM 581 CD ARG A 42 62.785 -5.771 -7.487 1.00 1.00 C ATOM 582 NE ARG A 42 63.913 -6.690 -7.505 1.00 1.00 N ATOM 583 CZ ARG A 42 64.550 -7.015 -6.388 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.166 -6.508 -5.249 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.560 -7.838 -6.434 1.00 1.00 N ATOM 0 H ARG A 42 59.511 -6.176 -10.785 1.00 1.00 H new ATOM 0 HA ARG A 42 60.853 -3.682 -11.169 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.832 -4.175 -9.752 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.393 -3.833 -8.812 1.00 1.00 H new ATOM 0 HG2 ARG A 42 60.985 -6.318 -8.579 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.468 -6.626 -9.461 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.140 -4.746 -7.379 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.147 -5.980 -6.628 1.00 1.00 H new ATOM 0 HE ARG A 42 64.219 -7.091 -8.392 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.377 -5.863 -5.218 1.00 1.00 H new ATOM 0 HH12 ARG A 42 64.655 -6.757 -4.389 1.00 1.00 H new ATOM 0 HH21 ARG A 42 65.858 -8.230 -7.327 1.00 1.00 H new ATOM 0 HH22 ARG A 42 66.052 -8.090 -5.577 1.00 1.00 H new ATOM 599 N ARG A 43 62.718 -4.974 -12.424 1.00 1.00 N ATOM 600 CA ARG A 43 63.465 -5.682 -13.470 1.00 1.00 C ATOM 601 C ARG A 43 64.160 -6.932 -12.904 1.00 1.00 C ATOM 602 O ARG A 43 65.127 -7.431 -13.480 1.00 1.00 O ATOM 603 CB ARG A 43 64.506 -4.736 -14.093 1.00 1.00 C ATOM 604 CG ARG A 43 64.737 -5.074 -15.579 1.00 1.00 C ATOM 605 CD ARG A 43 63.521 -4.664 -16.433 1.00 1.00 C ATOM 606 NE ARG A 43 63.950 -4.364 -17.793 1.00 1.00 N ATOM 607 CZ ARG A 43 64.216 -5.333 -18.662 1.00 1.00 C ATOM 608 NH1 ARG A 43 64.089 -6.583 -18.312 1.00 1.00 N ATOM 609 NH2 ARG A 43 64.605 -5.029 -19.869 1.00 1.00 N ATOM 0 H ARG A 43 63.060 -4.035 -12.221 1.00 1.00 H new ATOM 0 HA ARG A 43 62.762 -6.005 -14.237 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.168 -3.704 -13.999 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.447 -4.814 -13.548 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.628 -4.560 -15.938 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.919 -6.143 -15.689 1.00 1.00 H new ATOM 0 HD2 ARG A 43 62.785 -5.468 -16.443 1.00 1.00 H new ATOM 0 HD3 ARG A 43 63.035 -3.792 -15.995 1.00 1.00 H new ATOM 0 HE ARG A 43 64.048 -3.391 -18.083 1.00 1.00 H new ATOM 0 HH11 ARG A 43 63.784 -6.820 -17.368 1.00 1.00 H new ATOM 0 HH12 ARG A 43 64.294 -7.324 -18.982 1.00 1.00 H new ATOM 0 HH21 ARG A 43 64.704 -4.051 -20.142 1.00 1.00 H new ATOM 0 HH22 ARG A 43 64.811 -5.769 -20.540 1.00 1.00 H new ATOM 623 N GLY A 44 63.652 -7.429 -11.782 1.00 1.00 N ATOM 624 CA GLY A 44 64.210 -8.614 -11.142 1.00 1.00 C ATOM 625 C GLY A 44 65.563 -8.324 -10.496 1.00 1.00 C ATOM 626 O GLY A 44 65.947 -8.984 -9.533 1.00 1.00 O ATOM 0 H GLY A 44 62.851 -7.027 -11.295 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.516 -8.979 -10.385 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.322 -9.408 -11.881 1.00 1.00 H new ATOM 630 N PHE A 45 66.296 -7.348 -11.031 1.00 1.00 N ATOM 631 CA PHE A 45 67.612 -7.004 -10.496 1.00 1.00 C ATOM 632 C PHE A 45 67.905 -5.521 -10.755 1.00 1.00 C ATOM 633 O PHE A 45 67.454 -4.994 -11.756 1.00 1.00 O ATOM 634 CB PHE A 45 68.661 -7.882 -11.181 1.00 1.00 C ATOM 635 CG PHE A 45 70.043 -7.444 -10.774 1.00 1.00 C ATOM 636 CD1 PHE A 45 70.629 -6.339 -11.396 1.00 1.00 C ATOM 637 CD2 PHE A 45 70.735 -8.137 -9.774 1.00 1.00 C ATOM 638 CE1 PHE A 45 71.911 -5.923 -11.020 1.00 1.00 C ATOM 639 CE2 PHE A 45 72.017 -7.722 -9.397 1.00 1.00 C ATOM 640 CZ PHE A 45 72.604 -6.616 -10.020 1.00 1.00 C ATOM 0 H PHE A 45 66.003 -6.785 -11.829 1.00 1.00 H new ATOM 0 HA PHE A 45 67.638 -7.177 -9.420 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.507 -8.926 -10.910 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.553 -7.815 -12.264 1.00 1.00 H new ATOM 0 HD1 PHE A 45 70.093 -5.806 -12.167 1.00 1.00 H new ATOM 0 HD2 PHE A 45 70.280 -8.991 -9.294 1.00 1.00 H new ATOM 0 HE1 PHE A 45 72.365 -5.069 -11.500 1.00 1.00 H new ATOM 0 HE2 PHE A 45 72.553 -8.255 -8.626 1.00 1.00 H new ATOM 0 HZ PHE A 45 73.594 -6.296 -9.729 1.00 1.00 H new ATOM 650 N PHE A 46 68.688 -4.891 -9.860 1.00 1.00 N ATOM 651 CA PHE A 46 69.095 -3.455 -9.957 1.00 1.00 C ATOM 652 C PHE A 46 69.085 -2.815 -8.554 1.00 1.00 C ATOM 653 O PHE A 46 68.098 -2.183 -8.200 1.00 1.00 O ATOM 654 CB PHE A 46 68.155 -2.592 -10.877 1.00 1.00 C ATOM 655 CG PHE A 46 68.750 -2.367 -12.266 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.919 -1.605 -12.406 1.00 1.00 C ATOM 657 CD2 PHE A 46 68.118 -2.873 -13.414 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.452 -1.359 -13.679 1.00 1.00 C ATOM 659 CE2 PHE A 46 68.653 -2.622 -14.685 1.00 1.00 C ATOM 660 CZ PHE A 46 69.819 -1.866 -14.816 1.00 1.00 C ATOM 0 H PHE A 46 69.066 -5.359 -9.036 1.00 1.00 H new ATOM 0 HA PHE A 46 70.091 -3.459 -10.400 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.190 -3.089 -10.974 1.00 1.00 H new ATOM 0 HB3 PHE A 46 67.971 -1.628 -10.402 1.00 1.00 H new ATOM 0 HD1 PHE A 46 70.410 -1.207 -11.530 1.00 1.00 H new ATOM 0 HD2 PHE A 46 67.216 -3.458 -13.317 1.00 1.00 H new ATOM 0 HE1 PHE A 46 71.355 -0.776 -13.781 1.00 1.00 H new ATOM 0 HE2 PHE A 46 68.163 -3.014 -15.564 1.00 1.00 H new ATOM 0 HZ PHE A 46 70.231 -1.673 -15.795 1.00 1.00 H new ATOM 670 N ARG A 47 70.181 -2.984 -7.784 1.00 1.00 N ATOM 671 CA ARG A 47 70.324 -2.418 -6.414 1.00 1.00 C ATOM 672 C ARG A 47 70.957 -3.468 -5.500 1.00 1.00 C ATOM 673 O ARG A 47 70.543 -4.626 -5.529 1.00 1.00 O ATOM 674 CB ARG A 47 68.969 -1.998 -5.780 1.00 1.00 C ATOM 675 CG ARG A 47 68.525 -0.585 -6.268 1.00 1.00 C ATOM 676 CD ARG A 47 68.814 0.495 -5.210 1.00 1.00 C ATOM 677 NE ARG A 47 70.231 0.854 -5.226 1.00 1.00 N ATOM 678 CZ ARG A 47 70.690 1.824 -6.013 1.00 1.00 C ATOM 679 NH1 ARG A 47 69.888 2.412 -6.859 1.00 1.00 N ATOM 680 NH2 ARG A 47 71.945 2.178 -5.948 1.00 1.00 N ATOM 0 H ARG A 47 70.996 -3.516 -8.090 1.00 1.00 H new ATOM 0 HA ARG A 47 70.944 -1.527 -6.510 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.203 -2.730 -6.036 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.059 -1.998 -4.694 1.00 1.00 H new ATOM 0 HG2 ARG A 47 69.046 -0.338 -7.193 1.00 1.00 H new ATOM 0 HG3 ARG A 47 67.459 -0.596 -6.496 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.206 1.378 -5.406 1.00 1.00 H new ATOM 0 HD3 ARG A 47 68.536 0.129 -4.222 1.00 1.00 H new ATOM 0 HE ARG A 47 70.881 0.351 -4.622 1.00 1.00 H new ATOM 0 HH11 ARG A 47 68.910 2.128 -6.916 1.00 1.00 H new ATOM 0 HH12 ARG A 47 70.239 3.156 -7.462 1.00 1.00 H new ATOM 0 HH21 ARG A 47 72.573 1.711 -5.294 1.00 1.00 H new ATOM 0 HH22 ARG A 47 72.297 2.921 -6.551 1.00 1.00 H new ATOM 694 N CYS A 48 71.952 -3.088 -4.685 1.00 1.00 N ATOM 695 CA CYS A 48 72.593 -4.043 -3.786 1.00 1.00 C ATOM 696 C CYS A 48 73.565 -4.926 -4.562 1.00 1.00 C ATOM 697 O CYS A 48 73.320 -6.111 -4.702 1.00 1.00 O ATOM 698 CB CYS A 48 71.543 -4.942 -3.087 1.00 1.00 C ATOM 699 SG CYS A 48 69.996 -4.049 -2.800 1.00 1.00 S ATOM 0 H CYS A 48 72.322 -2.139 -4.634 1.00 1.00 H new ATOM 0 HA CYS A 48 73.133 -3.475 -3.028 1.00 1.00 H new ATOM 0 HB2 CYS A 48 71.349 -5.822 -3.701 1.00 1.00 H new ATOM 0 HB3 CYS A 48 71.941 -5.298 -2.137 1.00 1.00 H new ATOM 0 HG CYS A 48 69.249 -4.123 -3.861 1.00 1.00 H new ATOM 704 N ASN A 49 74.688 -4.399 -5.053 1.00 1.00 N ATOM 705 CA ASN A 49 75.638 -5.233 -5.792 1.00 1.00 C ATOM 706 C ASN A 49 76.943 -5.321 -4.996 1.00 1.00 C ATOM 707 O ASN A 49 77.308 -4.372 -4.306 1.00 1.00 O ATOM 708 CB ASN A 49 75.890 -4.592 -7.175 1.00 1.00 C ATOM 709 CG ASN A 49 74.676 -3.764 -7.595 1.00 1.00 C ATOM 710 OD1 ASN A 49 73.574 -4.297 -7.719 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.812 -2.483 -7.813 1.00 1.00 N ATOM 0 H ASN A 49 74.959 -3.420 -4.956 1.00 1.00 H new ATOM 0 HA ASN A 49 75.240 -6.238 -5.932 1.00 1.00 H new ATOM 0 HB2 ASN A 49 76.777 -3.959 -7.136 1.00 1.00 H new ATOM 0 HB3 ASN A 49 76.085 -5.368 -7.915 1.00 1.00 H new ATOM 0 HD21 ASN A 49 74.004 -1.924 -8.086 1.00 1.00 H new ATOM 0 HD22 ASN A 49 75.726 -2.042 -7.710 1.00 1.00 H new ATOM 718 N PRO A 50 77.653 -6.417 -5.070 1.00 1.00 N ATOM 719 CA PRO A 50 78.931 -6.576 -4.325 1.00 1.00 C ATOM 720 C PRO A 50 80.042 -5.738 -4.954 1.00 1.00 C ATOM 721 O PRO A 50 81.077 -6.265 -5.364 1.00 1.00 O ATOM 722 CB PRO A 50 79.222 -8.078 -4.430 1.00 1.00 C ATOM 723 CG PRO A 50 78.590 -8.492 -5.718 1.00 1.00 C ATOM 724 CD PRO A 50 77.336 -7.623 -5.863 1.00 1.00 C ATOM 0 HA PRO A 50 78.870 -6.235 -3.292 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.294 -8.275 -4.432 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.799 -8.624 -3.587 1.00 1.00 H new ATOM 0 HG2 PRO A 50 79.271 -8.339 -6.555 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.333 -9.551 -5.705 1.00 1.00 H new ATOM 0 HD2 PRO A 50 77.138 -7.376 -6.906 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.450 -8.131 -5.482 1.00 1.00 H new ATOM 732 N GLU A 51 79.826 -4.426 -5.017 1.00 1.00 N ATOM 733 CA GLU A 51 80.817 -3.526 -5.584 1.00 1.00 C ATOM 734 C GLU A 51 81.130 -3.896 -7.032 1.00 1.00 C ATOM 735 O GLU A 51 82.275 -4.189 -7.375 1.00 1.00 O ATOM 736 CB GLU A 51 82.095 -3.579 -4.747 1.00 1.00 C ATOM 737 CG GLU A 51 81.732 -3.564 -3.258 1.00 1.00 C ATOM 738 CD GLU A 51 80.824 -2.378 -2.949 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.197 -1.267 -3.288 1.00 1.00 O ATOM 740 OE2 GLU A 51 79.769 -2.598 -2.376 1.00 1.00 O ATOM 0 H GLU A 51 78.978 -3.968 -4.684 1.00 1.00 H new ATOM 0 HA GLU A 51 80.411 -2.514 -5.572 1.00 1.00 H new ATOM 0 HB2 GLU A 51 82.661 -4.479 -4.985 1.00 1.00 H new ATOM 0 HB3 GLU A 51 82.734 -2.729 -4.985 1.00 1.00 H new ATOM 0 HG2 GLU A 51 81.232 -4.494 -2.989 1.00 1.00 H new ATOM 0 HG3 GLU A 51 82.639 -3.504 -2.656 1.00 1.00 H new ATOM 747 N ARG A 52 80.102 -3.876 -7.881 1.00 1.00 N ATOM 748 CA ARG A 52 80.269 -4.205 -9.300 1.00 1.00 C ATOM 749 C ARG A 52 79.320 -3.374 -10.152 1.00 1.00 C ATOM 750 O ARG A 52 78.535 -2.584 -9.626 1.00 1.00 O ATOM 751 CB ARG A 52 79.994 -5.694 -9.540 1.00 1.00 C ATOM 752 CG ARG A 52 78.526 -6.017 -9.235 1.00 1.00 C ATOM 753 CD ARG A 52 78.257 -7.490 -9.524 1.00 1.00 C ATOM 754 NE ARG A 52 76.823 -7.765 -9.382 1.00 1.00 N ATOM 755 CZ ARG A 52 76.124 -8.437 -10.305 1.00 1.00 C ATOM 756 NH1 ARG A 52 76.712 -8.938 -11.360 1.00 1.00 N ATOM 757 NH2 ARG A 52 74.840 -8.604 -10.144 1.00 1.00 N ATOM 0 H ARG A 52 79.147 -3.636 -7.614 1.00 1.00 H new ATOM 0 HA ARG A 52 81.297 -3.980 -9.582 1.00 1.00 H new ATOM 0 HB2 ARG A 52 80.223 -5.952 -10.574 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.646 -6.298 -8.909 1.00 1.00 H new ATOM 0 HG2 ARG A 52 78.303 -5.794 -8.192 1.00 1.00 H new ATOM 0 HG3 ARG A 52 77.872 -5.391 -9.842 1.00 1.00 H new ATOM 0 HD2 ARG A 52 78.587 -7.739 -10.532 1.00 1.00 H new ATOM 0 HD3 ARG A 52 78.827 -8.116 -8.838 1.00 1.00 H new ATOM 0 HE ARG A 52 76.340 -7.431 -8.548 1.00 1.00 H new ATOM 0 HH11 ARG A 52 77.717 -8.819 -11.488 1.00 1.00 H new ATOM 0 HH12 ARG A 52 76.166 -9.448 -12.055 1.00 1.00 H new ATOM 0 HH21 ARG A 52 74.376 -8.224 -9.319 1.00 1.00 H new ATOM 0 HH22 ARG A 52 74.301 -9.115 -10.843 1.00 1.00 H new ATOM 771 N ILE A 53 79.387 -3.556 -11.473 1.00 1.00 N ATOM 772 CA ILE A 53 78.522 -2.821 -12.390 1.00 1.00 C ATOM 773 C ILE A 53 77.185 -3.551 -12.568 1.00 1.00 C ATOM 774 O ILE A 53 77.124 -4.774 -12.641 1.00 1.00 O ATOM 775 CB ILE A 53 79.259 -2.642 -13.749 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.286 -2.545 -14.953 1.00 1.00 C ATOM 777 CG2 ILE A 53 80.190 -3.834 -13.972 1.00 1.00 C ATOM 778 CD1 ILE A 53 77.316 -1.360 -14.812 1.00 1.00 C ATOM 0 H ILE A 53 80.030 -4.204 -11.927 1.00 1.00 H new ATOM 0 HA ILE A 53 78.300 -1.836 -11.979 1.00 1.00 H new ATOM 0 HB ILE A 53 79.813 -1.705 -13.694 1.00 1.00 H new ATOM 0 HG12 ILE A 53 78.858 -2.438 -15.875 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.718 -3.471 -15.036 1.00 1.00 H new ATOM 0 HG21 ILE A 53 80.710 -3.716 -14.922 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.919 -3.883 -13.163 1.00 1.00 H new ATOM 0 HG23 ILE A 53 79.605 -4.754 -13.990 1.00 1.00 H new ATOM 0 HD11 ILE A 53 76.652 -1.328 -15.676 1.00 1.00 H new ATOM 0 HD12 ILE A 53 76.725 -1.480 -13.904 1.00 1.00 H new ATOM 0 HD13 ILE A 53 77.883 -0.431 -14.756 1.00 1.00 H new ATOM 790 N GLN A 54 76.126 -2.765 -12.586 1.00 1.00 N ATOM 791 CA GLN A 54 74.781 -3.336 -12.705 1.00 1.00 C ATOM 792 C GLN A 54 74.666 -4.074 -14.052 1.00 1.00 C ATOM 793 O GLN A 54 74.134 -3.546 -15.029 1.00 1.00 O ATOM 794 CB GLN A 54 73.701 -2.223 -12.595 1.00 1.00 C ATOM 795 CG GLN A 54 74.372 -0.845 -12.486 1.00 1.00 C ATOM 796 CD GLN A 54 73.320 0.261 -12.462 1.00 1.00 C ATOM 797 OE1 GLN A 54 73.146 0.974 -13.451 1.00 1.00 O ATOM 798 NE2 GLN A 54 72.600 0.444 -11.388 1.00 1.00 N ATOM 0 H GLN A 54 76.159 -1.748 -12.522 1.00 1.00 H new ATOM 0 HA GLN A 54 74.614 -4.041 -11.891 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.049 -2.251 -13.468 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.073 -2.400 -11.722 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.977 -0.799 -11.581 1.00 1.00 H new ATOM 0 HG3 GLN A 54 75.047 -0.695 -13.329 1.00 1.00 H new ATOM 0 HE21 GLN A 54 72.745 -0.147 -10.570 1.00 1.00 H new ATOM 0 HE22 GLN A 54 71.892 1.178 -11.367 1.00 1.00 H new ATOM 807 N ILE A 55 75.147 -5.327 -14.076 1.00 1.00 N ATOM 808 CA ILE A 55 75.073 -6.171 -15.275 1.00 1.00 C ATOM 809 C ILE A 55 74.961 -7.649 -14.888 1.00 1.00 C ATOM 810 O ILE A 55 75.338 -8.027 -13.775 1.00 1.00 O ATOM 811 CB ILE A 55 76.307 -5.968 -16.160 1.00 1.00 C ATOM 812 CG1 ILE A 55 76.109 -6.721 -17.478 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.551 -6.510 -15.452 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.167 -6.268 -18.485 1.00 1.00 C ATOM 0 H ILE A 55 75.592 -5.777 -13.276 1.00 1.00 H new ATOM 0 HA ILE A 55 74.184 -5.879 -15.834 1.00 1.00 H new ATOM 0 HB ILE A 55 76.440 -4.904 -16.355 1.00 1.00 H new ATOM 0 HG12 ILE A 55 76.186 -7.795 -17.311 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.111 -6.531 -17.872 1.00 1.00 H new ATOM 0 HG21 ILE A 55 78.424 -6.362 -16.087 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.693 -5.980 -14.510 1.00 1.00 H new ATOM 0 HG23 ILE A 55 77.422 -7.574 -15.254 1.00 1.00 H new ATOM 0 HD11 ILE A 55 77.028 -6.803 -19.424 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.068 -5.197 -18.660 1.00 1.00 H new ATOM 0 HD13 ILE A 55 78.160 -6.481 -18.090 1.00 1.00 H new ATOM 826 N GLY A 56 74.449 -8.492 -15.791 1.00 1.00 N ATOM 827 CA GLY A 56 74.302 -9.930 -15.508 1.00 1.00 C ATOM 828 C GLY A 56 72.836 -10.305 -15.342 1.00 1.00 C ATOM 829 O GLY A 56 72.492 -11.482 -15.228 1.00 1.00 O ATOM 0 H GLY A 56 74.131 -8.210 -16.718 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.740 -10.511 -16.320 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.851 -10.184 -14.601 1.00 1.00 H new ATOM 833 N ASP A 57 71.985 -9.292 -15.353 1.00 1.00 N ATOM 834 CA ASP A 57 70.551 -9.523 -15.230 1.00 1.00 C ATOM 835 C ASP A 57 70.006 -10.002 -16.576 1.00 1.00 C ATOM 836 O ASP A 57 69.818 -9.215 -17.504 1.00 1.00 O ATOM 837 CB ASP A 57 69.839 -8.243 -14.788 1.00 1.00 C ATOM 838 CG ASP A 57 69.920 -7.190 -15.884 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.018 -6.920 -16.341 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.879 -6.678 -16.260 1.00 1.00 O ATOM 0 H ASP A 57 72.255 -8.313 -15.445 1.00 1.00 H new ATOM 0 HA ASP A 57 70.370 -10.286 -14.473 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.796 -8.460 -14.558 1.00 1.00 H new ATOM 0 HB3 ASP A 57 70.294 -7.862 -13.874 1.00 1.00 H new ATOM 845 N TRP A 58 69.802 -11.316 -16.679 1.00 1.00 N ATOM 846 CA TRP A 58 69.330 -11.936 -17.926 1.00 1.00 C ATOM 847 C TRP A 58 67.793 -11.991 -18.038 1.00 1.00 C ATOM 848 O TRP A 58 67.038 -11.619 -17.139 1.00 1.00 O ATOM 849 CB TRP A 58 69.970 -13.338 -18.148 1.00 1.00 C ATOM 850 CG TRP A 58 71.174 -13.268 -19.054 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.222 -12.682 -20.276 1.00 1.00 C ATOM 852 CD2 TRP A 58 72.503 -13.820 -18.816 1.00 1.00 C ATOM 853 NE1 TRP A 58 72.502 -12.825 -20.791 1.00 1.00 N ATOM 854 CE2 TRP A 58 73.324 -13.523 -19.929 1.00 1.00 C ATOM 855 CE3 TRP A 58 73.069 -14.539 -17.747 1.00 1.00 C ATOM 856 CZ2 TRP A 58 74.661 -13.925 -19.979 1.00 1.00 C ATOM 857 CZ3 TRP A 58 74.412 -14.947 -17.795 1.00 1.00 C ATOM 858 CH2 TRP A 58 75.206 -14.640 -18.908 1.00 1.00 C ATOM 0 H TRP A 58 69.955 -11.975 -15.916 1.00 1.00 H new ATOM 0 HA TRP A 58 69.666 -11.282 -18.730 1.00 1.00 H new ATOM 0 HB2 TRP A 58 70.263 -13.760 -17.187 1.00 1.00 H new ATOM 0 HB3 TRP A 58 69.229 -14.011 -18.579 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.399 -12.185 -20.768 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.799 -12.459 -21.696 1.00 1.00 H new ATOM 0 HE3 TRP A 58 72.466 -14.779 -16.883 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 75.269 -13.685 -20.839 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 74.835 -15.500 -16.970 1.00 1.00 H new ATOM 0 HH2 TRP A 58 76.238 -14.955 -18.939 1.00 1.00 H new ATOM 869 N ARG A 59 67.413 -12.449 -19.211 1.00 1.00 N ATOM 870 CA ARG A 59 65.993 -12.567 -19.585 1.00 1.00 C ATOM 871 C ARG A 59 65.313 -13.827 -19.017 1.00 1.00 C ATOM 872 O ARG A 59 64.311 -13.746 -18.304 1.00 1.00 O ATOM 873 CB ARG A 59 65.835 -12.599 -21.112 1.00 1.00 C ATOM 874 CG ARG A 59 66.839 -11.651 -21.777 1.00 1.00 C ATOM 875 CD ARG A 59 66.379 -11.362 -23.209 1.00 1.00 C ATOM 876 NE ARG A 59 65.946 -12.611 -23.853 1.00 1.00 N ATOM 877 CZ ARG A 59 64.777 -12.718 -24.497 1.00 1.00 C ATOM 878 NH1 ARG A 59 63.992 -11.683 -24.643 1.00 1.00 N ATOM 879 NH2 ARG A 59 64.419 -13.868 -24.999 1.00 1.00 N ATOM 0 H ARG A 59 68.062 -12.752 -19.937 1.00 1.00 H new ATOM 0 HA ARG A 59 65.508 -11.690 -19.155 1.00 1.00 H new ATOM 0 HB2 ARG A 59 65.988 -13.614 -21.478 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.819 -12.311 -21.384 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.912 -10.723 -21.211 1.00 1.00 H new ATOM 0 HG3 ARG A 59 67.832 -12.099 -21.784 1.00 1.00 H new ATOM 0 HD2 ARG A 59 65.559 -10.643 -23.200 1.00 1.00 H new ATOM 0 HD3 ARG A 59 67.192 -10.911 -23.778 1.00 1.00 H new ATOM 0 HE ARG A 59 66.558 -13.425 -23.807 1.00 1.00 H new ATOM 0 HH11 ARG A 59 64.267 -10.777 -24.264 1.00 1.00 H new ATOM 0 HH12 ARG A 59 63.105 -11.781 -25.136 1.00 1.00 H new ATOM 0 HH21 ARG A 59 65.029 -14.680 -24.900 1.00 1.00 H new ATOM 0 HH22 ARG A 59 63.530 -13.955 -25.491 1.00 1.00 H new ATOM 893 N TYR A 60 65.859 -14.966 -19.391 1.00 1.00 N ATOM 894 CA TYR A 60 65.351 -16.294 -19.014 1.00 1.00 C ATOM 895 C TYR A 60 65.928 -16.819 -17.696 1.00 1.00 C ATOM 896 O TYR A 60 65.479 -17.853 -17.160 1.00 1.00 O ATOM 897 CB TYR A 60 65.592 -17.297 -20.163 1.00 1.00 C ATOM 898 CG TYR A 60 66.930 -17.986 -20.001 1.00 1.00 C ATOM 899 CD1 TYR A 60 68.114 -17.246 -20.090 1.00 1.00 C ATOM 900 CD2 TYR A 60 66.983 -19.365 -19.757 1.00 1.00 C ATOM 901 CE1 TYR A 60 69.350 -17.882 -19.936 1.00 1.00 C ATOM 902 CE2 TYR A 60 68.217 -20.002 -19.603 1.00 1.00 C ATOM 903 CZ TYR A 60 69.400 -19.260 -19.691 1.00 1.00 C ATOM 904 OH TYR A 60 70.618 -19.891 -19.538 1.00 1.00 O ATOM 0 H TYR A 60 66.690 -15.008 -19.981 1.00 1.00 H new ATOM 0 HA TYR A 60 64.280 -16.185 -18.843 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.794 -18.040 -20.177 1.00 1.00 H new ATOM 0 HB3 TYR A 60 65.559 -16.776 -21.120 1.00 1.00 H new ATOM 0 HD1 TYR A 60 68.073 -16.183 -20.278 1.00 1.00 H new ATOM 0 HD2 TYR A 60 66.069 -19.936 -19.688 1.00 1.00 H new ATOM 0 HE1 TYR A 60 70.264 -17.311 -20.006 1.00 1.00 H new ATOM 0 HE2 TYR A 60 68.258 -21.065 -19.416 1.00 1.00 H new ATOM 0 HH TYR A 60 70.473 -20.846 -19.373 1.00 1.00 H new ATOM 914 N GLU A 61 66.929 -16.142 -17.182 1.00 1.00 N ATOM 915 CA GLU A 61 67.582 -16.571 -15.969 1.00 1.00 C ATOM 916 C GLU A 61 66.734 -16.372 -14.734 1.00 1.00 C ATOM 917 O GLU A 61 67.102 -16.832 -13.662 1.00 1.00 O ATOM 918 CB GLU A 61 68.897 -15.795 -15.805 1.00 1.00 C ATOM 919 CG GLU A 61 68.656 -14.346 -15.303 1.00 1.00 C ATOM 920 CD GLU A 61 69.959 -13.764 -14.755 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.004 -14.318 -15.054 1.00 1.00 O ATOM 922 OE2 GLU A 61 69.892 -12.773 -14.045 1.00 1.00 O ATOM 0 H GLU A 61 67.310 -15.287 -17.588 1.00 1.00 H new ATOM 0 HA GLU A 61 67.762 -17.642 -16.064 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.543 -16.320 -15.101 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.423 -15.766 -16.759 1.00 1.00 H new ATOM 0 HG2 GLU A 61 68.285 -13.726 -16.119 1.00 1.00 H new ATOM 0 HG3 GLU A 61 67.891 -14.343 -14.527 1.00 1.00 H new ATOM 929 N VAL A 62 65.669 -15.600 -14.827 1.00 1.00 N ATOM 930 CA VAL A 62 64.904 -15.291 -13.619 1.00 1.00 C ATOM 931 C VAL A 62 64.636 -16.585 -12.875 1.00 1.00 C ATOM 932 O VAL A 62 64.987 -16.730 -11.732 1.00 1.00 O ATOM 933 CB VAL A 62 63.583 -14.569 -14.009 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.350 -13.352 -13.105 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.657 -14.090 -15.465 1.00 1.00 C ATOM 0 H VAL A 62 65.317 -15.185 -15.690 1.00 1.00 H new ATOM 0 HA VAL A 62 65.465 -14.622 -12.966 1.00 1.00 H new ATOM 0 HB VAL A 62 62.762 -15.275 -13.889 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.421 -12.858 -13.392 1.00 1.00 H new ATOM 0 HG12 VAL A 62 63.283 -13.677 -12.067 1.00 1.00 H new ATOM 0 HG13 VAL A 62 64.180 -12.654 -13.213 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.728 -13.586 -15.730 1.00 1.00 H new ATOM 0 HG22 VAL A 62 64.491 -13.397 -15.578 1.00 1.00 H new ATOM 0 HG23 VAL A 62 63.805 -14.947 -16.123 1.00 1.00 H new ATOM 945 N ALA A 63 63.983 -17.505 -13.510 1.00 1.00 N ATOM 946 CA ALA A 63 63.676 -18.760 -12.864 1.00 1.00 C ATOM 947 C ALA A 63 64.951 -19.552 -12.580 1.00 1.00 C ATOM 948 O ALA A 63 65.230 -19.902 -11.433 1.00 1.00 O ATOM 949 CB ALA A 63 62.756 -19.584 -13.762 1.00 1.00 C ATOM 0 H ALA A 63 63.650 -17.421 -14.470 1.00 1.00 H new ATOM 0 HA ALA A 63 63.180 -18.549 -11.917 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.524 -20.531 -13.274 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.833 -19.033 -13.941 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.253 -19.777 -14.713 1.00 1.00 H new ATOM 955 N HIS A 64 65.730 -19.821 -13.626 1.00 1.00 N ATOM 956 CA HIS A 64 66.959 -20.592 -13.421 1.00 1.00 C ATOM 957 C HIS A 64 67.802 -19.933 -12.324 1.00 1.00 C ATOM 958 O HIS A 64 68.167 -20.558 -11.335 1.00 1.00 O ATOM 959 CB HIS A 64 67.738 -20.702 -14.735 1.00 1.00 C ATOM 960 CG HIS A 64 66.936 -21.518 -15.720 1.00 1.00 C ATOM 961 ND1 HIS A 64 67.228 -22.847 -15.992 1.00 1.00 N ATOM 962 CD2 HIS A 64 65.838 -21.213 -16.489 1.00 1.00 C ATOM 963 CE1 HIS A 64 66.325 -23.287 -16.890 1.00 1.00 C ATOM 964 NE2 HIS A 64 65.456 -22.331 -17.227 1.00 1.00 N ATOM 0 H HIS A 64 65.546 -19.532 -14.587 1.00 1.00 H new ATOM 0 HA HIS A 64 66.708 -21.602 -13.099 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.933 -19.709 -15.140 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.706 -21.170 -14.560 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.346 -20.252 -16.517 1.00 1.00 H new ATOM 0 HE1 HIS A 64 66.306 -24.291 -17.289 1.00 1.00 H new ATOM 0 HE2 HIS A 64 64.679 -22.404 -17.884 1.00 1.00 H new ATOM 972 N ASP A 65 68.127 -18.675 -12.508 1.00 1.00 N ATOM 973 CA ASP A 65 68.928 -17.961 -11.518 1.00 1.00 C ATOM 974 C ASP A 65 68.084 -17.538 -10.302 1.00 1.00 C ATOM 975 O ASP A 65 68.418 -17.859 -9.147 1.00 1.00 O ATOM 976 CB ASP A 65 69.566 -16.741 -12.162 1.00 1.00 C ATOM 977 CG ASP A 65 70.684 -16.204 -11.289 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.436 -15.951 -10.122 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.775 -16.061 -11.809 1.00 1.00 O ATOM 0 H ASP A 65 67.857 -18.122 -13.322 1.00 1.00 H new ATOM 0 HA ASP A 65 69.705 -18.636 -11.160 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.958 -17.004 -13.144 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.813 -15.968 -12.316 1.00 1.00 H new ATOM 984 N GLY A 66 66.947 -16.886 -10.521 1.00 1.00 N ATOM 985 CA GLY A 66 66.086 -16.498 -9.410 1.00 1.00 C ATOM 986 C GLY A 66 65.400 -17.723 -8.816 1.00 1.00 C ATOM 987 O GLY A 66 64.352 -17.624 -8.181 1.00 1.00 O ATOM 0 H GLY A 66 66.604 -16.618 -11.443 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.676 -15.996 -8.643 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.337 -15.785 -9.754 1.00 1.00 H new ATOM 991 N ARG A 67 66.059 -18.860 -8.971 1.00 1.00 N ATOM 992 CA ARG A 67 65.616 -20.118 -8.408 1.00 1.00 C ATOM 993 C ARG A 67 65.908 -20.071 -6.923 1.00 1.00 C ATOM 994 O ARG A 67 65.753 -21.070 -6.219 1.00 1.00 O ATOM 995 CB ARG A 67 66.332 -21.305 -9.066 1.00 1.00 C ATOM 996 CG ARG A 67 65.383 -22.516 -9.189 1.00 1.00 C ATOM 997 CD ARG A 67 64.546 -22.392 -10.465 1.00 1.00 C ATOM 998 NE ARG A 67 63.710 -23.575 -10.643 1.00 1.00 N ATOM 999 CZ ARG A 67 62.506 -23.658 -10.093 1.00 1.00 C ATOM 1000 NH1 ARG A 67 62.062 -22.682 -9.351 1.00 1.00 N ATOM 1001 NH2 ARG A 67 61.771 -24.714 -10.295 1.00 1.00 N ATOM 0 H ARG A 67 66.928 -18.932 -9.499 1.00 1.00 H new ATOM 0 HA ARG A 67 64.550 -20.258 -8.588 1.00 1.00 H new ATOM 0 HB2 ARG A 67 66.691 -21.017 -10.054 1.00 1.00 H new ATOM 0 HB3 ARG A 67 67.206 -21.581 -8.477 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.960 -23.441 -9.210 1.00 1.00 H new ATOM 0 HG3 ARG A 67 64.730 -22.567 -8.318 1.00 1.00 H new ATOM 0 HD2 ARG A 67 63.920 -21.501 -10.412 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.202 -22.269 -11.327 1.00 1.00 H new ATOM 0 HE ARG A 67 64.059 -24.354 -11.202 1.00 1.00 H new ATOM 0 HH11 ARG A 67 62.640 -21.857 -9.194 1.00 1.00 H new ATOM 0 HH12 ARG A 67 61.136 -22.744 -8.927 1.00 1.00 H new ATOM 0 HH21 ARG A 67 62.122 -25.476 -10.876 1.00 1.00 H new ATOM 0 HH22 ARG A 67 60.845 -24.779 -9.873 1.00 1.00 H new ATOM 1015 N LEU A 68 66.396 -18.894 -6.482 1.00 1.00 N ATOM 1016 CA LEU A 68 66.784 -18.689 -5.074 1.00 1.00 C ATOM 1017 C LEU A 68 65.858 -19.509 -4.183 1.00 1.00 C ATOM 1018 O LEU A 68 66.221 -19.901 -3.082 1.00 1.00 O ATOM 1019 CB LEU A 68 66.628 -17.210 -4.641 1.00 1.00 C ATOM 1020 CG LEU A 68 67.133 -16.269 -5.719 1.00 1.00 C ATOM 1021 CD1 LEU A 68 67.069 -14.824 -5.214 1.00 1.00 C ATOM 1022 CD2 LEU A 68 68.572 -16.623 -6.084 1.00 1.00 C ATOM 0 H LEU A 68 66.530 -18.076 -7.077 1.00 1.00 H new ATOM 0 HA LEU A 68 67.828 -18.988 -4.977 1.00 1.00 H new ATOM 0 HB2 LEU A 68 65.580 -16.998 -4.431 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.179 -17.038 -3.717 1.00 1.00 H new ATOM 0 HG LEU A 68 66.505 -16.370 -6.604 1.00 1.00 H new ATOM 0 HD11 LEU A 68 67.432 -14.151 -5.990 1.00 1.00 H new ATOM 0 HD12 LEU A 68 66.038 -14.570 -4.967 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.691 -14.721 -4.325 1.00 1.00 H new ATOM 0 HD21 LEU A 68 68.929 -15.944 -6.858 1.00 1.00 H new ATOM 0 HD22 LEU A 68 69.205 -16.531 -5.201 1.00 1.00 H new ATOM 0 HD23 LEU A 68 68.612 -17.648 -6.454 1.00 1.00 H new ATOM 1034 N LEU A 69 64.646 -19.727 -4.669 1.00 1.00 N ATOM 1035 CA LEU A 69 63.682 -20.490 -3.874 1.00 1.00 C ATOM 1036 C LEU A 69 64.163 -21.951 -3.715 1.00 1.00 C ATOM 1037 O LEU A 69 64.477 -22.376 -2.603 1.00 1.00 O ATOM 1038 CB LEU A 69 62.311 -20.459 -4.585 1.00 1.00 C ATOM 1039 CG LEU A 69 61.155 -20.589 -3.579 1.00 1.00 C ATOM 1040 CD1 LEU A 69 59.841 -20.245 -4.283 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.073 -22.021 -3.046 1.00 1.00 C ATOM 0 H LEU A 69 64.309 -19.403 -5.576 1.00 1.00 H new ATOM 0 HA LEU A 69 63.592 -20.046 -2.883 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.209 -19.527 -5.141 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.257 -21.271 -5.311 1.00 1.00 H new ATOM 0 HG LEU A 69 61.330 -19.908 -2.746 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.016 -20.335 -3.577 1.00 1.00 H new ATOM 0 HD12 LEU A 69 59.887 -19.223 -4.660 1.00 1.00 H new ATOM 0 HD13 LEU A 69 59.683 -20.932 -5.115 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.250 -22.098 -2.335 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.902 -22.708 -3.875 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.008 -22.278 -2.548 1.00 1.00 H new ATOM 1053 N ALA A 70 64.221 -22.718 -4.817 1.00 1.00 N ATOM 1054 CA ALA A 70 64.674 -24.116 -4.686 1.00 1.00 C ATOM 1055 C ALA A 70 66.192 -24.123 -4.592 1.00 1.00 C ATOM 1056 O ALA A 70 66.745 -24.251 -3.506 1.00 1.00 O ATOM 1057 CB ALA A 70 64.223 -24.941 -5.900 1.00 1.00 C ATOM 0 H ALA A 70 63.975 -22.418 -5.760 1.00 1.00 H new ATOM 0 HA ALA A 70 64.239 -24.560 -3.791 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.565 -25.970 -5.788 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.135 -24.925 -5.967 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.648 -24.514 -6.808 1.00 1.00 H new ATOM 1063 N ALA A 71 66.845 -23.971 -5.740 1.00 1.00 N ATOM 1064 CA ALA A 71 68.298 -23.932 -5.895 1.00 1.00 C ATOM 1065 C ALA A 71 68.974 -22.952 -4.939 1.00 1.00 C ATOM 1066 O ALA A 71 70.152 -22.646 -5.111 1.00 1.00 O ATOM 1067 CB ALA A 71 68.658 -23.659 -7.363 1.00 1.00 C ATOM 0 H ALA A 71 66.355 -23.867 -6.628 1.00 1.00 H new ATOM 0 HA ALA A 71 68.689 -24.911 -5.619 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.742 -23.631 -7.473 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.250 -24.451 -7.991 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.238 -22.701 -7.669 1.00 1.00 H new ATOM 1073 N HIS A 72 68.219 -22.421 -3.981 1.00 1.00 N ATOM 1074 CA HIS A 72 68.723 -21.428 -3.040 1.00 1.00 C ATOM 1075 C HIS A 72 70.237 -21.475 -2.848 1.00 1.00 C ATOM 1076 O HIS A 72 70.910 -20.477 -3.103 1.00 1.00 O ATOM 1077 CB HIS A 72 68.046 -21.665 -1.678 1.00 1.00 C ATOM 1078 CG HIS A 72 68.424 -23.021 -1.120 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.483 -23.260 0.244 1.00 1.00 N ATOM 1080 CD2 HIS A 72 68.753 -24.221 -1.717 1.00 1.00 C ATOM 1081 CE1 HIS A 72 68.831 -24.551 0.418 1.00 1.00 C ATOM 1082 NE2 HIS A 72 69.006 -25.178 -0.747 1.00 1.00 N ATOM 0 H HIS A 72 67.240 -22.668 -3.836 1.00 1.00 H new ATOM 0 HA HIS A 72 68.489 -20.447 -3.454 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.342 -20.883 -0.978 1.00 1.00 H new ATOM 0 HB3 HIS A 72 66.964 -21.601 -1.788 1.00 1.00 H new ATOM 0 HD2 HIS A 72 68.806 -24.389 -2.782 1.00 1.00 H new ATOM 0 HE1 HIS A 72 68.953 -25.021 1.383 1.00 1.00 H new ATOM 0 HE2 HIS A 72 69.269 -26.153 -0.892 1.00 1.00 H new ATOM 1090 N MET A 73 70.786 -22.594 -2.417 1.00 1.00 N ATOM 1091 CA MET A 73 72.218 -22.665 -2.242 1.00 1.00 C ATOM 1092 C MET A 73 72.891 -22.622 -3.608 1.00 1.00 C ATOM 1093 O MET A 73 73.899 -21.936 -3.781 1.00 1.00 O ATOM 1094 CB MET A 73 72.576 -23.931 -1.467 1.00 1.00 C ATOM 1095 CG MET A 73 72.176 -23.728 0.001 1.00 1.00 C ATOM 1096 SD MET A 73 72.375 -25.273 0.923 1.00 1.00 S ATOM 1097 CE MET A 73 74.183 -25.320 0.923 1.00 1.00 C ATOM 0 H MET A 73 70.275 -23.446 -2.187 1.00 1.00 H new ATOM 0 HA MET A 73 72.575 -21.813 -1.664 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.056 -24.792 -1.886 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.644 -24.134 -1.545 1.00 1.00 H new ATOM 0 HG2 MET A 73 72.791 -22.947 0.448 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.141 -23.391 0.060 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.530 -25.991 1.709 1.00 1.00 H new ATOM 0 HE2 MET A 73 74.538 -25.679 -0.043 1.00 1.00 H new ATOM 0 HE3 MET A 73 74.573 -24.318 1.103 1.00 1.00 H new ATOM 1107 N VAL A 74 72.383 -23.408 -4.565 1.00 1.00 N ATOM 1108 CA VAL A 74 73.016 -23.487 -5.880 1.00 1.00 C ATOM 1109 C VAL A 74 73.382 -22.112 -6.410 1.00 1.00 C ATOM 1110 O VAL A 74 74.486 -21.978 -6.936 1.00 1.00 O ATOM 1111 CB VAL A 74 72.103 -24.172 -6.878 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.846 -24.353 -8.207 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.679 -25.540 -6.340 1.00 1.00 C ATOM 0 H VAL A 74 71.551 -23.987 -4.454 1.00 1.00 H new ATOM 0 HA VAL A 74 73.928 -24.070 -5.756 1.00 1.00 H new ATOM 0 HB VAL A 74 71.216 -23.558 -7.035 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.191 -24.845 -8.926 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.142 -23.378 -8.594 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.734 -24.964 -8.047 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.023 -26.027 -7.061 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.563 -26.157 -6.178 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.149 -25.411 -5.396 1.00 1.00 H new ATOM 1123 N ASN A 75 72.514 -21.067 -6.311 1.00 1.00 N ATOM 1124 CA ASN A 75 72.863 -19.721 -6.801 1.00 1.00 C ATOM 1125 C ASN A 75 74.321 -19.374 -6.491 1.00 1.00 C ATOM 1126 O ASN A 75 74.862 -18.412 -7.005 1.00 1.00 O ATOM 1127 CB ASN A 75 71.905 -18.671 -6.184 1.00 1.00 C ATOM 1128 CG ASN A 75 72.487 -18.052 -4.907 1.00 1.00 C ATOM 1129 OD1 ASN A 75 73.469 -17.313 -4.968 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.938 -18.313 -3.752 1.00 1.00 N ATOM 0 H ASN A 75 71.583 -21.138 -5.901 1.00 1.00 H new ATOM 0 HA ASN A 75 72.750 -19.711 -7.885 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.709 -17.885 -6.913 1.00 1.00 H new ATOM 0 HB3 ASN A 75 70.948 -19.141 -5.957 1.00 1.00 H new ATOM 0 HD21 ASN A 75 72.323 -17.904 -2.900 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.124 -18.926 -3.701 1.00 1.00 H new ATOM 1137 N GLY A 76 74.931 -20.201 -5.664 1.00 1.00 N ATOM 1138 CA GLY A 76 76.333 -20.017 -5.315 1.00 1.00 C ATOM 1139 C GLY A 76 77.080 -19.646 -6.605 1.00 1.00 C ATOM 1140 O GLY A 76 78.065 -18.925 -6.576 1.00 1.00 O ATOM 0 H GLY A 76 74.484 -21.004 -5.221 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.443 -19.231 -4.568 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.744 -20.929 -4.882 1.00 1.00 H new ATOM 1144 N ILE A 77 76.531 -20.108 -7.740 1.00 1.00 N ATOM 1145 CA ILE A 77 77.101 -19.766 -9.042 1.00 1.00 C ATOM 1146 C ILE A 77 76.870 -18.270 -9.302 1.00 1.00 C ATOM 1147 O ILE A 77 77.764 -17.569 -9.725 1.00 1.00 O ATOM 1148 CB ILE A 77 76.518 -20.628 -10.182 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.001 -20.786 -10.037 1.00 1.00 C ATOM 1150 CG2 ILE A 77 77.170 -22.014 -10.166 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.446 -21.517 -11.266 1.00 1.00 C ATOM 0 H ILE A 77 75.707 -20.709 -7.778 1.00 1.00 H new ATOM 0 HA ILE A 77 78.170 -19.978 -9.022 1.00 1.00 H new ATOM 0 HB ILE A 77 76.727 -20.125 -11.126 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.767 -21.345 -9.131 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.530 -19.808 -9.938 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.756 -22.620 -10.972 1.00 1.00 H new ATOM 0 HG22 ILE A 77 78.246 -21.911 -10.305 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.972 -22.498 -9.210 1.00 1.00 H new ATOM 0 HD11 ILE A 77 73.367 -21.631 -11.165 1.00 1.00 H new ATOM 0 HD12 ILE A 77 74.668 -20.940 -12.164 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.909 -22.501 -11.344 1.00 1.00 H new ATOM 1163 N VAL A 78 75.627 -17.839 -9.110 1.00 1.00 N ATOM 1164 CA VAL A 78 75.249 -16.448 -9.398 1.00 1.00 C ATOM 1165 C VAL A 78 76.462 -15.533 -9.118 1.00 1.00 C ATOM 1166 O VAL A 78 76.733 -14.604 -9.879 1.00 1.00 O ATOM 1167 CB VAL A 78 74.032 -15.984 -8.553 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.465 -15.518 -7.146 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.355 -14.803 -9.261 1.00 1.00 C ATOM 0 H VAL A 78 74.867 -18.422 -8.760 1.00 1.00 H new ATOM 0 HA VAL A 78 74.955 -16.385 -10.446 1.00 1.00 H new ATOM 0 HB VAL A 78 73.351 -16.829 -8.450 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.588 -15.200 -6.582 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.953 -16.341 -6.624 1.00 1.00 H new ATOM 0 HG13 VAL A 78 75.160 -14.683 -7.237 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.499 -14.470 -8.675 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.066 -13.983 -9.362 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.019 -15.116 -10.249 1.00 1.00 H new ATOM 1179 N ILE A 79 77.211 -15.832 -8.041 1.00 1.00 N ATOM 1180 CA ILE A 79 78.414 -15.053 -7.705 1.00 1.00 C ATOM 1181 C ILE A 79 79.685 -15.759 -8.223 1.00 1.00 C ATOM 1182 O ILE A 79 80.697 -15.117 -8.517 1.00 1.00 O ATOM 1183 CB ILE A 79 78.484 -14.790 -6.176 1.00 1.00 C ATOM 1184 CG1 ILE A 79 78.449 -16.117 -5.380 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.269 -13.931 -5.740 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.840 -16.765 -5.271 1.00 1.00 C ATOM 0 H ILE A 79 77.008 -16.597 -7.397 1.00 1.00 H new ATOM 0 HA ILE A 79 78.353 -14.085 -8.203 1.00 1.00 H new ATOM 0 HB ILE A 79 79.419 -14.271 -5.968 1.00 1.00 H new ATOM 0 HG12 ILE A 79 78.058 -15.929 -4.380 1.00 1.00 H new ATOM 0 HG13 ILE A 79 77.763 -16.812 -5.865 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.320 -13.747 -4.667 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.286 -12.980 -6.272 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.346 -14.461 -5.974 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.766 -17.693 -4.704 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.221 -16.979 -6.270 1.00 1.00 H new ATOM 0 HD13 ILE A 79 80.520 -16.083 -4.762 1.00 1.00 H new ATOM 1198 N ALA A 80 79.586 -17.086 -8.388 1.00 1.00 N ATOM 1199 CA ALA A 80 80.681 -17.917 -8.923 1.00 1.00 C ATOM 1200 C ALA A 80 80.689 -18.002 -10.472 1.00 1.00 C ATOM 1201 O ALA A 80 81.660 -18.497 -11.049 1.00 1.00 O ATOM 1202 CB ALA A 80 80.684 -19.342 -8.317 1.00 1.00 C ATOM 0 H ALA A 80 78.746 -17.616 -8.155 1.00 1.00 H new ATOM 0 HA ALA A 80 81.594 -17.406 -8.619 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.508 -19.916 -8.741 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.806 -19.277 -7.236 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.741 -19.837 -8.547 1.00 1.00 H new ATOM 1208 N GLU A 81 79.631 -17.524 -11.157 1.00 1.00 N ATOM 1209 CA GLU A 81 79.576 -17.577 -12.600 1.00 1.00 C ATOM 1210 C GLU A 81 80.233 -16.342 -13.174 1.00 1.00 C ATOM 1211 O GLU A 81 81.332 -16.442 -13.720 1.00 1.00 O ATOM 1212 CB GLU A 81 78.111 -17.655 -13.026 1.00 1.00 C ATOM 1213 CG GLU A 81 77.999 -17.661 -14.552 1.00 1.00 C ATOM 1214 CD GLU A 81 76.537 -17.825 -14.954 1.00 1.00 C ATOM 1215 OE1 GLU A 81 75.688 -17.701 -14.086 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.290 -18.072 -16.121 1.00 1.00 O ATOM 0 H GLU A 81 78.813 -17.101 -10.719 1.00 1.00 H new ATOM 0 HA GLU A 81 80.107 -18.453 -12.971 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.655 -18.557 -12.618 1.00 1.00 H new ATOM 0 HB3 GLU A 81 77.561 -16.807 -12.618 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.397 -16.732 -14.960 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.595 -18.473 -14.968 1.00 1.00 H new ATOM 1223 N ASP A 82 79.614 -15.159 -13.055 1.00 1.00 N ATOM 1224 CA ASP A 82 80.225 -13.958 -13.575 1.00 1.00 C ATOM 1225 C ASP A 82 81.425 -13.579 -12.743 1.00 1.00 C ATOM 1226 O ASP A 82 82.196 -12.721 -13.175 1.00 1.00 O ATOM 1227 CB ASP A 82 79.209 -12.799 -13.609 1.00 1.00 C ATOM 1228 CG ASP A 82 78.452 -12.795 -14.937 1.00 1.00 C ATOM 1229 OD1 ASP A 82 77.925 -13.833 -15.301 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.423 -11.756 -15.574 1.00 1.00 O ATOM 0 H ASP A 82 78.707 -15.023 -12.609 1.00 1.00 H new ATOM 0 HA ASP A 82 80.554 -14.155 -14.595 1.00 1.00 H new ATOM 0 HB2 ASP A 82 78.506 -12.899 -12.782 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.726 -11.849 -13.475 1.00 1.00 H new ATOM 1235 N ALA A 83 81.592 -14.226 -11.561 1.00 1.00 N ATOM 1236 CA ALA A 83 82.748 -13.967 -10.695 1.00 1.00 C ATOM 1237 C ALA A 83 83.881 -13.302 -11.452 1.00 1.00 C ATOM 1238 O ALA A 83 84.541 -12.459 -10.916 1.00 1.00 O ATOM 1239 CB ALA A 83 83.252 -15.284 -10.109 1.00 1.00 C ATOM 0 H ALA A 83 80.942 -14.923 -11.197 1.00 1.00 H new ATOM 0 HA ALA A 83 82.423 -13.293 -9.903 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.111 -15.091 -9.466 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.458 -15.750 -9.525 1.00 1.00 H new ATOM 0 HB3 ALA A 83 83.547 -15.953 -10.918 1.00 1.00 H new ATOM 1245 N LEU A 84 84.178 -13.762 -12.662 1.00 1.00 N ATOM 1246 CA LEU A 84 85.320 -13.236 -13.428 1.00 1.00 C ATOM 1247 C LEU A 84 85.657 -11.790 -13.034 1.00 1.00 C ATOM 1248 O LEU A 84 86.827 -11.406 -13.029 1.00 1.00 O ATOM 1249 CB LEU A 84 84.943 -13.232 -14.914 1.00 1.00 C ATOM 1250 CG LEU A 84 84.403 -14.603 -15.355 1.00 1.00 C ATOM 1251 CD1 LEU A 84 83.704 -14.461 -16.707 1.00 1.00 C ATOM 1252 CD2 LEU A 84 85.553 -15.607 -15.481 1.00 1.00 C ATOM 0 H LEU A 84 83.652 -14.494 -13.139 1.00 1.00 H new ATOM 0 HA LEU A 84 86.184 -13.868 -13.221 1.00 1.00 H new ATOM 0 HB2 LEU A 84 84.191 -12.465 -15.099 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.816 -12.973 -15.513 1.00 1.00 H new ATOM 0 HG LEU A 84 83.695 -14.964 -14.609 1.00 1.00 H new ATOM 0 HD11 LEU A 84 83.320 -15.431 -17.022 1.00 1.00 H new ATOM 0 HD12 LEU A 84 82.878 -13.756 -16.617 1.00 1.00 H new ATOM 0 HD13 LEU A 84 84.415 -14.094 -17.447 1.00 1.00 H new ATOM 0 HD21 LEU A 84 85.159 -16.574 -15.794 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.268 -15.250 -16.222 1.00 1.00 H new ATOM 0 HD23 LEU A 84 86.051 -15.713 -14.517 1.00 1.00 H new ATOM 1264 N ILE A 85 84.648 -11.020 -12.623 1.00 1.00 N ATOM 1265 CA ILE A 85 84.885 -9.661 -12.133 1.00 1.00 C ATOM 1266 C ILE A 85 84.912 -9.666 -10.582 1.00 1.00 C ATOM 1267 O ILE A 85 85.640 -8.885 -9.981 1.00 1.00 O ATOM 1268 CB ILE A 85 83.810 -8.686 -12.712 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.510 -7.583 -13.527 1.00 1.00 C ATOM 1270 CG2 ILE A 85 82.978 -8.023 -11.603 1.00 1.00 C ATOM 1271 CD1 ILE A 85 83.477 -6.684 -14.205 1.00 1.00 C ATOM 0 H ILE A 85 83.670 -11.309 -12.619 1.00 1.00 H new ATOM 0 HA ILE A 85 85.855 -9.303 -12.476 1.00 1.00 H new ATOM 0 HB ILE A 85 83.139 -9.271 -13.341 1.00 1.00 H new ATOM 0 HG12 ILE A 85 85.146 -6.987 -12.873 1.00 1.00 H new ATOM 0 HG13 ILE A 85 85.158 -8.033 -14.279 1.00 1.00 H new ATOM 0 HG21 ILE A 85 82.243 -7.354 -12.050 1.00 1.00 H new ATOM 0 HG22 ILE A 85 82.464 -8.791 -11.025 1.00 1.00 H new ATOM 0 HG23 ILE A 85 83.635 -7.453 -10.946 1.00 1.00 H new ATOM 0 HD11 ILE A 85 83.988 -5.910 -14.777 1.00 1.00 H new ATOM 0 HD12 ILE A 85 82.859 -7.281 -14.875 1.00 1.00 H new ATOM 0 HD13 ILE A 85 82.846 -6.219 -13.447 1.00 1.00 H new ATOM 1283 N ALA A 86 84.129 -10.585 -9.977 1.00 1.00 N ATOM 1284 CA ALA A 86 84.041 -10.752 -8.503 1.00 1.00 C ATOM 1285 C ALA A 86 85.051 -11.800 -7.958 1.00 1.00 C ATOM 1286 O ALA A 86 85.476 -11.755 -6.802 1.00 1.00 O ATOM 1287 CB ALA A 86 82.600 -11.157 -8.123 1.00 1.00 C ATOM 0 H ALA A 86 83.537 -11.235 -10.495 1.00 1.00 H new ATOM 0 HA ALA A 86 84.300 -9.797 -8.045 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.530 -11.281 -7.042 1.00 1.00 H new ATOM 0 HB2 ALA A 86 81.907 -10.380 -8.445 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.345 -12.097 -8.613 1.00 1.00 H new ATOM 1293 N GLU A 87 85.381 -12.728 -8.826 1.00 1.00 N ATOM 1294 CA GLU A 87 86.300 -13.820 -8.500 1.00 1.00 C ATOM 1295 C GLU A 87 87.549 -13.263 -7.799 1.00 1.00 C ATOM 1296 O GLU A 87 88.189 -13.961 -7.009 1.00 1.00 O ATOM 1297 CB GLU A 87 86.697 -14.631 -9.767 1.00 1.00 C ATOM 1298 CG GLU A 87 88.027 -14.135 -10.361 1.00 1.00 C ATOM 1299 CD GLU A 87 88.261 -14.762 -11.731 1.00 1.00 C ATOM 1300 OE1 GLU A 87 88.275 -15.980 -11.808 1.00 1.00 O ATOM 1301 OE2 GLU A 87 88.436 -14.017 -12.679 1.00 1.00 O ATOM 0 H GLU A 87 85.025 -12.757 -9.782 1.00 1.00 H new ATOM 0 HA GLU A 87 85.787 -14.504 -7.823 1.00 1.00 H new ATOM 0 HB2 GLU A 87 86.783 -15.687 -9.512 1.00 1.00 H new ATOM 0 HB3 GLU A 87 85.909 -14.547 -10.516 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.011 -13.049 -10.449 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.849 -14.389 -9.692 1.00 1.00 H new ATOM 1308 N ALA A 88 87.893 -12.008 -8.114 1.00 1.00 N ATOM 1309 CA ALA A 88 89.083 -11.362 -7.529 1.00 1.00 C ATOM 1310 C ALA A 88 88.816 -9.888 -7.225 1.00 1.00 C ATOM 1311 O ALA A 88 89.730 -9.071 -7.149 1.00 1.00 O ATOM 1312 CB ALA A 88 90.270 -11.488 -8.486 1.00 1.00 C ATOM 0 H ALA A 88 87.372 -11.421 -8.765 1.00 1.00 H new ATOM 0 HA ALA A 88 89.317 -11.867 -6.592 1.00 1.00 H new ATOM 0 HB1 ALA A 88 91.144 -11.008 -8.046 1.00 1.00 H new ATOM 0 HB2 ALA A 88 90.485 -12.542 -8.663 1.00 1.00 H new ATOM 0 HB3 ALA A 88 90.028 -11.004 -9.432 1.00 1.00 H new ATOM 1318 N VAL A 89 87.552 -9.583 -7.030 1.00 1.00 N ATOM 1319 CA VAL A 89 87.159 -8.217 -6.697 1.00 1.00 C ATOM 1320 C VAL A 89 87.499 -7.932 -5.255 1.00 1.00 C ATOM 1321 O VAL A 89 86.780 -7.204 -4.594 1.00 1.00 O ATOM 1322 CB VAL A 89 85.676 -7.896 -6.963 1.00 1.00 C ATOM 1323 CG1 VAL A 89 84.760 -8.495 -5.873 1.00 1.00 C ATOM 1324 CG2 VAL A 89 85.482 -6.354 -7.048 1.00 1.00 C ATOM 0 H VAL A 89 86.781 -10.248 -7.093 1.00 1.00 H new ATOM 0 HA VAL A 89 87.723 -7.568 -7.366 1.00 1.00 H new ATOM 0 HB VAL A 89 85.394 -8.351 -7.912 1.00 1.00 H new ATOM 0 HG11 VAL A 89 83.722 -8.248 -6.094 1.00 1.00 H new ATOM 0 HG12 VAL A 89 84.879 -9.578 -5.853 1.00 1.00 H new ATOM 0 HG13 VAL A 89 85.032 -8.082 -4.902 1.00 1.00 H new ATOM 0 HG21 VAL A 89 84.432 -6.129 -7.236 1.00 1.00 H new ATOM 0 HG22 VAL A 89 85.788 -5.896 -6.107 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.090 -5.955 -7.860 1.00 1.00 H new ATOM 1334 N GLY A 90 88.609 -8.447 -4.729 1.00 1.00 N ATOM 1335 CA GLY A 90 88.939 -8.146 -3.361 1.00 1.00 C ATOM 1336 C GLY A 90 89.274 -6.672 -3.189 1.00 1.00 C ATOM 1337 O GLY A 90 88.867 -6.080 -2.207 1.00 1.00 O ATOM 0 H GLY A 90 89.267 -9.053 -5.219 1.00 1.00 H new ATOM 0 HA2 GLY A 90 88.101 -8.409 -2.715 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.787 -8.754 -3.046 1.00 1.00 H new ATOM 1341 N PRO A 91 89.982 -6.048 -4.108 1.00 1.00 N ATOM 1342 CA PRO A 91 90.324 -4.604 -3.974 1.00 1.00 C ATOM 1343 C PRO A 91 89.106 -3.822 -3.505 1.00 1.00 C ATOM 1344 O PRO A 91 89.217 -2.715 -2.974 1.00 1.00 O ATOM 1345 CB PRO A 91 90.768 -4.215 -5.386 1.00 1.00 C ATOM 1346 CG PRO A 91 91.362 -5.471 -5.937 1.00 1.00 C ATOM 1347 CD PRO A 91 90.531 -6.621 -5.352 1.00 1.00 C ATOM 0 HA PRO A 91 91.099 -4.394 -3.237 1.00 1.00 H new ATOM 0 HB2 PRO A 91 89.927 -3.873 -5.989 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.496 -3.404 -5.366 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.324 -5.476 -7.026 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.411 -5.564 -5.655 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.740 -6.933 -6.034 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.145 -7.500 -5.153 1.00 1.00 H new ATOM 1355 N HIS A 92 87.945 -4.429 -3.709 1.00 1.00 N ATOM 1356 CA HIS A 92 86.688 -3.810 -3.307 1.00 1.00 C ATOM 1357 C HIS A 92 86.694 -3.585 -1.801 1.00 1.00 C ATOM 1358 O HIS A 92 86.038 -2.686 -1.307 1.00 1.00 O ATOM 1359 CB HIS A 92 85.497 -4.709 -3.681 1.00 1.00 C ATOM 1360 CG HIS A 92 85.298 -5.791 -2.642 1.00 1.00 C ATOM 1361 ND1 HIS A 92 86.285 -6.710 -2.327 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.232 -6.096 -1.835 1.00 1.00 C ATOM 1363 CE1 HIS A 92 85.797 -7.520 -1.370 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.547 -7.188 -1.033 1.00 1.00 N ATOM 0 H HIS A 92 87.846 -5.344 -4.148 1.00 1.00 H new ATOM 0 HA HIS A 92 86.586 -2.857 -3.827 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.592 -4.107 -3.764 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.669 -5.162 -4.657 1.00 1.00 H new ATOM 0 HD2 HIS A 92 83.290 -5.568 -1.824 1.00 1.00 H new ATOM 0 HE1 HIS A 92 86.347 -8.338 -0.929 1.00 1.00 H new ATOM 0 HE2 HIS A 92 83.952 -7.638 -0.338 1.00 1.00 H new ATOM 1372 N LEU A 93 87.464 -4.388 -1.082 1.00 1.00 N ATOM 1373 CA LEU A 93 87.555 -4.221 0.359 1.00 1.00 C ATOM 1374 C LEU A 93 88.168 -2.856 0.646 1.00 1.00 C ATOM 1375 O LEU A 93 87.553 -2.008 1.290 1.00 1.00 O ATOM 1376 CB LEU A 93 88.396 -5.354 0.988 1.00 1.00 C ATOM 1377 CG LEU A 93 89.819 -5.423 0.347 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.869 -4.742 1.250 1.00 1.00 C ATOM 1379 CD2 LEU A 93 90.233 -6.890 0.109 1.00 1.00 C ATOM 0 H LEU A 93 88.025 -5.149 -1.465 1.00 1.00 H new ATOM 0 HA LEU A 93 86.561 -4.275 0.804 1.00 1.00 H new ATOM 0 HB2 LEU A 93 88.485 -5.191 2.062 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.886 -6.308 0.852 1.00 1.00 H new ATOM 0 HG LEU A 93 89.776 -4.896 -0.606 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.850 -4.805 0.779 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.602 -3.695 1.393 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.898 -5.244 2.217 1.00 1.00 H new ATOM 0 HD21 LEU A 93 91.227 -6.920 -0.338 1.00 1.00 H new ATOM 0 HD22 LEU A 93 90.247 -7.423 1.060 1.00 1.00 H new ATOM 0 HD23 LEU A 93 89.519 -7.365 -0.563 1.00 1.00 H new ATOM 1391 N ALA A 94 89.376 -2.645 0.134 1.00 1.00 N ATOM 1392 CA ALA A 94 90.062 -1.379 0.318 1.00 1.00 C ATOM 1393 C ALA A 94 89.183 -0.253 -0.199 1.00 1.00 C ATOM 1394 O ALA A 94 88.864 0.685 0.530 1.00 1.00 O ATOM 1395 CB ALA A 94 91.391 -1.387 -0.440 1.00 1.00 C ATOM 0 H ALA A 94 89.896 -3.334 -0.409 1.00 1.00 H new ATOM 0 HA ALA A 94 90.263 -1.229 1.379 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.898 -0.433 -0.296 1.00 1.00 H new ATOM 0 HB2 ALA A 94 92.020 -2.193 -0.063 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.203 -1.541 -1.503 1.00 1.00 H new ATOM 1401 N ARG A 95 88.785 -0.357 -1.462 1.00 1.00 N ATOM 1402 CA ARG A 95 87.936 0.669 -2.034 1.00 1.00 C ATOM 1403 C ARG A 95 86.655 0.758 -1.217 1.00 1.00 C ATOM 1404 O ARG A 95 86.331 1.784 -0.602 1.00 1.00 O ATOM 1405 CB ARG A 95 87.631 0.337 -3.500 1.00 1.00 C ATOM 1406 CG ARG A 95 86.603 1.319 -4.078 1.00 1.00 C ATOM 1407 CD ARG A 95 86.420 1.025 -5.572 1.00 1.00 C ATOM 1408 NE ARG A 95 86.085 -0.394 -5.774 1.00 1.00 N ATOM 1409 CZ ARG A 95 84.991 -0.800 -6.434 1.00 1.00 C ATOM 1410 NH1 ARG A 95 84.167 0.059 -6.976 1.00 1.00 N ATOM 1411 NH2 ARG A 95 84.753 -2.078 -6.556 1.00 1.00 N ATOM 0 H ARG A 95 89.031 -1.121 -2.091 1.00 1.00 H new ATOM 0 HA ARG A 95 88.443 1.634 -2.007 1.00 1.00 H new ATOM 0 HB2 ARG A 95 88.549 0.378 -4.086 1.00 1.00 H new ATOM 0 HB3 ARG A 95 87.250 -0.682 -3.575 1.00 1.00 H new ATOM 0 HG2 ARG A 95 85.652 1.220 -3.555 1.00 1.00 H new ATOM 0 HG3 ARG A 95 86.940 2.346 -3.934 1.00 1.00 H new ATOM 0 HD2 ARG A 95 85.629 1.654 -5.980 1.00 1.00 H new ATOM 0 HD3 ARG A 95 87.334 1.271 -6.113 1.00 1.00 H new ATOM 0 HE ARG A 95 86.714 -1.101 -5.394 1.00 1.00 H new ATOM 0 HH11 ARG A 95 84.351 1.059 -6.901 1.00 1.00 H new ATOM 0 HH12 ARG A 95 83.340 -0.272 -7.474 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.397 -2.758 -6.151 1.00 1.00 H new ATOM 0 HH22 ARG A 95 83.923 -2.397 -7.056 1.00 1.00 H new ATOM 1425 N ALA A 96 85.879 -0.289 -1.137 1.00 1.00 N ATOM 1426 CA ALA A 96 84.669 -0.175 -0.377 1.00 1.00 C ATOM 1427 C ALA A 96 84.908 0.466 0.992 1.00 1.00 C ATOM 1428 O ALA A 96 83.958 0.584 1.752 1.00 1.00 O ATOM 1429 CB ALA A 96 83.951 -1.499 -0.311 1.00 1.00 C ATOM 0 H ALA A 96 86.053 -1.196 -1.570 1.00 1.00 H new ATOM 0 HA ALA A 96 84.001 0.512 -0.897 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.036 -1.388 0.271 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.702 -1.829 -1.320 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.595 -2.239 0.164 1.00 1.00 H new ATOM 1435 N LEU A 97 86.202 0.586 1.399 1.00 1.00 N ATOM 1436 CA LEU A 97 86.607 0.911 2.790 1.00 1.00 C ATOM 1437 C LEU A 97 85.410 0.961 3.712 1.00 1.00 C ATOM 1438 O LEU A 97 85.461 0.281 4.704 1.00 1.00 O ATOM 1439 CB LEU A 97 87.300 2.306 2.780 1.00 1.00 C ATOM 1440 CG LEU A 97 86.260 3.454 2.552 1.00 1.00 C ATOM 1441 CD1 LEU A 97 85.643 3.944 3.895 1.00 1.00 C ATOM 1442 CD2 LEU A 97 86.932 4.644 1.839 1.00 1.00 C ATOM 0 H LEU A 97 86.993 0.459 0.768 1.00 1.00 H new ATOM 0 HA LEU A 97 87.283 0.137 3.154 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.818 2.464 3.726 1.00 1.00 H new ATOM 0 HB3 LEU A 97 88.055 2.334 1.994 1.00 1.00 H new ATOM 0 HG LEU A 97 85.459 3.052 1.931 1.00 1.00 H new ATOM 0 HD11 LEU A 97 84.926 4.741 3.697 1.00 1.00 H new ATOM 0 HD12 LEU A 97 85.136 3.114 4.387 1.00 1.00 H new ATOM 0 HD13 LEU A 97 86.434 4.321 4.543 1.00 1.00 H new ATOM 0 HD21 LEU A 97 86.200 5.437 1.685 1.00 1.00 H new ATOM 0 HD22 LEU A 97 87.751 5.020 2.452 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.321 4.318 0.875 1.00 1.00 H new ATOM 1454 N GLY A 98 84.350 1.679 3.472 1.00 1.00 N ATOM 1455 CA GLY A 98 83.225 1.590 4.373 1.00 1.00 C ATOM 1456 C GLY A 98 82.954 0.106 4.624 1.00 1.00 C ATOM 1457 O GLY A 98 82.437 -0.265 5.681 1.00 1.00 O ATOM 0 H GLY A 98 84.236 2.317 2.684 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.442 2.104 5.309 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.348 2.072 3.941 1.00 1.00 H new ATOM 1461 N GLN A 99 83.374 -0.776 3.676 1.00 1.00 N ATOM 1462 CA GLN A 99 83.194 -2.210 3.957 1.00 1.00 C ATOM 1463 C GLN A 99 84.052 -2.547 5.141 1.00 1.00 C ATOM 1464 O GLN A 99 83.839 -3.549 5.816 1.00 1.00 O ATOM 1465 CB GLN A 99 83.605 -3.120 2.797 1.00 1.00 C ATOM 1466 CG GLN A 99 82.464 -3.198 1.778 1.00 1.00 C ATOM 1467 CD GLN A 99 81.350 -4.080 2.299 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.605 -5.152 2.838 1.00 1.00 O ATOM 1469 NE2 GLN A 99 80.117 -3.679 2.157 1.00 1.00 N ATOM 0 H GLN A 99 83.805 -0.539 2.782 1.00 1.00 H new ATOM 0 HA GLN A 99 82.132 -2.381 4.133 1.00 1.00 H new ATOM 0 HB2 GLN A 99 84.506 -2.734 2.320 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.843 -4.116 3.169 1.00 1.00 H new ATOM 0 HG2 GLN A 99 82.080 -2.198 1.575 1.00 1.00 H new ATOM 0 HG3 GLN A 99 82.838 -3.593 0.834 1.00 1.00 H new ATOM 0 HE21 GLN A 99 79.920 -2.785 1.707 1.00 1.00 H new ATOM 0 HE22 GLN A 99 79.350 -4.259 2.496 1.00 1.00 H new ATOM 1478 N ILE A 100 85.010 -1.681 5.426 1.00 1.00 N ATOM 1479 CA ILE A 100 85.866 -1.897 6.585 1.00 1.00 C ATOM 1480 C ILE A 100 85.004 -1.809 7.820 1.00 1.00 C ATOM 1481 O ILE A 100 85.118 -2.629 8.719 1.00 1.00 O ATOM 1482 CB ILE A 100 87.015 -0.846 6.659 1.00 1.00 C ATOM 1483 CG1 ILE A 100 88.173 -1.401 7.510 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.540 0.469 7.310 1.00 1.00 C ATOM 1485 CD1 ILE A 100 89.405 -0.477 7.428 1.00 1.00 C ATOM 0 H ILE A 100 85.214 -0.840 4.886 1.00 1.00 H new ATOM 0 HA ILE A 100 86.336 -2.877 6.506 1.00 1.00 H new ATOM 0 HB ILE A 100 87.338 -0.646 5.637 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.854 -1.498 8.548 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.438 -2.400 7.164 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.368 1.178 7.344 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.725 0.892 6.723 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.192 0.268 8.323 1.00 1.00 H new ATOM 0 HD11 ILE A 100 90.210 -0.889 8.037 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.735 -0.402 6.392 1.00 1.00 H new ATOM 0 HD13 ILE A 100 89.142 0.514 7.797 1.00 1.00 H new ATOM 1497 N VAL A 101 84.132 -0.801 7.869 1.00 1.00 N ATOM 1498 CA VAL A 101 83.263 -0.661 9.022 1.00 1.00 C ATOM 1499 C VAL A 101 82.422 -1.923 9.119 1.00 1.00 C ATOM 1500 O VAL A 101 82.496 -2.642 10.088 1.00 1.00 O ATOM 1501 CB VAL A 101 82.358 0.579 8.856 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.426 0.727 10.066 1.00 1.00 C ATOM 1503 CG2 VAL A 101 83.232 1.834 8.748 1.00 1.00 C ATOM 0 H VAL A 101 84.015 -0.093 7.144 1.00 1.00 H new ATOM 0 HA VAL A 101 83.849 -0.527 9.931 1.00 1.00 H new ATOM 0 HB VAL A 101 81.758 0.457 7.954 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.795 1.606 9.934 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.799 -0.160 10.153 1.00 1.00 H new ATOM 0 HG13 VAL A 101 82.021 0.841 10.972 1.00 1.00 H new ATOM 0 HG21 VAL A 101 82.596 2.711 8.631 1.00 1.00 H new ATOM 0 HG22 VAL A 101 83.832 1.939 9.652 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.891 1.745 7.884 1.00 1.00 H new ATOM 1513 N CYS A 102 81.626 -2.203 8.105 1.00 1.00 N ATOM 1514 CA CYS A 102 80.780 -3.389 8.129 1.00 1.00 C ATOM 1515 C CYS A 102 81.559 -4.610 8.639 1.00 1.00 C ATOM 1516 O CYS A 102 80.986 -5.574 9.121 1.00 1.00 O ATOM 1517 CB CYS A 102 80.250 -3.648 6.699 1.00 1.00 C ATOM 1518 SG CYS A 102 78.513 -4.155 6.759 1.00 1.00 S ATOM 0 H CYS A 102 81.545 -1.635 7.262 1.00 1.00 H new ATOM 0 HA CYS A 102 79.946 -3.223 8.810 1.00 1.00 H new ATOM 0 HB2 CYS A 102 80.353 -2.746 6.096 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.846 -4.423 6.217 1.00 1.00 H new ATOM 0 HG CYS A 102 78.081 -4.367 5.551 1.00 1.00 H new ATOM 1523 N ARG A 103 82.876 -4.520 8.593 1.00 1.00 N ATOM 1524 CA ARG A 103 83.738 -5.595 9.103 1.00 1.00 C ATOM 1525 C ARG A 103 84.187 -5.332 10.550 1.00 1.00 C ATOM 1526 O ARG A 103 84.150 -6.206 11.413 1.00 1.00 O ATOM 1527 CB ARG A 103 84.952 -5.757 8.178 1.00 1.00 C ATOM 1528 CG ARG A 103 85.924 -6.798 8.742 1.00 1.00 C ATOM 1529 CD ARG A 103 86.937 -7.184 7.650 1.00 1.00 C ATOM 1530 NE ARG A 103 87.198 -6.034 6.774 1.00 1.00 N ATOM 1531 CZ ARG A 103 86.692 -5.949 5.535 1.00 1.00 C ATOM 1532 NH1 ARG A 103 85.923 -6.895 5.059 1.00 1.00 N ATOM 1533 NH2 ARG A 103 86.959 -4.908 4.797 1.00 1.00 N ATOM 0 H ARG A 103 83.380 -3.720 8.211 1.00 1.00 H new ATOM 0 HA ARG A 103 83.162 -6.520 9.113 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.621 -6.061 7.185 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.461 -4.800 8.066 1.00 1.00 H new ATOM 0 HG2 ARG A 103 86.443 -6.395 9.612 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.378 -7.680 9.077 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.867 -7.520 8.108 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.551 -8.018 7.063 1.00 1.00 H new ATOM 0 HE ARG A 103 87.784 -5.274 7.120 1.00 1.00 H new ATOM 0 HH11 ARG A 103 85.702 -7.709 5.632 1.00 1.00 H new ATOM 0 HH12 ARG A 103 85.545 -6.818 4.115 1.00 1.00 H new ATOM 0 HH21 ARG A 103 87.551 -4.162 5.163 1.00 1.00 H new ATOM 0 HH22 ARG A 103 86.576 -4.840 3.854 1.00 1.00 H new ATOM 1547 N TYR A 104 84.571 -4.087 10.771 1.00 1.00 N ATOM 1548 CA TYR A 104 85.022 -3.522 12.052 1.00 1.00 C ATOM 1549 C TYR A 104 83.942 -2.577 12.643 1.00 1.00 C ATOM 1550 O TYR A 104 84.239 -1.769 13.521 1.00 1.00 O ATOM 1551 CB TYR A 104 86.408 -2.835 11.869 1.00 1.00 C ATOM 1552 CG TYR A 104 86.492 -1.553 12.663 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.820 -1.583 14.027 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.188 -0.342 12.041 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.842 -0.391 14.763 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.219 0.847 12.772 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.542 0.824 14.133 1.00 1.00 C ATOM 1558 OH TYR A 104 86.557 1.999 14.854 1.00 1.00 O ATOM 0 H TYR A 104 84.581 -3.394 10.023 1.00 1.00 H new ATOM 0 HA TYR A 104 85.157 -4.321 12.781 1.00 1.00 H new ATOM 0 HB2 TYR A 104 87.198 -3.515 12.187 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.575 -2.623 10.813 1.00 1.00 H new ATOM 0 HD1 TYR A 104 87.055 -2.521 14.508 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.928 -0.324 10.993 1.00 1.00 H new ATOM 0 HE1 TYR A 104 87.090 -0.409 15.814 1.00 1.00 H new ATOM 0 HE2 TYR A 104 85.994 1.785 12.287 1.00 1.00 H new ATOM 0 HH TYR A 104 86.327 2.747 14.265 1.00 1.00 H new ATOM 1568 N GLY A 105 82.686 -2.675 12.211 1.00 1.00 N ATOM 1569 CA GLY A 105 81.678 -1.789 12.773 1.00 1.00 C ATOM 1570 C GLY A 105 80.270 -2.277 12.516 1.00 1.00 C ATOM 1571 O GLY A 105 79.324 -1.742 13.098 1.00 1.00 O ATOM 0 H GLY A 105 82.354 -3.331 11.504 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.837 -1.698 13.847 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.797 -0.792 12.348 1.00 1.00 H new ATOM 1575 N ALA A 106 80.125 -3.285 11.648 1.00 1.00 N ATOM 1576 CA ALA A 106 78.808 -3.842 11.337 1.00 1.00 C ATOM 1577 C ALA A 106 77.880 -3.701 12.544 1.00 1.00 C ATOM 1578 O ALA A 106 78.146 -4.283 13.595 1.00 1.00 O ATOM 1579 CB ALA A 106 78.981 -5.332 10.973 1.00 1.00 C ATOM 0 H ALA A 106 80.899 -3.728 11.153 1.00 1.00 H new ATOM 0 HA ALA A 106 78.365 -3.303 10.499 1.00 1.00 H new ATOM 0 HB1 ALA A 106 78.008 -5.764 10.738 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.637 -5.421 10.107 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.420 -5.864 11.817 1.00 1.00 H new ATOM 1585 N THR A 107 76.776 -2.967 12.396 1.00 1.00 N ATOM 1586 CA THR A 107 75.812 -2.810 13.475 1.00 1.00 C ATOM 1587 C THR A 107 74.455 -3.026 12.841 1.00 1.00 C ATOM 1588 O THR A 107 73.736 -3.900 13.215 1.00 1.00 O ATOM 1589 CB THR A 107 75.890 -1.419 14.109 1.00 1.00 C ATOM 1590 OG1 THR A 107 77.248 -1.092 14.367 1.00 1.00 O ATOM 1591 CG2 THR A 107 75.107 -1.421 15.425 1.00 1.00 C ATOM 0 H THR A 107 76.531 -2.474 11.537 1.00 1.00 H new ATOM 0 HA THR A 107 76.010 -3.519 14.279 1.00 1.00 H new ATOM 0 HB THR A 107 75.463 -0.682 13.429 1.00 1.00 H new ATOM 0 HG1 THR A 107 77.766 -1.169 13.539 1.00 1.00 H new ATOM 0 HG21 THR A 107 75.159 -0.432 15.881 1.00 1.00 H new ATOM 0 HG22 THR A 107 74.065 -1.675 15.228 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.538 -2.157 16.104 1.00 1.00 H new ATOM 1599 N VAL A 108 74.074 -2.192 11.907 1.00 1.00 N ATOM 1600 CA VAL A 108 72.784 -2.364 11.280 1.00 1.00 C ATOM 1601 C VAL A 108 72.722 -3.720 10.556 1.00 1.00 C ATOM 1602 O VAL A 108 71.962 -3.845 9.595 1.00 1.00 O ATOM 1603 CB VAL A 108 72.487 -1.225 10.290 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.337 0.089 11.058 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.623 -1.096 9.267 1.00 1.00 C ATOM 0 H VAL A 108 74.623 -1.402 11.568 1.00 1.00 H new ATOM 0 HA VAL A 108 72.025 -2.339 12.062 1.00 1.00 H new ATOM 0 HB VAL A 108 71.562 -1.450 9.759 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.126 0.898 10.358 1.00 1.00 H new ATOM 0 HG12 VAL A 108 71.516 0.003 11.770 1.00 1.00 H new ATOM 0 HG13 VAL A 108 73.261 0.305 11.594 1.00 1.00 H new ATOM 0 HG21 VAL A 108 73.398 -0.286 8.574 1.00 1.00 H new ATOM 0 HG22 VAL A 108 74.557 -0.881 9.786 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.722 -2.030 8.714 1.00 1.00 H new ATOM 1615 N ILE A 109 73.477 -4.769 11.015 1.00 1.00 N ATOM 1616 CA ILE A 109 73.411 -6.103 10.386 1.00 1.00 C ATOM 1617 C ILE A 109 72.757 -7.145 11.335 1.00 1.00 C ATOM 1618 O ILE A 109 71.965 -7.943 10.859 1.00 1.00 O ATOM 1619 CB ILE A 109 74.816 -6.555 9.842 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.369 -7.814 10.562 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.809 -5.404 9.988 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.702 -8.261 9.926 1.00 1.00 C ATOM 0 H ILE A 109 74.122 -4.706 11.803 1.00 1.00 H new ATOM 0 HA ILE A 109 72.759 -6.034 9.515 1.00 1.00 H new ATOM 0 HB ILE A 109 74.685 -6.821 8.793 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.519 -7.598 11.620 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.641 -8.623 10.502 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.784 -5.714 9.612 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.457 -4.545 9.417 1.00 1.00 H new ATOM 0 HG23 ILE A 109 75.896 -5.130 11.039 1.00 1.00 H new ATOM 0 HD11 ILE A 109 77.074 -9.145 10.444 1.00 1.00 H new ATOM 0 HD12 ILE A 109 76.542 -8.498 8.874 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.433 -7.457 10.010 1.00 1.00 H new ATOM 1634 N PRO A 110 73.063 -7.202 12.650 1.00 1.00 N ATOM 1635 CA PRO A 110 72.448 -8.207 13.576 1.00 1.00 C ATOM 1636 C PRO A 110 70.940 -7.991 13.732 1.00 1.00 C ATOM 1637 O PRO A 110 70.205 -8.942 14.005 1.00 1.00 O ATOM 1638 CB PRO A 110 73.207 -8.017 14.908 1.00 1.00 C ATOM 1639 CG PRO A 110 74.460 -7.342 14.489 1.00 1.00 C ATOM 1640 CD PRO A 110 73.971 -6.367 13.440 1.00 1.00 C ATOM 0 HA PRO A 110 72.538 -9.226 13.199 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.639 -7.410 15.613 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.407 -8.970 15.397 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.945 -6.833 15.322 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.184 -8.047 14.081 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.459 -5.513 13.883 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.789 -5.971 12.838 1.00 1.00 H new ATOM 1648 N ASN A 111 70.466 -6.749 13.583 1.00 1.00 N ATOM 1649 CA ASN A 111 69.037 -6.497 13.740 1.00 1.00 C ATOM 1650 C ASN A 111 68.263 -7.136 12.575 1.00 1.00 C ATOM 1651 O ASN A 111 67.544 -8.115 12.781 1.00 1.00 O ATOM 1652 CB ASN A 111 68.812 -4.969 13.785 1.00 1.00 C ATOM 1653 CG ASN A 111 67.706 -4.595 14.771 1.00 1.00 C ATOM 1654 OD1 ASN A 111 67.925 -3.777 15.666 1.00 1.00 O ATOM 1655 ND2 ASN A 111 66.532 -5.146 14.665 1.00 1.00 N ATOM 0 H ASN A 111 71.032 -5.930 13.361 1.00 1.00 H new ATOM 0 HA ASN A 111 68.671 -6.941 14.666 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.739 -4.472 14.071 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.551 -4.609 12.790 1.00 1.00 H new ATOM 0 HD21 ASN A 111 65.792 -4.901 15.323 1.00 1.00 H new ATOM 0 HD22 ASN A 111 66.351 -5.823 13.924 1.00 1.00 H new ATOM 1662 N ILE A 112 68.408 -6.605 11.350 1.00 1.00 N ATOM 1663 CA ILE A 112 67.709 -7.165 10.187 1.00 1.00 C ATOM 1664 C ILE A 112 67.901 -8.662 10.187 1.00 1.00 C ATOM 1665 O ILE A 112 67.114 -9.437 9.683 1.00 1.00 O ATOM 1666 CB ILE A 112 68.347 -6.559 8.907 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.752 -7.177 8.655 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.503 -5.041 9.107 1.00 1.00 C ATOM 1669 CD1 ILE A 112 70.413 -6.575 7.406 1.00 1.00 C ATOM 0 H ILE A 112 68.996 -5.798 11.143 1.00 1.00 H new ATOM 0 HA ILE A 112 66.644 -6.934 10.220 1.00 1.00 H new ATOM 0 HB ILE A 112 67.706 -6.774 8.052 1.00 1.00 H new ATOM 0 HG12 ILE A 112 70.388 -7.005 9.524 1.00 1.00 H new ATOM 0 HG13 ILE A 112 69.660 -8.257 8.535 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.950 -4.601 8.216 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.524 -4.594 9.280 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.146 -4.851 9.967 1.00 1.00 H new ATOM 0 HD11 ILE A 112 71.393 -7.029 7.259 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.788 -6.770 6.534 1.00 1.00 H new ATOM 0 HD13 ILE A 112 70.527 -5.499 7.538 1.00 1.00 H new ATOM 1681 N ASN A 113 69.011 -8.998 10.759 1.00 1.00 N ATOM 1682 CA ASN A 113 69.401 -10.390 10.846 1.00 1.00 C ATOM 1683 C ASN A 113 68.284 -11.115 11.554 1.00 1.00 C ATOM 1684 O ASN A 113 67.780 -12.091 11.040 1.00 1.00 O ATOM 1685 CB ASN A 113 70.761 -10.562 11.538 1.00 1.00 C ATOM 1686 CG ASN A 113 70.734 -11.606 12.662 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.416 -11.282 13.804 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.053 -12.843 12.405 1.00 1.00 N ATOM 0 H ASN A 113 69.670 -8.340 11.175 1.00 1.00 H new ATOM 0 HA ASN A 113 69.545 -10.816 9.853 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.505 -10.853 10.797 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.078 -9.603 11.948 1.00 1.00 H new ATOM 0 HD21 ASN A 113 71.038 -13.539 13.151 1.00 1.00 H new ATOM 0 HD22 ASN A 113 71.317 -13.115 11.458 1.00 1.00 H new ATOM 1695 N ALA A 114 67.877 -10.640 12.719 1.00 1.00 N ATOM 1696 CA ALA A 114 66.807 -11.298 13.446 1.00 1.00 C ATOM 1697 C ALA A 114 65.486 -11.296 12.685 1.00 1.00 C ATOM 1698 O ALA A 114 64.748 -12.279 12.760 1.00 1.00 O ATOM 1699 CB ALA A 114 66.602 -10.616 14.800 1.00 1.00 C ATOM 0 H ALA A 114 68.265 -9.814 13.175 1.00 1.00 H new ATOM 0 HA ALA A 114 67.111 -12.336 13.579 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.798 -11.115 15.341 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.522 -10.677 15.381 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.340 -9.569 14.644 1.00 1.00 H new ATOM 1705 N ALA A 115 65.166 -10.242 11.922 1.00 1.00 N ATOM 1706 CA ALA A 115 63.919 -10.243 11.163 1.00 1.00 C ATOM 1707 C ALA A 115 64.093 -11.000 9.847 1.00 1.00 C ATOM 1708 O ALA A 115 63.369 -11.926 9.560 1.00 1.00 O ATOM 1709 CB ALA A 115 63.479 -8.800 10.870 1.00 1.00 C ATOM 0 H ALA A 115 65.737 -9.403 11.818 1.00 1.00 H new ATOM 0 HA ALA A 115 63.155 -10.741 11.759 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.548 -8.811 10.303 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.326 -8.269 11.809 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.251 -8.295 10.289 1.00 1.00 H new ATOM 1715 N ILE A 116 65.071 -10.556 9.060 1.00 1.00 N ATOM 1716 CA ILE A 116 65.327 -11.195 7.752 1.00 1.00 C ATOM 1717 C ILE A 116 65.388 -12.708 7.966 1.00 1.00 C ATOM 1718 O ILE A 116 64.628 -13.485 7.399 1.00 1.00 O ATOM 1719 CB ILE A 116 66.642 -10.708 7.101 1.00 1.00 C ATOM 1720 CG1 ILE A 116 66.478 -9.241 6.660 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.964 -11.584 5.872 1.00 1.00 C ATOM 1722 CD1 ILE A 116 67.768 -8.737 6.001 1.00 1.00 C ATOM 0 H ILE A 116 65.690 -9.778 9.288 1.00 1.00 H new ATOM 0 HA ILE A 116 64.520 -10.923 7.072 1.00 1.00 H new ATOM 0 HB ILE A 116 67.457 -10.784 7.821 1.00 1.00 H new ATOM 0 HG12 ILE A 116 65.646 -9.155 5.961 1.00 1.00 H new ATOM 0 HG13 ILE A 116 66.235 -8.620 7.522 1.00 1.00 H new ATOM 0 HG21 ILE A 116 67.891 -11.240 5.413 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.077 -12.622 6.185 1.00 1.00 H new ATOM 0 HG23 ILE A 116 66.152 -11.509 5.149 1.00 1.00 H new ATOM 0 HD11 ILE A 116 67.638 -7.699 5.694 1.00 1.00 H new ATOM 0 HD12 ILE A 116 68.591 -8.805 6.713 1.00 1.00 H new ATOM 0 HD13 ILE A 116 67.993 -9.348 5.127 1.00 1.00 H new ATOM 1734 N GLU A 117 66.352 -13.061 8.785 1.00 1.00 N ATOM 1735 CA GLU A 117 66.588 -14.479 9.095 1.00 1.00 C ATOM 1736 C GLU A 117 65.228 -15.124 9.309 1.00 1.00 C ATOM 1737 O GLU A 117 64.881 -16.086 8.635 1.00 1.00 O ATOM 1738 CB GLU A 117 67.501 -14.752 10.294 1.00 1.00 C ATOM 1739 CG GLU A 117 68.952 -14.444 9.890 1.00 1.00 C ATOM 1740 CD GLU A 117 69.909 -14.811 11.017 1.00 1.00 C ATOM 1741 OE1 GLU A 117 69.436 -15.267 12.043 1.00 1.00 O ATOM 1742 OE2 GLU A 117 71.104 -14.640 10.831 1.00 1.00 O ATOM 0 H GLU A 117 66.984 -12.409 9.249 1.00 1.00 H new ATOM 0 HA GLU A 117 67.131 -14.907 8.252 1.00 1.00 H new ATOM 0 HB2 GLU A 117 67.206 -14.134 11.142 1.00 1.00 H new ATOM 0 HB3 GLU A 117 67.409 -15.791 10.610 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.211 -15.001 8.989 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.052 -13.385 9.650 1.00 1.00 H new ATOM 1749 N VAL A 118 64.433 -14.541 10.200 1.00 1.00 N ATOM 1750 CA VAL A 118 63.085 -15.055 10.429 1.00 1.00 C ATOM 1751 C VAL A 118 62.283 -14.969 9.119 1.00 1.00 C ATOM 1752 O VAL A 118 61.730 -15.963 8.662 1.00 1.00 O ATOM 1753 CB VAL A 118 62.398 -14.259 11.547 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.933 -14.694 11.673 1.00 1.00 C ATOM 1755 CG2 VAL A 118 63.126 -14.516 12.876 1.00 1.00 C ATOM 0 H VAL A 118 64.689 -13.731 10.764 1.00 1.00 H new ATOM 0 HA VAL A 118 63.137 -16.097 10.744 1.00 1.00 H new ATOM 0 HB VAL A 118 62.435 -13.196 11.308 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.452 -14.125 12.468 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.416 -14.510 10.731 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.888 -15.757 11.909 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.640 -13.952 13.672 1.00 1.00 H new ATOM 0 HG22 VAL A 118 63.090 -15.580 13.111 1.00 1.00 H new ATOM 0 HG23 VAL A 118 64.165 -14.199 12.789 1.00 1.00 H new ATOM 1765 N LEU A 119 62.213 -13.769 8.527 1.00 1.00 N ATOM 1766 CA LEU A 119 61.460 -13.595 7.284 1.00 1.00 C ATOM 1767 C LEU A 119 61.967 -14.626 6.275 1.00 1.00 C ATOM 1768 O LEU A 119 61.267 -15.594 5.978 1.00 1.00 O ATOM 1769 CB LEU A 119 61.720 -12.172 6.753 1.00 1.00 C ATOM 1770 CG LEU A 119 60.676 -11.750 5.691 1.00 1.00 C ATOM 1771 CD1 LEU A 119 59.516 -10.990 6.349 1.00 1.00 C ATOM 1772 CD2 LEU A 119 61.342 -10.829 4.658 1.00 1.00 C ATOM 0 H LEU A 119 62.659 -12.923 8.881 1.00 1.00 H new ATOM 0 HA LEU A 119 60.391 -13.732 7.448 1.00 1.00 H new ATOM 0 HB2 LEU A 119 61.699 -11.466 7.583 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.719 -12.124 6.319 1.00 1.00 H new ATOM 0 HG LEU A 119 60.291 -12.648 5.208 1.00 1.00 H new ATOM 0 HD11 LEU A 119 58.792 -10.701 5.587 1.00 1.00 H new ATOM 0 HD12 LEU A 119 59.032 -11.632 7.085 1.00 1.00 H new ATOM 0 HD13 LEU A 119 59.900 -10.097 6.842 1.00 1.00 H new ATOM 0 HD21 LEU A 119 60.608 -10.531 3.909 1.00 1.00 H new ATOM 0 HD22 LEU A 119 61.731 -9.942 5.158 1.00 1.00 H new ATOM 0 HD23 LEU A 119 62.161 -11.359 4.172 1.00 1.00 H new ATOM 1784 N GLY A 120 63.190 -14.448 5.745 1.00 1.00 N ATOM 1785 CA GLY A 120 63.685 -15.429 4.797 1.00 1.00 C ATOM 1786 C GLY A 120 63.910 -16.773 5.500 1.00 1.00 C ATOM 1787 O GLY A 120 63.055 -17.659 5.506 1.00 1.00 O ATOM 0 H GLY A 120 63.818 -13.671 5.950 1.00 1.00 H new ATOM 0 HA2 GLY A 120 62.972 -15.551 3.982 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.618 -15.080 4.355 1.00 1.00 H new ATOM 1791 N THR A 121 65.097 -16.853 6.077 1.00 1.00 N ATOM 1792 CA THR A 121 65.559 -18.038 6.812 1.00 1.00 C ATOM 1793 C THR A 121 67.054 -17.985 7.142 1.00 1.00 C ATOM 1794 O THR A 121 67.472 -18.431 8.210 1.00 1.00 O ATOM 1795 CB THR A 121 65.260 -19.324 6.007 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.954 -20.409 6.596 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.709 -19.181 4.544 1.00 1.00 C ATOM 0 H THR A 121 65.780 -16.095 6.053 1.00 1.00 H new ATOM 0 HA THR A 121 65.011 -18.049 7.754 1.00 1.00 H new ATOM 0 HB THR A 121 64.184 -19.499 6.024 1.00 1.00 H new ATOM 0 HG1 THR A 121 66.436 -20.905 5.901 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.486 -20.101 4.003 1.00 1.00 H new ATOM 0 HG22 THR A 121 65.178 -18.350 4.080 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.782 -18.991 4.510 1.00 1.00 H new ATOM 1805 N GLY A 122 67.861 -17.502 6.202 1.00 1.00 N ATOM 1806 CA GLY A 122 69.318 -17.468 6.385 1.00 1.00 C ATOM 1807 C GLY A 122 69.892 -18.644 5.610 1.00 1.00 C ATOM 1808 O GLY A 122 71.070 -18.692 5.265 1.00 1.00 O ATOM 0 H GLY A 122 67.538 -17.130 5.309 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.731 -16.527 6.020 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.576 -17.540 7.442 1.00 1.00 H new ATOM 1812 N THR A 123 68.967 -19.561 5.344 1.00 1.00 N ATOM 1813 CA THR A 123 69.291 -20.769 4.569 1.00 1.00 C ATOM 1814 C THR A 123 69.979 -20.266 3.298 1.00 1.00 C ATOM 1815 O THR A 123 69.346 -20.032 2.270 1.00 1.00 O ATOM 1816 CB THR A 123 68.048 -21.597 4.208 1.00 1.00 C ATOM 1817 OG1 THR A 123 67.292 -21.834 5.382 1.00 1.00 O ATOM 1818 CG2 THR A 123 68.461 -22.960 3.606 1.00 1.00 C ATOM 0 H THR A 123 67.995 -19.499 5.647 1.00 1.00 H new ATOM 0 HA THR A 123 69.923 -21.435 5.156 1.00 1.00 H new ATOM 0 HB THR A 123 67.460 -21.044 3.476 1.00 1.00 H new ATOM 0 HG1 THR A 123 66.496 -22.361 5.158 1.00 1.00 H new ATOM 0 HG21 THR A 123 67.568 -23.533 3.356 1.00 1.00 H new ATOM 0 HG22 THR A 123 69.051 -22.796 2.704 1.00 1.00 H new ATOM 0 HG23 THR A 123 69.056 -23.513 4.333 1.00 1.00 H new ATOM 1826 N ASP A 124 71.289 -20.088 3.418 1.00 1.00 N ATOM 1827 CA ASP A 124 72.103 -19.577 2.315 1.00 1.00 C ATOM 1828 C ASP A 124 73.577 -19.900 2.496 1.00 1.00 C ATOM 1829 O ASP A 124 74.018 -20.238 3.593 1.00 1.00 O ATOM 1830 CB ASP A 124 71.939 -18.059 2.230 1.00 1.00 C ATOM 1831 CG ASP A 124 70.510 -17.702 1.833 1.00 1.00 C ATOM 1832 OD1 ASP A 124 69.691 -17.544 2.724 1.00 1.00 O ATOM 1833 OD2 ASP A 124 70.253 -17.593 0.644 1.00 1.00 O ATOM 0 H ASP A 124 71.814 -20.290 4.269 1.00 1.00 H new ATOM 0 HA ASP A 124 71.760 -20.059 1.400 1.00 1.00 H new ATOM 0 HB2 ASP A 124 72.180 -17.606 3.192 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.639 -17.651 1.501 1.00 1.00 H new ATOM 1838 N TYR A 125 74.344 -19.754 1.419 1.00 1.00 N ATOM 1839 CA TYR A 125 75.780 -19.987 1.469 1.00 1.00 C ATOM 1840 C TYR A 125 76.467 -19.101 0.412 1.00 1.00 C ATOM 1841 O TYR A 125 75.934 -18.876 -0.667 1.00 1.00 O ATOM 1842 CB TYR A 125 76.073 -21.500 1.254 1.00 1.00 C ATOM 1843 CG TYR A 125 77.208 -21.708 0.274 1.00 1.00 C ATOM 1844 CD1 TYR A 125 76.954 -21.633 -1.097 1.00 1.00 C ATOM 1845 CD2 TYR A 125 78.505 -21.961 0.735 1.00 1.00 C ATOM 1846 CE1 TYR A 125 77.996 -21.812 -2.011 1.00 1.00 C ATOM 1847 CE2 TYR A 125 79.550 -22.137 -0.180 1.00 1.00 C ATOM 1848 CZ TYR A 125 79.293 -22.062 -1.554 1.00 1.00 C ATOM 1849 OH TYR A 125 80.321 -22.229 -2.458 1.00 1.00 O ATOM 0 H TYR A 125 73.993 -19.476 0.503 1.00 1.00 H new ATOM 0 HA TYR A 125 76.181 -19.717 2.446 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.325 -21.963 2.208 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.176 -21.997 0.885 1.00 1.00 H new ATOM 0 HD1 TYR A 125 75.953 -21.437 -1.451 1.00 1.00 H new ATOM 0 HD2 TYR A 125 78.700 -22.020 1.796 1.00 1.00 H new ATOM 0 HE1 TYR A 125 77.799 -21.757 -3.071 1.00 1.00 H new ATOM 0 HE2 TYR A 125 80.552 -22.330 0.173 1.00 1.00 H new ATOM 0 HH TYR A 125 81.158 -22.394 -1.975 1.00 1.00 H new ATOM 1859 N ARG A 126 77.678 -18.660 0.728 1.00 1.00 N ATOM 1860 CA ARG A 126 78.487 -17.855 -0.184 1.00 1.00 C ATOM 1861 C ARG A 126 79.981 -18.158 0.041 1.00 1.00 C ATOM 1862 O ARG A 126 80.389 -18.486 1.156 1.00 1.00 O ATOM 1863 CB ARG A 126 78.194 -16.350 0.032 1.00 1.00 C ATOM 1864 CG ARG A 126 78.155 -15.583 -1.320 1.00 1.00 C ATOM 1865 CD ARG A 126 76.703 -15.424 -1.794 1.00 1.00 C ATOM 1866 NE ARG A 126 76.061 -16.730 -1.943 1.00 1.00 N ATOM 1867 CZ ARG A 126 74.736 -16.863 -1.854 1.00 1.00 C ATOM 1868 NH1 ARG A 126 73.990 -15.825 -1.595 1.00 1.00 N ATOM 1869 NH2 ARG A 126 74.183 -18.034 -2.021 1.00 1.00 N ATOM 0 H ARG A 126 78.129 -18.849 1.623 1.00 1.00 H new ATOM 0 HA ARG A 126 78.231 -18.109 -1.213 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.240 -16.233 0.547 1.00 1.00 H new ATOM 0 HB3 ARG A 126 78.959 -15.917 0.676 1.00 1.00 H new ATOM 0 HG2 ARG A 126 78.618 -14.603 -1.205 1.00 1.00 H new ATOM 0 HG3 ARG A 126 78.734 -16.122 -2.070 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.146 -14.819 -1.079 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.682 -14.892 -2.745 1.00 1.00 H new ATOM 0 HE ARG A 126 76.636 -17.554 -2.118 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.419 -14.910 -1.460 1.00 1.00 H new ATOM 0 HH12 ARG A 126 72.978 -15.929 -1.527 1.00 1.00 H new ATOM 0 HH21 ARG A 126 74.764 -18.849 -2.220 1.00 1.00 H new ATOM 0 HH22 ARG A 126 73.170 -18.134 -1.953 1.00 1.00 H new ATOM 1883 N PHE A 127 80.787 -18.023 -1.010 1.00 1.00 N ATOM 1884 CA PHE A 127 82.231 -18.264 -0.899 1.00 1.00 C ATOM 1885 C PHE A 127 82.952 -17.813 -2.164 1.00 1.00 C ATOM 1886 O PHE A 127 82.735 -18.426 -3.197 1.00 1.00 O ATOM 1887 CB PHE A 127 82.524 -19.749 -0.654 1.00 1.00 C ATOM 1888 CG PHE A 127 84.023 -19.951 -0.541 1.00 1.00 C ATOM 1889 CD1 PHE A 127 84.676 -19.699 0.674 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.761 -20.385 -1.653 1.00 1.00 C ATOM 1891 CE1 PHE A 127 86.062 -19.881 0.776 1.00 1.00 C ATOM 1892 CE2 PHE A 127 86.147 -20.565 -1.547 1.00 1.00 C ATOM 1893 CZ PHE A 127 86.796 -20.313 -0.333 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.716 -16.865 -2.081 1.00 1.00 O ATOM 0 H PHE A 127 80.473 -17.751 -1.941 1.00 1.00 H new ATOM 0 HA PHE A 127 82.595 -17.685 -0.050 1.00 1.00 H new ATOM 0 HB2 PHE A 127 82.030 -20.083 0.259 1.00 1.00 H new ATOM 0 HB3 PHE A 127 82.125 -20.350 -1.471 1.00 1.00 H new ATOM 0 HD1 PHE A 127 84.111 -19.365 1.531 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.261 -20.580 -2.590 1.00 1.00 H new ATOM 0 HE1 PHE A 127 86.564 -19.687 1.713 1.00 1.00 H new ATOM 0 HE2 PHE A 127 86.715 -20.899 -2.403 1.00 1.00 H new ATOM 0 HZ PHE A 127 87.864 -20.452 -0.253 1.00 1.00 H new