USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 806 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -54:sc= 0.0849 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.0254 X(o=-0.025,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot -115:sc= -1.14 USER MOD Single : A 33 SER OG : rot 180:sc= -0.0462 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 12:sc= 0.786 USER MOD Single : A 40 LYS NZ :NH3+ -114:sc= -1.87! (180deg=-4.55!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -158:sc=-0.00113 (180deg=-0.521) USER MOD Single : A 44 ASN : amide:sc= -0.0635 X(o=-0.064,f=-0.54) USER MOD Single : A 51 SER OG : rot 180:sc= -0.675 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 HIS : no HD1:sc= -1.61 X(o=-1.6,f=-1.9) USER MOD Single : A 63 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 15:sc= -0.47 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot -140:sc= 0.151 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 3:sc= 0.768! USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN :FLIP amide:sc= -0.423 F(o=-1.9,f=-0.42) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.637 13.008 -11.195 1.00 0.00 N ATOM 2 CA GLY A 1 27.463 13.994 -10.523 1.00 0.00 C ATOM 3 C GLY A 1 27.583 13.731 -9.034 1.00 0.00 C ATOM 4 O GLY A 1 27.037 14.475 -8.220 1.00 0.00 O ATOM 0 H1 GLY A 1 26.586 13.231 -12.209 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.053 12.063 -11.069 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.680 13.022 -10.789 1.00 0.00 H new ATOM 0 HA2 GLY A 1 28.457 13.996 -10.970 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.040 14.986 -10.681 1.00 0.00 H new ATOM 8 N SER A 2 28.297 12.669 -8.678 1.00 0.00 N ATOM 9 CA SER A 2 28.483 12.307 -7.278 1.00 0.00 C ATOM 10 C SER A 2 27.138 12.102 -6.587 1.00 0.00 C ATOM 11 O SER A 2 26.939 12.535 -5.451 1.00 0.00 O ATOM 12 CB SER A 2 29.283 13.389 -6.551 1.00 0.00 C ATOM 13 OG SER A 2 29.808 12.900 -5.329 1.00 0.00 O ATOM 0 H SER A 2 28.757 12.044 -9.340 1.00 0.00 H new ATOM 0 HA SER A 2 29.038 11.369 -7.241 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.097 13.734 -7.188 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.644 14.250 -6.357 1.00 0.00 H new ATOM 0 HG SER A 2 29.082 12.526 -4.787 1.00 0.00 H new ATOM 19 N SER A 3 26.217 11.442 -7.282 1.00 0.00 N ATOM 20 CA SER A 3 24.889 11.183 -6.739 1.00 0.00 C ATOM 21 C SER A 3 24.886 9.914 -5.891 1.00 0.00 C ATOM 22 O SER A 3 25.762 9.061 -6.028 1.00 0.00 O ATOM 23 CB SER A 3 23.867 11.057 -7.870 1.00 0.00 C ATOM 24 OG SER A 3 24.132 9.918 -8.671 1.00 0.00 O ATOM 0 H SER A 3 26.366 11.077 -8.223 1.00 0.00 H new ATOM 0 HA SER A 3 24.614 12.024 -6.103 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.863 10.986 -7.451 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.891 11.954 -8.488 1.00 0.00 H new ATOM 0 HG SER A 3 23.464 9.858 -9.386 1.00 0.00 H new ATOM 30 N GLY A 4 23.893 9.796 -5.015 1.00 0.00 N ATOM 31 CA GLY A 4 23.794 8.629 -4.159 1.00 0.00 C ATOM 32 C GLY A 4 23.822 8.987 -2.686 1.00 0.00 C ATOM 33 O GLY A 4 23.079 8.416 -1.888 1.00 0.00 O ATOM 0 H GLY A 4 23.155 10.488 -4.883 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.870 8.095 -4.383 1.00 0.00 H new ATOM 0 HA3 GLY A 4 24.617 7.949 -4.380 1.00 0.00 H new ATOM 37 N SER A 5 24.682 9.934 -2.324 1.00 0.00 N ATOM 38 CA SER A 5 24.808 10.363 -0.937 1.00 0.00 C ATOM 39 C SER A 5 24.552 11.862 -0.807 1.00 0.00 C ATOM 40 O SER A 5 25.269 12.565 -0.094 1.00 0.00 O ATOM 41 CB SER A 5 26.199 10.023 -0.400 1.00 0.00 C ATOM 42 OG SER A 5 26.268 8.671 0.020 1.00 0.00 O ATOM 0 H SER A 5 25.302 10.419 -2.973 1.00 0.00 H new ATOM 0 HA SER A 5 24.060 9.832 -0.349 1.00 0.00 H new ATOM 0 HB2 SER A 5 26.945 10.205 -1.173 1.00 0.00 H new ATOM 0 HB3 SER A 5 26.440 10.679 0.436 1.00 0.00 H new ATOM 0 HG SER A 5 27.168 8.479 0.357 1.00 0.00 H new ATOM 48 N SER A 6 23.526 12.344 -1.500 1.00 0.00 N ATOM 49 CA SER A 6 23.178 13.759 -1.466 1.00 0.00 C ATOM 50 C SER A 6 21.877 13.980 -0.699 1.00 0.00 C ATOM 51 O SER A 6 20.792 13.970 -1.279 1.00 0.00 O ATOM 52 CB SER A 6 23.044 14.307 -2.887 1.00 0.00 C ATOM 53 OG SER A 6 24.300 14.729 -3.391 1.00 0.00 O ATOM 0 H SER A 6 22.921 11.775 -2.092 1.00 0.00 H new ATOM 0 HA SER A 6 23.978 14.292 -0.952 1.00 0.00 H new ATOM 0 HB2 SER A 6 22.626 13.539 -3.538 1.00 0.00 H new ATOM 0 HB3 SER A 6 22.346 15.144 -2.893 1.00 0.00 H new ATOM 0 HG SER A 6 24.188 15.074 -4.302 1.00 0.00 H new ATOM 59 N GLY A 7 21.995 14.179 0.610 1.00 0.00 N ATOM 60 CA GLY A 7 20.823 14.399 1.437 1.00 0.00 C ATOM 61 C GLY A 7 20.067 13.117 1.723 1.00 0.00 C ATOM 62 O GLY A 7 19.737 12.365 0.806 1.00 0.00 O ATOM 0 H GLY A 7 22.882 14.192 1.113 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.127 14.856 2.379 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.159 15.106 0.940 1.00 0.00 H new ATOM 66 N GLN A 8 19.793 12.865 3.000 1.00 0.00 N ATOM 67 CA GLN A 8 19.074 11.664 3.404 1.00 0.00 C ATOM 68 C GLN A 8 17.829 11.460 2.546 1.00 0.00 C ATOM 69 O GLN A 8 17.370 12.382 1.870 1.00 0.00 O ATOM 70 CB GLN A 8 18.682 11.752 4.880 1.00 0.00 C ATOM 71 CG GLN A 8 19.701 11.127 5.818 1.00 0.00 C ATOM 72 CD GLN A 8 19.636 11.704 7.219 1.00 0.00 C ATOM 73 OE1 GLN A 8 18.595 11.658 7.875 1.00 0.00 O ATOM 74 NE2 GLN A 8 20.752 12.253 7.685 1.00 0.00 N ATOM 0 H GLN A 8 20.059 13.477 3.771 1.00 0.00 H new ATOM 0 HA GLN A 8 19.735 10.809 3.261 1.00 0.00 H new ATOM 0 HB2 GLN A 8 18.547 12.799 5.150 1.00 0.00 H new ATOM 0 HB3 GLN A 8 17.720 11.260 5.022 1.00 0.00 H new ATOM 0 HG2 GLN A 8 19.534 10.051 5.864 1.00 0.00 H new ATOM 0 HG3 GLN A 8 20.702 11.277 5.413 1.00 0.00 H new ATOM 0 HE21 GLN A 8 21.592 12.269 7.107 1.00 0.00 H new ATOM 0 HE22 GLN A 8 20.769 12.658 8.621 1.00 0.00 H new ATOM 83 N LEU A 9 17.287 10.248 2.578 1.00 0.00 N ATOM 84 CA LEU A 9 16.095 9.922 1.803 1.00 0.00 C ATOM 85 C LEU A 9 14.960 10.892 2.117 1.00 0.00 C ATOM 86 O LEU A 9 14.918 11.484 3.194 1.00 0.00 O ATOM 87 CB LEU A 9 15.650 8.488 2.091 1.00 0.00 C ATOM 88 CG LEU A 9 14.290 8.079 1.526 1.00 0.00 C ATOM 89 CD1 LEU A 9 14.275 8.223 0.012 1.00 0.00 C ATOM 90 CD2 LEU A 9 13.950 6.653 1.932 1.00 0.00 C ATOM 0 H LEU A 9 17.654 9.474 3.132 1.00 0.00 H new ATOM 0 HA LEU A 9 16.344 10.012 0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 9 16.404 7.809 1.694 1.00 0.00 H new ATOM 0 HB3 LEU A 9 15.629 8.346 3.171 1.00 0.00 H new ATOM 0 HG LEU A 9 13.532 8.743 1.941 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.299 7.927 -0.372 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.471 9.261 -0.257 1.00 0.00 H new ATOM 0 HD13 LEU A 9 15.044 7.584 -0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.978 6.379 1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 9 14.711 5.974 1.548 1.00 0.00 H new ATOM 0 HD23 LEU A 9 13.917 6.582 3.019 1.00 0.00 H new ATOM 102 N GLU A 10 14.039 11.045 1.169 1.00 0.00 N ATOM 103 CA GLU A 10 12.903 11.940 1.347 1.00 0.00 C ATOM 104 C GLU A 10 11.629 11.323 0.779 1.00 0.00 C ATOM 105 O GLU A 10 11.667 10.270 0.142 1.00 0.00 O ATOM 106 CB GLU A 10 13.175 13.287 0.672 1.00 0.00 C ATOM 107 CG GLU A 10 14.580 13.814 0.911 1.00 0.00 C ATOM 108 CD GLU A 10 14.674 15.319 0.747 1.00 0.00 C ATOM 109 OE1 GLU A 10 13.716 16.019 1.137 1.00 0.00 O ATOM 110 OE2 GLU A 10 15.705 15.795 0.228 1.00 0.00 O ATOM 0 H GLU A 10 14.058 10.561 0.271 1.00 0.00 H new ATOM 0 HA GLU A 10 12.764 12.099 2.416 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.011 13.186 -0.401 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.454 14.019 1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.900 13.541 1.916 1.00 0.00 H new ATOM 0 HG3 GLU A 10 15.268 13.333 0.216 1.00 0.00 H new ATOM 117 N VAL A 11 10.500 11.985 1.015 1.00 0.00 N ATOM 118 CA VAL A 11 9.215 11.502 0.526 1.00 0.00 C ATOM 119 C VAL A 11 8.651 12.428 -0.545 1.00 0.00 C ATOM 120 O VAL A 11 8.125 13.501 -0.241 1.00 0.00 O ATOM 121 CB VAL A 11 8.191 11.376 1.671 1.00 0.00 C ATOM 122 CG1 VAL A 11 6.845 10.915 1.135 1.00 0.00 C ATOM 123 CG2 VAL A 11 8.704 10.424 2.741 1.00 0.00 C ATOM 0 H VAL A 11 10.450 12.857 1.542 1.00 0.00 H new ATOM 0 HA VAL A 11 9.390 10.517 0.094 1.00 0.00 H new ATOM 0 HB VAL A 11 8.056 12.358 2.125 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.135 10.832 1.958 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.475 11.639 0.409 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.958 9.944 0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.969 10.347 3.542 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.869 9.439 2.303 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.643 10.803 3.145 1.00 0.00 H new ATOM 133 N LEU A 12 8.763 12.008 -1.801 1.00 0.00 N ATOM 134 CA LEU A 12 8.262 12.801 -2.919 1.00 0.00 C ATOM 135 C LEU A 12 6.770 12.566 -3.129 1.00 0.00 C ATOM 136 O LEU A 12 5.986 13.512 -3.183 1.00 0.00 O ATOM 137 CB LEU A 12 9.029 12.454 -4.197 1.00 0.00 C ATOM 138 CG LEU A 12 10.508 12.105 -4.020 1.00 0.00 C ATOM 139 CD1 LEU A 12 11.197 11.997 -5.371 1.00 0.00 C ATOM 140 CD2 LEU A 12 11.198 13.142 -3.147 1.00 0.00 C ATOM 0 H LEU A 12 9.196 11.124 -2.070 1.00 0.00 H new ATOM 0 HA LEU A 12 8.415 13.854 -2.683 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.532 11.611 -4.677 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.955 13.299 -4.882 1.00 0.00 H new ATOM 0 HG LEU A 12 10.577 11.137 -3.523 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.248 11.748 -5.225 1.00 0.00 H new ATOM 0 HD12 LEU A 12 10.718 11.216 -5.962 1.00 0.00 H new ATOM 0 HD13 LEU A 12 11.119 12.949 -5.896 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.249 12.879 -3.031 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.119 14.123 -3.616 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.721 13.169 -2.167 1.00 0.00 H new ATOM 152 N GLN A 13 6.385 11.298 -3.243 1.00 0.00 N ATOM 153 CA GLN A 13 4.987 10.941 -3.444 1.00 0.00 C ATOM 154 C GLN A 13 4.474 10.076 -2.296 1.00 0.00 C ATOM 155 O GLN A 13 4.623 8.854 -2.312 1.00 0.00 O ATOM 156 CB GLN A 13 4.814 10.200 -4.771 1.00 0.00 C ATOM 157 CG GLN A 13 3.373 10.147 -5.255 1.00 0.00 C ATOM 158 CD GLN A 13 3.018 11.312 -6.159 1.00 0.00 C ATOM 159 OE1 GLN A 13 2.289 12.220 -5.760 1.00 0.00 O ATOM 160 NE2 GLN A 13 3.533 11.291 -7.382 1.00 0.00 N ATOM 0 H GLN A 13 7.022 10.502 -3.199 1.00 0.00 H new ATOM 0 HA GLN A 13 4.404 11.862 -3.470 1.00 0.00 H new ATOM 0 HB2 GLN A 13 5.426 10.685 -5.531 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.189 9.183 -4.661 1.00 0.00 H new ATOM 0 HG2 GLN A 13 3.208 9.212 -5.791 1.00 0.00 H new ATOM 0 HG3 GLN A 13 2.704 10.143 -4.394 1.00 0.00 H new ATOM 0 HE21 GLN A 13 4.133 10.518 -7.670 1.00 0.00 H new ATOM 0 HE22 GLN A 13 3.329 12.048 -8.034 1.00 0.00 H new ATOM 169 N ASP A 14 3.873 10.720 -1.302 1.00 0.00 N ATOM 170 CA ASP A 14 3.338 10.009 -0.145 1.00 0.00 C ATOM 171 C ASP A 14 2.073 9.243 -0.516 1.00 0.00 C ATOM 172 O ASP A 14 1.368 9.606 -1.458 1.00 0.00 O ATOM 173 CB ASP A 14 3.042 10.990 0.990 1.00 0.00 C ATOM 174 CG ASP A 14 2.060 10.429 2.000 1.00 0.00 C ATOM 175 OD1 ASP A 14 2.465 9.556 2.797 1.00 0.00 O ATOM 176 OD2 ASP A 14 0.889 10.860 1.992 1.00 0.00 O ATOM 0 H ASP A 14 3.744 11.731 -1.273 1.00 0.00 H new ATOM 0 HA ASP A 14 4.088 9.293 0.191 1.00 0.00 H new ATOM 0 HB2 ASP A 14 3.973 11.246 1.496 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.641 11.914 0.573 1.00 0.00 H new ATOM 181 N ILE A 15 1.790 8.181 0.231 1.00 0.00 N ATOM 182 CA ILE A 15 0.610 7.363 -0.019 1.00 0.00 C ATOM 183 C ILE A 15 -0.581 7.853 0.799 1.00 0.00 C ATOM 184 O ILE A 15 -0.413 8.468 1.852 1.00 0.00 O ATOM 185 CB ILE A 15 0.871 5.882 0.311 1.00 0.00 C ATOM 186 CG1 ILE A 15 1.741 5.761 1.564 1.00 0.00 C ATOM 187 CG2 ILE A 15 1.531 5.185 -0.869 1.00 0.00 C ATOM 188 CD1 ILE A 15 1.664 4.403 2.224 1.00 0.00 C ATOM 0 H ILE A 15 2.362 7.867 1.015 1.00 0.00 H new ATOM 0 HA ILE A 15 0.381 7.455 -1.081 1.00 0.00 H new ATOM 0 HB ILE A 15 -0.084 5.395 0.507 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.778 5.969 1.298 1.00 0.00 H new ATOM 0 HG13 ILE A 15 1.437 6.523 2.282 1.00 0.00 H new ATOM 0 HG21 ILE A 15 1.709 4.139 -0.620 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.877 5.245 -1.739 1.00 0.00 H new ATOM 0 HG23 ILE A 15 2.480 5.671 -1.094 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.306 4.390 3.105 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.635 4.201 2.521 1.00 0.00 H new ATOM 0 HD13 ILE A 15 1.996 3.638 1.522 1.00 0.00 H new ATOM 200 N ALA A 16 -1.784 7.574 0.308 1.00 0.00 N ATOM 201 CA ALA A 16 -3.003 7.982 0.994 1.00 0.00 C ATOM 202 C ALA A 16 -3.942 6.798 1.195 1.00 0.00 C ATOM 203 O ALA A 16 -3.851 5.794 0.489 1.00 0.00 O ATOM 204 CB ALA A 16 -3.702 9.087 0.216 1.00 0.00 C ATOM 0 H ALA A 16 -1.940 7.067 -0.563 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.727 8.364 1.977 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -4.611 9.382 0.740 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.038 9.947 0.129 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.958 8.725 -0.780 1.00 0.00 H new ATOM 210 N ASP A 17 -4.844 6.923 2.163 1.00 0.00 N ATOM 211 CA ASP A 17 -5.801 5.862 2.457 1.00 0.00 C ATOM 212 C ASP A 17 -6.447 5.343 1.176 1.00 0.00 C ATOM 213 O ASP A 17 -6.640 6.092 0.217 1.00 0.00 O ATOM 214 CB ASP A 17 -6.878 6.369 3.416 1.00 0.00 C ATOM 215 CG ASP A 17 -7.305 7.792 3.109 1.00 0.00 C ATOM 216 OD1 ASP A 17 -7.315 8.164 1.917 1.00 0.00 O ATOM 217 OD2 ASP A 17 -7.627 8.533 4.060 1.00 0.00 O ATOM 0 H ASP A 17 -4.932 7.748 2.757 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.262 5.041 2.930 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -7.747 5.713 3.362 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.503 6.318 4.438 1.00 0.00 H new ATOM 222 N LEU A 18 -6.779 4.056 1.166 1.00 0.00 N ATOM 223 CA LEU A 18 -7.402 3.436 0.002 1.00 0.00 C ATOM 224 C LEU A 18 -8.708 2.747 0.387 1.00 0.00 C ATOM 225 O LEU A 18 -8.716 1.808 1.184 1.00 0.00 O ATOM 226 CB LEU A 18 -6.447 2.425 -0.635 1.00 0.00 C ATOM 227 CG LEU A 18 -6.602 2.212 -2.141 1.00 0.00 C ATOM 228 CD1 LEU A 18 -6.041 3.398 -2.909 1.00 0.00 C ATOM 229 CD2 LEU A 18 -5.915 0.923 -2.570 1.00 0.00 C ATOM 0 H LEU A 18 -6.627 3.422 1.951 1.00 0.00 H new ATOM 0 HA LEU A 18 -7.625 4.220 -0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.425 2.747 -0.437 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.581 1.465 -0.137 1.00 0.00 H new ATOM 0 HG LEU A 18 -7.665 2.128 -2.369 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.160 3.228 -3.979 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.577 4.303 -2.623 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.983 3.515 -2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.035 0.787 -3.645 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.854 0.978 -2.328 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.364 0.080 -2.045 1.00 0.00 H new ATOM 241 N THR A 19 -9.810 3.216 -0.187 1.00 0.00 N ATOM 242 CA THR A 19 -11.121 2.646 0.094 1.00 0.00 C ATOM 243 C THR A 19 -11.525 1.641 -0.979 1.00 0.00 C ATOM 244 O THR A 19 -11.690 1.996 -2.147 1.00 0.00 O ATOM 245 CB THR A 19 -12.201 3.740 0.190 1.00 0.00 C ATOM 246 OG1 THR A 19 -11.660 4.910 0.811 1.00 0.00 O ATOM 247 CG2 THR A 19 -13.402 3.247 0.985 1.00 0.00 C ATOM 0 H THR A 19 -9.821 3.991 -0.851 1.00 0.00 H new ATOM 0 HA THR A 19 -11.045 2.137 1.055 1.00 0.00 H new ATOM 0 HB THR A 19 -12.529 3.985 -0.820 1.00 0.00 H new ATOM 0 HG1 THR A 19 -12.353 5.601 0.866 1.00 0.00 H new ATOM 0 HG21 THR A 19 -14.151 4.037 1.039 1.00 0.00 H new ATOM 0 HG22 THR A 19 -13.830 2.374 0.493 1.00 0.00 H new ATOM 0 HG23 THR A 19 -13.086 2.977 1.993 1.00 0.00 H new ATOM 255 N VAL A 20 -11.684 0.384 -0.577 1.00 0.00 N ATOM 256 CA VAL A 20 -12.071 -0.672 -1.503 1.00 0.00 C ATOM 257 C VAL A 20 -13.162 -1.555 -0.907 1.00 0.00 C ATOM 258 O VAL A 20 -13.533 -1.403 0.257 1.00 0.00 O ATOM 259 CB VAL A 20 -10.866 -1.552 -1.886 1.00 0.00 C ATOM 260 CG1 VAL A 20 -10.022 -0.867 -2.950 1.00 0.00 C ATOM 261 CG2 VAL A 20 -10.031 -1.875 -0.657 1.00 0.00 C ATOM 0 H VAL A 20 -11.550 0.073 0.385 1.00 0.00 H new ATOM 0 HA VAL A 20 -12.454 -0.182 -2.398 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.239 -2.489 -2.300 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -9.175 -1.503 -3.208 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.629 -0.692 -3.839 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.656 0.086 -2.567 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -9.184 -2.497 -0.946 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.666 -0.950 -0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.644 -2.410 0.069 1.00 0.00 H new ATOM 271 N LYS A 21 -13.673 -2.480 -1.712 1.00 0.00 N ATOM 272 CA LYS A 21 -14.721 -3.390 -1.266 1.00 0.00 C ATOM 273 C LYS A 21 -14.282 -4.843 -1.420 1.00 0.00 C ATOM 274 O LYS A 21 -13.195 -5.122 -1.926 1.00 0.00 O ATOM 275 CB LYS A 21 -16.007 -3.148 -2.058 1.00 0.00 C ATOM 276 CG LYS A 21 -16.297 -1.679 -2.313 1.00 0.00 C ATOM 277 CD LYS A 21 -17.108 -1.482 -3.583 1.00 0.00 C ATOM 278 CE LYS A 21 -17.802 -0.129 -3.598 1.00 0.00 C ATOM 279 NZ LYS A 21 -18.607 0.068 -4.835 1.00 0.00 N ATOM 0 H LYS A 21 -13.378 -2.619 -2.678 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.910 -3.196 -0.210 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.938 -3.667 -3.014 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -16.845 -3.587 -1.517 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.840 -1.262 -1.465 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.358 -1.130 -2.391 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.453 -1.566 -4.450 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -17.852 -2.274 -3.667 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -18.450 -0.044 -2.726 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.057 0.662 -3.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -19.064 1.002 -4.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -17.985 0.012 -5.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -19.335 -0.672 -4.897 1.00 0.00 H new ATOM 293 N ALA A 22 -15.134 -5.764 -0.983 1.00 0.00 N ATOM 294 CA ALA A 22 -14.836 -7.187 -1.076 1.00 0.00 C ATOM 295 C ALA A 22 -14.639 -7.612 -2.527 1.00 0.00 C ATOM 296 O ALA A 22 -15.437 -7.270 -3.398 1.00 0.00 O ATOM 297 CB ALA A 22 -15.947 -8.003 -0.432 1.00 0.00 C ATOM 0 H ALA A 22 -16.037 -5.549 -0.561 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.906 -7.374 -0.540 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.711 -9.064 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -16.039 -7.727 0.618 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -16.889 -7.803 -0.943 1.00 0.00 H new ATOM 303 N ALA A 23 -13.570 -8.361 -2.779 1.00 0.00 N ATOM 304 CA ALA A 23 -13.269 -8.835 -4.125 1.00 0.00 C ATOM 305 C ALA A 23 -12.888 -7.677 -5.042 1.00 0.00 C ATOM 306 O ALA A 23 -13.422 -7.545 -6.143 1.00 0.00 O ATOM 307 CB ALA A 23 -14.457 -9.594 -4.696 1.00 0.00 C ATOM 0 H ALA A 23 -12.898 -8.653 -2.069 1.00 0.00 H new ATOM 0 HA ALA A 23 -12.416 -9.511 -4.063 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -14.218 -9.942 -5.701 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -14.682 -10.450 -4.060 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.324 -8.935 -4.737 1.00 0.00 H new ATOM 313 N GLU A 24 -11.964 -6.840 -4.580 1.00 0.00 N ATOM 314 CA GLU A 24 -11.515 -5.693 -5.359 1.00 0.00 C ATOM 315 C GLU A 24 -9.993 -5.672 -5.468 1.00 0.00 C ATOM 316 O GLU A 24 -9.314 -6.584 -4.996 1.00 0.00 O ATOM 317 CB GLU A 24 -12.010 -4.392 -4.724 1.00 0.00 C ATOM 318 CG GLU A 24 -13.434 -4.029 -5.111 1.00 0.00 C ATOM 319 CD GLU A 24 -13.525 -3.418 -6.496 1.00 0.00 C ATOM 320 OE1 GLU A 24 -13.066 -4.064 -7.461 1.00 0.00 O ATOM 321 OE2 GLU A 24 -14.053 -2.293 -6.615 1.00 0.00 O ATOM 0 H GLU A 24 -11.512 -6.935 -3.670 1.00 0.00 H new ATOM 0 HA GLU A 24 -11.933 -5.781 -6.362 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.949 -4.481 -3.639 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.345 -3.579 -5.016 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.056 -4.923 -5.071 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -13.837 -3.327 -4.381 1.00 0.00 H new ATOM 328 N GLN A 25 -9.465 -4.623 -6.092 1.00 0.00 N ATOM 329 CA GLN A 25 -8.024 -4.485 -6.264 1.00 0.00 C ATOM 330 C GLN A 25 -7.523 -3.189 -5.633 1.00 0.00 C ATOM 331 O GLN A 25 -7.938 -2.097 -6.022 1.00 0.00 O ATOM 332 CB GLN A 25 -7.661 -4.515 -7.751 1.00 0.00 C ATOM 333 CG GLN A 25 -6.178 -4.319 -8.018 1.00 0.00 C ATOM 334 CD GLN A 25 -5.856 -4.245 -9.499 1.00 0.00 C ATOM 335 OE1 GLN A 25 -6.053 -3.210 -10.137 1.00 0.00 O ATOM 336 NE2 GLN A 25 -5.359 -5.344 -10.053 1.00 0.00 N ATOM 0 H GLN A 25 -10.013 -3.858 -6.486 1.00 0.00 H new ATOM 0 HA GLN A 25 -7.541 -5.324 -5.762 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -7.975 -5.469 -8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -8.221 -3.737 -8.269 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -5.843 -3.403 -7.531 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -5.620 -5.141 -7.569 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -5.212 -6.179 -9.486 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -5.124 -5.353 -11.045 1.00 0.00 H new ATOM 345 N ALA A 26 -6.630 -3.319 -4.658 1.00 0.00 N ATOM 346 CA ALA A 26 -6.072 -2.158 -3.974 1.00 0.00 C ATOM 347 C ALA A 26 -4.620 -1.927 -4.382 1.00 0.00 C ATOM 348 O ALA A 26 -3.757 -2.773 -4.148 1.00 0.00 O ATOM 349 CB ALA A 26 -6.177 -2.333 -2.467 1.00 0.00 C ATOM 0 H ALA A 26 -6.277 -4.216 -4.324 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.649 -1.281 -4.268 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.757 -1.459 -1.969 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.224 -2.442 -2.186 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.625 -3.223 -2.165 1.00 0.00 H new ATOM 355 N VAL A 27 -4.358 -0.777 -4.993 1.00 0.00 N ATOM 356 CA VAL A 27 -3.011 -0.434 -5.432 1.00 0.00 C ATOM 357 C VAL A 27 -2.504 0.817 -4.725 1.00 0.00 C ATOM 358 O VAL A 27 -3.209 1.822 -4.634 1.00 0.00 O ATOM 359 CB VAL A 27 -2.958 -0.206 -6.954 1.00 0.00 C ATOM 360 CG1 VAL A 27 -1.532 0.077 -7.403 1.00 0.00 C ATOM 361 CG2 VAL A 27 -3.529 -1.407 -7.692 1.00 0.00 C ATOM 0 H VAL A 27 -5.061 -0.066 -5.195 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.371 -1.278 -5.175 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.568 0.664 -7.195 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.515 0.235 -8.481 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.162 0.970 -6.899 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.896 -0.771 -7.151 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.484 -1.229 -8.766 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.947 -2.295 -7.447 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.566 -1.559 -7.393 1.00 0.00 H new ATOM 371 N PHE A 28 -1.275 0.749 -4.223 1.00 0.00 N ATOM 372 CA PHE A 28 -0.672 1.877 -3.522 1.00 0.00 C ATOM 373 C PHE A 28 0.580 2.362 -4.246 1.00 0.00 C ATOM 374 O PHE A 28 1.548 1.617 -4.407 1.00 0.00 O ATOM 375 CB PHE A 28 -0.323 1.485 -2.085 1.00 0.00 C ATOM 376 CG PHE A 28 -1.523 1.343 -1.193 1.00 0.00 C ATOM 377 CD1 PHE A 28 -2.102 2.457 -0.607 1.00 0.00 C ATOM 378 CD2 PHE A 28 -2.073 0.096 -0.943 1.00 0.00 C ATOM 379 CE1 PHE A 28 -3.206 2.329 0.214 1.00 0.00 C ATOM 380 CE2 PHE A 28 -3.179 -0.037 -0.123 1.00 0.00 C ATOM 381 CZ PHE A 28 -3.746 1.081 0.456 1.00 0.00 C ATOM 0 H PHE A 28 -0.677 -0.075 -4.289 1.00 0.00 H new ATOM 0 HA PHE A 28 -1.398 2.690 -3.504 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.224 0.542 -2.097 1.00 0.00 H new ATOM 0 HB3 PHE A 28 0.345 2.236 -1.664 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -1.686 3.436 -0.794 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.633 -0.782 -1.393 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.647 3.205 0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -3.599 -1.014 0.064 1.00 0.00 H new ATOM 0 HZ PHE A 28 -4.610 0.980 1.097 1.00 0.00 H new ATOM 391 N LYS A 29 0.555 3.617 -4.684 1.00 0.00 N ATOM 392 CA LYS A 29 1.687 4.203 -5.392 1.00 0.00 C ATOM 393 C LYS A 29 2.423 5.205 -4.507 1.00 0.00 C ATOM 394 O LYS A 29 1.801 5.949 -3.746 1.00 0.00 O ATOM 395 CB LYS A 29 1.212 4.893 -6.673 1.00 0.00 C ATOM 396 CG LYS A 29 2.333 5.543 -7.466 1.00 0.00 C ATOM 397 CD LYS A 29 1.793 6.363 -8.625 1.00 0.00 C ATOM 398 CE LYS A 29 1.634 5.517 -9.880 1.00 0.00 C ATOM 399 NZ LYS A 29 0.926 6.258 -10.960 1.00 0.00 N ATOM 0 H LYS A 29 -0.237 4.248 -4.561 1.00 0.00 H new ATOM 0 HA LYS A 29 2.376 3.399 -5.652 1.00 0.00 H new ATOM 0 HB2 LYS A 29 0.709 4.161 -7.305 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.474 5.652 -6.414 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.921 6.184 -6.809 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.005 4.773 -7.846 1.00 0.00 H new ATOM 0 HD2 LYS A 29 0.830 6.793 -8.350 1.00 0.00 H new ATOM 0 HD3 LYS A 29 2.467 7.195 -8.829 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.616 5.206 -10.236 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.081 4.609 -9.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 0.837 5.649 -11.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.021 6.533 -10.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 1.467 7.111 -11.208 1.00 0.00 H new ATOM 413 N CYS A 30 3.747 5.218 -4.611 1.00 0.00 N ATOM 414 CA CYS A 30 4.566 6.130 -3.820 1.00 0.00 C ATOM 415 C CYS A 30 5.850 6.489 -4.561 1.00 0.00 C ATOM 416 O CYS A 30 6.201 5.855 -5.555 1.00 0.00 O ATOM 417 CB CYS A 30 4.904 5.500 -2.467 1.00 0.00 C ATOM 418 SG CYS A 30 5.022 3.696 -2.500 1.00 0.00 S ATOM 0 H CYS A 30 4.276 4.608 -5.234 1.00 0.00 H new ATOM 0 HA CYS A 30 3.995 7.044 -3.656 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.851 5.909 -2.115 1.00 0.00 H new ATOM 0 HB3 CYS A 30 4.143 5.790 -1.743 1.00 0.00 H new ATOM 0 HG CYS A 30 4.076 3.186 -1.768 1.00 0.00 H new ATOM 424 N GLU A 31 6.543 7.512 -4.072 1.00 0.00 N ATOM 425 CA GLU A 31 7.786 7.957 -4.690 1.00 0.00 C ATOM 426 C GLU A 31 8.801 8.378 -3.631 1.00 0.00 C ATOM 427 O GLU A 31 8.435 8.870 -2.564 1.00 0.00 O ATOM 428 CB GLU A 31 7.517 9.122 -5.645 1.00 0.00 C ATOM 429 CG GLU A 31 8.635 9.358 -6.649 1.00 0.00 C ATOM 430 CD GLU A 31 8.543 10.716 -7.315 1.00 0.00 C ATOM 431 OE1 GLU A 31 7.750 11.558 -6.844 1.00 0.00 O ATOM 432 OE2 GLU A 31 9.265 10.939 -8.310 1.00 0.00 O ATOM 0 H GLU A 31 6.265 8.048 -3.250 1.00 0.00 H new ATOM 0 HA GLU A 31 8.201 7.121 -5.254 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.590 8.931 -6.185 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.366 10.031 -5.062 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.597 9.270 -6.144 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.603 8.580 -7.412 1.00 0.00 H new ATOM 439 N VAL A 32 10.080 8.179 -3.935 1.00 0.00 N ATOM 440 CA VAL A 32 11.149 8.537 -3.010 1.00 0.00 C ATOM 441 C VAL A 32 12.304 9.214 -3.740 1.00 0.00 C ATOM 442 O VAL A 32 12.273 9.369 -4.961 1.00 0.00 O ATOM 443 CB VAL A 32 11.683 7.301 -2.263 1.00 0.00 C ATOM 444 CG1 VAL A 32 10.731 6.897 -1.147 1.00 0.00 C ATOM 445 CG2 VAL A 32 11.901 6.148 -3.231 1.00 0.00 C ATOM 0 H VAL A 32 10.401 7.772 -4.814 1.00 0.00 H new ATOM 0 HA VAL A 32 10.722 9.232 -2.287 1.00 0.00 H new ATOM 0 HB VAL A 32 12.643 7.557 -1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.126 6.022 -0.631 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.629 7.720 -0.440 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.755 6.659 -1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.279 5.282 -2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.956 5.892 -3.710 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.625 6.443 -3.991 1.00 0.00 H new ATOM 455 N SER A 33 13.321 9.614 -2.985 1.00 0.00 N ATOM 456 CA SER A 33 14.485 10.278 -3.560 1.00 0.00 C ATOM 457 C SER A 33 15.609 9.279 -3.815 1.00 0.00 C ATOM 458 O SER A 33 16.783 9.647 -3.866 1.00 0.00 O ATOM 459 CB SER A 33 14.977 11.388 -2.629 1.00 0.00 C ATOM 460 OG SER A 33 15.848 10.874 -1.637 1.00 0.00 O ATOM 0 H SER A 33 13.363 9.490 -1.973 1.00 0.00 H new ATOM 0 HA SER A 33 14.188 10.717 -4.513 1.00 0.00 H new ATOM 0 HB2 SER A 33 15.494 12.152 -3.210 1.00 0.00 H new ATOM 0 HB3 SER A 33 14.124 11.872 -2.153 1.00 0.00 H new ATOM 0 HG SER A 33 16.149 11.604 -1.056 1.00 0.00 H new ATOM 466 N ASP A 34 15.240 8.012 -3.975 1.00 0.00 N ATOM 467 CA ASP A 34 16.216 6.958 -4.227 1.00 0.00 C ATOM 468 C ASP A 34 15.560 5.762 -4.909 1.00 0.00 C ATOM 469 O ASP A 34 14.634 5.158 -4.368 1.00 0.00 O ATOM 470 CB ASP A 34 16.873 6.517 -2.918 1.00 0.00 C ATOM 471 CG ASP A 34 18.280 5.991 -3.123 1.00 0.00 C ATOM 472 OD1 ASP A 34 18.487 5.207 -4.073 1.00 0.00 O ATOM 473 OD2 ASP A 34 19.173 6.365 -2.335 1.00 0.00 O ATOM 0 H ASP A 34 14.273 7.691 -3.935 1.00 0.00 H new ATOM 0 HA ASP A 34 16.982 7.358 -4.892 1.00 0.00 H new ATOM 0 HB2 ASP A 34 16.901 7.360 -2.227 1.00 0.00 H new ATOM 0 HB3 ASP A 34 16.263 5.743 -2.452 1.00 0.00 H new ATOM 478 N GLU A 35 16.046 5.426 -6.101 1.00 0.00 N ATOM 479 CA GLU A 35 15.505 4.303 -6.857 1.00 0.00 C ATOM 480 C GLU A 35 16.115 2.986 -6.387 1.00 0.00 C ATOM 481 O GLU A 35 15.479 1.934 -6.455 1.00 0.00 O ATOM 482 CB GLU A 35 15.765 4.494 -8.353 1.00 0.00 C ATOM 483 CG GLU A 35 17.209 4.246 -8.756 1.00 0.00 C ATOM 484 CD GLU A 35 18.079 5.478 -8.593 1.00 0.00 C ATOM 485 OE1 GLU A 35 17.864 6.457 -9.337 1.00 0.00 O ATOM 486 OE2 GLU A 35 18.976 5.461 -7.725 1.00 0.00 O ATOM 0 H GLU A 35 16.813 5.915 -6.563 1.00 0.00 H new ATOM 0 HA GLU A 35 14.429 4.267 -6.684 1.00 0.00 H new ATOM 0 HB2 GLU A 35 15.119 3.819 -8.915 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.487 5.510 -8.635 1.00 0.00 H new ATOM 0 HG2 GLU A 35 17.617 3.435 -8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 35 17.241 3.918 -9.795 1.00 0.00 H new ATOM 493 N LYS A 36 17.354 3.051 -5.912 1.00 0.00 N ATOM 494 CA LYS A 36 18.052 1.865 -5.429 1.00 0.00 C ATOM 495 C LYS A 36 17.412 1.340 -4.149 1.00 0.00 C ATOM 496 O LYS A 36 17.319 0.129 -3.942 1.00 0.00 O ATOM 497 CB LYS A 36 19.529 2.185 -5.179 1.00 0.00 C ATOM 498 CG LYS A 36 20.203 2.894 -6.340 1.00 0.00 C ATOM 499 CD LYS A 36 20.819 1.906 -7.316 1.00 0.00 C ATOM 500 CE LYS A 36 19.838 1.521 -8.414 1.00 0.00 C ATOM 501 NZ LYS A 36 20.312 0.345 -9.194 1.00 0.00 N ATOM 0 H LYS A 36 17.896 3.913 -5.851 1.00 0.00 H new ATOM 0 HA LYS A 36 17.977 1.093 -6.195 1.00 0.00 H new ATOM 0 HB2 LYS A 36 19.611 2.807 -4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 36 20.063 1.258 -4.971 1.00 0.00 H new ATOM 0 HG2 LYS A 36 19.474 3.515 -6.861 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.976 3.562 -5.960 1.00 0.00 H new ATOM 0 HD2 LYS A 36 21.713 2.343 -7.762 1.00 0.00 H new ATOM 0 HD3 LYS A 36 21.135 1.012 -6.779 1.00 0.00 H new ATOM 0 HE2 LYS A 36 18.868 1.296 -7.971 1.00 0.00 H new ATOM 0 HE3 LYS A 36 19.694 2.368 -9.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 19.616 0.114 -9.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 21.226 0.568 -9.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 20.425 -0.470 -8.558 1.00 0.00 H new ATOM 515 N VAL A 37 16.969 2.256 -3.294 1.00 0.00 N ATOM 516 CA VAL A 37 16.333 1.884 -2.036 1.00 0.00 C ATOM 517 C VAL A 37 15.210 0.878 -2.263 1.00 0.00 C ATOM 518 O VAL A 37 14.499 0.940 -3.266 1.00 0.00 O ATOM 519 CB VAL A 37 15.764 3.116 -1.309 1.00 0.00 C ATOM 520 CG1 VAL A 37 14.536 3.645 -2.034 1.00 0.00 C ATOM 521 CG2 VAL A 37 15.434 2.777 0.137 1.00 0.00 C ATOM 0 H VAL A 37 17.039 3.262 -3.450 1.00 0.00 H new ATOM 0 HA VAL A 37 17.104 1.429 -1.415 1.00 0.00 H new ATOM 0 HB VAL A 37 16.523 3.899 -1.311 1.00 0.00 H new ATOM 0 HG11 VAL A 37 14.148 4.516 -1.505 1.00 0.00 H new ATOM 0 HG12 VAL A 37 14.808 3.929 -3.051 1.00 0.00 H new ATOM 0 HG13 VAL A 37 13.771 2.870 -2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.033 3.660 0.635 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.693 1.978 0.163 1.00 0.00 H new ATOM 0 HG23 VAL A 37 16.339 2.451 0.650 1.00 0.00 H new ATOM 531 N THR A 38 15.055 -0.051 -1.324 1.00 0.00 N ATOM 532 CA THR A 38 14.020 -1.071 -1.421 1.00 0.00 C ATOM 533 C THR A 38 13.354 -1.310 -0.071 1.00 0.00 C ATOM 534 O THR A 38 13.980 -1.815 0.860 1.00 0.00 O ATOM 535 CB THR A 38 14.590 -2.403 -1.943 1.00 0.00 C ATOM 536 OG1 THR A 38 15.443 -2.991 -0.953 1.00 0.00 O ATOM 537 CG2 THR A 38 15.371 -2.191 -3.231 1.00 0.00 C ATOM 0 H THR A 38 15.634 -0.117 -0.487 1.00 0.00 H new ATOM 0 HA THR A 38 13.278 -0.701 -2.128 1.00 0.00 H new ATOM 0 HB THR A 38 13.756 -3.074 -2.150 1.00 0.00 H new ATOM 0 HG1 THR A 38 15.325 -2.523 -0.100 1.00 0.00 H new ATOM 0 HG21 THR A 38 15.764 -3.146 -3.580 1.00 0.00 H new ATOM 0 HG22 THR A 38 14.712 -1.770 -3.991 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.197 -1.505 -3.047 1.00 0.00 H new ATOM 545 N GLY A 39 12.080 -0.942 0.029 1.00 0.00 N ATOM 546 CA GLY A 39 11.351 -1.126 1.271 1.00 0.00 C ATOM 547 C GLY A 39 10.274 -2.188 1.159 1.00 0.00 C ATOM 548 O GLY A 39 10.056 -2.751 0.086 1.00 0.00 O ATOM 0 H GLY A 39 11.540 -0.520 -0.727 1.00 0.00 H new ATOM 0 HA2 GLY A 39 12.049 -1.403 2.061 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.895 -0.180 1.565 1.00 0.00 H new ATOM 552 N LYS A 40 9.600 -2.462 2.271 1.00 0.00 N ATOM 553 CA LYS A 40 8.540 -3.464 2.295 1.00 0.00 C ATOM 554 C LYS A 40 7.258 -2.884 2.884 1.00 0.00 C ATOM 555 O LYS A 40 7.297 -1.936 3.668 1.00 0.00 O ATOM 556 CB LYS A 40 8.982 -4.683 3.108 1.00 0.00 C ATOM 557 CG LYS A 40 10.005 -5.552 2.394 1.00 0.00 C ATOM 558 CD LYS A 40 9.335 -6.650 1.586 1.00 0.00 C ATOM 559 CE LYS A 40 8.863 -6.139 0.234 1.00 0.00 C ATOM 560 NZ LYS A 40 7.461 -5.639 0.288 1.00 0.00 N ATOM 0 H LYS A 40 9.769 -2.005 3.167 1.00 0.00 H new ATOM 0 HA LYS A 40 8.341 -3.772 1.269 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.403 -4.345 4.055 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.107 -5.288 3.346 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.613 -4.933 1.734 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.680 -5.997 3.125 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.034 -7.474 1.441 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.486 -7.046 2.143 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.522 -5.338 -0.101 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.935 -6.940 -0.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.852 -6.251 -0.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.126 -5.650 1.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.425 -4.666 -0.079 1.00 0.00 H new ATOM 574 N TRP A 41 6.125 -3.461 2.502 1.00 0.00 N ATOM 575 CA TRP A 41 4.831 -3.002 2.993 1.00 0.00 C ATOM 576 C TRP A 41 4.419 -3.772 4.244 1.00 0.00 C ATOM 577 O TRP A 41 4.394 -5.003 4.246 1.00 0.00 O ATOM 578 CB TRP A 41 3.764 -3.161 1.908 1.00 0.00 C ATOM 579 CG TRP A 41 4.047 -2.356 0.676 1.00 0.00 C ATOM 580 CD1 TRP A 41 4.907 -2.678 -0.335 1.00 0.00 C ATOM 581 CD2 TRP A 41 3.468 -1.094 0.326 1.00 0.00 C ATOM 582 NE1 TRP A 41 4.898 -1.692 -1.292 1.00 0.00 N ATOM 583 CE2 TRP A 41 4.024 -0.710 -0.911 1.00 0.00 C ATOM 584 CE3 TRP A 41 2.535 -0.251 0.936 1.00 0.00 C ATOM 585 CZ2 TRP A 41 3.676 0.480 -1.546 1.00 0.00 C ATOM 586 CZ3 TRP A 41 2.191 0.929 0.304 1.00 0.00 C ATOM 587 CH2 TRP A 41 2.759 1.285 -0.926 1.00 0.00 C ATOM 0 H TRP A 41 6.076 -4.247 1.854 1.00 0.00 H new ATOM 0 HA TRP A 41 4.922 -1.947 3.251 1.00 0.00 H new ATOM 0 HB2 TRP A 41 3.686 -4.214 1.636 1.00 0.00 H new ATOM 0 HB3 TRP A 41 2.797 -2.864 2.313 1.00 0.00 H new ATOM 0 HD1 TRP A 41 5.506 -3.576 -0.376 1.00 0.00 H new ATOM 0 HE1 TRP A 41 5.453 -1.692 -2.148 1.00 0.00 H new ATOM 0 HE3 TRP A 41 2.091 -0.517 1.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 4.114 0.757 -2.493 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.472 1.588 0.767 1.00 0.00 H new ATOM 0 HH2 TRP A 41 2.467 2.213 -1.395 1.00 0.00 H new ATOM 598 N TYR A 42 4.096 -3.040 5.304 1.00 0.00 N ATOM 599 CA TYR A 42 3.689 -3.654 6.562 1.00 0.00 C ATOM 600 C TYR A 42 2.213 -3.387 6.846 1.00 0.00 C ATOM 601 O TYR A 42 1.722 -2.275 6.648 1.00 0.00 O ATOM 602 CB TYR A 42 4.545 -3.127 7.713 1.00 0.00 C ATOM 603 CG TYR A 42 6.006 -3.501 7.603 1.00 0.00 C ATOM 604 CD1 TYR A 42 6.891 -2.720 6.871 1.00 0.00 C ATOM 605 CD2 TYR A 42 6.500 -4.638 8.230 1.00 0.00 C ATOM 606 CE1 TYR A 42 8.226 -3.059 6.767 1.00 0.00 C ATOM 607 CE2 TYR A 42 7.835 -4.985 8.132 1.00 0.00 C ATOM 608 CZ TYR A 42 8.693 -4.192 7.400 1.00 0.00 C ATOM 609 OH TYR A 42 10.021 -4.533 7.299 1.00 0.00 O ATOM 0 H TYR A 42 4.108 -2.020 5.317 1.00 0.00 H new ATOM 0 HA TYR A 42 3.835 -4.731 6.475 1.00 0.00 H new ATOM 0 HB2 TYR A 42 4.459 -2.041 7.751 1.00 0.00 H new ATOM 0 HB3 TYR A 42 4.150 -3.511 8.654 1.00 0.00 H new ATOM 0 HD1 TYR A 42 6.529 -1.832 6.374 1.00 0.00 H new ATOM 0 HD2 TYR A 42 5.830 -5.261 8.804 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.900 -2.440 6.193 1.00 0.00 H new ATOM 0 HE2 TYR A 42 8.203 -5.872 8.626 1.00 0.00 H new ATOM 0 HH TYR A 42 10.186 -5.357 7.803 1.00 0.00 H new ATOM 619 N LYS A 43 1.512 -4.414 7.311 1.00 0.00 N ATOM 620 CA LYS A 43 0.093 -4.292 7.624 1.00 0.00 C ATOM 621 C LYS A 43 -0.175 -4.655 9.082 1.00 0.00 C ATOM 622 O LYS A 43 -0.212 -5.831 9.441 1.00 0.00 O ATOM 623 CB LYS A 43 -0.734 -5.192 6.703 1.00 0.00 C ATOM 624 CG LYS A 43 -2.209 -5.242 7.065 1.00 0.00 C ATOM 625 CD LYS A 43 -3.074 -5.491 5.841 1.00 0.00 C ATOM 626 CE LYS A 43 -3.273 -6.978 5.592 1.00 0.00 C ATOM 627 NZ LYS A 43 -2.057 -7.610 5.008 1.00 0.00 N ATOM 0 H LYS A 43 1.903 -5.341 7.480 1.00 0.00 H new ATOM 0 HA LYS A 43 -0.200 -3.254 7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -0.632 -4.839 5.677 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -0.326 -6.202 6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -2.378 -6.031 7.798 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.502 -4.303 7.534 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.043 -5.011 5.975 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.610 -5.034 4.967 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -3.525 -7.473 6.530 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.117 -7.124 4.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -2.324 -8.487 4.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.616 -6.955 4.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -1.381 -7.830 5.767 1.00 0.00 H new ATOM 641 N ASN A 44 -0.364 -3.639 9.916 1.00 0.00 N ATOM 642 CA ASN A 44 -0.629 -3.851 11.334 1.00 0.00 C ATOM 643 C ASN A 44 0.522 -4.602 11.996 1.00 0.00 C ATOM 644 O ASN A 44 0.306 -5.481 12.829 1.00 0.00 O ATOM 645 CB ASN A 44 -1.933 -4.629 11.519 1.00 0.00 C ATOM 646 CG ASN A 44 -3.144 -3.720 11.595 1.00 0.00 C ATOM 647 OD1 ASN A 44 -3.118 -2.689 12.267 1.00 0.00 O ATOM 648 ND2 ASN A 44 -4.213 -4.097 10.903 1.00 0.00 N ATOM 0 H ASN A 44 -0.339 -2.659 9.634 1.00 0.00 H new ATOM 0 HA ASN A 44 -0.725 -2.875 11.810 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -2.057 -5.326 10.690 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -1.871 -5.224 12.430 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -5.057 -3.524 10.915 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -4.190 -4.960 10.359 1.00 0.00 H new ATOM 655 N GLY A 45 1.747 -4.248 11.619 1.00 0.00 N ATOM 656 CA GLY A 45 2.914 -4.898 12.187 1.00 0.00 C ATOM 657 C GLY A 45 3.148 -6.278 11.607 1.00 0.00 C ATOM 658 O GLY A 45 3.534 -7.202 12.324 1.00 0.00 O ATOM 0 H GLY A 45 1.952 -3.523 10.931 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.793 -4.279 12.010 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.792 -4.977 13.267 1.00 0.00 H new ATOM 662 N VAL A 46 2.913 -6.421 10.307 1.00 0.00 N ATOM 663 CA VAL A 46 3.100 -7.700 9.632 1.00 0.00 C ATOM 664 C VAL A 46 3.645 -7.503 8.223 1.00 0.00 C ATOM 665 O VAL A 46 3.040 -6.808 7.406 1.00 0.00 O ATOM 666 CB VAL A 46 1.781 -8.492 9.555 1.00 0.00 C ATOM 667 CG1 VAL A 46 1.987 -9.802 8.812 1.00 0.00 C ATOM 668 CG2 VAL A 46 1.228 -8.742 10.951 1.00 0.00 C ATOM 0 H VAL A 46 2.593 -5.667 9.700 1.00 0.00 H new ATOM 0 HA VAL A 46 3.821 -8.266 10.221 1.00 0.00 H new ATOM 0 HB VAL A 46 1.053 -7.899 9.001 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.044 -10.347 8.768 1.00 0.00 H new ATOM 0 HG12 VAL A 46 2.334 -9.595 7.800 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.730 -10.404 9.335 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.296 -9.303 10.878 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.951 -9.314 11.532 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.040 -7.788 11.444 1.00 0.00 H new ATOM 678 N GLU A 47 4.789 -8.120 7.944 1.00 0.00 N ATOM 679 CA GLU A 47 5.414 -8.011 6.631 1.00 0.00 C ATOM 680 C GLU A 47 4.478 -8.519 5.539 1.00 0.00 C ATOM 681 O GLU A 47 3.998 -9.652 5.593 1.00 0.00 O ATOM 682 CB GLU A 47 6.726 -8.798 6.601 1.00 0.00 C ATOM 683 CG GLU A 47 7.548 -8.564 5.345 1.00 0.00 C ATOM 684 CD GLU A 47 8.952 -9.128 5.451 1.00 0.00 C ATOM 685 OE1 GLU A 47 9.819 -8.450 6.042 1.00 0.00 O ATOM 686 OE2 GLU A 47 9.183 -10.245 4.944 1.00 0.00 O ATOM 0 H GLU A 47 5.301 -8.700 8.609 1.00 0.00 H new ATOM 0 HA GLU A 47 5.625 -6.958 6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 47 7.323 -8.526 7.472 1.00 0.00 H new ATOM 0 HB3 GLU A 47 6.504 -9.862 6.687 1.00 0.00 H new ATOM 0 HG2 GLU A 47 7.041 -9.019 4.494 1.00 0.00 H new ATOM 0 HG3 GLU A 47 7.605 -7.494 5.147 1.00 0.00 H new ATOM 693 N VAL A 48 4.223 -7.673 4.546 1.00 0.00 N ATOM 694 CA VAL A 48 3.345 -8.035 3.439 1.00 0.00 C ATOM 695 C VAL A 48 4.132 -8.673 2.300 1.00 0.00 C ATOM 696 O VAL A 48 5.176 -8.163 1.892 1.00 0.00 O ATOM 697 CB VAL A 48 2.585 -6.808 2.901 1.00 0.00 C ATOM 698 CG1 VAL A 48 1.715 -7.197 1.715 1.00 0.00 C ATOM 699 CG2 VAL A 48 1.748 -6.176 4.003 1.00 0.00 C ATOM 0 H VAL A 48 4.612 -6.732 4.485 1.00 0.00 H new ATOM 0 HA VAL A 48 2.626 -8.756 3.828 1.00 0.00 H new ATOM 0 HB VAL A 48 3.312 -6.071 2.561 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.186 -6.318 1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.342 -7.601 0.920 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.993 -7.952 2.026 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.218 -5.310 3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.027 -6.904 4.375 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.399 -5.860 4.818 1.00 0.00 H new ATOM 709 N ARG A 49 3.623 -9.789 1.789 1.00 0.00 N ATOM 710 CA ARG A 49 4.279 -10.497 0.696 1.00 0.00 C ATOM 711 C ARG A 49 3.307 -10.740 -0.454 1.00 0.00 C ATOM 712 O ARG A 49 2.100 -10.882 -0.260 1.00 0.00 O ATOM 713 CB ARG A 49 4.845 -11.829 1.190 1.00 0.00 C ATOM 714 CG ARG A 49 5.868 -11.681 2.304 1.00 0.00 C ATOM 715 CD ARG A 49 7.237 -11.307 1.757 1.00 0.00 C ATOM 716 NE ARG A 49 8.316 -11.740 2.641 1.00 0.00 N ATOM 717 CZ ARG A 49 8.773 -12.987 2.688 1.00 0.00 C ATOM 718 NH1 ARG A 49 8.247 -13.919 1.905 1.00 0.00 N ATOM 719 NH2 ARG A 49 9.757 -13.303 3.519 1.00 0.00 N ATOM 0 H ARG A 49 2.759 -10.222 2.114 1.00 0.00 H new ATOM 0 HA ARG A 49 5.097 -9.875 0.332 1.00 0.00 H new ATOM 0 HB2 ARG A 49 4.025 -12.454 1.542 1.00 0.00 H new ATOM 0 HB3 ARG A 49 5.306 -12.351 0.352 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.535 -10.917 3.007 1.00 0.00 H new ATOM 0 HG3 ARG A 49 5.940 -12.616 2.860 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.370 -11.759 0.774 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.291 -10.227 1.622 1.00 0.00 H new ATOM 0 HE ARG A 49 8.742 -11.047 3.256 1.00 0.00 H new ATOM 0 HH11 ARG A 49 7.490 -13.679 1.265 1.00 0.00 H new ATOM 0 HH12 ARG A 49 8.600 -14.875 1.943 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.164 -12.589 4.123 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.107 -14.260 3.554 1.00 0.00 H new ATOM 733 N PRO A 50 3.844 -10.788 -1.683 1.00 0.00 N ATOM 734 CA PRO A 50 3.042 -11.013 -2.890 1.00 0.00 C ATOM 735 C PRO A 50 2.497 -12.435 -2.965 1.00 0.00 C ATOM 736 O PRO A 50 3.144 -13.383 -2.519 1.00 0.00 O ATOM 737 CB PRO A 50 4.033 -10.759 -4.027 1.00 0.00 C ATOM 738 CG PRO A 50 5.371 -11.035 -3.433 1.00 0.00 C ATOM 739 CD PRO A 50 5.275 -10.626 -1.989 1.00 0.00 C ATOM 0 HA PRO A 50 2.163 -10.369 -2.922 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.835 -11.412 -4.877 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.965 -9.733 -4.390 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.628 -12.090 -3.523 1.00 0.00 H new ATOM 0 HG3 PRO A 50 6.150 -10.472 -3.947 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.896 -11.255 -1.351 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.604 -9.598 -1.840 1.00 0.00 H new ATOM 747 N SER A 51 1.304 -12.578 -3.534 1.00 0.00 N ATOM 748 CA SER A 51 0.670 -13.885 -3.666 1.00 0.00 C ATOM 749 C SER A 51 -0.135 -13.970 -4.958 1.00 0.00 C ATOM 750 O SER A 51 -0.214 -13.006 -5.720 1.00 0.00 O ATOM 751 CB SER A 51 -0.239 -14.157 -2.466 1.00 0.00 C ATOM 752 OG SER A 51 -0.847 -12.962 -2.005 1.00 0.00 O ATOM 0 H SER A 51 0.757 -11.804 -3.911 1.00 0.00 H new ATOM 0 HA SER A 51 1.455 -14.641 -3.697 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.009 -14.876 -2.745 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.341 -14.607 -1.661 1.00 0.00 H new ATOM 0 HG SER A 51 -1.424 -13.163 -1.239 1.00 0.00 H new ATOM 758 N LYS A 52 -0.731 -15.132 -5.200 1.00 0.00 N ATOM 759 CA LYS A 52 -1.532 -15.347 -6.399 1.00 0.00 C ATOM 760 C LYS A 52 -2.392 -14.124 -6.705 1.00 0.00 C ATOM 761 O LYS A 52 -2.508 -13.709 -7.858 1.00 0.00 O ATOM 762 CB LYS A 52 -2.423 -16.580 -6.230 1.00 0.00 C ATOM 763 CG LYS A 52 -1.742 -17.881 -6.618 1.00 0.00 C ATOM 764 CD LYS A 52 -0.880 -18.419 -5.490 1.00 0.00 C ATOM 765 CE LYS A 52 -0.140 -19.681 -5.905 1.00 0.00 C ATOM 766 NZ LYS A 52 1.047 -19.937 -5.043 1.00 0.00 N ATOM 0 H LYS A 52 -0.674 -15.941 -4.581 1.00 0.00 H new ATOM 0 HA LYS A 52 -0.852 -15.511 -7.235 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.746 -16.645 -5.191 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.321 -16.455 -6.836 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.496 -18.621 -6.885 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.126 -17.720 -7.503 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.161 -17.658 -5.186 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -1.505 -18.632 -4.623 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.818 -20.533 -5.852 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.178 -19.590 -6.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.524 -20.806 -5.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.706 -19.135 -5.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.741 -20.049 -4.055 1.00 0.00 H new ATOM 780 N ARG A 53 -2.991 -13.552 -5.666 1.00 0.00 N ATOM 781 CA ARG A 53 -3.840 -12.378 -5.824 1.00 0.00 C ATOM 782 C ARG A 53 -3.030 -11.096 -5.658 1.00 0.00 C ATOM 783 O ARG A 53 -3.116 -10.184 -6.481 1.00 0.00 O ATOM 784 CB ARG A 53 -4.983 -12.407 -4.808 1.00 0.00 C ATOM 785 CG ARG A 53 -4.524 -12.218 -3.370 1.00 0.00 C ATOM 786 CD ARG A 53 -5.590 -12.665 -2.382 1.00 0.00 C ATOM 787 NE ARG A 53 -5.739 -14.118 -2.358 1.00 0.00 N ATOM 788 CZ ARG A 53 -6.518 -14.762 -1.498 1.00 0.00 C ATOM 789 NH1 ARG A 53 -7.217 -14.086 -0.595 1.00 0.00 N ATOM 790 NH2 ARG A 53 -6.601 -16.087 -1.538 1.00 0.00 N ATOM 0 H ARG A 53 -2.904 -13.883 -4.705 1.00 0.00 H new ATOM 0 HA ARG A 53 -4.258 -12.396 -6.830 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -5.700 -11.625 -5.058 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -5.508 -13.359 -4.891 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -3.609 -12.786 -3.201 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -4.284 -11.169 -3.198 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -5.331 -12.311 -1.384 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -6.543 -12.207 -2.645 1.00 0.00 H new ATOM 0 HE ARG A 53 -5.216 -14.668 -3.040 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -7.156 -13.068 -0.560 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.815 -14.584 0.065 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -6.066 -16.611 -2.230 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -7.200 -16.581 -0.876 1.00 0.00 H new ATOM 804 N ILE A 54 -2.243 -11.033 -4.589 1.00 0.00 N ATOM 805 CA ILE A 54 -1.417 -9.864 -4.316 1.00 0.00 C ATOM 806 C ILE A 54 -0.215 -9.809 -5.253 1.00 0.00 C ATOM 807 O ILE A 54 0.555 -10.765 -5.350 1.00 0.00 O ATOM 808 CB ILE A 54 -0.919 -9.854 -2.859 1.00 0.00 C ATOM 809 CG1 ILE A 54 -2.099 -9.709 -1.895 1.00 0.00 C ATOM 810 CG2 ILE A 54 0.084 -8.729 -2.650 1.00 0.00 C ATOM 811 CD1 ILE A 54 -1.682 -9.484 -0.459 1.00 0.00 C ATOM 0 H ILE A 54 -2.160 -11.778 -3.898 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.045 -8.989 -4.482 1.00 0.00 H new ATOM 0 HB ILE A 54 -0.421 -10.802 -2.654 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -2.722 -8.875 -2.219 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -2.715 -10.607 -1.950 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.427 -8.735 -1.615 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.935 -8.872 -3.315 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.391 -7.773 -2.869 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.569 -9.390 0.167 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.084 -10.329 -0.117 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -1.091 -8.570 -0.390 1.00 0.00 H new ATOM 823 N THR A 55 -0.058 -8.683 -5.941 1.00 0.00 N ATOM 824 CA THR A 55 1.051 -8.501 -6.869 1.00 0.00 C ATOM 825 C THR A 55 1.792 -7.199 -6.593 1.00 0.00 C ATOM 826 O THR A 55 1.251 -6.111 -6.792 1.00 0.00 O ATOM 827 CB THR A 55 0.565 -8.503 -8.331 1.00 0.00 C ATOM 828 OG1 THR A 55 -0.151 -9.710 -8.609 1.00 0.00 O ATOM 829 CG2 THR A 55 1.738 -8.371 -9.291 1.00 0.00 C ATOM 0 H THR A 55 -0.686 -7.882 -5.873 1.00 0.00 H new ATOM 0 HA THR A 55 1.730 -9.340 -6.718 1.00 0.00 H new ATOM 0 HB THR A 55 -0.097 -7.649 -8.471 1.00 0.00 H new ATOM 0 HG1 THR A 55 -0.457 -9.702 -9.540 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.371 -8.375 -10.317 1.00 0.00 H new ATOM 0 HG22 THR A 55 2.263 -7.436 -9.097 1.00 0.00 H new ATOM 0 HG23 THR A 55 2.422 -9.208 -9.147 1.00 0.00 H new ATOM 837 N ILE A 56 3.033 -7.316 -6.134 1.00 0.00 N ATOM 838 CA ILE A 56 3.850 -6.147 -5.833 1.00 0.00 C ATOM 839 C ILE A 56 4.859 -5.879 -6.944 1.00 0.00 C ATOM 840 O ILE A 56 5.596 -6.776 -7.356 1.00 0.00 O ATOM 841 CB ILE A 56 4.603 -6.314 -4.499 1.00 0.00 C ATOM 842 CG1 ILE A 56 3.627 -6.237 -3.324 1.00 0.00 C ATOM 843 CG2 ILE A 56 5.686 -5.254 -4.366 1.00 0.00 C ATOM 844 CD1 ILE A 56 4.171 -6.837 -2.046 1.00 0.00 C ATOM 0 H ILE A 56 3.495 -8.209 -5.962 1.00 0.00 H new ATOM 0 HA ILE A 56 3.169 -5.299 -5.753 1.00 0.00 H new ATOM 0 HB ILE A 56 5.079 -7.295 -4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.369 -5.193 -3.145 1.00 0.00 H new ATOM 0 HG13 ILE A 56 2.705 -6.752 -3.594 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.209 -5.385 -3.419 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.395 -5.353 -5.188 1.00 0.00 H new ATOM 0 HG23 ILE A 56 5.231 -4.264 -4.395 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.426 -6.747 -1.256 1.00 0.00 H new ATOM 0 HD12 ILE A 56 4.403 -7.890 -2.208 1.00 0.00 H new ATOM 0 HD13 ILE A 56 5.077 -6.307 -1.752 1.00 0.00 H new ATOM 856 N SER A 57 4.890 -4.639 -7.423 1.00 0.00 N ATOM 857 CA SER A 57 5.808 -4.254 -8.488 1.00 0.00 C ATOM 858 C SER A 57 6.736 -3.135 -8.026 1.00 0.00 C ATOM 859 O SER A 57 6.420 -2.395 -7.093 1.00 0.00 O ATOM 860 CB SER A 57 5.028 -3.807 -9.725 1.00 0.00 C ATOM 861 OG SER A 57 5.859 -3.791 -10.873 1.00 0.00 O ATOM 0 H SER A 57 4.290 -3.884 -7.090 1.00 0.00 H new ATOM 0 HA SER A 57 6.414 -5.123 -8.744 1.00 0.00 H new ATOM 0 HB2 SER A 57 4.186 -4.479 -9.891 1.00 0.00 H new ATOM 0 HB3 SER A 57 4.614 -2.813 -9.558 1.00 0.00 H new ATOM 0 HG SER A 57 5.337 -3.504 -11.651 1.00 0.00 H new ATOM 867 N HIS A 58 7.883 -3.015 -8.687 1.00 0.00 N ATOM 868 CA HIS A 58 8.858 -1.985 -8.345 1.00 0.00 C ATOM 869 C HIS A 58 9.333 -1.251 -9.596 1.00 0.00 C ATOM 870 O HIS A 58 9.975 -1.837 -10.467 1.00 0.00 O ATOM 871 CB HIS A 58 10.052 -2.604 -7.620 1.00 0.00 C ATOM 872 CG HIS A 58 11.027 -1.593 -7.099 1.00 0.00 C ATOM 873 ND1 HIS A 58 11.836 -1.821 -6.005 1.00 0.00 N ATOM 874 CD2 HIS A 58 11.320 -0.343 -7.527 1.00 0.00 C ATOM 875 CE1 HIS A 58 12.584 -0.755 -5.784 1.00 0.00 C ATOM 876 NE2 HIS A 58 12.291 0.156 -6.695 1.00 0.00 N ATOM 0 H HIS A 58 8.160 -3.618 -9.462 1.00 0.00 H new ATOM 0 HA HIS A 58 8.374 -1.266 -7.684 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.688 -3.208 -6.789 1.00 0.00 H new ATOM 0 HB3 HIS A 58 10.570 -3.279 -8.301 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.873 0.167 -8.367 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.311 -0.647 -4.993 1.00 0.00 H new ATOM 0 HE2 HIS A 58 12.717 1.080 -6.768 1.00 0.00 H new ATOM 885 N VAL A 59 9.011 0.037 -9.678 1.00 0.00 N ATOM 886 CA VAL A 59 9.405 0.852 -10.820 1.00 0.00 C ATOM 887 C VAL A 59 10.309 2.002 -10.391 1.00 0.00 C ATOM 888 O VAL A 59 9.838 3.018 -9.882 1.00 0.00 O ATOM 889 CB VAL A 59 8.176 1.424 -11.552 1.00 0.00 C ATOM 890 CG1 VAL A 59 8.608 2.258 -12.749 1.00 0.00 C ATOM 891 CG2 VAL A 59 7.242 0.303 -11.981 1.00 0.00 C ATOM 0 H VAL A 59 8.478 0.537 -8.967 1.00 0.00 H new ATOM 0 HA VAL A 59 9.953 0.199 -11.500 1.00 0.00 H new ATOM 0 HB VAL A 59 7.634 2.073 -10.864 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.727 2.654 -13.254 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.234 3.084 -12.410 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.174 1.635 -13.442 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.379 0.725 -12.496 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.770 -0.374 -12.652 1.00 0.00 H new ATOM 0 HG23 VAL A 59 6.906 -0.247 -11.102 1.00 0.00 H new ATOM 901 N GLY A 60 11.611 1.834 -10.600 1.00 0.00 N ATOM 902 CA GLY A 60 12.561 2.867 -10.229 1.00 0.00 C ATOM 903 C GLY A 60 12.265 3.464 -8.868 1.00 0.00 C ATOM 904 O GLY A 60 12.248 2.754 -7.861 1.00 0.00 O ATOM 0 H GLY A 60 12.025 1.001 -11.019 1.00 0.00 H new ATOM 0 HA2 GLY A 60 13.567 2.448 -10.227 1.00 0.00 H new ATOM 0 HA3 GLY A 60 12.546 3.657 -10.980 1.00 0.00 H new ATOM 908 N ARG A 61 12.033 4.772 -8.834 1.00 0.00 N ATOM 909 CA ARG A 61 11.741 5.465 -7.585 1.00 0.00 C ATOM 910 C ARG A 61 10.244 5.443 -7.290 1.00 0.00 C ATOM 911 O ARG A 61 9.699 6.389 -6.720 1.00 0.00 O ATOM 912 CB ARG A 61 12.237 6.911 -7.650 1.00 0.00 C ATOM 913 CG ARG A 61 13.694 7.035 -8.066 1.00 0.00 C ATOM 914 CD ARG A 61 14.139 8.489 -8.103 1.00 0.00 C ATOM 915 NE ARG A 61 13.755 9.147 -9.349 1.00 0.00 N ATOM 916 CZ ARG A 61 14.267 8.836 -10.534 1.00 0.00 C ATOM 917 NH1 ARG A 61 15.181 7.880 -10.634 1.00 0.00 N ATOM 918 NH2 ARG A 61 13.867 9.480 -11.622 1.00 0.00 N ATOM 0 H ARG A 61 12.042 5.374 -9.658 1.00 0.00 H new ATOM 0 HA ARG A 61 12.262 4.946 -6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 61 11.618 7.468 -8.354 1.00 0.00 H new ATOM 0 HB3 ARG A 61 12.106 7.376 -6.673 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.321 6.479 -7.370 1.00 0.00 H new ATOM 0 HG3 ARG A 61 13.833 6.585 -9.049 1.00 0.00 H new ATOM 0 HD2 ARG A 61 13.701 9.024 -7.260 1.00 0.00 H new ATOM 0 HD3 ARG A 61 15.221 8.540 -7.985 1.00 0.00 H new ATOM 0 HE ARG A 61 13.054 9.887 -9.307 1.00 0.00 H new ATOM 0 HH11 ARG A 61 15.492 7.382 -9.800 1.00 0.00 H new ATOM 0 HH12 ARG A 61 15.573 7.643 -11.545 1.00 0.00 H new ATOM 0 HH21 ARG A 61 13.165 10.216 -11.550 1.00 0.00 H new ATOM 0 HH22 ARG A 61 14.262 9.239 -12.531 1.00 0.00 H new ATOM 932 N PHE A 62 9.584 4.358 -7.681 1.00 0.00 N ATOM 933 CA PHE A 62 8.151 4.212 -7.460 1.00 0.00 C ATOM 934 C PHE A 62 7.800 2.775 -7.089 1.00 0.00 C ATOM 935 O PHE A 62 8.207 1.831 -7.766 1.00 0.00 O ATOM 936 CB PHE A 62 7.375 4.632 -8.711 1.00 0.00 C ATOM 937 CG PHE A 62 7.451 6.105 -8.998 1.00 0.00 C ATOM 938 CD1 PHE A 62 8.567 6.646 -9.614 1.00 0.00 C ATOM 939 CD2 PHE A 62 6.407 6.946 -8.651 1.00 0.00 C ATOM 940 CE1 PHE A 62 8.641 8.001 -9.880 1.00 0.00 C ATOM 941 CE2 PHE A 62 6.475 8.301 -8.915 1.00 0.00 C ATOM 942 CZ PHE A 62 7.593 8.830 -9.529 1.00 0.00 C ATOM 0 H PHE A 62 10.020 3.566 -8.153 1.00 0.00 H new ATOM 0 HA PHE A 62 7.869 4.861 -6.631 1.00 0.00 H new ATOM 0 HB2 PHE A 62 7.761 4.082 -9.570 1.00 0.00 H new ATOM 0 HB3 PHE A 62 6.330 4.346 -8.593 1.00 0.00 H new ATOM 0 HD1 PHE A 62 9.389 6.002 -9.890 1.00 0.00 H new ATOM 0 HD2 PHE A 62 5.530 6.539 -8.169 1.00 0.00 H new ATOM 0 HE1 PHE A 62 9.517 8.411 -10.361 1.00 0.00 H new ATOM 0 HE2 PHE A 62 5.653 8.946 -8.641 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.648 9.889 -9.734 1.00 0.00 H new ATOM 952 N HIS A 63 7.041 2.617 -6.008 1.00 0.00 N ATOM 953 CA HIS A 63 6.635 1.295 -5.547 1.00 0.00 C ATOM 954 C HIS A 63 5.135 1.089 -5.738 1.00 0.00 C ATOM 955 O HIS A 63 4.347 2.024 -5.600 1.00 0.00 O ATOM 956 CB HIS A 63 7.002 1.111 -4.074 1.00 0.00 C ATOM 957 CG HIS A 63 8.469 0.918 -3.842 1.00 0.00 C ATOM 958 ND1 HIS A 63 9.006 -0.254 -3.351 1.00 0.00 N ATOM 959 CD2 HIS A 63 9.514 1.755 -4.039 1.00 0.00 C ATOM 960 CE1 HIS A 63 10.318 -0.128 -3.254 1.00 0.00 C ATOM 961 NE2 HIS A 63 10.652 1.082 -3.666 1.00 0.00 N ATOM 0 H HIS A 63 6.696 3.388 -5.436 1.00 0.00 H new ATOM 0 HA HIS A 63 7.165 0.552 -6.142 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.665 1.982 -3.513 1.00 0.00 H new ATOM 0 HB3 HIS A 63 6.464 0.250 -3.679 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.463 2.765 -4.419 1.00 0.00 H new ATOM 0 HE1 HIS A 63 11.001 -0.885 -2.898 1.00 0.00 H new ATOM 0 HE2 HIS A 63 11.600 1.456 -3.701 1.00 0.00 H new ATOM 970 N LYS A 64 4.748 -0.141 -6.059 1.00 0.00 N ATOM 971 CA LYS A 64 3.344 -0.471 -6.270 1.00 0.00 C ATOM 972 C LYS A 64 2.977 -1.771 -5.561 1.00 0.00 C ATOM 973 O LYS A 64 3.733 -2.743 -5.593 1.00 0.00 O ATOM 974 CB LYS A 64 3.045 -0.593 -7.766 1.00 0.00 C ATOM 975 CG LYS A 64 1.582 -0.856 -8.076 1.00 0.00 C ATOM 976 CD LYS A 64 1.324 -0.880 -9.573 1.00 0.00 C ATOM 977 CE LYS A 64 0.088 -1.699 -9.913 1.00 0.00 C ATOM 978 NZ LYS A 64 -0.262 -1.600 -11.356 1.00 0.00 N ATOM 0 H LYS A 64 5.388 -0.926 -6.179 1.00 0.00 H new ATOM 0 HA LYS A 64 2.742 0.335 -5.850 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.354 0.325 -8.265 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.647 -1.401 -8.183 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.282 -1.809 -7.639 1.00 0.00 H new ATOM 0 HG3 LYS A 64 0.967 -0.085 -7.612 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.198 0.139 -9.938 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.191 -1.297 -10.086 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.261 -2.743 -9.652 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.753 -1.355 -9.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.109 -2.172 -11.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.452 -0.607 -11.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 0.530 -1.952 -11.930 1.00 0.00 H new ATOM 992 N LEU A 65 1.813 -1.783 -4.922 1.00 0.00 N ATOM 993 CA LEU A 65 1.345 -2.965 -4.205 1.00 0.00 C ATOM 994 C LEU A 65 -0.100 -3.285 -4.569 1.00 0.00 C ATOM 995 O LEU A 65 -1.031 -2.632 -4.098 1.00 0.00 O ATOM 996 CB LEU A 65 1.467 -2.751 -2.696 1.00 0.00 C ATOM 997 CG LEU A 65 0.643 -3.692 -1.816 1.00 0.00 C ATOM 998 CD1 LEU A 65 1.364 -5.019 -1.632 1.00 0.00 C ATOM 999 CD2 LEU A 65 0.356 -3.047 -0.468 1.00 0.00 C ATOM 0 H LEU A 65 1.175 -0.988 -4.885 1.00 0.00 H new ATOM 0 HA LEU A 65 1.970 -3.809 -4.498 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.516 -2.852 -2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.175 -1.726 -2.470 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.308 -3.885 -2.314 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.763 -5.676 -1.003 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.517 -5.488 -2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 65 2.329 -4.846 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.231 -3.731 0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.296 -2.824 0.036 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.203 -2.123 -0.618 1.00 0.00 H new ATOM 1011 N VAL A 66 -0.282 -4.299 -5.411 1.00 0.00 N ATOM 1012 CA VAL A 66 -1.616 -4.709 -5.837 1.00 0.00 C ATOM 1013 C VAL A 66 -2.176 -5.791 -4.920 1.00 0.00 C ATOM 1014 O VAL A 66 -1.484 -6.751 -4.580 1.00 0.00 O ATOM 1015 CB VAL A 66 -1.606 -5.234 -7.285 1.00 0.00 C ATOM 1016 CG1 VAL A 66 -3.024 -5.339 -7.824 1.00 0.00 C ATOM 1017 CG2 VAL A 66 -0.755 -4.336 -8.170 1.00 0.00 C ATOM 0 H VAL A 66 0.477 -4.851 -5.811 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.252 -3.825 -5.783 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.167 -6.232 -7.289 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.997 -5.711 -8.848 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.599 -6.026 -7.203 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.493 -4.355 -7.808 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.759 -4.721 -9.190 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.163 -3.325 -8.162 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.268 -4.317 -7.793 1.00 0.00 H new ATOM 1027 N ILE A 67 -3.433 -5.629 -4.522 1.00 0.00 N ATOM 1028 CA ILE A 67 -4.088 -6.592 -3.646 1.00 0.00 C ATOM 1029 C ILE A 67 -5.425 -7.042 -4.224 1.00 0.00 C ATOM 1030 O ILE A 67 -6.429 -6.337 -4.114 1.00 0.00 O ATOM 1031 CB ILE A 67 -4.319 -6.007 -2.240 1.00 0.00 C ATOM 1032 CG1 ILE A 67 -2.993 -5.898 -1.484 1.00 0.00 C ATOM 1033 CG2 ILE A 67 -5.308 -6.866 -1.465 1.00 0.00 C ATOM 1034 CD1 ILE A 67 -3.140 -5.344 -0.084 1.00 0.00 C ATOM 0 H ILE A 67 -4.019 -4.839 -4.793 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.422 -7.451 -3.568 1.00 0.00 H new ATOM 0 HB ILE A 67 -4.739 -5.007 -2.344 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.533 -6.885 -1.429 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.313 -5.260 -2.049 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.461 -6.440 -0.473 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -6.259 -6.897 -1.997 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.914 -7.878 -1.368 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.161 -5.295 0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.571 -4.344 -0.132 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.794 -5.994 0.498 1.00 0.00 H new ATOM 1046 N ASP A 68 -5.432 -8.219 -4.839 1.00 0.00 N ATOM 1047 CA ASP A 68 -6.647 -8.765 -5.433 1.00 0.00 C ATOM 1048 C ASP A 68 -7.473 -9.510 -4.389 1.00 0.00 C ATOM 1049 O ASP A 68 -6.980 -9.839 -3.311 1.00 0.00 O ATOM 1050 CB ASP A 68 -6.297 -9.703 -6.589 1.00 0.00 C ATOM 1051 CG ASP A 68 -6.199 -8.975 -7.916 1.00 0.00 C ATOM 1052 OD1 ASP A 68 -6.978 -8.023 -8.129 1.00 0.00 O ATOM 1053 OD2 ASP A 68 -5.341 -9.357 -8.739 1.00 0.00 O ATOM 0 H ASP A 68 -4.610 -8.814 -4.939 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.241 -7.935 -5.816 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -5.349 -10.197 -6.378 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -7.054 -10.484 -6.661 1.00 0.00 H new ATOM 1058 N ASP A 69 -8.733 -9.772 -4.718 1.00 0.00 N ATOM 1059 CA ASP A 69 -9.630 -10.478 -3.810 1.00 0.00 C ATOM 1060 C ASP A 69 -9.626 -9.828 -2.430 1.00 0.00 C ATOM 1061 O ASP A 69 -9.586 -10.516 -1.408 1.00 0.00 O ATOM 1062 CB ASP A 69 -9.223 -11.948 -3.697 1.00 0.00 C ATOM 1063 CG ASP A 69 -10.405 -12.857 -3.423 1.00 0.00 C ATOM 1064 OD1 ASP A 69 -11.032 -13.322 -4.396 1.00 0.00 O ATOM 1065 OD2 ASP A 69 -10.702 -13.101 -2.235 1.00 0.00 O ATOM 0 H ASP A 69 -9.157 -9.506 -5.607 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.640 -10.420 -4.217 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -8.736 -12.259 -4.621 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.490 -12.059 -2.898 1.00 0.00 H new ATOM 1070 N VAL A 70 -9.666 -8.500 -2.406 1.00 0.00 N ATOM 1071 CA VAL A 70 -9.667 -7.757 -1.150 1.00 0.00 C ATOM 1072 C VAL A 70 -10.419 -8.518 -0.063 1.00 0.00 C ATOM 1073 O VAL A 70 -11.607 -8.806 -0.203 1.00 0.00 O ATOM 1074 CB VAL A 70 -10.303 -6.365 -1.322 1.00 0.00 C ATOM 1075 CG1 VAL A 70 -10.651 -5.767 0.032 1.00 0.00 C ATOM 1076 CG2 VAL A 70 -9.372 -5.447 -2.099 1.00 0.00 C ATOM 0 H VAL A 70 -9.698 -7.916 -3.242 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.626 -7.637 -0.851 1.00 0.00 H new ATOM 0 HB VAL A 70 -11.226 -6.473 -1.892 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -11.099 -4.784 -0.109 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -11.358 -6.418 0.546 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.745 -5.670 0.631 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -9.837 -4.468 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -8.431 -5.342 -1.559 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -9.180 -5.873 -3.084 1.00 0.00 H new ATOM 1086 N ARG A 71 -9.719 -8.838 1.019 1.00 0.00 N ATOM 1087 CA ARG A 71 -10.319 -9.565 2.131 1.00 0.00 C ATOM 1088 C ARG A 71 -10.835 -8.601 3.196 1.00 0.00 C ATOM 1089 O ARG A 71 -10.394 -7.456 3.298 1.00 0.00 O ATOM 1090 CB ARG A 71 -9.302 -10.527 2.748 1.00 0.00 C ATOM 1091 CG ARG A 71 -7.901 -9.947 2.854 1.00 0.00 C ATOM 1092 CD ARG A 71 -6.961 -10.891 3.586 1.00 0.00 C ATOM 1093 NE ARG A 71 -7.661 -11.696 4.583 1.00 0.00 N ATOM 1094 CZ ARG A 71 -8.286 -12.835 4.302 1.00 0.00 C ATOM 1095 NH1 ARG A 71 -8.299 -13.298 3.060 1.00 0.00 N ATOM 1096 NH2 ARG A 71 -8.901 -13.510 5.264 1.00 0.00 N ATOM 0 H ARG A 71 -8.735 -8.605 1.150 1.00 0.00 H new ATOM 0 HA ARG A 71 -11.162 -10.138 1.745 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -9.643 -10.814 3.743 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -9.265 -11.437 2.149 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -7.512 -9.747 1.855 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -7.940 -8.992 3.378 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.474 -11.549 2.866 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.175 -10.314 4.073 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.671 -11.366 5.548 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -7.829 -12.780 2.318 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -8.779 -14.172 2.847 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.895 -13.155 6.220 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.380 -14.384 5.048 1.00 0.00 H new ATOM 1110 N PRO A 72 -11.793 -9.073 4.008 1.00 0.00 N ATOM 1111 CA PRO A 72 -12.389 -8.270 5.079 1.00 0.00 C ATOM 1112 C PRO A 72 -11.412 -8.009 6.221 1.00 0.00 C ATOM 1113 O PRO A 72 -11.769 -7.396 7.226 1.00 0.00 O ATOM 1114 CB PRO A 72 -13.557 -9.133 5.561 1.00 0.00 C ATOM 1115 CG PRO A 72 -13.168 -10.528 5.211 1.00 0.00 C ATOM 1116 CD PRO A 72 -12.365 -10.428 3.943 1.00 0.00 C ATOM 0 HA PRO A 72 -12.687 -7.282 4.729 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.714 -9.023 6.634 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.488 -8.847 5.072 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.581 -10.982 6.010 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.048 -11.154 5.067 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -11.588 -11.191 3.898 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -12.990 -10.558 3.060 1.00 0.00 H new ATOM 1124 N GLU A 73 -10.180 -8.478 6.057 1.00 0.00 N ATOM 1125 CA GLU A 73 -9.152 -8.295 7.076 1.00 0.00 C ATOM 1126 C GLU A 73 -8.047 -7.371 6.574 1.00 0.00 C ATOM 1127 O GLU A 73 -7.170 -6.964 7.336 1.00 0.00 O ATOM 1128 CB GLU A 73 -8.558 -9.646 7.482 1.00 0.00 C ATOM 1129 CG GLU A 73 -9.561 -10.786 7.446 1.00 0.00 C ATOM 1130 CD GLU A 73 -9.218 -11.895 8.423 1.00 0.00 C ATOM 1131 OE1 GLU A 73 -8.899 -11.580 9.589 1.00 0.00 O ATOM 1132 OE2 GLU A 73 -9.270 -13.077 8.023 1.00 0.00 O ATOM 0 H GLU A 73 -9.869 -8.987 5.230 1.00 0.00 H new ATOM 0 HA GLU A 73 -9.618 -7.835 7.947 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.727 -9.883 6.817 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -8.148 -9.566 8.489 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.554 -10.399 7.675 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.604 -11.196 6.437 1.00 0.00 H new ATOM 1139 N ASP A 74 -8.095 -7.046 5.287 1.00 0.00 N ATOM 1140 CA ASP A 74 -7.099 -6.170 4.681 1.00 0.00 C ATOM 1141 C ASP A 74 -7.110 -4.795 5.342 1.00 0.00 C ATOM 1142 O ASP A 74 -6.061 -4.186 5.546 1.00 0.00 O ATOM 1143 CB ASP A 74 -7.356 -6.031 3.180 1.00 0.00 C ATOM 1144 CG ASP A 74 -8.673 -5.341 2.880 1.00 0.00 C ATOM 1145 OD1 ASP A 74 -9.527 -5.275 3.789 1.00 0.00 O ATOM 1146 OD2 ASP A 74 -8.849 -4.870 1.737 1.00 0.00 O ATOM 0 H ASP A 74 -8.814 -7.376 4.643 1.00 0.00 H new ATOM 0 HA ASP A 74 -6.117 -6.618 4.833 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.542 -5.467 2.726 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.354 -7.020 2.721 1.00 0.00 H new ATOM 1151 N GLU A 75 -8.304 -4.313 5.673 1.00 0.00 N ATOM 1152 CA GLU A 75 -8.451 -3.009 6.309 1.00 0.00 C ATOM 1153 C GLU A 75 -7.551 -2.898 7.536 1.00 0.00 C ATOM 1154 O GLU A 75 -7.608 -3.731 8.439 1.00 0.00 O ATOM 1155 CB GLU A 75 -9.909 -2.774 6.710 1.00 0.00 C ATOM 1156 CG GLU A 75 -10.071 -1.829 7.888 1.00 0.00 C ATOM 1157 CD GLU A 75 -11.508 -1.731 8.363 1.00 0.00 C ATOM 1158 OE1 GLU A 75 -12.022 -2.730 8.910 1.00 0.00 O ATOM 1159 OE2 GLU A 75 -12.117 -0.655 8.190 1.00 0.00 O ATOM 0 H GLU A 75 -9.183 -4.805 5.511 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.152 -2.247 5.590 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -10.452 -2.372 5.855 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -10.368 -3.731 6.957 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -9.442 -2.169 8.711 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -9.717 -0.838 7.605 1.00 0.00 H new ATOM 1166 N GLY A 76 -6.719 -1.861 7.560 1.00 0.00 N ATOM 1167 CA GLY A 76 -5.817 -1.659 8.680 1.00 0.00 C ATOM 1168 C GLY A 76 -4.913 -0.457 8.486 1.00 0.00 C ATOM 1169 O GLY A 76 -5.375 0.626 8.131 1.00 0.00 O ATOM 0 H GLY A 76 -6.653 -1.157 6.824 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.399 -1.529 9.592 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.206 -2.551 8.816 1.00 0.00 H new ATOM 1173 N ASP A 77 -3.619 -0.650 8.722 1.00 0.00 N ATOM 1174 CA ASP A 77 -2.647 0.426 8.571 1.00 0.00 C ATOM 1175 C ASP A 77 -1.463 -0.025 7.721 1.00 0.00 C ATOM 1176 O ASP A 77 -0.609 -0.783 8.181 1.00 0.00 O ATOM 1177 CB ASP A 77 -2.157 0.895 9.942 1.00 0.00 C ATOM 1178 CG ASP A 77 -3.121 1.861 10.603 1.00 0.00 C ATOM 1179 OD1 ASP A 77 -3.034 3.074 10.318 1.00 0.00 O ATOM 1180 OD2 ASP A 77 -3.962 1.403 11.404 1.00 0.00 O ATOM 0 H ASP A 77 -3.220 -1.541 9.018 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.138 1.257 8.065 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -2.014 0.029 10.589 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -1.185 1.375 9.832 1.00 0.00 H new ATOM 1185 N TYR A 78 -1.420 0.444 6.479 1.00 0.00 N ATOM 1186 CA TYR A 78 -0.344 0.087 5.564 1.00 0.00 C ATOM 1187 C TYR A 78 0.819 1.066 5.681 1.00 0.00 C ATOM 1188 O TYR A 78 0.699 2.238 5.325 1.00 0.00 O ATOM 1189 CB TYR A 78 -0.859 0.058 4.124 1.00 0.00 C ATOM 1190 CG TYR A 78 -1.562 -1.228 3.757 1.00 0.00 C ATOM 1191 CD1 TYR A 78 -2.739 -1.605 4.393 1.00 0.00 C ATOM 1192 CD2 TYR A 78 -1.050 -2.068 2.775 1.00 0.00 C ATOM 1193 CE1 TYR A 78 -3.385 -2.781 4.062 1.00 0.00 C ATOM 1194 CE2 TYR A 78 -1.691 -3.244 2.437 1.00 0.00 C ATOM 1195 CZ TYR A 78 -2.857 -3.597 3.083 1.00 0.00 C ATOM 1196 OH TYR A 78 -3.497 -4.768 2.749 1.00 0.00 O ATOM 0 H TYR A 78 -2.119 1.073 6.083 1.00 0.00 H new ATOM 0 HA TYR A 78 0.014 -0.906 5.835 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.545 0.892 3.976 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -0.021 0.210 3.444 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.156 -0.968 5.159 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.136 -1.797 2.268 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -4.298 -3.060 4.567 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.281 -3.884 1.670 1.00 0.00 H new ATOM 0 HH TYR A 78 -4.408 -4.758 3.111 1.00 0.00 H new ATOM 1206 N THR A 79 1.949 0.577 6.183 1.00 0.00 N ATOM 1207 CA THR A 79 3.135 1.407 6.349 1.00 0.00 C ATOM 1208 C THR A 79 4.326 0.822 5.599 1.00 0.00 C ATOM 1209 O THR A 79 4.669 -0.348 5.775 1.00 0.00 O ATOM 1210 CB THR A 79 3.507 1.567 7.835 1.00 0.00 C ATOM 1211 OG1 THR A 79 2.325 1.523 8.643 1.00 0.00 O ATOM 1212 CG2 THR A 79 4.242 2.877 8.071 1.00 0.00 C ATOM 0 H THR A 79 2.067 -0.391 6.482 1.00 0.00 H new ATOM 0 HA THR A 79 2.894 2.386 5.935 1.00 0.00 H new ATOM 0 HB THR A 79 4.167 0.745 8.113 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.570 1.624 9.587 1.00 0.00 H new ATOM 0 HG21 THR A 79 4.494 2.967 9.128 1.00 0.00 H new ATOM 0 HG22 THR A 79 5.156 2.894 7.477 1.00 0.00 H new ATOM 0 HG23 THR A 79 3.604 3.710 7.778 1.00 0.00 H new ATOM 1220 N PHE A 80 4.954 1.640 4.762 1.00 0.00 N ATOM 1221 CA PHE A 80 6.106 1.202 3.984 1.00 0.00 C ATOM 1222 C PHE A 80 7.399 1.779 4.555 1.00 0.00 C ATOM 1223 O PHE A 80 7.530 2.992 4.720 1.00 0.00 O ATOM 1224 CB PHE A 80 5.951 1.620 2.520 1.00 0.00 C ATOM 1225 CG PHE A 80 7.216 1.487 1.721 1.00 0.00 C ATOM 1226 CD1 PHE A 80 8.261 2.381 1.899 1.00 0.00 C ATOM 1227 CD2 PHE A 80 7.360 0.469 0.793 1.00 0.00 C ATOM 1228 CE1 PHE A 80 9.424 2.261 1.164 1.00 0.00 C ATOM 1229 CE2 PHE A 80 8.523 0.344 0.055 1.00 0.00 C ATOM 1230 CZ PHE A 80 9.556 1.241 0.241 1.00 0.00 C ATOM 0 H PHE A 80 4.684 2.611 4.605 1.00 0.00 H new ATOM 0 HA PHE A 80 6.157 0.115 4.040 1.00 0.00 H new ATOM 0 HB2 PHE A 80 5.173 1.012 2.058 1.00 0.00 H new ATOM 0 HB3 PHE A 80 5.613 2.655 2.480 1.00 0.00 H new ATOM 0 HD1 PHE A 80 8.164 3.179 2.620 1.00 0.00 H new ATOM 0 HD2 PHE A 80 6.555 -0.235 0.644 1.00 0.00 H new ATOM 0 HE1 PHE A 80 10.230 2.964 1.311 1.00 0.00 H new ATOM 0 HE2 PHE A 80 8.623 -0.454 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 80 10.465 1.146 -0.334 1.00 0.00 H new ATOM 1240 N VAL A 81 8.350 0.900 4.856 1.00 0.00 N ATOM 1241 CA VAL A 81 9.632 1.322 5.407 1.00 0.00 C ATOM 1242 C VAL A 81 10.783 0.924 4.489 1.00 0.00 C ATOM 1243 O VAL A 81 11.077 -0.255 4.294 1.00 0.00 O ATOM 1244 CB VAL A 81 9.870 0.713 6.802 1.00 0.00 C ATOM 1245 CG1 VAL A 81 11.173 1.227 7.395 1.00 0.00 C ATOM 1246 CG2 VAL A 81 8.699 1.019 7.723 1.00 0.00 C ATOM 0 H VAL A 81 8.257 -0.108 4.728 1.00 0.00 H new ATOM 0 HA VAL A 81 9.598 2.408 5.492 1.00 0.00 H new ATOM 0 HB VAL A 81 9.949 -0.369 6.698 1.00 0.00 H new ATOM 0 HG11 VAL A 81 11.323 0.786 8.380 1.00 0.00 H new ATOM 0 HG12 VAL A 81 12.003 0.952 6.744 1.00 0.00 H new ATOM 0 HG13 VAL A 81 11.128 2.312 7.487 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.884 0.581 8.704 1.00 0.00 H new ATOM 0 HG22 VAL A 81 8.587 2.099 7.822 1.00 0.00 H new ATOM 0 HG23 VAL A 81 7.786 0.597 7.303 1.00 0.00 H new ATOM 1256 N PRO A 82 11.452 1.933 3.911 1.00 0.00 N ATOM 1257 CA PRO A 82 12.583 1.715 3.003 1.00 0.00 C ATOM 1258 C PRO A 82 13.814 1.183 3.729 1.00 0.00 C ATOM 1259 O PRO A 82 14.407 1.878 4.555 1.00 0.00 O ATOM 1260 CB PRO A 82 12.857 3.109 2.435 1.00 0.00 C ATOM 1261 CG PRO A 82 12.341 4.048 3.471 1.00 0.00 C ATOM 1262 CD PRO A 82 11.157 3.363 4.097 1.00 0.00 C ATOM 0 HA PRO A 82 12.357 0.968 2.242 1.00 0.00 H new ATOM 0 HB2 PRO A 82 13.921 3.262 2.257 1.00 0.00 H new ATOM 0 HB3 PRO A 82 12.350 3.255 1.481 1.00 0.00 H new ATOM 0 HG2 PRO A 82 13.106 4.265 4.217 1.00 0.00 H new ATOM 0 HG3 PRO A 82 12.051 5.000 3.026 1.00 0.00 H new ATOM 0 HD2 PRO A 82 11.056 3.619 5.152 1.00 0.00 H new ATOM 0 HD3 PRO A 82 10.224 3.648 3.610 1.00 0.00 H new ATOM 1270 N ASP A 83 14.194 -0.050 3.416 1.00 0.00 N ATOM 1271 CA ASP A 83 15.357 -0.674 4.037 1.00 0.00 C ATOM 1272 C ASP A 83 16.600 0.192 3.856 1.00 0.00 C ATOM 1273 O ASP A 83 17.082 0.378 2.739 1.00 0.00 O ATOM 1274 CB ASP A 83 15.596 -2.062 3.444 1.00 0.00 C ATOM 1275 CG ASP A 83 16.515 -2.908 4.302 1.00 0.00 C ATOM 1276 OD1 ASP A 83 16.221 -3.070 5.506 1.00 0.00 O ATOM 1277 OD2 ASP A 83 17.528 -3.411 3.772 1.00 0.00 O ATOM 0 H ASP A 83 13.714 -0.638 2.735 1.00 0.00 H new ATOM 0 HA ASP A 83 15.158 -0.774 5.104 1.00 0.00 H new ATOM 0 HB2 ASP A 83 14.640 -2.573 3.327 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.027 -1.959 2.448 1.00 0.00 H new ATOM 1282 N GLY A 84 17.113 0.722 4.963 1.00 0.00 N ATOM 1283 CA GLY A 84 18.295 1.562 4.904 1.00 0.00 C ATOM 1284 C GLY A 84 18.065 2.929 5.516 1.00 0.00 C ATOM 1285 O GLY A 84 19.014 3.615 5.898 1.00 0.00 O ATOM 0 H GLY A 84 16.731 0.584 5.899 1.00 0.00 H new ATOM 0 HA2 GLY A 84 19.115 1.067 5.425 1.00 0.00 H new ATOM 0 HA3 GLY A 84 18.602 1.679 3.865 1.00 0.00 H new ATOM 1289 N TYR A 85 16.801 3.329 5.609 1.00 0.00 N ATOM 1290 CA TYR A 85 16.450 4.625 6.177 1.00 0.00 C ATOM 1291 C TYR A 85 15.515 4.462 7.371 1.00 0.00 C ATOM 1292 O TYR A 85 15.127 3.348 7.722 1.00 0.00 O ATOM 1293 CB TYR A 85 15.790 5.508 5.115 1.00 0.00 C ATOM 1294 CG TYR A 85 16.660 5.748 3.902 1.00 0.00 C ATOM 1295 CD1 TYR A 85 17.542 6.821 3.856 1.00 0.00 C ATOM 1296 CD2 TYR A 85 16.600 4.902 2.802 1.00 0.00 C ATOM 1297 CE1 TYR A 85 18.338 7.044 2.750 1.00 0.00 C ATOM 1298 CE2 TYR A 85 17.394 5.117 1.691 1.00 0.00 C ATOM 1299 CZ TYR A 85 18.260 6.190 1.670 1.00 0.00 C ATOM 1300 OH TYR A 85 19.052 6.409 0.566 1.00 0.00 O ATOM 0 H TYR A 85 16.003 2.774 5.298 1.00 0.00 H new ATOM 0 HA TYR A 85 17.367 5.103 6.520 1.00 0.00 H new ATOM 0 HB2 TYR A 85 14.857 5.043 4.796 1.00 0.00 H new ATOM 0 HB3 TYR A 85 15.531 6.468 5.562 1.00 0.00 H new ATOM 0 HD1 TYR A 85 17.606 7.492 4.700 1.00 0.00 H new ATOM 0 HD2 TYR A 85 15.921 4.062 2.815 1.00 0.00 H new ATOM 0 HE1 TYR A 85 19.018 7.883 2.731 1.00 0.00 H new ATOM 0 HE2 TYR A 85 17.336 4.449 0.845 1.00 0.00 H new ATOM 0 HH TYR A 85 18.538 6.223 -0.247 1.00 0.00 H new ATOM 1310 N ALA A 86 15.156 5.581 7.991 1.00 0.00 N ATOM 1311 CA ALA A 86 14.264 5.565 9.143 1.00 0.00 C ATOM 1312 C ALA A 86 12.932 6.233 8.817 1.00 0.00 C ATOM 1313 O ALA A 86 12.142 6.534 9.713 1.00 0.00 O ATOM 1314 CB ALA A 86 14.924 6.249 10.331 1.00 0.00 C ATOM 0 H ALA A 86 15.470 6.511 7.714 1.00 0.00 H new ATOM 0 HA ALA A 86 14.064 4.525 9.402 1.00 0.00 H new ATOM 0 HB1 ALA A 86 14.246 6.230 11.185 1.00 0.00 H new ATOM 0 HB2 ALA A 86 15.845 5.725 10.587 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.154 7.283 10.074 1.00 0.00 H new ATOM 1320 N LEU A 87 12.690 6.463 7.532 1.00 0.00 N ATOM 1321 CA LEU A 87 11.454 7.097 7.088 1.00 0.00 C ATOM 1322 C LEU A 87 10.357 6.059 6.873 1.00 0.00 C ATOM 1323 O LEU A 87 10.614 4.855 6.896 1.00 0.00 O ATOM 1324 CB LEU A 87 11.694 7.878 5.795 1.00 0.00 C ATOM 1325 CG LEU A 87 12.741 8.990 5.867 1.00 0.00 C ATOM 1326 CD1 LEU A 87 14.128 8.436 5.582 1.00 0.00 C ATOM 1327 CD2 LEU A 87 12.400 10.107 4.893 1.00 0.00 C ATOM 0 H LEU A 87 13.333 6.220 6.779 1.00 0.00 H new ATOM 0 HA LEU A 87 11.128 7.787 7.866 1.00 0.00 H new ATOM 0 HB2 LEU A 87 11.994 7.174 5.019 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.748 8.317 5.478 1.00 0.00 H new ATOM 0 HG LEU A 87 12.737 9.402 6.876 1.00 0.00 H new ATOM 0 HD11 LEU A 87 14.860 9.242 5.638 1.00 0.00 H new ATOM 0 HD12 LEU A 87 14.373 7.672 6.319 1.00 0.00 H new ATOM 0 HD13 LEU A 87 14.147 7.997 4.584 1.00 0.00 H new ATOM 0 HD21 LEU A 87 13.156 10.890 4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 87 12.375 9.710 3.878 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.424 10.523 5.144 1.00 0.00 H new ATOM 1339 N SER A 88 9.133 6.533 6.660 1.00 0.00 N ATOM 1340 CA SER A 88 7.997 5.647 6.441 1.00 0.00 C ATOM 1341 C SER A 88 6.747 6.444 6.078 1.00 0.00 C ATOM 1342 O SER A 88 6.606 7.606 6.460 1.00 0.00 O ATOM 1343 CB SER A 88 7.733 4.803 7.690 1.00 0.00 C ATOM 1344 OG SER A 88 7.675 5.615 8.850 1.00 0.00 O ATOM 0 H SER A 88 8.904 7.527 6.635 1.00 0.00 H new ATOM 0 HA SER A 88 8.239 4.986 5.609 1.00 0.00 H new ATOM 0 HB2 SER A 88 6.795 4.260 7.575 1.00 0.00 H new ATOM 0 HB3 SER A 88 8.520 4.058 7.803 1.00 0.00 H new ATOM 0 HG SER A 88 7.504 5.053 9.634 1.00 0.00 H new ATOM 1350 N LEU A 89 5.844 5.811 5.339 1.00 0.00 N ATOM 1351 CA LEU A 89 4.605 6.460 4.923 1.00 0.00 C ATOM 1352 C LEU A 89 3.434 6.001 5.787 1.00 0.00 C ATOM 1353 O LEU A 89 3.574 5.096 6.609 1.00 0.00 O ATOM 1354 CB LEU A 89 4.317 6.161 3.452 1.00 0.00 C ATOM 1355 CG LEU A 89 5.390 6.603 2.455 1.00 0.00 C ATOM 1356 CD1 LEU A 89 5.500 8.119 2.428 1.00 0.00 C ATOM 1357 CD2 LEU A 89 6.732 5.975 2.801 1.00 0.00 C ATOM 0 H LEU A 89 5.946 4.849 5.015 1.00 0.00 H new ATOM 0 HA LEU A 89 4.727 7.536 5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.168 5.087 3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.377 6.642 3.181 1.00 0.00 H new ATOM 0 HG LEU A 89 5.098 6.262 1.462 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.268 8.415 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.543 8.548 2.131 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.768 8.482 3.420 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.483 6.301 2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.031 6.285 3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.645 4.889 2.768 1.00 0.00 H new ATOM 1369 N SER A 90 2.279 6.628 5.590 1.00 0.00 N ATOM 1370 CA SER A 90 1.084 6.285 6.351 1.00 0.00 C ATOM 1371 C SER A 90 -0.141 6.230 5.443 1.00 0.00 C ATOM 1372 O SER A 90 -0.507 7.223 4.815 1.00 0.00 O ATOM 1373 CB SER A 90 0.856 7.302 7.471 1.00 0.00 C ATOM 1374 OG SER A 90 0.275 8.493 6.968 1.00 0.00 O ATOM 0 H SER A 90 2.146 7.376 4.910 1.00 0.00 H new ATOM 0 HA SER A 90 1.235 5.299 6.790 1.00 0.00 H new ATOM 0 HB2 SER A 90 0.206 6.870 8.232 1.00 0.00 H new ATOM 0 HB3 SER A 90 1.805 7.533 7.956 1.00 0.00 H new ATOM 0 HG SER A 90 0.099 8.392 6.009 1.00 0.00 H new ATOM 1380 N ALA A 91 -0.770 5.061 5.378 1.00 0.00 N ATOM 1381 CA ALA A 91 -1.955 4.875 4.549 1.00 0.00 C ATOM 1382 C ALA A 91 -2.922 3.884 5.187 1.00 0.00 C ATOM 1383 O ALA A 91 -2.542 2.767 5.539 1.00 0.00 O ATOM 1384 CB ALA A 91 -1.556 4.404 3.158 1.00 0.00 C ATOM 0 H ALA A 91 -0.479 4.228 5.890 1.00 0.00 H new ATOM 0 HA ALA A 91 -2.464 5.835 4.465 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.450 4.269 2.549 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -0.910 5.148 2.693 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -1.022 3.457 3.234 1.00 0.00 H new ATOM 1390 N LYS A 92 -4.175 4.300 5.336 1.00 0.00 N ATOM 1391 CA LYS A 92 -5.199 3.450 5.933 1.00 0.00 C ATOM 1392 C LYS A 92 -6.065 2.805 4.856 1.00 0.00 C ATOM 1393 O LYS A 92 -6.488 3.466 3.906 1.00 0.00 O ATOM 1394 CB LYS A 92 -6.075 4.264 6.887 1.00 0.00 C ATOM 1395 CG LYS A 92 -7.439 3.645 7.138 1.00 0.00 C ATOM 1396 CD LYS A 92 -7.981 4.024 8.506 1.00 0.00 C ATOM 1397 CE LYS A 92 -7.560 3.021 9.569 1.00 0.00 C ATOM 1398 NZ LYS A 92 -7.753 3.557 10.945 1.00 0.00 N ATOM 0 H LYS A 92 -4.506 5.222 5.051 1.00 0.00 H new ATOM 0 HA LYS A 92 -4.699 2.661 6.494 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -5.555 4.375 7.839 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.209 5.265 6.478 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.136 3.973 6.366 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -7.367 2.560 7.062 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.623 5.017 8.778 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -9.069 4.078 8.465 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -8.138 2.104 9.452 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -6.512 2.758 9.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -7.455 2.844 11.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -7.182 4.418 11.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -8.757 3.784 11.091 1.00 0.00 H new ATOM 1412 N LEU A 93 -6.326 1.511 5.009 1.00 0.00 N ATOM 1413 CA LEU A 93 -7.144 0.776 4.051 1.00 0.00 C ATOM 1414 C LEU A 93 -8.545 0.534 4.603 1.00 0.00 C ATOM 1415 O LEU A 93 -8.709 -0.085 5.653 1.00 0.00 O ATOM 1416 CB LEU A 93 -6.482 -0.557 3.703 1.00 0.00 C ATOM 1417 CG LEU A 93 -6.966 -1.233 2.419 1.00 0.00 C ATOM 1418 CD1 LEU A 93 -5.866 -2.098 1.824 1.00 0.00 C ATOM 1419 CD2 LEU A 93 -8.212 -2.064 2.691 1.00 0.00 C ATOM 0 H LEU A 93 -5.983 0.949 5.788 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.230 1.378 3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -5.407 -0.395 3.622 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.639 -1.245 4.533 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.221 -0.458 1.697 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -6.229 -2.571 0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.000 -1.477 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.579 -2.867 2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -8.542 -2.538 1.767 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.983 -2.832 3.430 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.004 -1.419 3.071 1.00 0.00 H new ATOM 1431 N ASN A 94 -9.551 1.024 3.886 1.00 0.00 N ATOM 1432 CA ASN A 94 -10.938 0.858 4.303 1.00 0.00 C ATOM 1433 C ASN A 94 -11.603 -0.285 3.543 1.00 0.00 C ATOM 1434 O ASN A 94 -11.601 -0.310 2.312 1.00 0.00 O ATOM 1435 CB ASN A 94 -11.718 2.156 4.079 1.00 0.00 C ATOM 1436 CG ASN A 94 -11.488 3.168 5.184 1.00 0.00 C ATOM 1437 OD1 ASN A 94 -10.231 3.548 5.386 1.00 0.00 O flip ATOM 1438 ND2 ASN A 94 -12.429 3.603 5.849 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.431 1.539 3.014 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.945 0.615 5.366 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -11.425 2.592 3.124 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -12.782 1.930 4.013 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.379 3.283 5.659 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.259 4.283 6.590 1.00 0.00 H new ATOM 1445 N PHE A 95 -12.170 -1.230 4.286 1.00 0.00 N ATOM 1446 CA PHE A 95 -12.839 -2.378 3.683 1.00 0.00 C ATOM 1447 C PHE A 95 -14.349 -2.292 3.876 1.00 0.00 C ATOM 1448 O PHE A 95 -14.851 -2.414 4.994 1.00 0.00 O ATOM 1449 CB PHE A 95 -12.308 -3.679 4.288 1.00 0.00 C ATOM 1450 CG PHE A 95 -12.975 -4.909 3.742 1.00 0.00 C ATOM 1451 CD1 PHE A 95 -14.217 -5.307 4.214 1.00 0.00 C ATOM 1452 CD2 PHE A 95 -12.362 -5.668 2.758 1.00 0.00 C ATOM 1453 CE1 PHE A 95 -14.832 -6.439 3.713 1.00 0.00 C ATOM 1454 CE2 PHE A 95 -12.974 -6.800 2.254 1.00 0.00 C ATOM 1455 CZ PHE A 95 -14.211 -7.186 2.732 1.00 0.00 C ATOM 0 H PHE A 95 -12.180 -1.224 5.306 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.628 -2.370 2.614 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.236 -3.745 4.104 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.445 -3.650 5.369 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -14.709 -4.727 4.981 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -11.395 -5.371 2.380 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -15.799 -6.739 4.089 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.485 -7.382 1.487 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.691 -8.070 2.339 1.00 0.00 H new ATOM 1465 N LEU A 96 -15.069 -2.079 2.781 1.00 0.00 N ATOM 1466 CA LEU A 96 -16.523 -1.975 2.829 1.00 0.00 C ATOM 1467 C LEU A 96 -17.176 -3.320 2.522 1.00 0.00 C ATOM 1468 O LEU A 96 -16.998 -3.872 1.437 1.00 0.00 O ATOM 1469 CB LEU A 96 -17.012 -0.919 1.836 1.00 0.00 C ATOM 1470 CG LEU A 96 -18.527 -0.738 1.741 1.00 0.00 C ATOM 1471 CD1 LEU A 96 -18.870 0.689 1.345 1.00 0.00 C ATOM 1472 CD2 LEU A 96 -19.122 -1.726 0.748 1.00 0.00 C ATOM 0 H LEU A 96 -14.670 -1.975 1.848 1.00 0.00 H new ATOM 0 HA LEU A 96 -16.808 -1.676 3.838 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -16.568 0.039 2.107 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -16.634 -1.177 0.847 1.00 0.00 H new ATOM 0 HG LEU A 96 -18.959 -0.935 2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -19.953 0.799 1.282 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -18.478 1.378 2.093 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -18.426 0.914 0.375 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.201 -1.582 0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.684 -1.561 -0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -18.908 -2.744 1.074 1.00 0.00 H new ATOM 1484 N GLU A 97 -17.933 -3.838 3.483 1.00 0.00 N ATOM 1485 CA GLU A 97 -18.612 -5.117 3.314 1.00 0.00 C ATOM 1486 C GLU A 97 -19.914 -4.942 2.536 1.00 0.00 C ATOM 1487 O GLU A 97 -20.637 -3.964 2.727 1.00 0.00 O ATOM 1488 CB GLU A 97 -18.901 -5.751 4.676 1.00 0.00 C ATOM 1489 CG GLU A 97 -19.521 -7.135 4.584 1.00 0.00 C ATOM 1490 CD GLU A 97 -19.157 -8.017 5.763 1.00 0.00 C ATOM 1491 OE1 GLU A 97 -17.950 -8.249 5.980 1.00 0.00 O ATOM 1492 OE2 GLU A 97 -20.081 -8.475 6.468 1.00 0.00 O ATOM 0 H GLU A 97 -18.092 -3.392 4.387 1.00 0.00 H new ATOM 0 HA GLU A 97 -17.955 -5.776 2.747 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -17.972 -5.815 5.242 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -19.571 -5.099 5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -20.605 -7.040 4.527 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -19.194 -7.615 3.661 1.00 0.00 H new ATOM 1499 N ILE A 98 -20.205 -5.898 1.659 1.00 0.00 N ATOM 1500 CA ILE A 98 -21.419 -5.850 0.853 1.00 0.00 C ATOM 1501 C ILE A 98 -22.205 -7.151 0.966 1.00 0.00 C ATOM 1502 O ILE A 98 -21.995 -8.086 0.194 1.00 0.00 O ATOM 1503 CB ILE A 98 -21.100 -5.583 -0.630 1.00 0.00 C ATOM 1504 CG1 ILE A 98 -20.396 -4.234 -0.789 1.00 0.00 C ATOM 1505 CG2 ILE A 98 -22.374 -5.623 -1.462 1.00 0.00 C ATOM 1506 CD1 ILE A 98 -19.842 -4.001 -2.177 1.00 0.00 C ATOM 0 H ILE A 98 -19.617 -6.714 1.489 1.00 0.00 H new ATOM 0 HA ILE A 98 -22.022 -5.029 1.240 1.00 0.00 H new ATOM 0 HB ILE A 98 -20.430 -6.365 -0.988 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -21.099 -3.436 -0.548 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -19.582 -4.171 -0.067 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -22.132 -5.432 -2.508 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -22.838 -6.605 -1.370 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -23.066 -4.860 -1.105 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -19.357 -3.026 -2.216 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -19.115 -4.778 -2.414 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -20.655 -4.032 -2.903 1.00 0.00 H new ATOM 1518 N LYS A 99 -23.115 -7.204 1.934 1.00 0.00 N ATOM 1519 CA LYS A 99 -23.936 -8.389 2.149 1.00 0.00 C ATOM 1520 C LYS A 99 -25.413 -8.072 1.938 1.00 0.00 C ATOM 1521 O LYS A 99 -25.791 -6.913 1.764 1.00 0.00 O ATOM 1522 CB LYS A 99 -23.718 -8.939 3.560 1.00 0.00 C ATOM 1523 CG LYS A 99 -24.035 -7.938 4.658 1.00 0.00 C ATOM 1524 CD LYS A 99 -23.937 -8.572 6.035 1.00 0.00 C ATOM 1525 CE LYS A 99 -24.234 -7.565 7.135 1.00 0.00 C ATOM 1526 NZ LYS A 99 -25.698 -7.403 7.358 1.00 0.00 N ATOM 0 H LYS A 99 -23.302 -6.439 2.582 1.00 0.00 H new ATOM 0 HA LYS A 99 -23.636 -9.144 1.422 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -24.339 -9.824 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -22.681 -9.259 3.660 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -23.346 -7.096 4.594 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -25.039 -7.540 4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -24.637 -9.405 6.104 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -22.938 -8.983 6.177 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -23.759 -7.888 8.061 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -23.798 -6.601 6.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -25.859 -6.709 8.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -26.148 -7.070 6.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -26.110 -8.317 7.633 1.00 0.00 H new ATOM 1540 N VAL A 100 -26.245 -9.109 1.957 1.00 0.00 N ATOM 1541 CA VAL A 100 -27.681 -8.941 1.770 1.00 0.00 C ATOM 1542 C VAL A 100 -28.463 -9.599 2.901 1.00 0.00 C ATOM 1543 O VAL A 100 -28.172 -10.728 3.296 1.00 0.00 O ATOM 1544 CB VAL A 100 -28.146 -9.532 0.427 1.00 0.00 C ATOM 1545 CG1 VAL A 100 -27.485 -8.806 -0.735 1.00 0.00 C ATOM 1546 CG2 VAL A 100 -27.852 -11.023 0.371 1.00 0.00 C ATOM 0 H VAL A 100 -25.949 -10.074 2.100 1.00 0.00 H new ATOM 0 HA VAL A 100 -27.877 -7.869 1.773 1.00 0.00 H new ATOM 0 HB VAL A 100 -29.224 -9.394 0.344 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -27.826 -9.238 -1.676 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -27.752 -7.750 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -26.402 -8.909 -0.660 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -28.187 -11.424 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -26.780 -11.187 0.477 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -28.378 -11.528 1.181 1.00 0.00 H new ATOM 1556 N SER A 101 -29.458 -8.886 3.419 1.00 0.00 N ATOM 1557 CA SER A 101 -30.281 -9.401 4.508 1.00 0.00 C ATOM 1558 C SER A 101 -31.647 -9.844 3.994 1.00 0.00 C ATOM 1559 O SER A 101 -32.081 -9.435 2.917 1.00 0.00 O ATOM 1560 CB SER A 101 -30.453 -8.335 5.592 1.00 0.00 C ATOM 1561 OG SER A 101 -29.221 -8.059 6.237 1.00 0.00 O ATOM 0 H SER A 101 -29.714 -7.951 3.103 1.00 0.00 H new ATOM 0 HA SER A 101 -29.775 -10.267 4.935 1.00 0.00 H new ATOM 0 HB2 SER A 101 -30.847 -7.421 5.148 1.00 0.00 H new ATOM 0 HB3 SER A 101 -31.184 -8.674 6.327 1.00 0.00 H new ATOM 0 HG SER A 101 -29.358 -7.374 6.924 1.00 0.00 H new ATOM 1567 N GLY A 102 -32.323 -10.684 4.772 1.00 0.00 N ATOM 1568 CA GLY A 102 -33.632 -11.170 4.380 1.00 0.00 C ATOM 1569 C GLY A 102 -33.603 -12.618 3.933 1.00 0.00 C ATOM 1570 O GLY A 102 -32.635 -13.086 3.336 1.00 0.00 O ATOM 0 H GLY A 102 -31.986 -11.037 5.668 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -34.321 -11.066 5.218 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -34.019 -10.551 3.571 1.00 0.00 H new ATOM 1574 N PRO A 103 -34.686 -13.353 4.227 1.00 0.00 N ATOM 1575 CA PRO A 103 -34.804 -14.768 3.862 1.00 0.00 C ATOM 1576 C PRO A 103 -34.956 -14.967 2.358 1.00 0.00 C ATOM 1577 O PRO A 103 -35.301 -14.037 1.631 1.00 0.00 O ATOM 1578 CB PRO A 103 -36.072 -15.218 4.592 1.00 0.00 C ATOM 1579 CG PRO A 103 -36.873 -13.973 4.762 1.00 0.00 C ATOM 1580 CD PRO A 103 -35.877 -12.860 4.939 1.00 0.00 C ATOM 0 HA PRO A 103 -33.914 -15.335 4.135 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -36.618 -15.964 4.014 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -35.835 -15.671 5.555 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -37.507 -13.795 3.893 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -37.532 -14.048 5.627 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -36.240 -11.924 4.515 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -35.667 -12.672 5.992 1.00 0.00 H new ATOM 1588 N SER A 104 -34.697 -16.188 1.899 1.00 0.00 N ATOM 1589 CA SER A 104 -34.803 -16.508 0.480 1.00 0.00 C ATOM 1590 C SER A 104 -34.891 -18.017 0.269 1.00 0.00 C ATOM 1591 O SER A 104 -34.438 -18.799 1.104 1.00 0.00 O ATOM 1592 CB SER A 104 -33.601 -15.945 -0.282 1.00 0.00 C ATOM 1593 OG SER A 104 -33.904 -15.772 -1.655 1.00 0.00 O ATOM 0 H SER A 104 -34.413 -16.971 2.488 1.00 0.00 H new ATOM 0 HA SER A 104 -35.715 -16.051 0.096 1.00 0.00 H new ATOM 0 HB2 SER A 104 -33.306 -14.989 0.152 1.00 0.00 H new ATOM 0 HB3 SER A 104 -32.751 -16.619 -0.176 1.00 0.00 H new ATOM 0 HG SER A 104 -33.121 -15.410 -2.120 1.00 0.00 H new ATOM 1599 N SER A 105 -35.479 -18.418 -0.854 1.00 0.00 N ATOM 1600 CA SER A 105 -35.633 -19.831 -1.174 1.00 0.00 C ATOM 1601 C SER A 105 -35.484 -20.068 -2.674 1.00 0.00 C ATOM 1602 O SER A 105 -35.828 -19.210 -3.486 1.00 0.00 O ATOM 1603 CB SER A 105 -36.994 -20.339 -0.698 1.00 0.00 C ATOM 1604 OG SER A 105 -38.049 -19.695 -1.391 1.00 0.00 O ATOM 0 H SER A 105 -35.857 -17.783 -1.557 1.00 0.00 H new ATOM 0 HA SER A 105 -34.848 -20.382 -0.657 1.00 0.00 H new ATOM 0 HB2 SER A 105 -37.058 -21.416 -0.852 1.00 0.00 H new ATOM 0 HB3 SER A 105 -37.097 -20.163 0.373 1.00 0.00 H new ATOM 0 HG SER A 105 -38.909 -20.038 -1.070 1.00 0.00 H new ATOM 1610 N GLY A 106 -34.970 -21.240 -3.034 1.00 0.00 N ATOM 1611 CA GLY A 106 -34.784 -21.569 -4.436 1.00 0.00 C ATOM 1612 C GLY A 106 -33.341 -21.890 -4.770 1.00 0.00 C ATOM 1613 O GLY A 106 -32.889 -23.019 -4.580 1.00 0.00 O ATOM 0 H GLY A 106 -34.679 -21.967 -2.381 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -35.411 -22.423 -4.692 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -35.118 -20.732 -5.050 1.00 0.00 H new TER 1617 GLY A 106