USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 896 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 26 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 56 GLN : amide:sc= -3.03 X(o=-3,f=-2.8!) USER MOD Set 2.1: A 54 GLN : amide:sc= -0.849 K(o=-1.4,f=-0.53) USER MOD Set 2.2: A 64 TYR OH : rot -153:sc= 0.202 USER MOD Set 2.3: A 80 THR OG1 : rot 40:sc= -0.728 USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.0739 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.0196 X(o=-0.02,f=-0.48) USER MOD Single : A 16 GLN : amide:sc= -0.0445 K(o=-0.044,f=-0.76) USER MOD Single : A 17 SER OG : rot 33:sc= 0.271 USER MOD Single : A 18 GLN : amide:sc= -0.0391 K(o=-0.039,f=-0.94) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.145 X(o=-0.15,f=-0.15) USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= -0.0863 K(o=-0.086,f=-1.9!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc=-0.00175 X(o=-0.0018,f=-0.07) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.302) USER MOD Single : A 65 GLN : amide:sc= -0.624 K(o=-0.62,f=-2.6!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= -0.0617 (180deg=-0.0617) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -6.11! C(o=-6.1!,f=-10!) USER MOD Single : A 82 THR OG1 : rot -17:sc= 0.464 USER MOD Single : A 88 HIS : no HD1:sc= -3.96! C(o=-4!,f=-6.7!) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot 138:sc= 1.09 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -9.28! C(o=-9.3!,f=-16!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HE2:sc= -0.261 K(o=-0.26,f=-2.7!) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0.0107 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.646 95.901 1.336 1.00 0.00 N ATOM 2 CA GLY A 1 -2.118 94.638 1.871 1.00 0.00 C ATOM 3 C GLY A 1 -3.128 93.964 0.963 1.00 0.00 C ATOM 4 O GLY A 1 -3.697 94.600 0.076 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.675 95.786 0.980 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.267 96.202 0.558 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.657 96.621 2.086 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.269 93.971 2.023 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.569 94.807 2.849 1.00 0.00 H new ATOM 8 N SER A 2 -3.349 92.672 1.183 1.00 0.00 N ATOM 9 CA SER A 2 -4.292 91.910 0.373 1.00 0.00 C ATOM 10 C SER A 2 -4.456 90.494 0.918 1.00 0.00 C ATOM 11 O SER A 2 -3.528 89.929 1.496 1.00 0.00 O ATOM 12 CB SER A 2 -3.823 91.857 -1.082 1.00 0.00 C ATOM 13 OG SER A 2 -2.730 90.968 -1.233 1.00 0.00 O ATOM 0 H SER A 2 -2.888 92.131 1.915 1.00 0.00 H new ATOM 0 HA SER A 2 -5.258 92.412 0.417 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.646 91.538 -1.721 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.532 92.855 -1.410 1.00 0.00 H new ATOM 0 HG SER A 2 -2.450 90.951 -2.172 1.00 0.00 H new ATOM 19 N SER A 3 -5.643 89.927 0.728 1.00 0.00 N ATOM 20 CA SER A 3 -5.931 88.579 1.203 1.00 0.00 C ATOM 21 C SER A 3 -7.166 88.011 0.512 1.00 0.00 C ATOM 22 O SER A 3 -7.937 88.744 -0.106 1.00 0.00 O ATOM 23 CB SER A 3 -6.138 88.583 2.719 1.00 0.00 C ATOM 24 OG SER A 3 -7.302 89.308 3.073 1.00 0.00 O ATOM 0 H SER A 3 -6.421 90.380 0.248 1.00 0.00 H new ATOM 0 HA SER A 3 -5.077 87.946 0.961 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.220 87.558 3.081 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.269 89.024 3.207 1.00 0.00 H new ATOM 0 HG SER A 3 -7.413 89.294 4.047 1.00 0.00 H new ATOM 30 N GLY A 4 -7.347 86.698 0.620 1.00 0.00 N ATOM 31 CA GLY A 4 -8.490 86.053 0.001 1.00 0.00 C ATOM 32 C GLY A 4 -8.437 84.543 0.117 1.00 0.00 C ATOM 33 O GLY A 4 -7.415 83.979 0.510 1.00 0.00 O ATOM 0 H GLY A 4 -6.722 86.070 1.125 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.405 86.418 0.467 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.535 86.332 -1.052 1.00 0.00 H new ATOM 37 N SER A 5 -9.540 83.885 -0.224 1.00 0.00 N ATOM 38 CA SER A 5 -9.617 82.431 -0.151 1.00 0.00 C ATOM 39 C SER A 5 -10.323 81.861 -1.378 1.00 0.00 C ATOM 40 O SER A 5 -11.181 82.514 -1.972 1.00 0.00 O ATOM 41 CB SER A 5 -10.352 82.001 1.120 1.00 0.00 C ATOM 42 OG SER A 5 -9.528 82.153 2.263 1.00 0.00 O ATOM 0 H SER A 5 -10.393 84.336 -0.554 1.00 0.00 H new ATOM 0 HA SER A 5 -8.600 82.039 -0.124 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.257 82.596 1.239 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.664 80.961 1.029 1.00 0.00 H new ATOM 0 HG SER A 5 -10.022 81.873 3.062 1.00 0.00 H new ATOM 48 N SER A 6 -9.955 80.640 -1.751 1.00 0.00 N ATOM 49 CA SER A 6 -10.550 79.983 -2.909 1.00 0.00 C ATOM 50 C SER A 6 -11.435 78.818 -2.477 1.00 0.00 C ATOM 51 O SER A 6 -12.634 78.799 -2.754 1.00 0.00 O ATOM 52 CB SER A 6 -9.456 79.484 -3.855 1.00 0.00 C ATOM 53 OG SER A 6 -8.637 80.552 -4.297 1.00 0.00 O ATOM 0 H SER A 6 -9.248 80.086 -1.268 1.00 0.00 H new ATOM 0 HA SER A 6 -11.169 80.712 -3.432 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.844 78.739 -3.347 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.911 78.991 -4.714 1.00 0.00 H new ATOM 0 HG SER A 6 -7.945 80.206 -4.899 1.00 0.00 H new ATOM 59 N GLY A 7 -10.835 77.846 -1.796 1.00 0.00 N ATOM 60 CA GLY A 7 -11.582 76.691 -1.337 1.00 0.00 C ATOM 61 C GLY A 7 -11.663 75.598 -2.385 1.00 0.00 C ATOM 62 O GLY A 7 -11.143 75.750 -3.491 1.00 0.00 O ATOM 0 H GLY A 7 -9.844 77.839 -1.554 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.113 76.293 -0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.590 77.001 -1.061 1.00 0.00 H new ATOM 66 N CYS A 8 -12.313 74.493 -2.036 1.00 0.00 N ATOM 67 CA CYS A 8 -12.457 73.369 -2.955 1.00 0.00 C ATOM 68 C CYS A 8 -13.476 72.364 -2.428 1.00 0.00 C ATOM 69 O CYS A 8 -14.033 72.541 -1.345 1.00 0.00 O ATOM 70 CB CYS A 8 -11.108 72.682 -3.168 1.00 0.00 C ATOM 71 SG CYS A 8 -10.511 71.764 -1.729 1.00 0.00 S ATOM 0 H CYS A 8 -12.748 74.351 -1.124 1.00 0.00 H new ATOM 0 HA CYS A 8 -12.814 73.755 -3.910 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -11.190 71.998 -4.013 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -10.368 73.435 -3.438 1.00 0.00 H new ATOM 0 HG CYS A 8 -9.365 71.217 -2.008 1.00 0.00 H new ATOM 77 N GLU A 9 -13.715 71.311 -3.203 1.00 0.00 N ATOM 78 CA GLU A 9 -14.670 70.279 -2.814 1.00 0.00 C ATOM 79 C GLU A 9 -14.367 68.963 -3.525 1.00 0.00 C ATOM 80 O GLU A 9 -13.949 68.951 -4.682 1.00 0.00 O ATOM 81 CB GLU A 9 -16.097 70.727 -3.134 1.00 0.00 C ATOM 82 CG GLU A 9 -17.160 69.981 -2.345 1.00 0.00 C ATOM 83 CD GLU A 9 -16.862 69.939 -0.859 1.00 0.00 C ATOM 84 OE1 GLU A 9 -16.363 70.951 -0.324 1.00 0.00 O ATOM 85 OE2 GLU A 9 -17.129 68.893 -0.231 1.00 0.00 O ATOM 0 H GLU A 9 -13.262 71.150 -4.102 1.00 0.00 H new ATOM 0 HA GLU A 9 -14.579 70.122 -1.739 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -16.188 71.794 -2.931 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -16.282 70.588 -4.199 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -18.127 70.458 -2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -17.241 68.962 -2.724 1.00 0.00 H new ATOM 92 N GLY A 10 -14.582 67.854 -2.823 1.00 0.00 N ATOM 93 CA GLY A 10 -14.327 66.548 -3.402 1.00 0.00 C ATOM 94 C GLY A 10 -14.440 65.431 -2.383 1.00 0.00 C ATOM 95 O GLY A 10 -14.556 65.683 -1.185 1.00 0.00 O ATOM 0 H GLY A 10 -14.928 67.837 -1.864 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -15.033 66.369 -4.213 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -13.329 66.537 -3.840 1.00 0.00 H new ATOM 99 N GLY A 11 -14.407 64.191 -2.862 1.00 0.00 N ATOM 100 CA GLY A 11 -14.509 63.049 -1.971 1.00 0.00 C ATOM 101 C GLY A 11 -14.245 61.736 -2.680 1.00 0.00 C ATOM 102 O GLY A 11 -15.038 61.302 -3.516 1.00 0.00 O ATOM 0 H GLY A 11 -14.312 63.957 -3.850 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -13.799 63.166 -1.153 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -15.505 63.025 -1.528 1.00 0.00 H new ATOM 106 N VAL A 12 -13.125 61.100 -2.348 1.00 0.00 N ATOM 107 CA VAL A 12 -12.758 59.828 -2.959 1.00 0.00 C ATOM 108 C VAL A 12 -12.123 58.891 -1.937 1.00 0.00 C ATOM 109 O VAL A 12 -11.347 59.321 -1.084 1.00 0.00 O ATOM 110 CB VAL A 12 -11.780 60.031 -4.131 1.00 0.00 C ATOM 111 CG1 VAL A 12 -11.408 58.693 -4.753 1.00 0.00 C ATOM 112 CG2 VAL A 12 -12.382 60.963 -5.172 1.00 0.00 C ATOM 0 H VAL A 12 -12.457 61.445 -1.659 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.677 59.380 -3.336 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.870 60.492 -3.747 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.716 58.856 -5.580 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -10.933 58.062 -4.002 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -12.307 58.202 -5.124 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -11.677 61.095 -5.993 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.308 60.532 -5.554 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -12.593 61.930 -4.716 1.00 0.00 H new ATOM 122 N ASP A 13 -12.457 57.609 -2.032 1.00 0.00 N ATOM 123 CA ASP A 13 -11.918 56.609 -1.117 1.00 0.00 C ATOM 124 C ASP A 13 -11.923 55.226 -1.760 1.00 0.00 C ATOM 125 O ASP A 13 -12.951 54.762 -2.250 1.00 0.00 O ATOM 126 CB ASP A 13 -12.728 56.585 0.181 1.00 0.00 C ATOM 127 CG ASP A 13 -12.221 57.588 1.198 1.00 0.00 C ATOM 128 OD1 ASP A 13 -11.005 57.874 1.195 1.00 0.00 O ATOM 129 OD2 ASP A 13 -13.041 58.088 1.997 1.00 0.00 O ATOM 0 H ASP A 13 -13.098 57.237 -2.733 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.887 56.880 -0.888 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -13.774 56.796 -0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -12.690 55.584 0.611 1.00 0.00 H new ATOM 134 N MET A 14 -10.765 54.573 -1.754 1.00 0.00 N ATOM 135 CA MET A 14 -10.636 53.242 -2.337 1.00 0.00 C ATOM 136 C MET A 14 -9.559 52.436 -1.618 1.00 0.00 C ATOM 137 O MET A 14 -8.636 53.001 -1.032 1.00 0.00 O ATOM 138 CB MET A 14 -10.304 53.344 -3.827 1.00 0.00 C ATOM 139 CG MET A 14 -11.386 54.030 -4.645 1.00 0.00 C ATOM 140 SD MET A 14 -12.884 53.036 -4.786 1.00 0.00 S ATOM 141 CE MET A 14 -12.566 52.159 -6.315 1.00 0.00 C ATOM 0 H MET A 14 -9.904 54.943 -1.352 1.00 0.00 H new ATOM 0 HA MET A 14 -11.590 52.727 -2.219 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.369 53.891 -3.946 1.00 0.00 H new ATOM 0 HB3 MET A 14 -10.140 52.342 -4.224 1.00 0.00 H new ATOM 0 HG2 MET A 14 -11.632 54.987 -4.185 1.00 0.00 H new ATOM 0 HG3 MET A 14 -11.001 54.244 -5.642 1.00 0.00 H new ATOM 0 HE1 MET A 14 -13.406 51.501 -6.538 1.00 0.00 H new ATOM 0 HE2 MET A 14 -12.441 52.876 -7.126 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.658 51.566 -6.212 1.00 0.00 H new ATOM 151 N GLN A 15 -9.685 51.113 -1.667 1.00 0.00 N ATOM 152 CA GLN A 15 -8.722 50.231 -1.019 1.00 0.00 C ATOM 153 C GLN A 15 -8.398 49.033 -1.906 1.00 0.00 C ATOM 154 O GLN A 15 -9.295 48.315 -2.346 1.00 0.00 O ATOM 155 CB GLN A 15 -9.264 49.750 0.328 1.00 0.00 C ATOM 156 CG GLN A 15 -9.014 50.725 1.468 1.00 0.00 C ATOM 157 CD GLN A 15 -9.892 50.453 2.673 1.00 0.00 C ATOM 158 OE1 GLN A 15 -11.092 50.212 2.538 1.00 0.00 O ATOM 159 NE2 GLN A 15 -9.298 50.489 3.859 1.00 0.00 N ATOM 0 H GLN A 15 -10.443 50.630 -2.148 1.00 0.00 H new ATOM 0 HA GLN A 15 -7.805 50.796 -0.853 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -10.336 49.577 0.238 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -8.806 48.792 0.573 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -7.967 50.668 1.766 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -9.191 51.742 1.117 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -8.301 50.693 3.924 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -9.839 50.313 4.706 1.00 0.00 H new ATOM 168 N GLN A 16 -7.111 48.826 -2.165 1.00 0.00 N ATOM 169 CA GLN A 16 -6.670 47.715 -3.001 1.00 0.00 C ATOM 170 C GLN A 16 -5.405 47.078 -2.436 1.00 0.00 C ATOM 171 O GLN A 16 -4.546 47.764 -1.882 1.00 0.00 O ATOM 172 CB GLN A 16 -6.418 48.195 -4.431 1.00 0.00 C ATOM 173 CG GLN A 16 -7.654 48.767 -5.107 1.00 0.00 C ATOM 174 CD GLN A 16 -7.551 48.755 -6.619 1.00 0.00 C ATOM 175 OE1 GLN A 16 -7.072 47.788 -7.213 1.00 0.00 O ATOM 176 NE2 GLN A 16 -8.000 49.832 -7.253 1.00 0.00 N ATOM 0 H GLN A 16 -6.356 49.412 -1.809 1.00 0.00 H new ATOM 0 HA GLN A 16 -7.460 46.964 -3.011 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -5.637 48.955 -4.418 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -6.042 47.361 -5.024 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -8.529 48.193 -4.802 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -7.809 49.790 -4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -8.389 50.611 -6.722 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -7.956 49.880 -8.271 1.00 0.00 H new ATOM 185 N SER A 17 -5.297 45.761 -2.579 1.00 0.00 N ATOM 186 CA SER A 17 -4.138 45.030 -2.080 1.00 0.00 C ATOM 187 C SER A 17 -4.181 43.572 -2.528 1.00 0.00 C ATOM 188 O SER A 17 -5.162 42.868 -2.293 1.00 0.00 O ATOM 189 CB SER A 17 -4.081 45.104 -0.553 1.00 0.00 C ATOM 190 OG SER A 17 -5.205 44.467 0.031 1.00 0.00 O ATOM 0 H SER A 17 -5.998 45.178 -3.036 1.00 0.00 H new ATOM 0 HA SER A 17 -3.242 45.493 -2.493 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.166 44.632 -0.197 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.045 46.147 -0.237 1.00 0.00 H new ATOM 0 HG SER A 17 -5.483 43.714 -0.531 1.00 0.00 H new ATOM 196 N GLN A 18 -3.108 43.127 -3.175 1.00 0.00 N ATOM 197 CA GLN A 18 -3.023 41.754 -3.658 1.00 0.00 C ATOM 198 C GLN A 18 -1.697 41.117 -3.256 1.00 0.00 C ATOM 199 O GLN A 18 -0.648 41.438 -3.815 1.00 0.00 O ATOM 200 CB GLN A 18 -3.182 41.714 -5.179 1.00 0.00 C ATOM 201 CG GLN A 18 -4.598 42.003 -5.651 1.00 0.00 C ATOM 202 CD GLN A 18 -5.552 40.861 -5.365 1.00 0.00 C ATOM 203 OE1 GLN A 18 -5.169 39.691 -5.405 1.00 0.00 O ATOM 204 NE2 GLN A 18 -6.804 41.194 -5.073 1.00 0.00 N ATOM 0 H GLN A 18 -2.286 43.697 -3.376 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.832 41.184 -3.201 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.504 42.441 -5.626 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -2.881 40.731 -5.542 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -4.962 42.907 -5.163 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.586 42.202 -6.723 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -7.079 42.176 -5.051 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -7.491 40.468 -4.871 1.00 0.00 H new ATOM 213 N VAL A 19 -1.750 40.213 -2.283 1.00 0.00 N ATOM 214 CA VAL A 19 -0.553 39.531 -1.807 1.00 0.00 C ATOM 215 C VAL A 19 -0.566 38.059 -2.202 1.00 0.00 C ATOM 216 O VAL A 19 -1.536 37.346 -1.945 1.00 0.00 O ATOM 217 CB VAL A 19 -0.417 39.639 -0.276 1.00 0.00 C ATOM 218 CG1 VAL A 19 0.819 38.894 0.204 1.00 0.00 C ATOM 219 CG2 VAL A 19 -0.370 41.098 0.152 1.00 0.00 C ATOM 0 H VAL A 19 -2.610 39.936 -1.809 1.00 0.00 H new ATOM 0 HA VAL A 19 0.299 40.023 -2.276 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.291 39.177 0.183 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.899 38.981 1.288 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.739 37.842 -0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.706 39.324 -0.261 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.274 41.156 1.236 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.485 41.587 -0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -1.288 41.598 -0.158 1.00 0.00 H new ATOM 229 N GLN A 20 0.517 37.610 -2.828 1.00 0.00 N ATOM 230 CA GLN A 20 0.630 36.222 -3.259 1.00 0.00 C ATOM 231 C GLN A 20 1.887 35.574 -2.686 1.00 0.00 C ATOM 232 O GLN A 20 2.962 36.175 -2.685 1.00 0.00 O ATOM 233 CB GLN A 20 0.650 36.140 -4.786 1.00 0.00 C ATOM 234 CG GLN A 20 0.469 34.729 -5.322 1.00 0.00 C ATOM 235 CD GLN A 20 0.834 34.610 -6.789 1.00 0.00 C ATOM 236 OE1 GLN A 20 -0.038 34.568 -7.656 1.00 0.00 O ATOM 237 NE2 GLN A 20 2.130 34.555 -7.073 1.00 0.00 N ATOM 0 H GLN A 20 1.329 38.187 -3.048 1.00 0.00 H new ATOM 0 HA GLN A 20 -0.238 35.680 -2.885 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -0.140 36.776 -5.186 1.00 0.00 H new ATOM 0 HB3 GLN A 20 1.596 36.540 -5.151 1.00 0.00 H new ATOM 0 HG2 GLN A 20 1.085 34.042 -4.742 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -0.568 34.422 -5.183 1.00 0.00 H new ATOM 0 HE21 GLN A 20 2.819 34.593 -6.322 1.00 0.00 H new ATOM 0 HE22 GLN A 20 2.437 34.475 -8.042 1.00 0.00 H new ATOM 246 N LEU A 21 1.745 34.346 -2.200 1.00 0.00 N ATOM 247 CA LEU A 21 2.869 33.617 -1.624 1.00 0.00 C ATOM 248 C LEU A 21 2.877 32.167 -2.097 1.00 0.00 C ATOM 249 O LEU A 21 1.968 31.730 -2.803 1.00 0.00 O ATOM 250 CB LEU A 21 2.805 33.666 -0.096 1.00 0.00 C ATOM 251 CG LEU A 21 2.759 35.061 0.529 1.00 0.00 C ATOM 252 CD1 LEU A 21 2.238 34.989 1.956 1.00 0.00 C ATOM 253 CD2 LEU A 21 4.136 35.707 0.493 1.00 0.00 C ATOM 0 H LEU A 21 0.863 33.834 -2.193 1.00 0.00 H new ATOM 0 HA LEU A 21 3.790 34.095 -1.959 1.00 0.00 H new ATOM 0 HB2 LEU A 21 1.922 33.115 0.229 1.00 0.00 H new ATOM 0 HB3 LEU A 21 3.673 33.140 0.301 1.00 0.00 H new ATOM 0 HG LEU A 21 2.076 35.678 -0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.212 35.991 2.385 1.00 0.00 H new ATOM 0 HD12 LEU A 21 1.232 34.568 1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 21 2.896 34.356 2.552 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.084 36.699 0.942 1.00 0.00 H new ATOM 0 HD22 LEU A 21 4.841 35.092 1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.470 35.794 -0.541 1.00 0.00 H new ATOM 265 N GLN A 22 3.907 31.426 -1.702 1.00 0.00 N ATOM 266 CA GLN A 22 4.032 30.025 -2.085 1.00 0.00 C ATOM 267 C GLN A 22 3.084 29.151 -1.270 1.00 0.00 C ATOM 268 O GLN A 22 2.765 29.467 -0.123 1.00 0.00 O ATOM 269 CB GLN A 22 5.473 29.548 -1.895 1.00 0.00 C ATOM 270 CG GLN A 22 6.393 29.919 -3.047 1.00 0.00 C ATOM 271 CD GLN A 22 6.074 29.156 -4.317 1.00 0.00 C ATOM 272 OE1 GLN A 22 6.141 27.926 -4.350 1.00 0.00 O ATOM 273 NE2 GLN A 22 5.726 29.882 -5.373 1.00 0.00 N ATOM 0 H GLN A 22 4.667 31.773 -1.117 1.00 0.00 H new ATOM 0 HA GLN A 22 3.764 29.938 -3.138 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.869 29.973 -0.973 1.00 0.00 H new ATOM 0 HB3 GLN A 22 5.475 28.465 -1.773 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.313 30.989 -3.241 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.426 29.723 -2.760 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.683 30.899 -5.301 1.00 0.00 H new ATOM 0 HE22 GLN A 22 5.501 29.423 -6.256 1.00 0.00 H new ATOM 282 N CYS A 23 2.636 28.054 -1.870 1.00 0.00 N ATOM 283 CA CYS A 23 1.723 27.135 -1.200 1.00 0.00 C ATOM 284 C CYS A 23 2.410 25.807 -0.901 1.00 0.00 C ATOM 285 O CYS A 23 3.317 25.375 -1.613 1.00 0.00 O ATOM 286 CB CYS A 23 0.481 26.898 -2.062 1.00 0.00 C ATOM 287 SG CYS A 23 -0.567 28.357 -2.263 1.00 0.00 S ATOM 0 H CYS A 23 2.890 27.779 -2.819 1.00 0.00 H new ATOM 0 HA CYS A 23 1.420 27.587 -0.256 1.00 0.00 H new ATOM 0 HB2 CYS A 23 0.796 26.552 -3.046 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -0.110 26.098 -1.616 1.00 0.00 H new ATOM 0 HG CYS A 23 -1.589 28.058 -3.008 1.00 0.00 H new ATOM 293 N PRO A 24 1.970 25.142 0.178 1.00 0.00 N ATOM 294 CA PRO A 24 2.530 23.854 0.597 1.00 0.00 C ATOM 295 C PRO A 24 2.172 22.726 -0.364 1.00 0.00 C ATOM 296 O PRO A 24 1.638 22.966 -1.448 1.00 0.00 O ATOM 297 CB PRO A 24 1.886 23.615 1.965 1.00 0.00 C ATOM 298 CG PRO A 24 0.615 24.391 1.926 1.00 0.00 C ATOM 299 CD PRO A 24 0.892 25.597 1.072 1.00 0.00 C ATOM 0 HA PRO A 24 3.620 23.872 0.621 1.00 0.00 H new ATOM 0 HB2 PRO A 24 1.698 22.555 2.134 1.00 0.00 H new ATOM 0 HB3 PRO A 24 2.534 23.956 2.773 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -0.194 23.793 1.507 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.307 24.686 2.929 1.00 0.00 H new ATOM 0 HD2 PRO A 24 0.009 25.904 0.512 1.00 0.00 H new ATOM 0 HD3 PRO A 24 1.202 26.452 1.673 1.00 0.00 H new ATOM 307 N LEU A 25 2.468 21.495 0.038 1.00 0.00 N ATOM 308 CA LEU A 25 2.176 20.329 -0.788 1.00 0.00 C ATOM 309 C LEU A 25 0.739 19.861 -0.583 1.00 0.00 C ATOM 310 O LEU A 25 -0.007 20.441 0.207 1.00 0.00 O ATOM 311 CB LEU A 25 3.146 19.192 -0.461 1.00 0.00 C ATOM 312 CG LEU A 25 4.606 19.422 -0.851 1.00 0.00 C ATOM 313 CD1 LEU A 25 5.340 20.176 0.247 1.00 0.00 C ATOM 314 CD2 LEU A 25 5.295 18.097 -1.143 1.00 0.00 C ATOM 0 H LEU A 25 2.910 21.279 0.931 1.00 0.00 H new ATOM 0 HA LEU A 25 2.299 20.615 -1.833 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.103 19.002 0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.796 18.288 -0.959 1.00 0.00 H new ATOM 0 HG LEU A 25 4.629 20.028 -1.757 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.378 20.330 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.861 21.142 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.308 19.597 1.170 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.333 18.280 -1.419 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.261 17.466 -0.255 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.784 17.595 -1.965 1.00 0.00 H new ATOM 326 N THR A 26 0.357 18.807 -1.297 1.00 0.00 N ATOM 327 CA THR A 26 -0.990 18.261 -1.193 1.00 0.00 C ATOM 328 C THR A 26 -0.960 16.807 -0.735 1.00 0.00 C ATOM 329 O THR A 26 -0.026 16.059 -1.026 1.00 0.00 O ATOM 330 CB THR A 26 -1.738 18.349 -2.537 1.00 0.00 C ATOM 331 OG1 THR A 26 -0.830 18.110 -3.618 1.00 0.00 O ATOM 332 CG2 THR A 26 -2.389 19.713 -2.706 1.00 0.00 C ATOM 0 H THR A 26 0.962 18.314 -1.954 1.00 0.00 H new ATOM 0 HA THR A 26 -1.518 18.862 -0.452 1.00 0.00 H new ATOM 0 HB THR A 26 -2.519 17.589 -2.544 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.313 18.166 -4.469 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.911 19.751 -3.662 1.00 0.00 H new ATOM 0 HG22 THR A 26 -3.101 19.879 -1.897 1.00 0.00 H new ATOM 0 HG23 THR A 26 -1.623 20.488 -2.680 1.00 0.00 H new ATOM 340 N PRO A 27 -2.005 16.395 -0.002 1.00 0.00 N ATOM 341 CA PRO A 27 -2.122 15.027 0.511 1.00 0.00 C ATOM 342 C PRO A 27 -2.374 14.012 -0.599 1.00 0.00 C ATOM 343 O PRO A 27 -3.017 14.305 -1.607 1.00 0.00 O ATOM 344 CB PRO A 27 -3.327 15.102 1.451 1.00 0.00 C ATOM 345 CG PRO A 27 -4.138 16.241 0.938 1.00 0.00 C ATOM 346 CD PRO A 27 -3.153 17.233 0.383 1.00 0.00 C ATOM 0 HA PRO A 27 -1.205 14.694 0.998 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.897 14.173 1.439 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.015 15.271 2.482 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -4.834 15.909 0.167 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -4.734 16.686 1.735 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.563 17.771 -0.472 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.874 17.980 1.126 1.00 0.00 H new ATOM 354 N PRO A 28 -1.858 12.788 -0.412 1.00 0.00 N ATOM 355 CA PRO A 28 -2.015 11.705 -1.386 1.00 0.00 C ATOM 356 C PRO A 28 -3.451 11.194 -1.458 1.00 0.00 C ATOM 357 O PRO A 28 -3.935 10.544 -0.532 1.00 0.00 O ATOM 358 CB PRO A 28 -1.085 10.611 -0.855 1.00 0.00 C ATOM 359 CG PRO A 28 -0.987 10.876 0.608 1.00 0.00 C ATOM 360 CD PRO A 28 -1.080 12.368 0.766 1.00 0.00 C ATOM 0 HA PRO A 28 -1.777 12.031 -2.399 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -1.489 9.618 -1.051 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.106 10.657 -1.332 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.790 10.376 1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.047 10.499 1.011 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -1.578 12.643 1.696 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.094 12.833 0.783 1.00 0.00 H new ATOM 368 N ARG A 29 -4.125 11.494 -2.564 1.00 0.00 N ATOM 369 CA ARG A 29 -5.506 11.066 -2.756 1.00 0.00 C ATOM 370 C ARG A 29 -5.605 10.038 -3.879 1.00 0.00 C ATOM 371 O ARG A 29 -4.874 10.109 -4.866 1.00 0.00 O ATOM 372 CB ARG A 29 -6.396 12.269 -3.071 1.00 0.00 C ATOM 373 CG ARG A 29 -6.994 12.924 -1.836 1.00 0.00 C ATOM 374 CD ARG A 29 -8.183 12.136 -1.308 1.00 0.00 C ATOM 375 NE ARG A 29 -8.883 12.850 -0.244 1.00 0.00 N ATOM 376 CZ ARG A 29 -10.136 12.591 0.114 1.00 0.00 C ATOM 377 NH1 ARG A 29 -10.822 11.639 -0.504 1.00 0.00 N ATOM 378 NH2 ARG A 29 -10.705 13.284 1.092 1.00 0.00 N ATOM 0 H ARG A 29 -3.738 12.031 -3.340 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.848 10.602 -1.831 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.812 13.009 -3.618 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -7.204 11.950 -3.730 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -6.233 13.001 -1.059 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -7.307 13.940 -2.077 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -8.875 11.933 -2.125 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -7.841 11.171 -0.933 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.383 13.588 0.252 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -10.388 11.104 -1.256 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -11.784 11.442 -0.227 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.180 14.017 1.570 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -11.667 13.084 1.366 1.00 0.00 H new ATOM 392 N GLY A 30 -6.515 9.081 -3.721 1.00 0.00 N ATOM 393 CA GLY A 30 -6.693 8.053 -4.729 1.00 0.00 C ATOM 394 C GLY A 30 -5.745 6.885 -4.539 1.00 0.00 C ATOM 395 O GLY A 30 -5.755 5.934 -5.322 1.00 0.00 O ATOM 0 H GLY A 30 -7.132 9.000 -2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.721 7.692 -4.698 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.538 8.486 -5.717 1.00 0.00 H new ATOM 399 N LEU A 31 -4.922 6.956 -3.498 1.00 0.00 N ATOM 400 CA LEU A 31 -3.962 5.897 -3.208 1.00 0.00 C ATOM 401 C LEU A 31 -4.675 4.611 -2.805 1.00 0.00 C ATOM 402 O LEU A 31 -5.339 4.557 -1.769 1.00 0.00 O ATOM 403 CB LEU A 31 -3.009 6.336 -2.095 1.00 0.00 C ATOM 404 CG LEU A 31 -1.911 5.341 -1.720 1.00 0.00 C ATOM 405 CD1 LEU A 31 -2.456 4.271 -0.787 1.00 0.00 C ATOM 406 CD2 LEU A 31 -1.315 4.708 -2.970 1.00 0.00 C ATOM 0 H LEU A 31 -4.901 7.736 -2.841 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.388 5.703 -4.114 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.537 7.271 -2.396 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.598 6.550 -1.203 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.121 5.881 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.660 3.572 -0.531 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.834 4.739 0.122 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.265 3.734 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.535 4.002 -2.684 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.096 4.182 -3.519 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.887 5.485 -3.603 1.00 0.00 H new ATOM 418 N GLN A 32 -4.532 3.577 -3.628 1.00 0.00 N ATOM 419 CA GLN A 32 -5.162 2.291 -3.355 1.00 0.00 C ATOM 420 C GLN A 32 -4.374 1.152 -3.995 1.00 0.00 C ATOM 421 O GLN A 32 -3.556 1.374 -4.888 1.00 0.00 O ATOM 422 CB GLN A 32 -6.601 2.284 -3.872 1.00 0.00 C ATOM 423 CG GLN A 32 -6.704 2.331 -5.388 1.00 0.00 C ATOM 424 CD GLN A 32 -8.060 2.811 -5.867 1.00 0.00 C ATOM 425 OE1 GLN A 32 -8.843 3.366 -5.095 1.00 0.00 O ATOM 426 NE2 GLN A 32 -8.345 2.599 -7.146 1.00 0.00 N ATOM 0 H GLN A 32 -3.986 3.605 -4.489 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.171 2.141 -2.275 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.104 1.387 -3.510 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -7.133 3.139 -3.454 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -5.930 2.991 -5.781 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -6.511 1.337 -5.792 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -7.666 2.135 -7.750 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -9.243 2.900 -7.525 1.00 0.00 H new ATOM 435 N VAL A 33 -4.625 -0.068 -3.532 1.00 0.00 N ATOM 436 CA VAL A 33 -3.940 -1.242 -4.059 1.00 0.00 C ATOM 437 C VAL A 33 -4.882 -2.097 -4.899 1.00 0.00 C ATOM 438 O VAL A 33 -6.087 -2.136 -4.653 1.00 0.00 O ATOM 439 CB VAL A 33 -3.353 -2.106 -2.926 1.00 0.00 C ATOM 440 CG1 VAL A 33 -2.163 -1.409 -2.285 1.00 0.00 C ATOM 441 CG2 VAL A 33 -4.421 -2.419 -1.888 1.00 0.00 C ATOM 0 H VAL A 33 -5.298 -0.269 -2.793 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.127 -0.878 -4.687 1.00 0.00 H new ATOM 0 HB VAL A 33 -3.006 -3.047 -3.352 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.762 -2.034 -1.487 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.392 -1.240 -3.037 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.481 -0.452 -1.871 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.990 -3.030 -1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.800 -1.489 -1.464 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.239 -2.963 -2.360 1.00 0.00 H new ATOM 451 N SER A 34 -4.323 -2.781 -5.892 1.00 0.00 N ATOM 452 CA SER A 34 -5.114 -3.634 -6.772 1.00 0.00 C ATOM 453 C SER A 34 -4.304 -4.844 -7.229 1.00 0.00 C ATOM 454 O SER A 34 -3.079 -4.779 -7.336 1.00 0.00 O ATOM 455 CB SER A 34 -5.596 -2.841 -7.988 1.00 0.00 C ATOM 456 OG SER A 34 -6.394 -1.738 -7.594 1.00 0.00 O ATOM 0 H SER A 34 -3.326 -2.761 -6.107 1.00 0.00 H new ATOM 0 HA SER A 34 -5.979 -3.988 -6.211 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.738 -2.487 -8.559 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.170 -3.493 -8.647 1.00 0.00 H new ATOM 0 HG SER A 34 -6.688 -1.246 -8.389 1.00 0.00 H new ATOM 462 N ILE A 35 -4.997 -5.945 -7.497 1.00 0.00 N ATOM 463 CA ILE A 35 -4.342 -7.169 -7.943 1.00 0.00 C ATOM 464 C ILE A 35 -4.096 -7.144 -9.447 1.00 0.00 C ATOM 465 O ILE A 35 -5.036 -7.064 -10.238 1.00 0.00 O ATOM 466 CB ILE A 35 -5.178 -8.414 -7.591 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.446 -8.467 -6.086 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.466 -9.677 -8.052 1.00 0.00 C ATOM 469 CD1 ILE A 35 -6.338 -9.616 -5.671 1.00 0.00 C ATOM 0 H ILE A 35 -6.011 -6.015 -7.413 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.386 -7.224 -7.422 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.135 -8.349 -8.109 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.495 -8.547 -5.559 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.906 -7.529 -5.774 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -5.069 -10.548 -7.796 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.322 -9.640 -9.132 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.497 -9.749 -7.559 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.485 -9.591 -4.591 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.303 -9.527 -6.171 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.870 -10.560 -5.952 1.00 0.00 H new ATOM 481 N GLN A 36 -2.827 -7.215 -9.835 1.00 0.00 N ATOM 482 CA GLN A 36 -2.458 -7.201 -11.246 1.00 0.00 C ATOM 483 C GLN A 36 -3.479 -7.964 -12.083 1.00 0.00 C ATOM 484 O GLN A 36 -3.396 -9.184 -12.221 1.00 0.00 O ATOM 485 CB GLN A 36 -1.068 -7.809 -11.437 1.00 0.00 C ATOM 486 CG GLN A 36 -0.308 -7.232 -12.620 1.00 0.00 C ATOM 487 CD GLN A 36 0.827 -8.127 -13.078 1.00 0.00 C ATOM 488 OE1 GLN A 36 0.620 -9.299 -13.393 1.00 0.00 O ATOM 489 NE2 GLN A 36 2.035 -7.578 -13.118 1.00 0.00 N ATOM 0 H GLN A 36 -2.037 -7.283 -9.193 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.443 -6.164 -11.581 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -0.484 -7.652 -10.530 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.167 -8.886 -11.570 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -0.998 -7.075 -13.449 1.00 0.00 H new ATOM 0 HG3 GLN A 36 0.092 -6.255 -12.348 1.00 0.00 H new ATOM 0 HE21 GLN A 36 2.161 -6.602 -12.848 1.00 0.00 H new ATOM 0 HE22 GLN A 36 2.837 -8.132 -13.419 1.00 0.00 H new ATOM 498 N GLY A 37 -4.443 -7.237 -12.640 1.00 0.00 N ATOM 499 CA GLY A 37 -5.467 -7.863 -13.456 1.00 0.00 C ATOM 500 C GLY A 37 -6.662 -8.315 -12.641 1.00 0.00 C ATOM 501 O GLY A 37 -6.512 -8.761 -11.505 1.00 0.00 O ATOM 0 H GLY A 37 -4.533 -6.226 -12.541 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.798 -7.160 -14.221 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.040 -8.721 -13.975 1.00 0.00 H new ATOM 505 N GLU A 38 -7.851 -8.198 -13.223 1.00 0.00 N ATOM 506 CA GLU A 38 -9.077 -8.596 -12.541 1.00 0.00 C ATOM 507 C GLU A 38 -9.050 -10.083 -12.199 1.00 0.00 C ATOM 508 O GLU A 38 -9.151 -10.936 -13.080 1.00 0.00 O ATOM 509 CB GLU A 38 -10.296 -8.284 -13.411 1.00 0.00 C ATOM 510 CG GLU A 38 -11.552 -7.979 -12.613 1.00 0.00 C ATOM 511 CD GLU A 38 -11.675 -6.510 -12.258 1.00 0.00 C ATOM 512 OE1 GLU A 38 -10.824 -6.012 -11.492 1.00 0.00 O ATOM 513 OE2 GLU A 38 -12.623 -5.859 -12.745 1.00 0.00 O ATOM 0 H GLU A 38 -7.992 -7.831 -14.164 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.147 -8.028 -11.613 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.067 -7.432 -14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.490 -9.132 -14.067 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -12.426 -8.284 -13.188 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.549 -8.571 -11.698 1.00 0.00 H new ATOM 520 N ALA A 39 -8.914 -10.386 -10.912 1.00 0.00 N ATOM 521 CA ALA A 39 -8.875 -11.769 -10.452 1.00 0.00 C ATOM 522 C ALA A 39 -10.139 -12.124 -9.676 1.00 0.00 C ATOM 523 O ALA A 39 -10.878 -11.244 -9.237 1.00 0.00 O ATOM 524 CB ALA A 39 -7.642 -12.005 -9.594 1.00 0.00 C ATOM 0 H ALA A 39 -8.829 -9.692 -10.169 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.823 -12.417 -11.327 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.626 -13.042 -9.258 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.746 -11.800 -10.180 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.669 -11.343 -8.728 1.00 0.00 H new ATOM 530 N VAL A 40 -10.381 -13.421 -9.510 1.00 0.00 N ATOM 531 CA VAL A 40 -11.555 -13.893 -8.786 1.00 0.00 C ATOM 532 C VAL A 40 -11.156 -14.780 -7.611 1.00 0.00 C ATOM 533 O VAL A 40 -11.416 -14.449 -6.455 1.00 0.00 O ATOM 534 CB VAL A 40 -12.505 -14.679 -9.709 1.00 0.00 C ATOM 535 CG1 VAL A 40 -13.658 -15.268 -8.911 1.00 0.00 C ATOM 536 CG2 VAL A 40 -13.020 -13.786 -10.827 1.00 0.00 C ATOM 0 H VAL A 40 -9.779 -14.163 -9.867 1.00 0.00 H new ATOM 0 HA VAL A 40 -12.073 -13.010 -8.412 1.00 0.00 H new ATOM 0 HB VAL A 40 -11.949 -15.501 -10.159 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -14.319 -15.820 -9.580 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -13.266 -15.943 -8.150 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -14.216 -14.464 -8.431 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.690 -14.357 -11.470 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -13.560 -12.942 -10.399 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.179 -13.418 -11.415 1.00 0.00 H new ATOM 546 N ALA A 41 -10.523 -15.907 -7.916 1.00 0.00 N ATOM 547 CA ALA A 41 -10.086 -16.841 -6.886 1.00 0.00 C ATOM 548 C ALA A 41 -8.690 -17.376 -7.186 1.00 0.00 C ATOM 549 O ALA A 41 -8.461 -17.991 -8.228 1.00 0.00 O ATOM 550 CB ALA A 41 -11.077 -17.988 -6.758 1.00 0.00 C ATOM 0 H ALA A 41 -10.301 -16.196 -8.869 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.045 -16.304 -5.938 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.738 -18.678 -5.985 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.057 -17.594 -6.488 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.148 -18.516 -7.709 1.00 0.00 H new ATOM 556 N VAL A 42 -7.759 -17.138 -6.267 1.00 0.00 N ATOM 557 CA VAL A 42 -6.385 -17.596 -6.434 1.00 0.00 C ATOM 558 C VAL A 42 -6.130 -18.869 -5.635 1.00 0.00 C ATOM 559 O VAL A 42 -6.822 -19.149 -4.656 1.00 0.00 O ATOM 560 CB VAL A 42 -5.376 -16.518 -5.997 1.00 0.00 C ATOM 561 CG1 VAL A 42 -4.092 -17.160 -5.495 1.00 0.00 C ATOM 562 CG2 VAL A 42 -5.091 -15.560 -7.143 1.00 0.00 C ATOM 0 H VAL A 42 -7.932 -16.631 -5.399 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.247 -17.802 -7.495 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.812 -15.947 -5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.391 -16.383 -5.191 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.315 -17.801 -4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.648 -17.757 -6.292 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.376 -14.805 -6.817 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.675 -16.113 -7.985 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.017 -15.074 -7.450 1.00 0.00 H new ATOM 572 N ARG A 43 -5.132 -19.637 -6.058 1.00 0.00 N ATOM 573 CA ARG A 43 -4.785 -20.882 -5.383 1.00 0.00 C ATOM 574 C ARG A 43 -3.677 -20.654 -4.359 1.00 0.00 C ATOM 575 O ARG A 43 -2.871 -19.730 -4.474 1.00 0.00 O ATOM 576 CB ARG A 43 -4.344 -21.935 -6.401 1.00 0.00 C ATOM 577 CG ARG A 43 -5.500 -22.585 -7.144 1.00 0.00 C ATOM 578 CD ARG A 43 -5.841 -21.826 -8.417 1.00 0.00 C ATOM 579 NE ARG A 43 -6.941 -22.450 -9.147 1.00 0.00 N ATOM 580 CZ ARG A 43 -7.278 -22.121 -10.389 1.00 0.00 C ATOM 581 NH1 ARG A 43 -6.604 -21.180 -11.036 1.00 0.00 N ATOM 582 NH2 ARG A 43 -8.292 -22.734 -10.987 1.00 0.00 N ATOM 0 H ARG A 43 -4.549 -19.419 -6.866 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.672 -21.242 -4.861 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -3.673 -21.471 -7.124 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -3.773 -22.708 -5.887 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -5.242 -23.615 -7.391 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.376 -22.622 -6.496 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -6.108 -20.799 -8.167 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -4.961 -21.779 -9.058 1.00 0.00 H new ATOM 0 HE ARG A 43 -7.480 -23.178 -8.678 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -5.824 -20.706 -10.580 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -6.865 -20.930 -11.990 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -8.813 -23.458 -10.493 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.550 -22.481 -11.941 1.00 0.00 H new ATOM 596 N PRO A 44 -3.634 -21.515 -3.331 1.00 0.00 N ATOM 597 CA PRO A 44 -2.629 -21.428 -2.267 1.00 0.00 C ATOM 598 C PRO A 44 -1.232 -21.792 -2.758 1.00 0.00 C ATOM 599 O PRO A 44 -1.001 -22.901 -3.237 1.00 0.00 O ATOM 600 CB PRO A 44 -3.116 -22.449 -1.235 1.00 0.00 C ATOM 601 CG PRO A 44 -3.920 -23.427 -2.021 1.00 0.00 C ATOM 602 CD PRO A 44 -4.562 -22.640 -3.130 1.00 0.00 C ATOM 0 HA PRO A 44 -2.537 -20.415 -1.875 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.279 -22.936 -0.734 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.718 -21.973 -0.461 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -3.288 -24.220 -2.421 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -4.673 -23.905 -1.395 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -4.672 -23.237 -4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.558 -22.295 -2.853 1.00 0.00 H new ATOM 610 N GLY A 45 -0.302 -20.849 -2.634 1.00 0.00 N ATOM 611 CA GLY A 45 1.061 -21.090 -3.069 1.00 0.00 C ATOM 612 C GLY A 45 1.387 -20.387 -4.372 1.00 0.00 C ATOM 613 O GLY A 45 2.458 -20.589 -4.942 1.00 0.00 O ATOM 0 H GLY A 45 -0.469 -19.923 -2.240 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.751 -20.753 -2.295 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.216 -22.162 -3.189 1.00 0.00 H new ATOM 617 N GLU A 46 0.459 -19.560 -4.844 1.00 0.00 N ATOM 618 CA GLU A 46 0.653 -18.827 -6.090 1.00 0.00 C ATOM 619 C GLU A 46 1.091 -17.391 -5.813 1.00 0.00 C ATOM 620 O GLU A 46 0.365 -16.620 -5.186 1.00 0.00 O ATOM 621 CB GLU A 46 -0.635 -18.829 -6.915 1.00 0.00 C ATOM 622 CG GLU A 46 -0.860 -20.117 -7.689 1.00 0.00 C ATOM 623 CD GLU A 46 -0.033 -20.187 -8.958 1.00 0.00 C ATOM 624 OE1 GLU A 46 1.194 -19.969 -8.881 1.00 0.00 O ATOM 625 OE2 GLU A 46 -0.614 -20.460 -10.030 1.00 0.00 O ATOM 0 H GLU A 46 -0.433 -19.381 -4.383 1.00 0.00 H new ATOM 0 HA GLU A 46 1.439 -19.326 -6.657 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.483 -18.662 -6.250 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.609 -17.994 -7.615 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.614 -20.967 -7.052 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.916 -20.204 -7.943 1.00 0.00 H new ATOM 632 N ASP A 47 2.282 -17.041 -6.287 1.00 0.00 N ATOM 633 CA ASP A 47 2.817 -15.698 -6.092 1.00 0.00 C ATOM 634 C ASP A 47 1.889 -14.650 -6.698 1.00 0.00 C ATOM 635 O ASP A 47 1.919 -14.402 -7.904 1.00 0.00 O ATOM 636 CB ASP A 47 4.209 -15.586 -6.714 1.00 0.00 C ATOM 637 CG ASP A 47 5.115 -16.735 -6.317 1.00 0.00 C ATOM 638 OD1 ASP A 47 5.768 -16.636 -5.257 1.00 0.00 O ATOM 639 OD2 ASP A 47 5.172 -17.732 -7.067 1.00 0.00 O ATOM 0 H ASP A 47 2.895 -17.668 -6.808 1.00 0.00 H new ATOM 0 HA ASP A 47 2.891 -15.515 -5.020 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.117 -15.558 -7.800 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.666 -14.645 -6.408 1.00 0.00 H new ATOM 644 N VAL A 48 1.064 -14.037 -5.855 1.00 0.00 N ATOM 645 CA VAL A 48 0.127 -13.016 -6.307 1.00 0.00 C ATOM 646 C VAL A 48 0.819 -11.667 -6.465 1.00 0.00 C ATOM 647 O VAL A 48 1.738 -11.336 -5.714 1.00 0.00 O ATOM 648 CB VAL A 48 -1.053 -12.864 -5.329 1.00 0.00 C ATOM 649 CG1 VAL A 48 -0.558 -12.422 -3.960 1.00 0.00 C ATOM 650 CG2 VAL A 48 -2.076 -11.882 -5.878 1.00 0.00 C ATOM 0 H VAL A 48 1.026 -14.230 -4.854 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.253 -13.342 -7.275 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.538 -13.834 -5.218 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.406 -12.320 -3.282 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.134 -13.166 -3.566 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.048 -11.463 -4.050 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.903 -11.787 -5.174 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.606 -10.909 -6.020 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.453 -12.246 -6.834 1.00 0.00 H new ATOM 660 N LEU A 49 0.373 -10.890 -7.446 1.00 0.00 N ATOM 661 CA LEU A 49 0.949 -9.575 -7.703 1.00 0.00 C ATOM 662 C LEU A 49 0.016 -8.469 -7.222 1.00 0.00 C ATOM 663 O LEU A 49 -1.180 -8.480 -7.514 1.00 0.00 O ATOM 664 CB LEU A 49 1.233 -9.404 -9.196 1.00 0.00 C ATOM 665 CG LEU A 49 2.381 -10.242 -9.761 1.00 0.00 C ATOM 666 CD1 LEU A 49 3.723 -9.630 -9.389 1.00 0.00 C ATOM 667 CD2 LEU A 49 2.290 -11.677 -9.261 1.00 0.00 C ATOM 0 H LEU A 49 -0.386 -11.148 -8.077 1.00 0.00 H new ATOM 0 HA LEU A 49 1.886 -9.501 -7.150 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.326 -9.648 -9.748 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.449 -8.353 -9.386 1.00 0.00 H new ATOM 0 HG LEU A 49 2.298 -10.251 -10.848 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.527 -10.240 -9.800 1.00 0.00 H new ATOM 0 HD12 LEU A 49 3.788 -8.621 -9.797 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.816 -9.590 -8.304 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.115 -12.259 -9.673 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.347 -11.687 -8.173 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.343 -12.114 -9.579 1.00 0.00 H new ATOM 679 N PHE A 50 0.571 -7.513 -6.484 1.00 0.00 N ATOM 680 CA PHE A 50 -0.212 -6.398 -5.963 1.00 0.00 C ATOM 681 C PHE A 50 0.311 -5.069 -6.501 1.00 0.00 C ATOM 682 O PHE A 50 1.387 -4.610 -6.115 1.00 0.00 O ATOM 683 CB PHE A 50 -0.175 -6.392 -4.434 1.00 0.00 C ATOM 684 CG PHE A 50 -1.170 -7.327 -3.807 1.00 0.00 C ATOM 685 CD1 PHE A 50 -2.502 -6.966 -3.692 1.00 0.00 C ATOM 686 CD2 PHE A 50 -0.772 -8.566 -3.333 1.00 0.00 C ATOM 687 CE1 PHE A 50 -3.420 -7.824 -3.116 1.00 0.00 C ATOM 688 CE2 PHE A 50 -1.685 -9.429 -2.757 1.00 0.00 C ATOM 689 CZ PHE A 50 -3.011 -9.057 -2.647 1.00 0.00 C ATOM 0 H PHE A 50 1.559 -7.488 -6.233 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.243 -6.524 -6.294 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.827 -6.664 -4.102 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.365 -5.380 -4.078 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.827 -6.003 -4.057 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.264 -8.861 -3.414 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.456 -7.531 -3.033 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.362 -10.393 -2.393 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.726 -9.729 -2.195 1.00 0.00 H new ATOM 699 N VAL A 51 -0.457 -4.455 -7.395 1.00 0.00 N ATOM 700 CA VAL A 51 -0.073 -3.178 -7.986 1.00 0.00 C ATOM 701 C VAL A 51 -0.509 -2.012 -7.106 1.00 0.00 C ATOM 702 O VAL A 51 -1.588 -2.037 -6.514 1.00 0.00 O ATOM 703 CB VAL A 51 -0.683 -3.004 -9.389 1.00 0.00 C ATOM 704 CG1 VAL A 51 -0.142 -1.747 -10.054 1.00 0.00 C ATOM 705 CG2 VAL A 51 -0.406 -4.230 -10.246 1.00 0.00 C ATOM 0 H VAL A 51 -1.349 -4.821 -7.726 1.00 0.00 H new ATOM 0 HA VAL A 51 1.014 -3.181 -8.068 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.763 -2.897 -9.286 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.584 -1.640 -11.045 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.395 -0.877 -9.448 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.941 -1.822 -10.146 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.844 -4.090 -11.234 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.671 -4.370 -10.343 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -0.846 -5.110 -9.776 1.00 0.00 H new ATOM 715 N VAL A 52 0.337 -0.991 -7.024 1.00 0.00 N ATOM 716 CA VAL A 52 0.039 0.187 -6.218 1.00 0.00 C ATOM 717 C VAL A 52 0.099 1.458 -7.058 1.00 0.00 C ATOM 718 O VAL A 52 1.110 1.743 -7.700 1.00 0.00 O ATOM 719 CB VAL A 52 1.018 0.320 -5.036 1.00 0.00 C ATOM 720 CG1 VAL A 52 2.356 0.868 -5.509 1.00 0.00 C ATOM 721 CG2 VAL A 52 0.424 1.204 -3.950 1.00 0.00 C ATOM 0 H VAL A 52 1.235 -0.955 -7.506 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.972 0.058 -5.831 1.00 0.00 H new ATOM 0 HB VAL A 52 1.188 -0.671 -4.614 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.034 0.955 -4.660 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.785 0.192 -6.249 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.209 1.850 -5.958 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.129 1.287 -3.123 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.223 2.195 -4.357 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.506 0.764 -3.591 1.00 0.00 H new ATOM 731 N ARG A 53 -0.991 2.218 -7.048 1.00 0.00 N ATOM 732 CA ARG A 53 -1.063 3.459 -7.810 1.00 0.00 C ATOM 733 C ARG A 53 -2.140 4.381 -7.246 1.00 0.00 C ATOM 734 O ARG A 53 -3.201 3.924 -6.820 1.00 0.00 O ATOM 735 CB ARG A 53 -1.351 3.163 -9.283 1.00 0.00 C ATOM 736 CG ARG A 53 -1.468 4.410 -10.144 1.00 0.00 C ATOM 737 CD ARG A 53 -1.343 4.079 -11.623 1.00 0.00 C ATOM 738 NE ARG A 53 -1.529 5.258 -12.465 1.00 0.00 N ATOM 739 CZ ARG A 53 -2.701 5.857 -12.643 1.00 0.00 C ATOM 740 NH1 ARG A 53 -3.786 5.389 -12.041 1.00 0.00 N ATOM 741 NH2 ARG A 53 -2.790 6.925 -13.424 1.00 0.00 N ATOM 0 H ARG A 53 -1.836 1.996 -6.521 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.099 3.961 -7.729 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -0.556 2.531 -9.680 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.277 2.593 -9.356 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.427 4.893 -9.958 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -0.692 5.122 -9.862 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -0.361 3.647 -11.816 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -2.082 3.323 -11.889 1.00 0.00 H new ATOM 0 HE ARG A 53 -0.714 5.642 -12.943 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -3.721 4.567 -11.440 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.685 5.851 -12.179 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -1.958 7.288 -13.889 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -3.691 7.384 -13.560 1.00 0.00 H new ATOM 755 N GLN A 54 -1.860 5.680 -7.247 1.00 0.00 N ATOM 756 CA GLN A 54 -2.805 6.666 -6.734 1.00 0.00 C ATOM 757 C GLN A 54 -3.373 7.515 -7.866 1.00 0.00 C ATOM 758 O GLN A 54 -2.779 7.613 -8.939 1.00 0.00 O ATOM 759 CB GLN A 54 -2.126 7.564 -5.699 1.00 0.00 C ATOM 760 CG GLN A 54 -0.740 8.030 -6.113 1.00 0.00 C ATOM 761 CD GLN A 54 -0.146 9.031 -5.142 1.00 0.00 C ATOM 762 OE1 GLN A 54 0.979 8.864 -4.671 1.00 0.00 O ATOM 763 NE2 GLN A 54 -0.901 10.080 -4.837 1.00 0.00 N ATOM 0 H GLN A 54 -0.987 6.075 -7.597 1.00 0.00 H new ATOM 0 HA GLN A 54 -3.627 6.131 -6.257 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.755 8.436 -5.519 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -2.052 7.024 -4.755 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.079 7.167 -6.189 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.793 8.479 -7.105 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -1.828 10.179 -5.251 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -0.554 10.787 -4.189 1.00 0.00 H new ATOM 772 N GLU A 55 -4.528 8.126 -7.619 1.00 0.00 N ATOM 773 CA GLU A 55 -5.177 8.966 -8.619 1.00 0.00 C ATOM 774 C GLU A 55 -4.443 10.295 -8.773 1.00 0.00 C ATOM 775 O GLU A 55 -4.346 10.838 -9.873 1.00 0.00 O ATOM 776 CB GLU A 55 -6.636 9.218 -8.236 1.00 0.00 C ATOM 777 CG GLU A 55 -7.388 10.082 -9.235 1.00 0.00 C ATOM 778 CD GLU A 55 -7.244 9.583 -10.660 1.00 0.00 C ATOM 779 OE1 GLU A 55 -6.155 9.761 -11.245 1.00 0.00 O ATOM 780 OE2 GLU A 55 -8.222 9.015 -11.190 1.00 0.00 O ATOM 0 H GLU A 55 -5.033 8.055 -6.736 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.145 8.441 -9.574 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -7.148 8.261 -8.139 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -6.668 9.697 -7.258 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.444 10.106 -8.967 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.020 11.106 -9.173 1.00 0.00 H new ATOM 787 N GLN A 56 -3.928 10.812 -7.661 1.00 0.00 N ATOM 788 CA GLN A 56 -3.204 12.077 -7.672 1.00 0.00 C ATOM 789 C GLN A 56 -1.828 11.912 -8.308 1.00 0.00 C ATOM 790 O GLN A 56 -1.249 12.870 -8.818 1.00 0.00 O ATOM 791 CB GLN A 56 -3.060 12.619 -6.249 1.00 0.00 C ATOM 792 CG GLN A 56 -2.105 13.796 -6.140 1.00 0.00 C ATOM 793 CD GLN A 56 -2.092 14.411 -4.754 1.00 0.00 C ATOM 794 OE1 GLN A 56 -1.898 13.717 -3.756 1.00 0.00 O ATOM 795 NE2 GLN A 56 -2.299 15.721 -4.686 1.00 0.00 N ATOM 0 H GLN A 56 -3.999 10.374 -6.742 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.776 12.788 -8.268 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -4.041 12.923 -5.884 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.712 11.818 -5.597 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -1.098 13.467 -6.397 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.387 14.556 -6.868 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -2.456 16.258 -5.539 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -2.301 16.191 -3.781 1.00 0.00 H new ATOM 804 N GLY A 57 -1.308 10.688 -8.273 1.00 0.00 N ATOM 805 CA GLY A 57 -0.004 10.419 -8.848 1.00 0.00 C ATOM 806 C GLY A 57 1.024 11.466 -8.468 1.00 0.00 C ATOM 807 O GLY A 57 0.772 12.310 -7.607 1.00 0.00 O ATOM 0 H GLY A 57 -1.768 9.878 -7.856 1.00 0.00 H new ATOM 0 HA2 GLY A 57 0.340 9.439 -8.517 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.091 10.377 -9.934 1.00 0.00 H new ATOM 811 N ASP A 58 2.186 11.413 -9.110 1.00 0.00 N ATOM 812 CA ASP A 58 3.257 12.364 -8.834 1.00 0.00 C ATOM 813 C ASP A 58 3.833 12.143 -7.439 1.00 0.00 C ATOM 814 O ASP A 58 4.191 13.096 -6.746 1.00 0.00 O ATOM 815 CB ASP A 58 2.741 13.797 -8.965 1.00 0.00 C ATOM 816 CG ASP A 58 1.691 13.938 -10.050 1.00 0.00 C ATOM 817 OD1 ASP A 58 1.946 13.482 -11.185 1.00 0.00 O ATOM 818 OD2 ASP A 58 0.615 14.504 -9.766 1.00 0.00 O ATOM 0 H ASP A 58 2.410 10.721 -9.825 1.00 0.00 H new ATOM 0 HA ASP A 58 4.050 12.203 -9.565 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.320 14.117 -8.012 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.576 14.462 -9.183 1.00 0.00 H new ATOM 823 N VAL A 59 3.920 10.881 -7.033 1.00 0.00 N ATOM 824 CA VAL A 59 4.453 10.535 -5.720 1.00 0.00 C ATOM 825 C VAL A 59 5.531 11.522 -5.287 1.00 0.00 C ATOM 826 O VAL A 59 6.366 11.940 -6.091 1.00 0.00 O ATOM 827 CB VAL A 59 5.043 9.112 -5.711 1.00 0.00 C ATOM 828 CG1 VAL A 59 6.120 8.973 -6.776 1.00 0.00 C ATOM 829 CG2 VAL A 59 5.596 8.774 -4.335 1.00 0.00 C ATOM 0 H VAL A 59 3.628 10.081 -7.594 1.00 0.00 H new ATOM 0 HA VAL A 59 3.620 10.580 -5.019 1.00 0.00 H new ATOM 0 HB VAL A 59 4.246 8.405 -5.941 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.525 7.961 -6.754 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.689 9.170 -7.757 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.919 9.688 -6.581 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.009 7.765 -4.347 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.380 9.484 -4.074 1.00 0.00 H new ATOM 0 HG23 VAL A 59 4.795 8.830 -3.597 1.00 0.00 H new ATOM 839 N LEU A 60 5.508 11.893 -4.012 1.00 0.00 N ATOM 840 CA LEU A 60 6.484 12.832 -3.470 1.00 0.00 C ATOM 841 C LEU A 60 7.190 12.242 -2.253 1.00 0.00 C ATOM 842 O LEU A 60 7.000 12.703 -1.127 1.00 0.00 O ATOM 843 CB LEU A 60 5.799 14.146 -3.089 1.00 0.00 C ATOM 844 CG LEU A 60 4.360 14.032 -2.586 1.00 0.00 C ATOM 845 CD1 LEU A 60 4.333 13.894 -1.071 1.00 0.00 C ATOM 846 CD2 LEU A 60 3.543 15.238 -3.028 1.00 0.00 C ATOM 0 H LEU A 60 4.824 11.558 -3.334 1.00 0.00 H new ATOM 0 HA LEU A 60 7.230 13.028 -4.240 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.395 14.632 -2.317 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.808 14.802 -3.959 1.00 0.00 H new ATOM 0 HG LEU A 60 3.914 13.137 -3.020 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.300 13.814 -0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.882 12.999 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.797 14.770 -0.618 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.521 15.140 -2.661 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.988 16.147 -2.623 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.534 15.292 -4.117 1.00 0.00 H new ATOM 858 N THR A 61 8.008 11.221 -2.488 1.00 0.00 N ATOM 859 CA THR A 61 8.744 10.569 -1.412 1.00 0.00 C ATOM 860 C THR A 61 7.804 10.106 -0.305 1.00 0.00 C ATOM 861 O THR A 61 8.082 10.296 0.880 1.00 0.00 O ATOM 862 CB THR A 61 9.807 11.506 -0.810 1.00 0.00 C ATOM 863 OG1 THR A 61 10.287 12.411 -1.811 1.00 0.00 O ATOM 864 CG2 THR A 61 10.971 10.710 -0.240 1.00 0.00 C ATOM 0 H THR A 61 8.177 10.828 -3.414 1.00 0.00 H new ATOM 0 HA THR A 61 9.241 9.703 -1.849 1.00 0.00 H new ATOM 0 HB THR A 61 9.344 12.071 -0.002 1.00 0.00 H new ATOM 0 HG1 THR A 61 10.961 13.004 -1.419 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.709 11.394 0.179 1.00 0.00 H new ATOM 0 HG22 THR A 61 10.608 10.044 0.542 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.432 10.121 -1.033 1.00 0.00 H new ATOM 872 N THR A 62 6.689 9.497 -0.697 1.00 0.00 N ATOM 873 CA THR A 62 5.708 9.008 0.263 1.00 0.00 C ATOM 874 C THR A 62 5.924 7.530 0.565 1.00 0.00 C ATOM 875 O THR A 62 5.903 6.691 -0.336 1.00 0.00 O ATOM 876 CB THR A 62 4.270 9.210 -0.251 1.00 0.00 C ATOM 877 OG1 THR A 62 4.110 10.545 -0.745 1.00 0.00 O ATOM 878 CG2 THR A 62 3.258 8.949 0.854 1.00 0.00 C ATOM 0 H THR A 62 6.443 9.331 -1.673 1.00 0.00 H new ATOM 0 HA THR A 62 5.844 9.587 1.177 1.00 0.00 H new ATOM 0 HB THR A 62 4.093 8.500 -1.059 1.00 0.00 H new ATOM 0 HG1 THR A 62 3.194 10.665 -1.072 1.00 0.00 H new ATOM 0 HG21 THR A 62 2.250 9.098 0.467 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.363 7.924 1.208 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.435 9.638 1.680 1.00 0.00 H new ATOM 886 N LYS A 63 6.132 7.215 1.839 1.00 0.00 N ATOM 887 CA LYS A 63 6.350 5.837 2.262 1.00 0.00 C ATOM 888 C LYS A 63 5.054 5.035 2.194 1.00 0.00 C ATOM 889 O LYS A 63 3.963 5.587 2.340 1.00 0.00 O ATOM 890 CB LYS A 63 6.910 5.801 3.685 1.00 0.00 C ATOM 891 CG LYS A 63 8.205 6.577 3.849 1.00 0.00 C ATOM 892 CD LYS A 63 9.417 5.707 3.560 1.00 0.00 C ATOM 893 CE LYS A 63 10.712 6.414 3.931 1.00 0.00 C ATOM 894 NZ LYS A 63 11.061 7.481 2.952 1.00 0.00 N ATOM 0 H LYS A 63 6.154 7.897 2.597 1.00 0.00 H new ATOM 0 HA LYS A 63 7.072 5.385 1.582 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.165 6.205 4.370 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.079 4.764 3.974 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.204 7.435 3.177 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.270 6.967 4.865 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.338 4.774 4.118 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.434 5.445 2.502 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.616 6.851 4.925 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.522 5.686 3.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.081 7.449 2.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.531 7.329 2.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.814 8.410 3.349 1.00 0.00 H new ATOM 908 N TYR A 64 5.181 3.732 1.973 1.00 0.00 N ATOM 909 CA TYR A 64 4.019 2.854 1.885 1.00 0.00 C ATOM 910 C TYR A 64 4.244 1.572 2.680 1.00 0.00 C ATOM 911 O TYR A 64 5.296 0.943 2.579 1.00 0.00 O ATOM 912 CB TYR A 64 3.720 2.516 0.423 1.00 0.00 C ATOM 913 CG TYR A 64 3.426 3.728 -0.432 1.00 0.00 C ATOM 914 CD1 TYR A 64 2.355 4.563 -0.142 1.00 0.00 C ATOM 915 CD2 TYR A 64 4.220 4.037 -1.529 1.00 0.00 C ATOM 916 CE1 TYR A 64 2.082 5.672 -0.921 1.00 0.00 C ATOM 917 CE2 TYR A 64 3.957 5.144 -2.312 1.00 0.00 C ATOM 918 CZ TYR A 64 2.887 5.958 -2.004 1.00 0.00 C ATOM 919 OH TYR A 64 2.620 7.061 -2.783 1.00 0.00 O ATOM 0 H TYR A 64 6.077 3.259 1.851 1.00 0.00 H new ATOM 0 HA TYR A 64 3.164 3.379 2.312 1.00 0.00 H new ATOM 0 HB2 TYR A 64 4.572 1.982 0.001 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.867 1.838 0.383 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.725 4.342 0.707 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.058 3.401 -1.774 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.244 6.310 -0.683 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.586 5.371 -3.160 1.00 0.00 H new ATOM 0 HH TYR A 64 2.954 6.908 -3.692 1.00 0.00 H new ATOM 929 N GLN A 65 3.245 1.192 3.471 1.00 0.00 N ATOM 930 CA GLN A 65 3.332 -0.015 4.284 1.00 0.00 C ATOM 931 C GLN A 65 2.381 -1.089 3.768 1.00 0.00 C ATOM 932 O GLN A 65 1.161 -0.940 3.841 1.00 0.00 O ATOM 933 CB GLN A 65 3.015 0.305 5.745 1.00 0.00 C ATOM 934 CG GLN A 65 3.342 -0.830 6.702 1.00 0.00 C ATOM 935 CD GLN A 65 4.804 -0.855 7.100 1.00 0.00 C ATOM 936 OE1 GLN A 65 5.649 -1.375 6.371 1.00 0.00 O ATOM 937 NE2 GLN A 65 5.111 -0.292 8.262 1.00 0.00 N ATOM 0 H GLN A 65 2.367 1.702 3.566 1.00 0.00 H new ATOM 0 HA GLN A 65 4.351 -0.396 4.216 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.573 1.192 6.043 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.956 0.550 5.833 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.727 -0.734 7.597 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.080 -1.780 6.236 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.379 0.128 8.835 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.079 -0.279 8.582 1.00 0.00 H new ATOM 946 N VAL A 66 2.946 -2.173 3.246 1.00 0.00 N ATOM 947 CA VAL A 66 2.148 -3.273 2.718 1.00 0.00 C ATOM 948 C VAL A 66 2.022 -4.400 3.738 1.00 0.00 C ATOM 949 O VAL A 66 3.013 -5.032 4.105 1.00 0.00 O ATOM 950 CB VAL A 66 2.757 -3.836 1.420 1.00 0.00 C ATOM 951 CG1 VAL A 66 1.938 -5.014 0.913 1.00 0.00 C ATOM 952 CG2 VAL A 66 2.853 -2.748 0.362 1.00 0.00 C ATOM 0 H VAL A 66 3.954 -2.313 3.177 1.00 0.00 H new ATOM 0 HA VAL A 66 1.158 -2.870 2.501 1.00 0.00 H new ATOM 0 HB VAL A 66 3.765 -4.191 1.636 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.383 -5.399 -0.005 1.00 0.00 H new ATOM 0 HG12 VAL A 66 1.926 -5.800 1.668 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.917 -4.688 0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.285 -3.163 -0.548 1.00 0.00 H new ATOM 0 HG22 VAL A 66 1.857 -2.361 0.147 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.485 -1.939 0.728 1.00 0.00 H new ATOM 962 N ASP A 67 0.798 -4.646 4.191 1.00 0.00 N ATOM 963 CA ASP A 67 0.542 -5.698 5.168 1.00 0.00 C ATOM 964 C ASP A 67 -0.226 -6.853 4.534 1.00 0.00 C ATOM 965 O ASP A 67 -1.410 -6.726 4.217 1.00 0.00 O ATOM 966 CB ASP A 67 -0.243 -5.139 6.357 1.00 0.00 C ATOM 967 CG ASP A 67 -0.715 -6.227 7.301 1.00 0.00 C ATOM 968 OD1 ASP A 67 0.136 -7.002 7.787 1.00 0.00 O ATOM 969 OD2 ASP A 67 -1.935 -6.303 7.555 1.00 0.00 O ATOM 0 H ASP A 67 -0.032 -4.132 3.898 1.00 0.00 H new ATOM 0 HA ASP A 67 1.502 -6.074 5.521 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.384 -4.434 6.904 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.105 -4.581 5.990 1.00 0.00 H new ATOM 974 N LEU A 68 0.454 -7.979 4.350 1.00 0.00 N ATOM 975 CA LEU A 68 -0.164 -9.157 3.752 1.00 0.00 C ATOM 976 C LEU A 68 -1.324 -9.657 4.607 1.00 0.00 C ATOM 977 O LEU A 68 -2.330 -10.137 4.087 1.00 0.00 O ATOM 978 CB LEU A 68 0.873 -10.269 3.580 1.00 0.00 C ATOM 979 CG LEU A 68 1.854 -10.098 2.419 1.00 0.00 C ATOM 980 CD1 LEU A 68 1.269 -10.668 1.137 1.00 0.00 C ATOM 981 CD2 LEU A 68 2.214 -8.630 2.237 1.00 0.00 C ATOM 0 H LEU A 68 1.434 -8.101 4.606 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.553 -8.876 2.773 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.445 -10.351 4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.345 -11.213 3.447 1.00 0.00 H new ATOM 0 HG LEU A 68 2.765 -10.649 2.654 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.981 -10.537 0.322 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.063 -11.730 1.272 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.343 -10.146 0.896 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.913 -8.527 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.311 -8.058 2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.676 -8.253 3.149 1.00 0.00 H new ATOM 993 N GLY A 69 -1.177 -9.538 5.923 1.00 0.00 N ATOM 994 CA GLY A 69 -2.221 -9.980 6.829 1.00 0.00 C ATOM 995 C GLY A 69 -1.748 -11.066 7.774 1.00 0.00 C ATOM 996 O GLY A 69 -1.685 -10.860 8.986 1.00 0.00 O ATOM 0 H GLY A 69 -0.354 -9.143 6.378 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -2.579 -9.129 7.409 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.067 -10.350 6.250 1.00 0.00 H new ATOM 1000 N ASP A 70 -1.414 -12.226 7.220 1.00 0.00 N ATOM 1001 CA ASP A 70 -0.944 -13.350 8.022 1.00 0.00 C ATOM 1002 C ASP A 70 0.152 -12.908 8.987 1.00 0.00 C ATOM 1003 O ASP A 70 -0.056 -12.860 10.198 1.00 0.00 O ATOM 1004 CB ASP A 70 -0.424 -14.468 7.117 1.00 0.00 C ATOM 1005 CG ASP A 70 0.576 -15.364 7.820 1.00 0.00 C ATOM 1006 OD1 ASP A 70 0.145 -16.222 8.618 1.00 0.00 O ATOM 1007 OD2 ASP A 70 1.791 -15.206 7.573 1.00 0.00 O ATOM 0 H ASP A 70 -1.460 -12.413 6.218 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.785 -13.726 8.604 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.264 -15.069 6.768 1.00 0.00 H new ATOM 0 HB3 ASP A 70 0.043 -14.030 6.235 1.00 0.00 H new ATOM 1012 N GLY A 71 1.320 -12.587 8.440 1.00 0.00 N ATOM 1013 CA GLY A 71 2.432 -12.154 9.267 1.00 0.00 C ATOM 1014 C GLY A 71 3.577 -11.589 8.450 1.00 0.00 C ATOM 1015 O GLY A 71 4.720 -11.559 8.907 1.00 0.00 O ATOM 0 H GLY A 71 1.517 -12.619 7.440 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.084 -11.398 9.971 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.792 -12.997 9.857 1.00 0.00 H new ATOM 1019 N PHE A 72 3.271 -11.141 7.237 1.00 0.00 N ATOM 1020 CA PHE A 72 4.284 -10.576 6.353 1.00 0.00 C ATOM 1021 C PHE A 72 3.935 -9.139 5.974 1.00 0.00 C ATOM 1022 O PHE A 72 2.935 -8.888 5.300 1.00 0.00 O ATOM 1023 CB PHE A 72 4.422 -11.429 5.090 1.00 0.00 C ATOM 1024 CG PHE A 72 5.671 -11.142 4.307 1.00 0.00 C ATOM 1025 CD1 PHE A 72 6.891 -11.664 4.707 1.00 0.00 C ATOM 1026 CD2 PHE A 72 5.625 -10.351 3.170 1.00 0.00 C ATOM 1027 CE1 PHE A 72 8.041 -11.400 3.988 1.00 0.00 C ATOM 1028 CE2 PHE A 72 6.772 -10.085 2.447 1.00 0.00 C ATOM 1029 CZ PHE A 72 7.982 -10.611 2.856 1.00 0.00 C ATOM 0 H PHE A 72 2.330 -11.158 6.844 1.00 0.00 H new ATOM 0 HA PHE A 72 5.235 -10.572 6.886 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.412 -12.482 5.370 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.555 -11.261 4.451 1.00 0.00 H new ATOM 0 HD1 PHE A 72 6.943 -12.284 5.590 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.682 -9.938 2.845 1.00 0.00 H new ATOM 0 HE1 PHE A 72 8.986 -11.811 4.311 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.723 -9.466 1.563 1.00 0.00 H new ATOM 0 HZ PHE A 72 8.880 -10.406 2.292 1.00 0.00 H new ATOM 1039 N LYS A 73 4.766 -8.200 6.411 1.00 0.00 N ATOM 1040 CA LYS A 73 4.549 -6.788 6.119 1.00 0.00 C ATOM 1041 C LYS A 73 5.870 -6.082 5.831 1.00 0.00 C ATOM 1042 O LYS A 73 6.860 -6.288 6.532 1.00 0.00 O ATOM 1043 CB LYS A 73 3.839 -6.107 7.291 1.00 0.00 C ATOM 1044 CG LYS A 73 4.157 -6.729 8.639 1.00 0.00 C ATOM 1045 CD LYS A 73 4.085 -5.703 9.758 1.00 0.00 C ATOM 1046 CE LYS A 73 4.551 -6.289 11.082 1.00 0.00 C ATOM 1047 NZ LYS A 73 6.026 -6.173 11.251 1.00 0.00 N ATOM 0 H LYS A 73 5.598 -8.391 6.970 1.00 0.00 H new ATOM 0 HA LYS A 73 3.920 -6.719 5.231 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.118 -5.054 7.311 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.762 -6.148 7.126 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.456 -7.539 8.841 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.154 -7.169 8.611 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.702 -4.841 9.503 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.061 -5.344 9.858 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.050 -5.776 11.903 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.260 -7.338 11.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.304 -6.584 12.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.505 -6.684 10.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.301 -5.170 11.224 1.00 0.00 H new ATOM 1061 N ALA A 74 5.877 -5.248 4.796 1.00 0.00 N ATOM 1062 CA ALA A 74 7.075 -4.509 4.419 1.00 0.00 C ATOM 1063 C ALA A 74 6.736 -3.074 4.031 1.00 0.00 C ATOM 1064 O ALA A 74 5.608 -2.778 3.639 1.00 0.00 O ATOM 1065 CB ALA A 74 7.790 -5.213 3.274 1.00 0.00 C ATOM 0 H ALA A 74 5.066 -5.068 4.204 1.00 0.00 H new ATOM 0 HA ALA A 74 7.739 -4.476 5.283 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.683 -4.651 3.002 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.075 -6.218 3.586 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.124 -5.275 2.413 1.00 0.00 H new ATOM 1071 N MET A 75 7.719 -2.187 4.143 1.00 0.00 N ATOM 1072 CA MET A 75 7.524 -0.783 3.803 1.00 0.00 C ATOM 1073 C MET A 75 8.221 -0.439 2.491 1.00 0.00 C ATOM 1074 O MET A 75 9.450 -0.429 2.414 1.00 0.00 O ATOM 1075 CB MET A 75 8.051 0.114 4.925 1.00 0.00 C ATOM 1076 CG MET A 75 8.030 1.594 4.580 1.00 0.00 C ATOM 1077 SD MET A 75 9.340 2.518 5.406 1.00 0.00 S ATOM 1078 CE MET A 75 10.676 2.337 4.227 1.00 0.00 C ATOM 0 H MET A 75 8.659 -2.416 4.467 1.00 0.00 H new ATOM 0 HA MET A 75 6.455 -0.610 3.682 1.00 0.00 H new ATOM 0 HB2 MET A 75 7.453 -0.050 5.821 1.00 0.00 H new ATOM 0 HB3 MET A 75 9.073 -0.180 5.165 1.00 0.00 H new ATOM 0 HG2 MET A 75 8.131 1.713 3.501 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.063 2.014 4.858 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.560 2.856 4.597 1.00 0.00 H new ATOM 0 HE2 MET A 75 10.905 1.279 4.096 1.00 0.00 H new ATOM 0 HE3 MET A 75 10.377 2.765 3.270 1.00 0.00 H new ATOM 1088 N TYR A 76 7.430 -0.158 1.462 1.00 0.00 N ATOM 1089 CA TYR A 76 7.971 0.184 0.152 1.00 0.00 C ATOM 1090 C TYR A 76 7.929 1.691 -0.079 1.00 0.00 C ATOM 1091 O TYR A 76 6.872 2.316 0.015 1.00 0.00 O ATOM 1092 CB TYR A 76 7.190 -0.534 -0.950 1.00 0.00 C ATOM 1093 CG TYR A 76 7.264 -2.042 -0.860 1.00 0.00 C ATOM 1094 CD1 TYR A 76 6.457 -2.745 0.027 1.00 0.00 C ATOM 1095 CD2 TYR A 76 8.140 -2.763 -1.661 1.00 0.00 C ATOM 1096 CE1 TYR A 76 6.522 -4.122 0.113 1.00 0.00 C ATOM 1097 CE2 TYR A 76 8.210 -4.140 -1.583 1.00 0.00 C ATOM 1098 CZ TYR A 76 7.399 -4.815 -0.695 1.00 0.00 C ATOM 1099 OH TYR A 76 7.467 -6.187 -0.613 1.00 0.00 O ATOM 0 H TYR A 76 6.411 -0.160 1.510 1.00 0.00 H new ATOM 0 HA TYR A 76 9.011 -0.141 0.122 1.00 0.00 H new ATOM 0 HB2 TYR A 76 6.145 -0.226 -0.903 1.00 0.00 H new ATOM 0 HB3 TYR A 76 7.572 -0.217 -1.920 1.00 0.00 H new ATOM 0 HD1 TYR A 76 5.768 -2.205 0.660 1.00 0.00 H new ATOM 0 HD2 TYR A 76 8.777 -2.238 -2.357 1.00 0.00 H new ATOM 0 HE1 TYR A 76 5.890 -4.653 0.809 1.00 0.00 H new ATOM 0 HE2 TYR A 76 8.896 -4.685 -2.214 1.00 0.00 H new ATOM 0 HH TYR A 76 8.133 -6.520 -1.250 1.00 0.00 H new ATOM 1109 N VAL A 77 9.087 2.270 -0.382 1.00 0.00 N ATOM 1110 CA VAL A 77 9.183 3.704 -0.629 1.00 0.00 C ATOM 1111 C VAL A 77 9.084 4.013 -2.118 1.00 0.00 C ATOM 1112 O VAL A 77 9.472 3.202 -2.958 1.00 0.00 O ATOM 1113 CB VAL A 77 10.504 4.279 -0.083 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.690 3.709 -0.846 1.00 0.00 C ATOM 1115 CG2 VAL A 77 10.493 5.799 -0.156 1.00 0.00 C ATOM 0 H VAL A 77 9.971 1.768 -0.462 1.00 0.00 H new ATOM 0 HA VAL A 77 8.348 4.172 -0.108 1.00 0.00 H new ATOM 0 HB VAL A 77 10.602 3.989 0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 77 12.614 4.126 -0.447 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.705 2.624 -0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 77 11.602 3.967 -1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 77 11.433 6.189 0.234 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.372 6.113 -1.193 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.666 6.186 0.439 1.00 0.00 H new ATOM 1125 N ASN A 78 8.562 5.193 -2.438 1.00 0.00 N ATOM 1126 CA ASN A 78 8.411 5.610 -3.827 1.00 0.00 C ATOM 1127 C ASN A 78 7.904 4.458 -4.690 1.00 0.00 C ATOM 1128 O ASN A 78 8.135 4.425 -5.899 1.00 0.00 O ATOM 1129 CB ASN A 78 9.744 6.124 -4.375 1.00 0.00 C ATOM 1130 CG ASN A 78 10.766 5.016 -4.540 1.00 0.00 C ATOM 1131 OD1 ASN A 78 10.460 3.947 -5.069 1.00 0.00 O ATOM 1132 ND2 ASN A 78 11.989 5.268 -4.087 1.00 0.00 N ATOM 0 H ASN A 78 8.237 5.877 -1.754 1.00 0.00 H new ATOM 0 HA ASN A 78 7.677 6.415 -3.860 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.576 6.606 -5.338 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.141 6.884 -3.703 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.720 4.561 -4.171 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.198 6.168 -3.655 1.00 0.00 H new ATOM 1139 N LEU A 79 7.211 3.515 -4.060 1.00 0.00 N ATOM 1140 CA LEU A 79 6.671 2.361 -4.769 1.00 0.00 C ATOM 1141 C LEU A 79 5.895 2.797 -6.008 1.00 0.00 C ATOM 1142 O LEU A 79 6.094 2.263 -7.099 1.00 0.00 O ATOM 1143 CB LEU A 79 5.762 1.549 -3.844 1.00 0.00 C ATOM 1144 CG LEU A 79 5.478 0.110 -4.276 1.00 0.00 C ATOM 1145 CD1 LEU A 79 6.775 -0.672 -4.414 1.00 0.00 C ATOM 1146 CD2 LEU A 79 4.546 -0.570 -3.285 1.00 0.00 C ATOM 0 H LEU A 79 7.010 3.527 -3.060 1.00 0.00 H new ATOM 0 HA LEU A 79 7.507 1.737 -5.087 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.213 1.527 -2.852 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.811 2.073 -3.750 1.00 0.00 H new ATOM 0 HG LEU A 79 4.987 0.133 -5.249 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.553 -1.694 -4.722 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.408 -0.197 -5.163 1.00 0.00 H new ATOM 0 HD13 LEU A 79 7.295 -0.687 -3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.355 -1.593 -3.608 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.010 -0.582 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.604 -0.023 -3.237 1.00 0.00 H new ATOM 1158 N THR A 80 5.010 3.774 -5.832 1.00 0.00 N ATOM 1159 CA THR A 80 4.205 4.283 -6.935 1.00 0.00 C ATOM 1160 C THR A 80 5.085 4.858 -8.039 1.00 0.00 C ATOM 1161 O THR A 80 4.649 5.002 -9.182 1.00 0.00 O ATOM 1162 CB THR A 80 3.223 5.370 -6.458 1.00 0.00 C ATOM 1163 OG1 THR A 80 3.870 6.238 -5.521 1.00 0.00 O ATOM 1164 CG2 THR A 80 1.994 4.745 -5.815 1.00 0.00 C ATOM 0 H THR A 80 4.833 4.228 -4.936 1.00 0.00 H new ATOM 0 HA THR A 80 3.639 3.439 -7.329 1.00 0.00 H new ATOM 0 HB THR A 80 2.905 5.947 -7.326 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.788 6.412 -5.817 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.315 5.532 -5.486 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.487 4.109 -6.541 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.297 4.146 -4.957 1.00 0.00 H new ATOM 1172 N LEU A 81 6.325 5.184 -7.691 1.00 0.00 N ATOM 1173 CA LEU A 81 7.268 5.742 -8.653 1.00 0.00 C ATOM 1174 C LEU A 81 7.941 4.637 -9.461 1.00 0.00 C ATOM 1175 O LEU A 81 8.079 4.740 -10.680 1.00 0.00 O ATOM 1176 CB LEU A 81 8.325 6.580 -7.933 1.00 0.00 C ATOM 1177 CG LEU A 81 9.199 7.466 -8.822 1.00 0.00 C ATOM 1178 CD1 LEU A 81 9.646 8.707 -8.065 1.00 0.00 C ATOM 1179 CD2 LEU A 81 10.404 6.688 -9.331 1.00 0.00 C ATOM 0 H LEU A 81 6.701 5.071 -6.749 1.00 0.00 H new ATOM 0 HA LEU A 81 6.713 6.381 -9.340 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.822 7.215 -7.204 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.975 5.907 -7.374 1.00 0.00 H new ATOM 0 HG LEU A 81 8.606 7.782 -9.680 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.267 9.325 -8.714 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.771 9.276 -7.750 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.221 8.411 -7.188 1.00 0.00 H new ATOM 0 HD21 LEU A 81 11.014 7.334 -9.962 1.00 0.00 H new ATOM 0 HD22 LEU A 81 10.997 6.342 -8.485 1.00 0.00 H new ATOM 0 HD23 LEU A 81 10.064 5.830 -9.912 1.00 0.00 H new ATOM 1191 N THR A 82 8.357 3.578 -8.773 1.00 0.00 N ATOM 1192 CA THR A 82 9.015 2.453 -9.425 1.00 0.00 C ATOM 1193 C THR A 82 8.021 1.631 -10.238 1.00 0.00 C ATOM 1194 O THR A 82 8.409 0.853 -11.108 1.00 0.00 O ATOM 1195 CB THR A 82 9.706 1.535 -8.400 1.00 0.00 C ATOM 1196 OG1 THR A 82 8.737 1.000 -7.491 1.00 0.00 O ATOM 1197 CG2 THR A 82 10.771 2.295 -7.624 1.00 0.00 C ATOM 0 H THR A 82 8.250 3.476 -7.764 1.00 0.00 H new ATOM 0 HA THR A 82 9.769 2.871 -10.092 1.00 0.00 H new ATOM 0 HB THR A 82 10.186 0.719 -8.941 1.00 0.00 H new ATOM 0 HG1 THR A 82 7.915 1.531 -7.539 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.245 1.626 -6.906 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.522 2.677 -8.315 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.310 3.128 -7.094 1.00 0.00 H new ATOM 1205 N GLY A 83 6.735 1.811 -9.949 1.00 0.00 N ATOM 1206 CA GLY A 83 5.706 1.079 -10.663 1.00 0.00 C ATOM 1207 C GLY A 83 5.915 -0.422 -10.606 1.00 0.00 C ATOM 1208 O GLY A 83 5.326 -1.167 -11.388 1.00 0.00 O ATOM 0 H GLY A 83 6.389 2.450 -9.234 1.00 0.00 H new ATOM 0 HA2 GLY A 83 4.731 1.323 -10.240 1.00 0.00 H new ATOM 0 HA3 GLY A 83 5.692 1.401 -11.704 1.00 0.00 H new ATOM 1212 N GLU A 84 6.758 -0.865 -9.678 1.00 0.00 N ATOM 1213 CA GLU A 84 7.045 -2.286 -9.524 1.00 0.00 C ATOM 1214 C GLU A 84 6.006 -2.958 -8.631 1.00 0.00 C ATOM 1215 O GLU A 84 5.677 -2.475 -7.548 1.00 0.00 O ATOM 1216 CB GLU A 84 8.444 -2.486 -8.937 1.00 0.00 C ATOM 1217 CG GLU A 84 8.469 -2.508 -7.418 1.00 0.00 C ATOM 1218 CD GLU A 84 9.877 -2.568 -6.859 1.00 0.00 C ATOM 1219 OE1 GLU A 84 10.587 -3.556 -7.141 1.00 0.00 O ATOM 1220 OE2 GLU A 84 10.270 -1.626 -6.139 1.00 0.00 O ATOM 0 H GLU A 84 7.253 -0.261 -9.022 1.00 0.00 H new ATOM 0 HA GLU A 84 7.003 -2.747 -10.511 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.856 -3.423 -9.312 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.095 -1.687 -9.291 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.968 -1.618 -7.037 1.00 0.00 H new ATOM 0 HG3 GLU A 84 7.903 -3.369 -7.061 1.00 0.00 H new ATOM 1227 N PRO A 85 5.476 -4.099 -9.096 1.00 0.00 N ATOM 1228 CA PRO A 85 4.467 -4.862 -8.356 1.00 0.00 C ATOM 1229 C PRO A 85 5.040 -5.522 -7.106 1.00 0.00 C ATOM 1230 O PRO A 85 6.239 -5.433 -6.841 1.00 0.00 O ATOM 1231 CB PRO A 85 4.016 -5.923 -9.362 1.00 0.00 C ATOM 1232 CG PRO A 85 5.174 -6.086 -10.285 1.00 0.00 C ATOM 1233 CD PRO A 85 5.822 -4.733 -10.379 1.00 0.00 C ATOM 0 HA PRO A 85 3.659 -4.226 -7.996 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.771 -6.861 -8.865 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.123 -5.605 -9.900 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.875 -6.829 -9.904 1.00 0.00 H new ATOM 0 HG3 PRO A 85 4.846 -6.431 -11.266 1.00 0.00 H new ATOM 0 HD2 PRO A 85 6.901 -4.813 -10.510 1.00 0.00 H new ATOM 0 HD3 PRO A 85 5.440 -4.162 -11.225 1.00 0.00 H new ATOM 1241 N ILE A 86 4.177 -6.184 -6.344 1.00 0.00 N ATOM 1242 CA ILE A 86 4.598 -6.860 -5.123 1.00 0.00 C ATOM 1243 C ILE A 86 4.389 -8.367 -5.229 1.00 0.00 C ATOM 1244 O ILE A 86 3.270 -8.860 -5.087 1.00 0.00 O ATOM 1245 CB ILE A 86 3.835 -6.333 -3.894 1.00 0.00 C ATOM 1246 CG1 ILE A 86 4.241 -4.888 -3.596 1.00 0.00 C ATOM 1247 CG2 ILE A 86 4.094 -7.222 -2.687 1.00 0.00 C ATOM 1248 CD1 ILE A 86 3.230 -4.137 -2.758 1.00 0.00 C ATOM 0 H ILE A 86 3.182 -6.267 -6.550 1.00 0.00 H new ATOM 0 HA ILE A 86 5.660 -6.650 -4.998 1.00 0.00 H new ATOM 0 HB ILE A 86 2.767 -6.353 -4.112 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.201 -4.888 -3.079 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.386 -4.358 -4.538 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.547 -6.836 -1.827 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.759 -8.236 -2.904 1.00 0.00 H new ATOM 0 HG23 ILE A 86 5.161 -7.232 -2.464 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.583 -3.120 -2.586 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.275 -4.105 -3.282 1.00 0.00 H new ATOM 0 HD13 ILE A 86 3.102 -4.643 -1.801 1.00 0.00 H new ATOM 1260 N ARG A 87 5.474 -9.094 -5.478 1.00 0.00 N ATOM 1261 CA ARG A 87 5.410 -10.545 -5.602 1.00 0.00 C ATOM 1262 C ARG A 87 5.419 -11.209 -4.229 1.00 0.00 C ATOM 1263 O ARG A 87 6.281 -10.927 -3.396 1.00 0.00 O ATOM 1264 CB ARG A 87 6.584 -11.059 -6.437 1.00 0.00 C ATOM 1265 CG ARG A 87 6.475 -12.531 -6.800 1.00 0.00 C ATOM 1266 CD ARG A 87 7.647 -12.981 -7.659 1.00 0.00 C ATOM 1267 NE ARG A 87 8.790 -13.397 -6.851 1.00 0.00 N ATOM 1268 CZ ARG A 87 9.982 -13.689 -7.359 1.00 0.00 C ATOM 1269 NH1 ARG A 87 10.186 -13.610 -8.667 1.00 0.00 N ATOM 1270 NH2 ARG A 87 10.973 -14.061 -6.559 1.00 0.00 N ATOM 0 H ARG A 87 6.408 -8.701 -5.598 1.00 0.00 H new ATOM 0 HA ARG A 87 4.477 -10.801 -6.104 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.652 -10.472 -7.353 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.510 -10.897 -5.885 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.439 -13.130 -5.890 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.542 -12.707 -7.335 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.333 -13.808 -8.296 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.947 -12.167 -8.319 1.00 0.00 H new ATOM 0 HE ARG A 87 8.666 -13.467 -5.841 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.427 -13.324 -9.285 1.00 0.00 H new ATOM 0 HH12 ARG A 87 11.102 -13.835 -9.055 1.00 0.00 H new ATOM 0 HH21 ARG A 87 10.820 -14.123 -5.552 1.00 0.00 H new ATOM 0 HH22 ARG A 87 11.888 -14.285 -6.951 1.00 0.00 H new ATOM 1284 N HIS A 88 4.452 -12.092 -3.998 1.00 0.00 N ATOM 1285 CA HIS A 88 4.349 -12.797 -2.725 1.00 0.00 C ATOM 1286 C HIS A 88 3.408 -13.992 -2.841 1.00 0.00 C ATOM 1287 O HIS A 88 2.353 -13.905 -3.470 1.00 0.00 O ATOM 1288 CB HIS A 88 3.856 -11.849 -1.632 1.00 0.00 C ATOM 1289 CG HIS A 88 4.186 -12.310 -0.245 1.00 0.00 C ATOM 1290 ND1 HIS A 88 3.399 -13.195 0.461 1.00 0.00 N ATOM 1291 CD2 HIS A 88 5.226 -12.004 0.565 1.00 0.00 C ATOM 1292 CE1 HIS A 88 3.940 -13.413 1.646 1.00 0.00 C ATOM 1293 NE2 HIS A 88 5.050 -12.702 1.734 1.00 0.00 N ATOM 0 H HIS A 88 3.729 -12.336 -4.675 1.00 0.00 H new ATOM 0 HA HIS A 88 5.341 -13.162 -2.458 1.00 0.00 H new ATOM 0 HB2 HIS A 88 4.294 -10.864 -1.792 1.00 0.00 H new ATOM 0 HB3 HIS A 88 2.776 -11.736 -1.721 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.042 -11.335 0.335 1.00 0.00 H new ATOM 0 HE1 HIS A 88 3.543 -14.062 2.412 1.00 0.00 H new ATOM 0 HE2 HIS A 88 5.675 -12.676 2.540 1.00 0.00 H new ATOM 1302 N ARG A 89 3.797 -15.107 -2.230 1.00 0.00 N ATOM 1303 CA ARG A 89 2.988 -16.320 -2.267 1.00 0.00 C ATOM 1304 C ARG A 89 2.503 -16.691 -0.869 1.00 0.00 C ATOM 1305 O ARG A 89 3.023 -16.198 0.132 1.00 0.00 O ATOM 1306 CB ARG A 89 3.793 -17.476 -2.863 1.00 0.00 C ATOM 1307 CG ARG A 89 5.137 -17.695 -2.187 1.00 0.00 C ATOM 1308 CD ARG A 89 5.556 -19.156 -2.242 1.00 0.00 C ATOM 1309 NE ARG A 89 6.145 -19.509 -3.530 1.00 0.00 N ATOM 1310 CZ ARG A 89 6.832 -20.626 -3.743 1.00 0.00 C ATOM 1311 NH1 ARG A 89 7.015 -21.494 -2.758 1.00 0.00 N ATOM 1312 NH2 ARG A 89 7.338 -20.876 -4.944 1.00 0.00 N ATOM 0 H ARG A 89 4.666 -15.195 -1.704 1.00 0.00 H new ATOM 0 HA ARG A 89 2.119 -16.129 -2.896 1.00 0.00 H new ATOM 0 HB2 ARG A 89 3.206 -18.392 -2.791 1.00 0.00 H new ATOM 0 HB3 ARG A 89 3.956 -17.285 -3.924 1.00 0.00 H new ATOM 0 HG2 ARG A 89 5.894 -17.079 -2.672 1.00 0.00 H new ATOM 0 HG3 ARG A 89 5.080 -17.370 -1.148 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.275 -19.357 -1.448 1.00 0.00 H new ATOM 0 HD3 ARG A 89 4.689 -19.789 -2.055 1.00 0.00 H new ATOM 0 HE ARG A 89 6.022 -18.863 -4.309 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.628 -21.305 -1.833 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.543 -22.351 -2.925 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.200 -20.210 -5.704 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.865 -21.734 -5.107 1.00 0.00 H new ATOM 1326 N TYR A 90 1.502 -17.563 -0.809 1.00 0.00 N ATOM 1327 CA TYR A 90 0.944 -17.999 0.466 1.00 0.00 C ATOM 1328 C TYR A 90 1.273 -19.464 0.733 1.00 0.00 C ATOM 1329 O TYR A 90 1.668 -20.197 -0.173 1.00 0.00 O ATOM 1330 CB TYR A 90 -0.572 -17.795 0.479 1.00 0.00 C ATOM 1331 CG TYR A 90 -0.988 -16.342 0.441 1.00 0.00 C ATOM 1332 CD1 TYR A 90 -0.499 -15.434 1.373 1.00 0.00 C ATOM 1333 CD2 TYR A 90 -1.870 -15.876 -0.526 1.00 0.00 C ATOM 1334 CE1 TYR A 90 -0.877 -14.106 1.343 1.00 0.00 C ATOM 1335 CE2 TYR A 90 -2.252 -14.549 -0.565 1.00 0.00 C ATOM 1336 CZ TYR A 90 -1.753 -13.668 0.372 1.00 0.00 C ATOM 1337 OH TYR A 90 -2.131 -12.346 0.338 1.00 0.00 O ATOM 0 H TYR A 90 1.061 -17.981 -1.628 1.00 0.00 H new ATOM 0 HA TYR A 90 1.393 -17.395 1.255 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -1.007 -18.311 -0.377 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -0.985 -18.259 1.375 1.00 0.00 H new ATOM 0 HD1 TYR A 90 0.189 -15.773 2.134 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.264 -16.563 -1.260 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.489 -13.414 2.076 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -2.937 -14.203 -1.325 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.751 -12.202 -0.407 1.00 0.00 H new ATOM 1347 N GLU A 91 1.107 -19.884 1.983 1.00 0.00 N ATOM 1348 CA GLU A 91 1.387 -21.261 2.370 1.00 0.00 C ATOM 1349 C GLU A 91 0.102 -22.083 2.424 1.00 0.00 C ATOM 1350 O GLU A 91 0.015 -23.158 1.831 1.00 0.00 O ATOM 1351 CB GLU A 91 2.088 -21.300 3.730 1.00 0.00 C ATOM 1352 CG GLU A 91 3.528 -20.819 3.686 1.00 0.00 C ATOM 1353 CD GLU A 91 4.303 -21.181 4.938 1.00 0.00 C ATOM 1354 OE1 GLU A 91 3.862 -20.793 6.041 1.00 0.00 O ATOM 1355 OE2 GLU A 91 5.348 -21.853 4.816 1.00 0.00 O ATOM 0 H GLU A 91 0.780 -19.290 2.745 1.00 0.00 H new ATOM 0 HA GLU A 91 2.045 -21.696 1.618 1.00 0.00 H new ATOM 0 HB2 GLU A 91 1.529 -20.684 4.435 1.00 0.00 H new ATOM 0 HB3 GLU A 91 2.066 -22.321 4.111 1.00 0.00 H new ATOM 0 HG2 GLU A 91 4.025 -21.252 2.818 1.00 0.00 H new ATOM 0 HG3 GLU A 91 3.542 -19.737 3.555 1.00 0.00 H new ATOM 1362 N SER A 92 -0.893 -21.568 3.139 1.00 0.00 N ATOM 1363 CA SER A 92 -2.172 -22.256 3.275 1.00 0.00 C ATOM 1364 C SER A 92 -3.318 -21.369 2.798 1.00 0.00 C ATOM 1365 O SER A 92 -3.238 -20.141 2.822 1.00 0.00 O ATOM 1366 CB SER A 92 -2.402 -22.668 4.730 1.00 0.00 C ATOM 1367 OG SER A 92 -2.265 -21.558 5.602 1.00 0.00 O ATOM 0 H SER A 92 -0.838 -20.677 3.633 1.00 0.00 H new ATOM 0 HA SER A 92 -2.144 -23.150 2.653 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.398 -23.098 4.837 1.00 0.00 H new ATOM 0 HB3 SER A 92 -1.689 -23.444 5.009 1.00 0.00 H new ATOM 0 HG SER A 92 -2.418 -21.847 6.526 1.00 0.00 H new ATOM 1373 N PRO A 93 -4.412 -22.006 2.355 1.00 0.00 N ATOM 1374 CA PRO A 93 -5.597 -21.295 1.865 1.00 0.00 C ATOM 1375 C PRO A 93 -6.347 -20.578 2.982 1.00 0.00 C ATOM 1376 O PRO A 93 -6.368 -21.038 4.123 1.00 0.00 O ATOM 1377 CB PRO A 93 -6.460 -22.412 1.272 1.00 0.00 C ATOM 1378 CG PRO A 93 -6.041 -23.642 2.000 1.00 0.00 C ATOM 1379 CD PRO A 93 -4.577 -23.468 2.299 1.00 0.00 C ATOM 0 HA PRO A 93 -5.337 -20.513 1.151 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.522 -22.210 1.415 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.296 -22.512 0.199 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -6.615 -23.766 2.918 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.212 -24.532 1.394 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.301 -23.940 3.242 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -3.953 -23.914 1.524 1.00 0.00 H new ATOM 1387 N GLY A 94 -6.964 -19.449 2.645 1.00 0.00 N ATOM 1388 CA GLY A 94 -7.707 -18.688 3.632 1.00 0.00 C ATOM 1389 C GLY A 94 -7.713 -17.202 3.333 1.00 0.00 C ATOM 1390 O GLY A 94 -6.676 -16.623 3.007 1.00 0.00 O ATOM 0 H GLY A 94 -6.962 -19.049 1.707 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -8.734 -19.052 3.670 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -7.273 -18.856 4.618 1.00 0.00 H new ATOM 1394 N ILE A 95 -8.884 -16.582 3.443 1.00 0.00 N ATOM 1395 CA ILE A 95 -9.020 -15.155 3.181 1.00 0.00 C ATOM 1396 C ILE A 95 -7.866 -14.371 3.797 1.00 0.00 C ATOM 1397 O ILE A 95 -7.414 -14.675 4.901 1.00 0.00 O ATOM 1398 CB ILE A 95 -10.350 -14.606 3.730 1.00 0.00 C ATOM 1399 CG1 ILE A 95 -11.514 -15.043 2.839 1.00 0.00 C ATOM 1400 CG2 ILE A 95 -10.294 -13.089 3.834 1.00 0.00 C ATOM 1401 CD1 ILE A 95 -11.909 -16.491 3.027 1.00 0.00 C ATOM 0 H ILE A 95 -9.752 -17.046 3.712 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.004 -15.030 2.098 1.00 0.00 H new ATOM 0 HB ILE A 95 -10.510 -15.013 4.728 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.377 -14.410 3.046 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.243 -14.881 1.796 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.241 -12.716 4.223 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.486 -12.800 4.506 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.115 -12.663 2.847 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -12.740 -16.731 2.364 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.060 -17.133 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.212 -16.654 4.061 1.00 0.00 H new ATOM 1413 N TYR A 96 -7.394 -13.360 3.076 1.00 0.00 N ATOM 1414 CA TYR A 96 -6.292 -12.531 3.551 1.00 0.00 C ATOM 1415 C TYR A 96 -6.685 -11.057 3.564 1.00 0.00 C ATOM 1416 O TYR A 96 -7.426 -10.593 2.698 1.00 0.00 O ATOM 1417 CB TYR A 96 -5.058 -12.734 2.670 1.00 0.00 C ATOM 1418 CG TYR A 96 -4.408 -14.088 2.841 1.00 0.00 C ATOM 1419 CD1 TYR A 96 -3.911 -14.491 4.075 1.00 0.00 C ATOM 1420 CD2 TYR A 96 -4.289 -14.964 1.769 1.00 0.00 C ATOM 1421 CE1 TYR A 96 -3.315 -15.727 4.236 1.00 0.00 C ATOM 1422 CE2 TYR A 96 -3.696 -16.203 1.922 1.00 0.00 C ATOM 1423 CZ TYR A 96 -3.211 -16.579 3.156 1.00 0.00 C ATOM 1424 OH TYR A 96 -2.618 -17.812 3.312 1.00 0.00 O ATOM 0 H TYR A 96 -7.757 -13.095 2.161 1.00 0.00 H new ATOM 0 HA TYR A 96 -6.056 -12.834 4.571 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -5.343 -12.606 1.626 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -4.327 -11.958 2.898 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -3.992 -13.827 4.923 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -4.666 -14.672 0.800 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -2.933 -16.024 5.201 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -3.613 -16.873 1.079 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.135 -18.487 2.825 1.00 0.00 H new ATOM 1434 N ARG A 97 -6.181 -10.326 4.553 1.00 0.00 N ATOM 1435 CA ARG A 97 -6.479 -8.905 4.681 1.00 0.00 C ATOM 1436 C ARG A 97 -5.270 -8.059 4.293 1.00 0.00 C ATOM 1437 O ARG A 97 -4.313 -7.937 5.058 1.00 0.00 O ATOM 1438 CB ARG A 97 -6.905 -8.578 6.114 1.00 0.00 C ATOM 1439 CG ARG A 97 -8.385 -8.803 6.375 1.00 0.00 C ATOM 1440 CD ARG A 97 -8.886 -7.939 7.522 1.00 0.00 C ATOM 1441 NE ARG A 97 -10.000 -8.562 8.231 1.00 0.00 N ATOM 1442 CZ ARG A 97 -9.872 -9.636 9.003 1.00 0.00 C ATOM 1443 NH1 ARG A 97 -8.684 -10.202 9.165 1.00 0.00 N ATOM 1444 NH2 ARG A 97 -10.933 -10.145 9.616 1.00 0.00 N ATOM 0 H ARG A 97 -5.564 -10.695 5.277 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.299 -8.669 4.003 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.326 -9.190 6.805 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.661 -7.538 6.328 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.953 -8.577 5.473 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.559 -9.854 6.607 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.070 -7.755 8.220 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -9.199 -6.969 7.135 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.927 -8.150 8.128 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -7.866 -9.813 8.697 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -8.588 -11.026 9.758 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -11.849 -9.712 9.495 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -10.833 -10.969 10.208 1.00 0.00 H new ATOM 1458 N VAL A 98 -5.320 -7.477 3.099 1.00 0.00 N ATOM 1459 CA VAL A 98 -4.230 -6.643 2.609 1.00 0.00 C ATOM 1460 C VAL A 98 -4.551 -5.162 2.781 1.00 0.00 C ATOM 1461 O VAL A 98 -5.701 -4.746 2.642 1.00 0.00 O ATOM 1462 CB VAL A 98 -3.932 -6.923 1.124 1.00 0.00 C ATOM 1463 CG1 VAL A 98 -2.847 -5.989 0.611 1.00 0.00 C ATOM 1464 CG2 VAL A 98 -3.532 -8.377 0.926 1.00 0.00 C ATOM 0 H VAL A 98 -6.104 -7.568 2.453 1.00 0.00 H new ATOM 0 HA VAL A 98 -3.350 -6.893 3.202 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.839 -6.738 0.549 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.650 -6.202 -0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -3.177 -4.955 0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.935 -6.139 1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -3.325 -8.557 -0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.639 -8.592 1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -4.345 -9.026 1.252 1.00 0.00 H new ATOM 1474 N SER A 99 -3.526 -4.372 3.084 1.00 0.00 N ATOM 1475 CA SER A 99 -3.700 -2.937 3.278 1.00 0.00 C ATOM 1476 C SER A 99 -2.505 -2.165 2.726 1.00 0.00 C ATOM 1477 O SER A 99 -1.539 -2.757 2.243 1.00 0.00 O ATOM 1478 CB SER A 99 -3.884 -2.621 4.764 1.00 0.00 C ATOM 1479 OG SER A 99 -2.639 -2.348 5.385 1.00 0.00 O ATOM 0 H SER A 99 -2.567 -4.701 3.200 1.00 0.00 H new ATOM 0 HA SER A 99 -4.593 -2.627 2.734 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.546 -1.763 4.877 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.365 -3.463 5.261 1.00 0.00 H new ATOM 0 HG SER A 99 -2.783 -2.148 6.333 1.00 0.00 H new ATOM 1485 N VAL A 100 -2.577 -0.840 2.802 1.00 0.00 N ATOM 1486 CA VAL A 100 -1.502 0.014 2.312 1.00 0.00 C ATOM 1487 C VAL A 100 -1.520 1.372 3.004 1.00 0.00 C ATOM 1488 O VAL A 100 -2.363 2.219 2.711 1.00 0.00 O ATOM 1489 CB VAL A 100 -1.603 0.225 0.789 1.00 0.00 C ATOM 1490 CG1 VAL A 100 -2.935 0.862 0.425 1.00 0.00 C ATOM 1491 CG2 VAL A 100 -0.443 1.074 0.292 1.00 0.00 C ATOM 0 H VAL A 100 -3.369 -0.335 3.199 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.565 -0.494 2.540 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.548 -0.748 0.300 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.988 1.003 -0.655 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.749 0.212 0.746 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.024 1.828 0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.530 1.213 -0.786 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.465 2.045 0.786 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.498 0.573 0.519 1.00 0.00 H new ATOM 1501 N ARG A 101 -0.582 1.572 3.925 1.00 0.00 N ATOM 1502 CA ARG A 101 -0.490 2.828 4.660 1.00 0.00 C ATOM 1503 C ARG A 101 0.310 3.862 3.873 1.00 0.00 C ATOM 1504 O ARG A 101 1.090 3.514 2.987 1.00 0.00 O ATOM 1505 CB ARG A 101 0.159 2.597 6.026 1.00 0.00 C ATOM 1506 CG ARG A 101 0.041 3.786 6.966 1.00 0.00 C ATOM 1507 CD ARG A 101 0.854 3.576 8.234 1.00 0.00 C ATOM 1508 NE ARG A 101 0.074 2.921 9.281 1.00 0.00 N ATOM 1509 CZ ARG A 101 -0.998 3.464 9.847 1.00 0.00 C ATOM 1510 NH1 ARG A 101 -1.416 4.664 9.469 1.00 0.00 N ATOM 1511 NH2 ARG A 101 -1.655 2.805 10.794 1.00 0.00 N ATOM 0 H ARG A 101 0.124 0.881 4.179 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.501 3.210 4.805 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -0.301 1.727 6.495 1.00 0.00 H new ATOM 0 HB3 ARG A 101 1.214 2.361 5.883 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.383 4.688 6.458 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.006 3.944 7.226 1.00 0.00 H new ATOM 0 HD2 ARG A 101 1.733 2.973 8.006 1.00 0.00 H new ATOM 0 HD3 ARG A 101 1.213 4.539 8.598 1.00 0.00 H new ATOM 0 HE ARG A 101 0.369 1.996 9.595 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.914 5.173 8.742 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -2.240 5.078 9.906 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -1.337 1.881 11.087 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -2.478 3.222 11.228 1.00 0.00 H new ATOM 1525 N ALA A 102 0.110 5.133 4.204 1.00 0.00 N ATOM 1526 CA ALA A 102 0.814 6.217 3.529 1.00 0.00 C ATOM 1527 C ALA A 102 0.782 7.494 4.362 1.00 0.00 C ATOM 1528 O ALA A 102 -0.285 8.043 4.632 1.00 0.00 O ATOM 1529 CB ALA A 102 0.207 6.466 2.156 1.00 0.00 C ATOM 0 H ALA A 102 -0.533 5.438 4.935 1.00 0.00 H new ATOM 0 HA ALA A 102 1.855 5.920 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.742 7.278 1.663 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.286 5.561 1.554 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.843 6.738 2.266 1.00 0.00 H new ATOM 1535 N GLU A 103 1.960 7.960 4.767 1.00 0.00 N ATOM 1536 CA GLU A 103 2.065 9.172 5.571 1.00 0.00 C ATOM 1537 C GLU A 103 3.164 10.086 5.036 1.00 0.00 C ATOM 1538 O GLU A 103 4.351 9.791 5.169 1.00 0.00 O ATOM 1539 CB GLU A 103 2.348 8.818 7.033 1.00 0.00 C ATOM 1540 CG GLU A 103 2.652 10.025 7.903 1.00 0.00 C ATOM 1541 CD GLU A 103 2.814 9.663 9.367 1.00 0.00 C ATOM 1542 OE1 GLU A 103 1.797 9.661 10.092 1.00 0.00 O ATOM 1543 OE2 GLU A 103 3.955 9.383 9.787 1.00 0.00 O ATOM 0 H GLU A 103 2.853 7.517 4.552 1.00 0.00 H new ATOM 0 HA GLU A 103 1.114 9.701 5.510 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.486 8.292 7.444 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.192 8.129 7.075 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.565 10.504 7.548 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.849 10.754 7.800 1.00 0.00 H new ATOM 1550 N ASN A 104 2.758 11.197 4.430 1.00 0.00 N ATOM 1551 CA ASN A 104 3.707 12.154 3.874 1.00 0.00 C ATOM 1552 C ASN A 104 3.634 13.486 4.614 1.00 0.00 C ATOM 1553 O ASN A 104 2.731 13.713 5.420 1.00 0.00 O ATOM 1554 CB ASN A 104 3.432 12.370 2.384 1.00 0.00 C ATOM 1555 CG ASN A 104 2.040 12.914 2.126 1.00 0.00 C ATOM 1556 OD1 ASN A 104 1.046 12.347 2.580 1.00 0.00 O ATOM 1557 ND2 ASN A 104 1.963 14.020 1.395 1.00 0.00 N ATOM 0 H ASN A 104 1.779 11.456 4.312 1.00 0.00 H new ATOM 0 HA ASN A 104 4.710 11.745 3.996 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.170 13.061 1.977 1.00 0.00 H new ATOM 0 HB3 ASN A 104 3.554 11.425 1.854 1.00 0.00 H new ATOM 0 HD21 ASN A 104 1.053 14.433 1.189 1.00 0.00 H new ATOM 0 HD22 ASN A 104 2.813 14.456 1.039 1.00 0.00 H new ATOM 1564 N THR A 105 4.591 14.366 4.335 1.00 0.00 N ATOM 1565 CA THR A 105 4.636 15.675 4.974 1.00 0.00 C ATOM 1566 C THR A 105 3.291 16.385 4.869 1.00 0.00 C ATOM 1567 O THR A 105 2.809 16.968 5.839 1.00 0.00 O ATOM 1568 CB THR A 105 5.725 16.568 4.349 1.00 0.00 C ATOM 1569 OG1 THR A 105 6.978 15.876 4.337 1.00 0.00 O ATOM 1570 CG2 THR A 105 5.866 17.871 5.122 1.00 0.00 C ATOM 0 H THR A 105 5.346 14.195 3.670 1.00 0.00 H new ATOM 0 HA THR A 105 4.873 15.506 6.024 1.00 0.00 H new ATOM 0 HB THR A 105 5.430 16.802 3.326 1.00 0.00 H new ATOM 0 HG1 THR A 105 7.665 16.449 3.937 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.641 18.485 4.662 1.00 0.00 H new ATOM 0 HG22 THR A 105 4.918 18.409 5.104 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.140 17.654 6.154 1.00 0.00 H new ATOM 1578 N ALA A 106 2.689 16.331 3.685 1.00 0.00 N ATOM 1579 CA ALA A 106 1.398 16.966 3.455 1.00 0.00 C ATOM 1580 C ALA A 106 0.303 16.301 4.283 1.00 0.00 C ATOM 1581 O ALA A 106 -0.224 16.894 5.223 1.00 0.00 O ATOM 1582 CB ALA A 106 1.044 16.921 1.976 1.00 0.00 C ATOM 0 H ALA A 106 3.075 15.854 2.871 1.00 0.00 H new ATOM 0 HA ALA A 106 1.472 18.007 3.769 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.077 17.399 1.819 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.807 17.448 1.403 1.00 0.00 H new ATOM 0 HB3 ALA A 106 0.994 15.884 1.645 1.00 0.00 H new ATOM 1588 N GLY A 107 -0.035 15.066 3.926 1.00 0.00 N ATOM 1589 CA GLY A 107 -1.065 14.341 4.646 1.00 0.00 C ATOM 1590 C GLY A 107 -0.786 12.853 4.717 1.00 0.00 C ATOM 1591 O GLY A 107 0.361 12.436 4.882 1.00 0.00 O ATOM 0 H GLY A 107 0.386 14.555 3.151 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -1.147 14.741 5.657 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -2.027 14.504 4.160 1.00 0.00 H new ATOM 1595 N HIS A 108 -1.838 12.049 4.594 1.00 0.00 N ATOM 1596 CA HIS A 108 -1.700 10.598 4.646 1.00 0.00 C ATOM 1597 C HIS A 108 -2.888 9.915 3.975 1.00 0.00 C ATOM 1598 O HIS A 108 -3.966 10.498 3.856 1.00 0.00 O ATOM 1599 CB HIS A 108 -1.580 10.128 6.096 1.00 0.00 C ATOM 1600 CG HIS A 108 -2.634 10.691 6.998 1.00 0.00 C ATOM 1601 ND1 HIS A 108 -3.972 10.723 6.664 1.00 0.00 N ATOM 1602 CD2 HIS A 108 -2.542 11.246 8.230 1.00 0.00 C ATOM 1603 CE1 HIS A 108 -4.656 11.274 7.651 1.00 0.00 C ATOM 1604 NE2 HIS A 108 -3.812 11.600 8.613 1.00 0.00 N ATOM 0 H HIS A 108 -2.794 12.378 4.458 1.00 0.00 H new ATOM 0 HA HIS A 108 -0.793 10.324 4.106 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -1.635 9.040 6.122 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -0.599 10.407 6.480 1.00 0.00 H new ATOM 0 HD1 HIS A 108 -4.371 10.376 5.792 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -1.638 11.384 8.804 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -5.724 11.431 7.668 1.00 0.00 H new ATOM 1613 N ASP A 109 -2.683 8.678 3.538 1.00 0.00 N ATOM 1614 CA ASP A 109 -3.737 7.915 2.878 1.00 0.00 C ATOM 1615 C ASP A 109 -3.541 6.418 3.094 1.00 0.00 C ATOM 1616 O ASP A 109 -2.434 5.901 2.951 1.00 0.00 O ATOM 1617 CB ASP A 109 -3.762 8.228 1.381 1.00 0.00 C ATOM 1618 CG ASP A 109 -5.100 7.907 0.745 1.00 0.00 C ATOM 1619 OD1 ASP A 109 -5.987 8.786 0.751 1.00 0.00 O ATOM 1620 OD2 ASP A 109 -5.260 6.776 0.240 1.00 0.00 O ATOM 0 H ASP A 109 -1.797 8.181 3.629 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.691 8.205 3.318 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.535 9.283 1.230 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.979 7.658 0.880 1.00 0.00 H new ATOM 1625 N GLU A 110 -4.624 5.729 3.441 1.00 0.00 N ATOM 1626 CA GLU A 110 -4.569 4.291 3.679 1.00 0.00 C ATOM 1627 C GLU A 110 -5.711 3.577 2.961 1.00 0.00 C ATOM 1628 O GLU A 110 -6.835 4.077 2.910 1.00 0.00 O ATOM 1629 CB GLU A 110 -4.632 3.997 5.179 1.00 0.00 C ATOM 1630 CG GLU A 110 -4.780 2.520 5.504 1.00 0.00 C ATOM 1631 CD GLU A 110 -5.030 2.270 6.979 1.00 0.00 C ATOM 1632 OE1 GLU A 110 -4.460 3.004 7.811 1.00 0.00 O ATOM 1633 OE2 GLU A 110 -5.798 1.338 7.299 1.00 0.00 O ATOM 0 H GLU A 110 -5.548 6.142 3.563 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.624 3.919 3.283 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.727 4.376 5.653 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.471 4.542 5.613 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.604 2.105 4.924 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.877 1.992 5.198 1.00 0.00 H new ATOM 1640 N ALA A 111 -5.415 2.406 2.409 1.00 0.00 N ATOM 1641 CA ALA A 111 -6.416 1.622 1.695 1.00 0.00 C ATOM 1642 C ALA A 111 -6.506 0.206 2.255 1.00 0.00 C ATOM 1643 O ALA A 111 -5.648 -0.223 3.026 1.00 0.00 O ATOM 1644 CB ALA A 111 -6.096 1.584 0.209 1.00 0.00 C ATOM 0 H ALA A 111 -4.490 1.978 2.442 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.384 2.102 1.834 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.852 0.995 -0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.090 2.599 -0.188 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -5.116 1.130 0.059 1.00 0.00 H new ATOM 1650 N VAL A 112 -7.551 -0.515 1.863 1.00 0.00 N ATOM 1651 CA VAL A 112 -7.753 -1.883 2.325 1.00 0.00 C ATOM 1652 C VAL A 112 -8.333 -2.757 1.219 1.00 0.00 C ATOM 1653 O VAL A 112 -9.373 -2.437 0.641 1.00 0.00 O ATOM 1654 CB VAL A 112 -8.691 -1.930 3.546 1.00 0.00 C ATOM 1655 CG1 VAL A 112 -8.923 -3.367 3.986 1.00 0.00 C ATOM 1656 CG2 VAL A 112 -8.121 -1.100 4.687 1.00 0.00 C ATOM 0 H VAL A 112 -8.271 -0.174 1.226 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.774 -2.268 2.612 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.652 -1.503 3.261 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -9.588 -3.380 4.850 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.377 -3.929 3.170 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -7.970 -3.824 4.255 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -8.796 -1.144 5.542 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.147 -1.496 4.973 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.011 -0.065 4.364 1.00 0.00 H new ATOM 1666 N LEU A 113 -7.656 -3.862 0.929 1.00 0.00 N ATOM 1667 CA LEU A 113 -8.104 -4.784 -0.108 1.00 0.00 C ATOM 1668 C LEU A 113 -8.212 -6.205 0.436 1.00 0.00 C ATOM 1669 O LEU A 113 -7.298 -6.699 1.096 1.00 0.00 O ATOM 1670 CB LEU A 113 -7.141 -4.753 -1.297 1.00 0.00 C ATOM 1671 CG LEU A 113 -7.670 -5.340 -2.605 1.00 0.00 C ATOM 1672 CD1 LEU A 113 -6.928 -4.750 -3.794 1.00 0.00 C ATOM 1673 CD2 LEU A 113 -7.548 -6.857 -2.597 1.00 0.00 C ATOM 0 H LEU A 113 -6.794 -4.141 1.398 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.092 -4.466 -0.440 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.852 -3.718 -1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.236 -5.293 -1.020 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.725 -5.081 -2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -7.318 -5.180 -4.716 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -7.067 -3.669 -3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.865 -4.977 -3.709 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -7.929 -7.258 -3.536 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.501 -7.137 -2.482 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.126 -7.264 -1.767 1.00 0.00 H new ATOM 1685 N PHE A 114 -9.335 -6.858 0.153 1.00 0.00 N ATOM 1686 CA PHE A 114 -9.562 -8.223 0.613 1.00 0.00 C ATOM 1687 C PHE A 114 -9.246 -9.228 -0.490 1.00 0.00 C ATOM 1688 O PHE A 114 -9.665 -9.063 -1.636 1.00 0.00 O ATOM 1689 CB PHE A 114 -11.011 -8.393 1.074 1.00 0.00 C ATOM 1690 CG PHE A 114 -11.258 -7.899 2.470 1.00 0.00 C ATOM 1691 CD1 PHE A 114 -11.533 -6.562 2.708 1.00 0.00 C ATOM 1692 CD2 PHE A 114 -11.214 -8.771 3.546 1.00 0.00 C ATOM 1693 CE1 PHE A 114 -11.761 -6.104 3.992 1.00 0.00 C ATOM 1694 CE2 PHE A 114 -11.442 -8.319 4.832 1.00 0.00 C ATOM 1695 CZ PHE A 114 -11.714 -6.984 5.056 1.00 0.00 C ATOM 0 H PHE A 114 -10.101 -6.464 -0.392 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.895 -8.413 1.454 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -11.667 -7.859 0.387 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -11.280 -9.448 1.017 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -11.570 -5.869 1.880 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -10.999 -9.816 3.378 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.976 -5.059 4.163 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -11.407 -9.010 5.661 1.00 0.00 H new ATOM 0 HZ PHE A 114 -11.890 -6.629 6.061 1.00 0.00 H new ATOM 1705 N VAL A 115 -8.502 -10.272 -0.136 1.00 0.00 N ATOM 1706 CA VAL A 115 -8.129 -11.305 -1.095 1.00 0.00 C ATOM 1707 C VAL A 115 -8.598 -12.680 -0.631 1.00 0.00 C ATOM 1708 O VAL A 115 -8.175 -13.169 0.415 1.00 0.00 O ATOM 1709 CB VAL A 115 -6.605 -11.342 -1.316 1.00 0.00 C ATOM 1710 CG1 VAL A 115 -6.194 -12.644 -1.986 1.00 0.00 C ATOM 1711 CG2 VAL A 115 -6.158 -10.144 -2.140 1.00 0.00 C ATOM 0 H VAL A 115 -8.146 -10.424 0.808 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.619 -11.055 -2.036 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.113 -11.290 -0.345 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -5.114 -12.652 -2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.480 -13.485 -1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.693 -12.730 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -5.079 -10.186 -2.287 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -6.657 -10.162 -3.109 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -6.418 -9.224 -1.616 1.00 0.00 H new ATOM 1721 N GLN A 116 -9.474 -13.296 -1.418 1.00 0.00 N ATOM 1722 CA GLN A 116 -10.000 -14.615 -1.088 1.00 0.00 C ATOM 1723 C GLN A 116 -9.272 -15.704 -1.870 1.00 0.00 C ATOM 1724 O GLN A 116 -9.406 -15.800 -3.090 1.00 0.00 O ATOM 1725 CB GLN A 116 -11.500 -14.677 -1.380 1.00 0.00 C ATOM 1726 CG GLN A 116 -12.048 -16.093 -1.454 1.00 0.00 C ATOM 1727 CD GLN A 116 -13.551 -16.149 -1.261 1.00 0.00 C ATOM 1728 OE1 GLN A 116 -14.272 -15.228 -1.647 1.00 0.00 O ATOM 1729 NE2 GLN A 116 -14.031 -17.231 -0.661 1.00 0.00 N ATOM 0 H GLN A 116 -9.834 -12.903 -2.288 1.00 0.00 H new ATOM 0 HA GLN A 116 -9.837 -14.787 -0.024 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -12.035 -14.129 -0.605 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -11.699 -14.170 -2.324 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -11.793 -16.527 -2.421 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -11.565 -16.706 -0.693 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.396 -17.970 -0.358 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -15.034 -17.324 -0.503 1.00 0.00 H new ATOM 1738 N VAL A 117 -8.502 -16.521 -1.159 1.00 0.00 N ATOM 1739 CA VAL A 117 -7.753 -17.604 -1.787 1.00 0.00 C ATOM 1740 C VAL A 117 -8.428 -18.950 -1.547 1.00 0.00 C ATOM 1741 O VAL A 117 -8.476 -19.439 -0.419 1.00 0.00 O ATOM 1742 CB VAL A 117 -6.307 -17.665 -1.259 1.00 0.00 C ATOM 1743 CG1 VAL A 117 -6.266 -17.340 0.226 1.00 0.00 C ATOM 1744 CG2 VAL A 117 -5.700 -19.034 -1.530 1.00 0.00 C ATOM 0 H VAL A 117 -8.380 -16.454 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 117 -7.733 -17.397 -2.857 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.714 -16.918 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.236 -17.388 0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.660 -16.337 0.390 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.872 -18.062 0.773 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.678 -19.061 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.293 -19.800 -1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.694 -19.223 -2.603 1.00 0.00 H new ATOM 1754 N SER A 118 -8.948 -19.544 -2.617 1.00 0.00 N ATOM 1755 CA SER A 118 -9.623 -20.832 -2.523 1.00 0.00 C ATOM 1756 C SER A 118 -8.616 -21.978 -2.563 1.00 0.00 C ATOM 1757 O SER A 118 -7.727 -22.008 -3.412 1.00 0.00 O ATOM 1758 CB SER A 118 -10.633 -20.987 -3.661 1.00 0.00 C ATOM 1759 OG SER A 118 -11.111 -22.319 -3.742 1.00 0.00 O ATOM 0 H SER A 118 -8.914 -19.153 -3.559 1.00 0.00 H new ATOM 0 HA SER A 118 -10.151 -20.868 -1.570 1.00 0.00 H new ATOM 0 HB2 SER A 118 -11.470 -20.306 -3.504 1.00 0.00 H new ATOM 0 HB3 SER A 118 -10.167 -20.707 -4.606 1.00 0.00 H new ATOM 0 HG SER A 118 -11.756 -22.391 -4.476 1.00 0.00 H new ATOM 1765 N GLY A 119 -8.763 -22.920 -1.635 1.00 0.00 N ATOM 1766 CA GLY A 119 -7.860 -24.054 -1.581 1.00 0.00 C ATOM 1767 C GLY A 119 -8.325 -25.207 -2.448 1.00 0.00 C ATOM 1768 O GLY A 119 -9.240 -25.071 -3.261 1.00 0.00 O ATOM 0 H GLY A 119 -9.491 -22.917 -0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.867 -23.739 -1.902 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -7.769 -24.393 -0.549 1.00 0.00 H new ATOM 1772 N PRO A 120 -7.685 -26.374 -2.281 1.00 0.00 N ATOM 1773 CA PRO A 120 -8.021 -27.578 -3.047 1.00 0.00 C ATOM 1774 C PRO A 120 -9.378 -28.154 -2.658 1.00 0.00 C ATOM 1775 O PRO A 120 -9.465 -29.048 -1.816 1.00 0.00 O ATOM 1776 CB PRO A 120 -6.901 -28.555 -2.682 1.00 0.00 C ATOM 1777 CG PRO A 120 -6.426 -28.104 -1.344 1.00 0.00 C ATOM 1778 CD PRO A 120 -6.585 -26.609 -1.330 1.00 0.00 C ATOM 0 HA PRO A 120 -8.096 -27.373 -4.115 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -7.267 -29.581 -2.647 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -6.097 -28.528 -3.417 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -7.009 -28.566 -0.547 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -5.386 -28.387 -1.183 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -6.829 -26.240 -0.334 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.670 -26.105 -1.641 1.00 0.00 H new ATOM 1786 N SER A 121 -10.435 -27.636 -3.275 1.00 0.00 N ATOM 1787 CA SER A 121 -11.789 -28.096 -2.990 1.00 0.00 C ATOM 1788 C SER A 121 -12.467 -28.609 -4.257 1.00 0.00 C ATOM 1789 O SER A 121 -12.564 -27.894 -5.254 1.00 0.00 O ATOM 1790 CB SER A 121 -12.617 -26.965 -2.376 1.00 0.00 C ATOM 1791 OG SER A 121 -11.963 -26.409 -1.249 1.00 0.00 O ATOM 0 H SER A 121 -10.380 -26.897 -3.976 1.00 0.00 H new ATOM 0 HA SER A 121 -11.724 -28.917 -2.276 1.00 0.00 H new ATOM 0 HB2 SER A 121 -12.787 -26.188 -3.122 1.00 0.00 H new ATOM 0 HB3 SER A 121 -13.596 -27.345 -2.082 1.00 0.00 H new ATOM 0 HG SER A 121 -12.511 -25.687 -0.876 1.00 0.00 H new ATOM 1797 N SER A 122 -12.933 -29.852 -4.209 1.00 0.00 N ATOM 1798 CA SER A 122 -13.599 -30.463 -5.354 1.00 0.00 C ATOM 1799 C SER A 122 -15.100 -30.192 -5.318 1.00 0.00 C ATOM 1800 O SER A 122 -15.691 -29.778 -6.314 1.00 0.00 O ATOM 1801 CB SER A 122 -13.342 -31.972 -5.374 1.00 0.00 C ATOM 1802 OG SER A 122 -13.568 -32.545 -4.098 1.00 0.00 O ATOM 0 H SER A 122 -12.862 -30.456 -3.390 1.00 0.00 H new ATOM 0 HA SER A 122 -13.189 -30.019 -6.261 1.00 0.00 H new ATOM 0 HB2 SER A 122 -13.993 -32.445 -6.109 1.00 0.00 H new ATOM 0 HB3 SER A 122 -12.316 -32.165 -5.686 1.00 0.00 H new ATOM 0 HG SER A 122 -13.399 -33.509 -4.138 1.00 0.00 H new ATOM 1808 N GLY A 123 -15.710 -30.428 -4.161 1.00 0.00 N ATOM 1809 CA GLY A 123 -17.137 -30.204 -4.015 1.00 0.00 C ATOM 1810 C GLY A 123 -17.886 -31.466 -3.634 1.00 0.00 C ATOM 1811 O GLY A 123 -19.061 -31.412 -3.272 1.00 0.00 O ATOM 0 H GLY A 123 -15.242 -30.770 -3.322 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -17.306 -29.441 -3.255 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -17.538 -29.816 -4.951 1.00 0.00 H new TER 1815 GLY A 123