USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=27 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 63 LYS NZ :NH3+ -142:sc= -1.3 (180deg=-2.17) USER MOD Set 1.2: A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 64 TYR OH : rot 180:sc= -0.224 USER MOD Set 2.2: A 80 THR OG1 : rot -166:sc= 1.25 USER MOD Set 3.1: A 62 THR OG1 : rot 180:sc= -0.761 USER MOD Set 3.2: A 104 ASN : amide:sc= -4.07! C(o=-4.8!,f=-6!) USER MOD Set 4.1: A 61 THR OG1 : rot 62:sc= 1.26 USER MOD Set 4.2: A 78 ASN : amide:sc= -0.289 K(o=0.97,f=-1.5) USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0699 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 42:sc= 1.13 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= -0.0386 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.086 X(o=-0.086,f=-0.14) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -2.57 K(o=-2.6,f=-5!) USER MOD Single : A 23 CYS SG : rot 180:sc= -1.48 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.00958 USER MOD Single : A 32 GLN : amide:sc= -1.96 X(o=-2,f=-2.4) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -1.58! K(o=-1.6!,f=-0.76) USER MOD Single : A 54 GLN : amide:sc= -2.23! C(o=-2.2!,f=-5.1!) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 147:sc= -0.037 (180deg=-1.27) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -4.51! X(o=-4.5!,f=-4.9) 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 -176:sc= 1.1 USER MOD Single : A 99 SER OG : rot 47:sc= 0.0437 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HE2:sc= 0.387 K(o=0.39,f=-2!) USER MOD Single : A 116 GLN : amide:sc= -1.62 K(o=-1.6,f=-9.3!) 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 66:sc= 0.46 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -45.139 12.824 7.347 1.00 0.00 N ATOM 2 CA GLY A 1 -44.243 13.160 6.255 1.00 0.00 C ATOM 3 C GLY A 1 -43.163 14.138 6.671 1.00 0.00 C ATOM 4 O GLY A 1 -43.261 14.772 7.722 1.00 0.00 O ATOM 0 H1 GLY A 1 -44.889 11.889 7.726 1.00 0.00 H new ATOM 0 H2 GLY A 1 -45.052 13.537 8.099 1.00 0.00 H new ATOM 0 H3 GLY A 1 -46.119 12.805 6.999 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -43.778 12.249 5.877 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -44.819 13.587 5.435 1.00 0.00 H new ATOM 8 N SER A 2 -42.128 14.260 5.846 1.00 0.00 N ATOM 9 CA SER A 2 -41.021 15.165 6.137 1.00 0.00 C ATOM 10 C SER A 2 -40.077 15.270 4.943 1.00 0.00 C ATOM 11 O SER A 2 -39.550 14.266 4.464 1.00 0.00 O ATOM 12 CB SER A 2 -40.252 14.684 7.369 1.00 0.00 C ATOM 13 OG SER A 2 -39.066 15.436 7.555 1.00 0.00 O ATOM 0 H SER A 2 -42.032 13.744 4.971 1.00 0.00 H new ATOM 0 HA SER A 2 -41.435 16.153 6.339 1.00 0.00 H new ATOM 0 HB2 SER A 2 -40.884 14.771 8.253 1.00 0.00 H new ATOM 0 HB3 SER A 2 -40.003 13.629 7.257 1.00 0.00 H new ATOM 0 HG SER A 2 -38.593 15.110 8.349 1.00 0.00 H new ATOM 19 N SER A 3 -39.869 16.493 4.467 1.00 0.00 N ATOM 20 CA SER A 3 -38.993 16.731 3.326 1.00 0.00 C ATOM 21 C SER A 3 -38.701 18.220 3.166 1.00 0.00 C ATOM 22 O SER A 3 -39.606 19.051 3.224 1.00 0.00 O ATOM 23 CB SER A 3 -39.626 16.183 2.046 1.00 0.00 C ATOM 24 OG SER A 3 -39.252 14.833 1.829 1.00 0.00 O ATOM 0 H SER A 3 -40.295 17.335 4.854 1.00 0.00 H new ATOM 0 HA SER A 3 -38.052 16.212 3.508 1.00 0.00 H new ATOM 0 HB2 SER A 3 -40.711 16.257 2.113 1.00 0.00 H new ATOM 0 HB3 SER A 3 -39.317 16.790 1.195 1.00 0.00 H new ATOM 0 HG SER A 3 -39.286 14.344 2.677 1.00 0.00 H new ATOM 30 N GLY A 4 -37.428 18.549 2.965 1.00 0.00 N ATOM 31 CA GLY A 4 -37.038 19.937 2.799 1.00 0.00 C ATOM 32 C GLY A 4 -36.294 20.179 1.502 1.00 0.00 C ATOM 33 O GLY A 4 -36.507 19.475 0.515 1.00 0.00 O ATOM 0 H GLY A 4 -36.660 17.879 2.914 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -37.927 20.567 2.827 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -36.408 20.237 3.637 1.00 0.00 H new ATOM 37 N SER A 5 -35.418 21.179 1.501 1.00 0.00 N ATOM 38 CA SER A 5 -34.643 21.516 0.313 1.00 0.00 C ATOM 39 C SER A 5 -33.437 22.377 0.678 1.00 0.00 C ATOM 40 O SER A 5 -33.521 23.247 1.544 1.00 0.00 O ATOM 41 CB SER A 5 -35.520 22.251 -0.702 1.00 0.00 C ATOM 42 OG SER A 5 -35.999 23.475 -0.172 1.00 0.00 O ATOM 0 H SER A 5 -35.227 21.770 2.310 1.00 0.00 H new ATOM 0 HA SER A 5 -34.284 20.588 -0.132 1.00 0.00 H new ATOM 0 HB2 SER A 5 -34.948 22.443 -1.609 1.00 0.00 H new ATOM 0 HB3 SER A 5 -36.362 21.619 -0.984 1.00 0.00 H new ATOM 0 HG SER A 5 -36.555 23.926 -0.841 1.00 0.00 H new ATOM 48 N SER A 6 -32.316 22.128 0.009 1.00 0.00 N ATOM 49 CA SER A 6 -31.091 22.877 0.263 1.00 0.00 C ATOM 50 C SER A 6 -30.156 22.814 -0.940 1.00 0.00 C ATOM 51 O SER A 6 -30.345 22.005 -1.847 1.00 0.00 O ATOM 52 CB SER A 6 -30.382 22.329 1.504 1.00 0.00 C ATOM 53 OG SER A 6 -29.540 23.310 2.085 1.00 0.00 O ATOM 0 H SER A 6 -32.231 21.413 -0.713 1.00 0.00 H new ATOM 0 HA SER A 6 -31.361 23.919 0.437 1.00 0.00 H new ATOM 0 HB2 SER A 6 -31.122 22.001 2.234 1.00 0.00 H new ATOM 0 HB3 SER A 6 -29.792 21.453 1.233 1.00 0.00 H new ATOM 0 HG SER A 6 -29.100 22.936 2.877 1.00 0.00 H new ATOM 59 N GLY A 7 -29.144 23.677 -0.941 1.00 0.00 N ATOM 60 CA GLY A 7 -28.194 23.705 -2.038 1.00 0.00 C ATOM 61 C GLY A 7 -27.096 24.729 -1.828 1.00 0.00 C ATOM 62 O GLY A 7 -27.251 25.662 -1.039 1.00 0.00 O ATOM 0 H GLY A 7 -28.965 24.357 -0.202 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.748 22.717 -2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -28.721 23.927 -2.966 1.00 0.00 H new ATOM 66 N CYS A 8 -25.985 24.556 -2.534 1.00 0.00 N ATOM 67 CA CYS A 8 -24.855 25.472 -2.420 1.00 0.00 C ATOM 68 C CYS A 8 -24.283 25.804 -3.794 1.00 0.00 C ATOM 69 O CYS A 8 -24.661 25.199 -4.797 1.00 0.00 O ATOM 70 CB CYS A 8 -23.767 24.864 -1.534 1.00 0.00 C ATOM 71 SG CYS A 8 -24.300 24.518 0.159 1.00 0.00 S ATOM 0 H CYS A 8 -25.842 23.790 -3.192 1.00 0.00 H new ATOM 0 HA CYS A 8 -25.212 26.395 -1.963 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -23.418 23.937 -1.990 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -22.916 25.545 -1.504 1.00 0.00 H new ATOM 0 HG CYS A 8 -23.311 24.004 0.829 1.00 0.00 H new ATOM 77 N GLU A 9 -23.370 26.770 -3.832 1.00 0.00 N ATOM 78 CA GLU A 9 -22.748 27.183 -5.084 1.00 0.00 C ATOM 79 C GLU A 9 -21.395 26.503 -5.270 1.00 0.00 C ATOM 80 O GLU A 9 -21.075 26.019 -6.354 1.00 0.00 O ATOM 81 CB GLU A 9 -22.577 28.703 -5.116 1.00 0.00 C ATOM 82 CG GLU A 9 -23.848 29.452 -5.480 1.00 0.00 C ATOM 83 CD GLU A 9 -24.914 29.348 -4.406 1.00 0.00 C ATOM 84 OE1 GLU A 9 -24.551 29.290 -3.213 1.00 0.00 O ATOM 85 OE2 GLU A 9 -26.111 29.324 -4.760 1.00 0.00 O ATOM 0 H GLU A 9 -23.045 27.280 -3.011 1.00 0.00 H new ATOM 0 HA GLU A 9 -23.402 26.881 -5.902 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -22.233 29.042 -4.139 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -21.797 28.957 -5.834 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -23.610 30.502 -5.650 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -24.242 29.058 -6.417 1.00 0.00 H new ATOM 92 N GLY A 10 -20.603 26.473 -4.202 1.00 0.00 N ATOM 93 CA GLY A 10 -19.293 25.852 -4.267 1.00 0.00 C ATOM 94 C GLY A 10 -18.198 26.843 -4.608 1.00 0.00 C ATOM 95 O GLY A 10 -17.992 27.175 -5.774 1.00 0.00 O ATOM 0 H GLY A 10 -20.845 26.868 -3.293 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -19.069 25.383 -3.309 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -19.307 25.059 -5.015 1.00 0.00 H new ATOM 99 N GLY A 11 -17.493 27.318 -3.585 1.00 0.00 N ATOM 100 CA GLY A 11 -16.423 28.274 -3.803 1.00 0.00 C ATOM 101 C GLY A 11 -15.943 28.911 -2.514 1.00 0.00 C ATOM 102 O GLY A 11 -16.373 28.527 -1.426 1.00 0.00 O ATOM 0 H GLY A 11 -17.644 27.058 -2.610 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.587 27.773 -4.291 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -16.769 29.053 -4.483 1.00 0.00 H new ATOM 106 N VAL A 12 -15.048 29.886 -2.634 1.00 0.00 N ATOM 107 CA VAL A 12 -14.509 30.577 -1.469 1.00 0.00 C ATOM 108 C VAL A 12 -14.310 32.061 -1.754 1.00 0.00 C ATOM 109 O VAL A 12 -14.358 32.495 -2.905 1.00 0.00 O ATOM 110 CB VAL A 12 -13.166 29.966 -1.026 1.00 0.00 C ATOM 111 CG1 VAL A 12 -13.342 28.501 -0.655 1.00 0.00 C ATOM 112 CG2 VAL A 12 -12.121 30.126 -2.120 1.00 0.00 C ATOM 0 H VAL A 12 -14.681 30.215 -3.527 1.00 0.00 H new ATOM 0 HA VAL A 12 -15.236 30.459 -0.666 1.00 0.00 H new ATOM 0 HB VAL A 12 -12.818 30.500 -0.142 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -12.383 28.086 -0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.056 28.416 0.164 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.713 27.949 -1.518 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -11.179 29.689 -1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.460 29.619 -3.023 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -11.975 31.185 -2.332 1.00 0.00 H new ATOM 122 N ASP A 13 -14.085 32.836 -0.698 1.00 0.00 N ATOM 123 CA ASP A 13 -13.877 34.273 -0.834 1.00 0.00 C ATOM 124 C ASP A 13 -12.389 34.611 -0.805 1.00 0.00 C ATOM 125 O ASP A 13 -11.552 33.749 -0.543 1.00 0.00 O ATOM 126 CB ASP A 13 -14.605 35.023 0.282 1.00 0.00 C ATOM 127 CG ASP A 13 -16.022 34.524 0.487 1.00 0.00 C ATOM 128 OD1 ASP A 13 -16.189 33.329 0.809 1.00 0.00 O ATOM 129 OD2 ASP A 13 -16.964 35.327 0.323 1.00 0.00 O ATOM 0 H ASP A 13 -14.042 32.493 0.262 1.00 0.00 H new ATOM 0 HA ASP A 13 -14.284 34.585 -1.796 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -14.047 34.915 1.212 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -14.628 36.087 0.046 1.00 0.00 H new ATOM 134 N MET A 14 -12.069 35.872 -1.077 1.00 0.00 N ATOM 135 CA MET A 14 -10.683 36.324 -1.082 1.00 0.00 C ATOM 136 C MET A 14 -10.171 36.524 0.342 1.00 0.00 C ATOM 137 O MET A 14 -10.347 37.591 0.929 1.00 0.00 O ATOM 138 CB MET A 14 -10.552 37.628 -1.871 1.00 0.00 C ATOM 139 CG MET A 14 -10.528 37.427 -3.377 1.00 0.00 C ATOM 140 SD MET A 14 -10.790 38.961 -4.287 1.00 0.00 S ATOM 141 CE MET A 14 -9.664 38.736 -5.662 1.00 0.00 C ATOM 0 H MET A 14 -12.751 36.598 -1.297 1.00 0.00 H new ATOM 0 HA MET A 14 -10.078 35.555 -1.562 1.00 0.00 H new ATOM 0 HB2 MET A 14 -11.384 38.284 -1.613 1.00 0.00 H new ATOM 0 HB3 MET A 14 -9.638 38.137 -1.566 1.00 0.00 H new ATOM 0 HG2 MET A 14 -9.570 36.996 -3.667 1.00 0.00 H new ATOM 0 HG3 MET A 14 -11.298 36.708 -3.656 1.00 0.00 H new ATOM 0 HE1 MET A 14 -9.712 39.606 -6.317 1.00 0.00 H new ATOM 0 HE2 MET A 14 -8.648 38.621 -5.285 1.00 0.00 H new ATOM 0 HE3 MET A 14 -9.946 37.844 -6.221 1.00 0.00 H new ATOM 151 N GLN A 15 -9.538 35.491 0.889 1.00 0.00 N ATOM 152 CA GLN A 15 -9.003 35.554 2.243 1.00 0.00 C ATOM 153 C GLN A 15 -7.601 34.956 2.303 1.00 0.00 C ATOM 154 O GLN A 15 -7.403 33.784 1.986 1.00 0.00 O ATOM 155 CB GLN A 15 -9.926 34.817 3.215 1.00 0.00 C ATOM 156 CG GLN A 15 -11.336 35.385 3.263 1.00 0.00 C ATOM 157 CD GLN A 15 -12.223 34.660 4.256 1.00 0.00 C ATOM 158 OE1 GLN A 15 -12.209 33.431 4.336 1.00 0.00 O ATOM 159 NE2 GLN A 15 -13.002 35.418 5.018 1.00 0.00 N ATOM 0 H GLN A 15 -9.383 34.601 0.415 1.00 0.00 H new ATOM 0 HA GLN A 15 -8.944 36.603 2.534 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -9.976 33.766 2.930 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -9.493 34.856 4.215 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -11.289 36.442 3.527 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -11.782 35.324 2.270 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -12.981 36.433 4.918 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -13.621 34.986 5.704 1.00 0.00 H new ATOM 168 N GLN A 16 -6.633 35.770 2.710 1.00 0.00 N ATOM 169 CA GLN A 16 -5.249 35.320 2.810 1.00 0.00 C ATOM 170 C GLN A 16 -4.953 34.776 4.204 1.00 0.00 C ATOM 171 O GLN A 16 -4.386 35.474 5.045 1.00 0.00 O ATOM 172 CB GLN A 16 -4.293 36.469 2.484 1.00 0.00 C ATOM 173 CG GLN A 16 -2.825 36.080 2.567 1.00 0.00 C ATOM 174 CD GLN A 16 -1.915 37.095 1.903 1.00 0.00 C ATOM 175 OE1 GLN A 16 -2.308 38.237 1.666 1.00 0.00 O ATOM 176 NE2 GLN A 16 -0.690 36.682 1.600 1.00 0.00 N ATOM 0 H GLN A 16 -6.781 36.744 2.976 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.101 34.517 2.088 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.507 36.835 1.480 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.481 37.294 3.171 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -2.540 35.972 3.614 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.683 35.107 2.096 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -0.406 35.726 1.815 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.033 37.321 1.153 1.00 0.00 H new ATOM 185 N SER A 17 -5.339 33.527 4.440 1.00 0.00 N ATOM 186 CA SER A 17 -5.119 32.891 5.734 1.00 0.00 C ATOM 187 C SER A 17 -3.627 32.764 6.029 1.00 0.00 C ATOM 188 O SER A 17 -2.857 32.294 5.193 1.00 0.00 O ATOM 189 CB SER A 17 -5.776 31.509 5.765 1.00 0.00 C ATOM 190 OG SER A 17 -5.825 30.998 7.086 1.00 0.00 O ATOM 0 H SER A 17 -5.806 32.935 3.753 1.00 0.00 H new ATOM 0 HA SER A 17 -5.572 33.518 6.502 1.00 0.00 H new ATOM 0 HB2 SER A 17 -6.785 31.573 5.359 1.00 0.00 H new ATOM 0 HB3 SER A 17 -5.219 30.823 5.127 1.00 0.00 H new ATOM 0 HG SER A 17 -6.251 30.115 7.080 1.00 0.00 H new ATOM 196 N GLN A 18 -3.230 33.186 7.225 1.00 0.00 N ATOM 197 CA GLN A 18 -1.831 33.121 7.631 1.00 0.00 C ATOM 198 C GLN A 18 -1.674 32.312 8.915 1.00 0.00 C ATOM 199 O GLN A 18 -0.880 32.661 9.788 1.00 0.00 O ATOM 200 CB GLN A 18 -1.269 34.529 7.831 1.00 0.00 C ATOM 201 CG GLN A 18 -1.900 35.277 8.994 1.00 0.00 C ATOM 202 CD GLN A 18 -3.143 36.045 8.589 1.00 0.00 C ATOM 203 OE1 GLN A 18 -3.094 36.912 7.716 1.00 0.00 O ATOM 204 NE2 GLN A 18 -4.267 35.731 9.223 1.00 0.00 N ATOM 0 H GLN A 18 -3.856 33.576 7.929 1.00 0.00 H new ATOM 0 HA GLN A 18 -1.272 32.624 6.838 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -0.193 34.462 7.994 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -1.418 35.104 6.917 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -2.156 34.568 9.781 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -1.171 35.969 9.414 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -4.262 35.006 9.940 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -5.135 36.215 8.993 1.00 0.00 H new ATOM 213 N VAL A 19 -2.437 31.228 9.022 1.00 0.00 N ATOM 214 CA VAL A 19 -2.382 30.368 10.198 1.00 0.00 C ATOM 215 C VAL A 19 -1.520 29.138 9.940 1.00 0.00 C ATOM 216 O VAL A 19 -0.804 28.673 10.827 1.00 0.00 O ATOM 217 CB VAL A 19 -3.790 29.915 10.628 1.00 0.00 C ATOM 218 CG1 VAL A 19 -3.707 28.974 11.821 1.00 0.00 C ATOM 219 CG2 VAL A 19 -4.663 31.118 10.947 1.00 0.00 C ATOM 0 H VAL A 19 -3.100 30.925 8.309 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.937 30.957 11.000 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.247 29.374 9.800 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -4.711 28.664 12.111 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.120 28.096 11.552 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.230 29.487 12.656 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -5.654 30.779 11.249 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.212 31.690 11.758 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.750 31.749 10.063 1.00 0.00 H new ATOM 229 N GLN A 20 -1.593 28.616 8.720 1.00 0.00 N ATOM 230 CA GLN A 20 -0.819 27.439 8.345 1.00 0.00 C ATOM 231 C GLN A 20 0.222 27.786 7.285 1.00 0.00 C ATOM 232 O GLN A 20 0.017 28.688 6.471 1.00 0.00 O ATOM 233 CB GLN A 20 -1.745 26.338 7.826 1.00 0.00 C ATOM 234 CG GLN A 20 -2.516 25.623 8.924 1.00 0.00 C ATOM 235 CD GLN A 20 -3.631 24.751 8.382 1.00 0.00 C ATOM 236 OE1 GLN A 20 -3.465 23.542 8.218 1.00 0.00 O ATOM 237 NE2 GLN A 20 -4.776 25.361 8.100 1.00 0.00 N ATOM 0 H GLN A 20 -2.180 28.990 7.974 1.00 0.00 H new ATOM 0 HA GLN A 20 -0.300 27.079 9.233 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.453 26.773 7.121 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.153 25.607 7.274 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -1.828 25.008 9.504 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -2.937 26.361 9.607 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -4.870 26.365 8.251 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -5.562 24.825 7.732 1.00 0.00 H new ATOM 246 N LEU A 21 1.338 27.066 7.301 1.00 0.00 N ATOM 247 CA LEU A 21 2.412 27.298 6.341 1.00 0.00 C ATOM 248 C LEU A 21 2.188 26.490 5.068 1.00 0.00 C ATOM 249 O LEU A 21 1.740 25.345 5.120 1.00 0.00 O ATOM 250 CB LEU A 21 3.763 26.934 6.960 1.00 0.00 C ATOM 251 CG LEU A 21 4.084 25.441 7.038 1.00 0.00 C ATOM 252 CD1 LEU A 21 4.696 24.958 5.732 1.00 0.00 C ATOM 253 CD2 LEU A 21 5.019 25.157 8.205 1.00 0.00 C ATOM 0 H LEU A 21 1.523 26.317 7.968 1.00 0.00 H new ATOM 0 HA LEU A 21 2.412 28.357 6.081 1.00 0.00 H new ATOM 0 HB2 LEU A 21 4.548 27.425 6.384 1.00 0.00 H new ATOM 0 HB3 LEU A 21 3.801 27.347 7.968 1.00 0.00 H new ATOM 0 HG LEU A 21 3.154 24.897 7.203 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.918 23.893 5.806 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.993 25.126 4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 21 5.617 25.508 5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 21 5.237 24.090 8.245 1.00 0.00 H new ATOM 0 HD22 LEU A 21 5.947 25.712 8.071 1.00 0.00 H new ATOM 0 HD23 LEU A 21 4.543 25.466 9.136 1.00 0.00 H new ATOM 265 N GLN A 22 2.504 27.093 3.927 1.00 0.00 N ATOM 266 CA GLN A 22 2.339 26.427 2.640 1.00 0.00 C ATOM 267 C GLN A 22 3.407 25.357 2.439 1.00 0.00 C ATOM 268 O GLN A 22 4.595 25.605 2.648 1.00 0.00 O ATOM 269 CB GLN A 22 2.403 27.448 1.502 1.00 0.00 C ATOM 270 CG GLN A 22 3.776 28.075 1.323 1.00 0.00 C ATOM 271 CD GLN A 22 4.689 27.240 0.446 1.00 0.00 C ATOM 272 OE1 GLN A 22 4.258 26.259 -0.161 1.00 0.00 O ATOM 273 NE2 GLN A 22 5.957 27.626 0.376 1.00 0.00 N ATOM 0 H GLN A 22 2.876 28.041 3.867 1.00 0.00 H new ATOM 0 HA GLN A 22 1.362 25.944 2.632 1.00 0.00 H new ATOM 0 HB2 GLN A 22 2.111 26.961 0.571 1.00 0.00 H new ATOM 0 HB3 GLN A 22 1.675 28.237 1.691 1.00 0.00 H new ATOM 0 HG2 GLN A 22 3.664 29.066 0.884 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.240 28.209 2.300 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.270 28.446 0.896 1.00 0.00 H new ATOM 0 HE22 GLN A 22 6.618 27.103 -0.198 1.00 0.00 H new ATOM 282 N CYS A 23 2.976 24.168 2.034 1.00 0.00 N ATOM 283 CA CYS A 23 3.896 23.059 1.806 1.00 0.00 C ATOM 284 C CYS A 23 4.070 22.795 0.314 1.00 0.00 C ATOM 285 O CYS A 23 3.108 22.768 -0.454 1.00 0.00 O ATOM 286 CB CYS A 23 3.388 21.796 2.503 1.00 0.00 C ATOM 287 SG CYS A 23 4.699 20.694 3.081 1.00 0.00 S ATOM 0 H CYS A 23 1.996 23.947 1.857 1.00 0.00 H new ATOM 0 HA CYS A 23 4.865 23.332 2.224 1.00 0.00 H new ATOM 0 HB2 CYS A 23 2.771 22.086 3.353 1.00 0.00 H new ATOM 0 HB3 CYS A 23 2.745 21.248 1.815 1.00 0.00 H new ATOM 0 HG CYS A 23 4.170 19.656 3.658 1.00 0.00 H new ATOM 293 N PRO A 24 5.327 22.597 -0.110 1.00 0.00 N ATOM 294 CA PRO A 24 5.658 22.333 -1.513 1.00 0.00 C ATOM 295 C PRO A 24 5.183 20.958 -1.972 1.00 0.00 C ATOM 296 O PRO A 24 5.356 20.586 -3.133 1.00 0.00 O ATOM 297 CB PRO A 24 7.187 22.405 -1.537 1.00 0.00 C ATOM 298 CG PRO A 24 7.604 22.075 -0.146 1.00 0.00 C ATOM 299 CD PRO A 24 6.523 22.615 0.750 1.00 0.00 C ATOM 0 HA PRO A 24 5.174 23.041 -2.186 1.00 0.00 H new ATOM 0 HB2 PRO A 24 7.605 21.698 -2.254 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.532 23.397 -1.829 1.00 0.00 H new ATOM 0 HG2 PRO A 24 7.716 20.998 -0.017 1.00 0.00 H new ATOM 0 HG3 PRO A 24 8.568 22.526 0.090 1.00 0.00 H new ATOM 0 HD2 PRO A 24 6.390 21.996 1.637 1.00 0.00 H new ATOM 0 HD3 PRO A 24 6.754 23.622 1.096 1.00 0.00 H new ATOM 307 N LEU A 25 4.583 20.208 -1.054 1.00 0.00 N ATOM 308 CA LEU A 25 4.082 18.874 -1.365 1.00 0.00 C ATOM 309 C LEU A 25 2.560 18.831 -1.282 1.00 0.00 C ATOM 310 O LEU A 25 1.942 19.629 -0.576 1.00 0.00 O ATOM 311 CB LEU A 25 4.685 17.845 -0.406 1.00 0.00 C ATOM 312 CG LEU A 25 6.164 17.517 -0.617 1.00 0.00 C ATOM 313 CD1 LEU A 25 7.040 18.458 0.195 1.00 0.00 C ATOM 314 CD2 LEU A 25 6.447 16.069 -0.248 1.00 0.00 C ATOM 0 H LEU A 25 4.432 20.501 -0.089 1.00 0.00 H new ATOM 0 HA LEU A 25 4.379 18.630 -2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.556 18.209 0.613 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.113 16.921 -0.490 1.00 0.00 H new ATOM 0 HG LEU A 25 6.400 17.654 -1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.089 18.210 0.033 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.858 19.486 -0.118 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.802 18.354 1.254 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.504 15.854 -0.404 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.194 15.904 0.799 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.846 15.410 -0.874 1.00 0.00 H new ATOM 326 N THR A 26 1.959 17.892 -2.007 1.00 0.00 N ATOM 327 CA THR A 26 0.509 17.744 -2.016 1.00 0.00 C ATOM 328 C THR A 26 0.079 16.502 -1.244 1.00 0.00 C ATOM 329 O THR A 26 0.806 15.513 -1.157 1.00 0.00 O ATOM 330 CB THR A 26 -0.039 17.657 -3.453 1.00 0.00 C ATOM 331 OG1 THR A 26 0.888 16.955 -4.288 1.00 0.00 O ATOM 332 CG2 THR A 26 -0.291 19.045 -4.021 1.00 0.00 C ATOM 0 H THR A 26 2.455 17.223 -2.596 1.00 0.00 H new ATOM 0 HA THR A 26 0.098 18.630 -1.532 1.00 0.00 H new ATOM 0 HB THR A 26 -0.985 17.116 -3.426 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.532 16.902 -5.200 1.00 0.00 H new ATOM 0 HG21 THR A 26 -0.678 18.958 -5.036 1.00 0.00 H new ATOM 0 HG22 THR A 26 -1.019 19.566 -3.399 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.643 19.607 -4.035 1.00 0.00 H new ATOM 340 N PRO A 27 -1.132 16.552 -0.669 1.00 0.00 N ATOM 341 CA PRO A 27 -1.687 15.437 0.105 1.00 0.00 C ATOM 342 C PRO A 27 -2.044 14.242 -0.773 1.00 0.00 C ATOM 343 O PRO A 27 -2.395 14.385 -1.944 1.00 0.00 O ATOM 344 CB PRO A 27 -2.949 16.035 0.733 1.00 0.00 C ATOM 345 CG PRO A 27 -3.339 17.144 -0.183 1.00 0.00 C ATOM 346 CD PRO A 27 -2.054 17.699 -0.732 1.00 0.00 C ATOM 0 HA PRO A 27 -0.973 15.051 0.833 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.742 15.291 0.814 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -2.754 16.403 1.740 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -3.981 16.780 -0.985 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -3.899 17.912 0.350 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.176 18.061 -1.753 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.692 18.538 -0.138 1.00 0.00 H new ATOM 354 N PRO A 28 -1.953 13.035 -0.195 1.00 0.00 N ATOM 355 CA PRO A 28 -2.264 11.792 -0.908 1.00 0.00 C ATOM 356 C PRO A 28 -3.753 11.648 -1.201 1.00 0.00 C ATOM 357 O PRO A 28 -4.591 11.847 -0.321 1.00 0.00 O ATOM 358 CB PRO A 28 -1.803 10.702 0.064 1.00 0.00 C ATOM 359 CG PRO A 28 -1.872 11.339 1.408 1.00 0.00 C ATOM 360 CD PRO A 28 -1.542 12.791 1.197 1.00 0.00 C ATOM 0 HA PRO A 28 -1.777 11.748 -1.882 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -2.447 9.824 0.009 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.790 10.370 -0.165 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.865 11.224 1.844 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -1.166 10.875 2.096 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.083 13.431 1.894 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.480 12.987 1.343 1.00 0.00 H new ATOM 368 N ARG A 29 -4.076 11.302 -2.443 1.00 0.00 N ATOM 369 CA ARG A 29 -5.465 11.132 -2.852 1.00 0.00 C ATOM 370 C ARG A 29 -5.595 10.019 -3.887 1.00 0.00 C ATOM 371 O ARG A 29 -4.663 9.750 -4.644 1.00 0.00 O ATOM 372 CB ARG A 29 -6.014 12.441 -3.423 1.00 0.00 C ATOM 373 CG ARG A 29 -7.483 12.369 -3.807 1.00 0.00 C ATOM 374 CD ARG A 29 -8.146 13.736 -3.732 1.00 0.00 C ATOM 375 NE ARG A 29 -8.019 14.333 -2.405 1.00 0.00 N ATOM 376 CZ ARG A 29 -8.632 15.455 -2.042 1.00 0.00 C ATOM 377 NH1 ARG A 29 -9.411 16.096 -2.903 1.00 0.00 N ATOM 378 NH2 ARG A 29 -8.468 15.936 -0.817 1.00 0.00 N ATOM 0 H ARG A 29 -3.395 11.134 -3.183 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.046 10.855 -1.972 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.878 13.234 -2.687 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -5.431 12.717 -4.301 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.577 11.973 -4.818 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -8.000 11.676 -3.144 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.697 14.398 -4.472 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -9.201 13.642 -3.988 1.00 0.00 H new ATOM 0 HE ARG A 29 -7.428 13.863 -1.720 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -9.540 15.728 -3.845 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -9.881 16.957 -2.623 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -7.871 15.445 -0.152 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -8.939 16.797 -0.540 1.00 0.00 H new ATOM 392 N GLY A 30 -6.758 9.375 -3.914 1.00 0.00 N ATOM 393 CA GLY A 30 -6.988 8.299 -4.859 1.00 0.00 C ATOM 394 C GLY A 30 -6.026 7.143 -4.668 1.00 0.00 C ATOM 395 O GLY A 30 -5.725 6.413 -5.613 1.00 0.00 O ATOM 0 H GLY A 30 -7.545 9.580 -3.298 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.011 7.938 -4.752 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.891 8.684 -5.874 1.00 0.00 H new ATOM 399 N LEU A 31 -5.541 6.977 -3.443 1.00 0.00 N ATOM 400 CA LEU A 31 -4.605 5.902 -3.130 1.00 0.00 C ATOM 401 C LEU A 31 -5.341 4.582 -2.921 1.00 0.00 C ATOM 402 O LEU A 31 -6.152 4.452 -2.005 1.00 0.00 O ATOM 403 CB LEU A 31 -3.796 6.252 -1.880 1.00 0.00 C ATOM 404 CG LEU A 31 -2.896 5.143 -1.331 1.00 0.00 C ATOM 405 CD1 LEU A 31 -3.716 4.130 -0.548 1.00 0.00 C ATOM 406 CD2 LEU A 31 -2.140 4.461 -2.461 1.00 0.00 C ATOM 0 H LEU A 31 -5.780 7.572 -2.650 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.926 5.787 -3.975 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.175 7.119 -2.105 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.490 6.552 -1.095 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.169 5.593 -0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.060 3.349 -0.165 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.211 4.629 0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.466 3.685 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.505 3.675 -2.052 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.851 4.025 -3.163 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.522 5.194 -2.979 1.00 0.00 H new ATOM 418 N GLN A 32 -5.049 3.607 -3.775 1.00 0.00 N ATOM 419 CA GLN A 32 -5.683 2.297 -3.683 1.00 0.00 C ATOM 420 C GLN A 32 -4.808 1.223 -4.321 1.00 0.00 C ATOM 421 O GLN A 32 -4.120 1.475 -5.310 1.00 0.00 O ATOM 422 CB GLN A 32 -7.055 2.321 -4.358 1.00 0.00 C ATOM 423 CG GLN A 32 -8.045 1.335 -3.760 1.00 0.00 C ATOM 424 CD GLN A 32 -7.972 -0.032 -4.410 1.00 0.00 C ATOM 425 OE1 GLN A 32 -7.882 -0.147 -5.633 1.00 0.00 O ATOM 426 NE2 GLN A 32 -8.011 -1.079 -3.594 1.00 0.00 N ATOM 0 H GLN A 32 -4.378 3.699 -4.538 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.810 2.057 -2.627 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.468 3.327 -4.286 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -6.933 2.102 -5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -7.853 1.236 -2.692 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -9.055 1.730 -3.867 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.086 -0.938 -2.587 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -7.966 -2.024 -3.975 1.00 0.00 H new ATOM 435 N VAL A 33 -4.838 0.024 -3.747 1.00 0.00 N ATOM 436 CA VAL A 33 -4.049 -1.089 -4.260 1.00 0.00 C ATOM 437 C VAL A 33 -4.900 -2.016 -5.122 1.00 0.00 C ATOM 438 O VAL A 33 -6.124 -2.042 -5.000 1.00 0.00 O ATOM 439 CB VAL A 33 -3.419 -1.905 -3.116 1.00 0.00 C ATOM 440 CG1 VAL A 33 -2.189 -1.198 -2.569 1.00 0.00 C ATOM 441 CG2 VAL A 33 -4.438 -2.149 -2.013 1.00 0.00 C ATOM 0 H VAL A 33 -5.401 -0.201 -2.926 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.255 -0.658 -4.870 1.00 0.00 H new ATOM 0 HB VAL A 33 -3.106 -2.871 -3.512 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.758 -1.790 -1.762 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.453 -1.080 -3.365 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.473 -0.217 -2.188 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.976 -2.727 -1.212 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.783 -1.193 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.286 -2.702 -2.417 1.00 0.00 H new ATOM 451 N SER A 34 -4.242 -2.775 -5.993 1.00 0.00 N ATOM 452 CA SER A 34 -4.938 -3.701 -6.878 1.00 0.00 C ATOM 453 C SER A 34 -4.066 -4.913 -7.191 1.00 0.00 C ATOM 454 O SER A 34 -2.868 -4.918 -6.908 1.00 0.00 O ATOM 455 CB SER A 34 -5.337 -2.997 -8.176 1.00 0.00 C ATOM 456 OG SER A 34 -6.423 -3.658 -8.803 1.00 0.00 O ATOM 0 H SER A 34 -3.228 -2.767 -6.104 1.00 0.00 H new ATOM 0 HA SER A 34 -5.838 -4.045 -6.368 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.610 -1.963 -7.963 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.484 -2.968 -8.854 1.00 0.00 H new ATOM 0 HG SER A 34 -6.660 -3.187 -9.629 1.00 0.00 H new ATOM 462 N ILE A 35 -4.677 -5.938 -7.775 1.00 0.00 N ATOM 463 CA ILE A 35 -3.957 -7.156 -8.127 1.00 0.00 C ATOM 464 C ILE A 35 -3.825 -7.298 -9.640 1.00 0.00 C ATOM 465 O ILE A 35 -4.819 -7.261 -10.365 1.00 0.00 O ATOM 466 CB ILE A 35 -4.656 -8.407 -7.564 1.00 0.00 C ATOM 467 CG1 ILE A 35 -4.772 -8.311 -6.041 1.00 0.00 C ATOM 468 CG2 ILE A 35 -3.898 -9.663 -7.965 1.00 0.00 C ATOM 469 CD1 ILE A 35 -5.716 -9.329 -5.442 1.00 0.00 C ATOM 0 H ILE A 35 -5.668 -5.950 -8.014 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.965 -7.075 -7.684 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.661 -8.464 -7.983 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.783 -8.441 -5.601 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.112 -7.311 -5.773 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.405 -10.539 -7.559 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.863 -9.735 -9.052 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.883 -9.616 -7.571 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.749 -9.202 -4.360 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.715 -9.186 -5.854 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.366 -10.334 -5.679 1.00 0.00 H new ATOM 481 N GLN A 36 -2.592 -7.463 -10.108 1.00 0.00 N ATOM 482 CA GLN A 36 -2.331 -7.613 -11.535 1.00 0.00 C ATOM 483 C GLN A 36 -3.453 -8.390 -12.215 1.00 0.00 C ATOM 484 O GLN A 36 -3.494 -9.618 -12.160 1.00 0.00 O ATOM 485 CB GLN A 36 -0.995 -8.323 -11.758 1.00 0.00 C ATOM 486 CG GLN A 36 -0.447 -8.159 -13.167 1.00 0.00 C ATOM 487 CD GLN A 36 -0.377 -6.709 -13.601 1.00 0.00 C ATOM 488 OE1 GLN A 36 0.675 -6.075 -13.521 1.00 0.00 O ATOM 489 NE2 GLN A 36 -1.501 -6.174 -14.064 1.00 0.00 N ATOM 0 H GLN A 36 -1.759 -7.496 -9.521 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.284 -6.618 -11.977 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -0.265 -7.938 -11.046 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.118 -9.385 -11.546 1.00 0.00 H new ATOM 0 HG2 GLN A 36 0.549 -8.598 -13.219 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.076 -8.713 -13.864 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -2.351 -6.736 -14.113 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -1.514 -5.201 -14.370 1.00 0.00 H new ATOM 498 N GLY A 37 -4.364 -7.664 -12.857 1.00 0.00 N ATOM 499 CA GLY A 37 -5.476 -8.302 -13.538 1.00 0.00 C ATOM 500 C GLY A 37 -6.611 -8.650 -12.596 1.00 0.00 C ATOM 501 O GLY A 37 -6.386 -9.213 -11.525 1.00 0.00 O ATOM 0 H GLY A 37 -4.352 -6.646 -12.918 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.847 -7.640 -14.320 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.125 -9.209 -14.029 1.00 0.00 H new ATOM 505 N GLU A 38 -7.833 -8.313 -12.994 1.00 0.00 N ATOM 506 CA GLU A 38 -9.007 -8.592 -12.175 1.00 0.00 C ATOM 507 C GLU A 38 -9.143 -10.088 -11.911 1.00 0.00 C ATOM 508 O GLU A 38 -9.486 -10.859 -12.807 1.00 0.00 O ATOM 509 CB GLU A 38 -10.271 -8.067 -12.860 1.00 0.00 C ATOM 510 CG GLU A 38 -11.497 -8.073 -11.963 1.00 0.00 C ATOM 511 CD GLU A 38 -12.662 -7.308 -12.561 1.00 0.00 C ATOM 512 OE1 GLU A 38 -12.828 -7.353 -13.798 1.00 0.00 O ATOM 513 OE2 GLU A 38 -13.406 -6.666 -11.792 1.00 0.00 O ATOM 0 H GLU A 38 -8.036 -7.847 -13.878 1.00 0.00 H new ATOM 0 HA GLU A 38 -8.881 -8.082 -11.220 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.090 -7.050 -13.207 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.474 -8.673 -13.743 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.801 -9.103 -11.777 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.238 -7.637 -10.998 1.00 0.00 H new ATOM 520 N ALA A 39 -8.870 -10.492 -10.674 1.00 0.00 N ATOM 521 CA ALA A 39 -8.963 -11.895 -10.290 1.00 0.00 C ATOM 522 C ALA A 39 -10.142 -12.130 -9.352 1.00 0.00 C ATOM 523 O ALA A 39 -10.596 -11.214 -8.667 1.00 0.00 O ATOM 524 CB ALA A 39 -7.667 -12.350 -9.637 1.00 0.00 C ATOM 0 H ALA A 39 -8.583 -9.867 -9.921 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.128 -12.483 -11.193 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.751 -13.400 -9.355 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.843 -12.227 -10.340 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.477 -11.749 -8.747 1.00 0.00 H new ATOM 530 N VAL A 40 -10.634 -13.365 -9.326 1.00 0.00 N ATOM 531 CA VAL A 40 -11.760 -13.721 -8.471 1.00 0.00 C ATOM 532 C VAL A 40 -11.302 -14.549 -7.275 1.00 0.00 C ATOM 533 O VAL A 40 -11.396 -14.108 -6.130 1.00 0.00 O ATOM 534 CB VAL A 40 -12.828 -14.512 -9.249 1.00 0.00 C ATOM 535 CG1 VAL A 40 -13.991 -14.878 -8.340 1.00 0.00 C ATOM 536 CG2 VAL A 40 -13.311 -13.714 -10.451 1.00 0.00 C ATOM 0 H VAL A 40 -10.270 -14.135 -9.887 1.00 0.00 H new ATOM 0 HA VAL A 40 -12.196 -12.787 -8.117 1.00 0.00 H new ATOM 0 HB VAL A 40 -12.378 -15.436 -9.612 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -14.735 -15.436 -8.908 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -13.629 -15.491 -7.515 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -14.444 -13.969 -7.945 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -14.065 -14.288 -10.989 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -13.744 -12.773 -10.113 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.470 -13.509 -11.113 1.00 0.00 H new ATOM 546 N ALA A 41 -10.805 -15.750 -7.549 1.00 0.00 N ATOM 547 CA ALA A 41 -10.330 -16.639 -6.496 1.00 0.00 C ATOM 548 C ALA A 41 -9.029 -17.323 -6.902 1.00 0.00 C ATOM 549 O ALA A 41 -8.955 -17.971 -7.946 1.00 0.00 O ATOM 550 CB ALA A 41 -11.392 -17.676 -6.162 1.00 0.00 C ATOM 0 H ALA A 41 -10.721 -16.130 -8.492 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.133 -16.038 -5.608 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.024 -18.333 -5.374 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.297 -17.173 -5.822 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.617 -18.266 -7.051 1.00 0.00 H new ATOM 556 N VAL A 42 -8.003 -17.175 -6.069 1.00 0.00 N ATOM 557 CA VAL A 42 -6.704 -17.779 -6.340 1.00 0.00 C ATOM 558 C VAL A 42 -6.504 -19.045 -5.515 1.00 0.00 C ATOM 559 O VAL A 42 -7.153 -19.238 -4.486 1.00 0.00 O ATOM 560 CB VAL A 42 -5.555 -16.798 -6.042 1.00 0.00 C ATOM 561 CG1 VAL A 42 -4.274 -17.555 -5.729 1.00 0.00 C ATOM 562 CG2 VAL A 42 -5.351 -15.847 -7.212 1.00 0.00 C ATOM 0 H VAL A 42 -8.047 -16.642 -5.201 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.688 -18.033 -7.400 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.822 -16.207 -5.166 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.473 -16.845 -5.521 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.431 -18.191 -4.858 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.998 -18.173 -6.584 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.535 -15.160 -6.985 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.106 -16.419 -8.107 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.266 -15.280 -7.383 1.00 0.00 H new ATOM 572 N ARG A 43 -5.600 -19.906 -5.971 1.00 0.00 N ATOM 573 CA ARG A 43 -5.314 -21.154 -5.275 1.00 0.00 C ATOM 574 C ARG A 43 -4.254 -20.946 -4.197 1.00 0.00 C ATOM 575 O ARG A 43 -3.387 -20.078 -4.305 1.00 0.00 O ATOM 576 CB ARG A 43 -4.845 -22.220 -6.267 1.00 0.00 C ATOM 577 CG ARG A 43 -5.981 -22.894 -7.019 1.00 0.00 C ATOM 578 CD ARG A 43 -6.360 -22.116 -8.270 1.00 0.00 C ATOM 579 NE ARG A 43 -7.771 -22.279 -8.608 1.00 0.00 N ATOM 580 CZ ARG A 43 -8.372 -21.616 -9.590 1.00 0.00 C ATOM 581 NH1 ARG A 43 -7.688 -20.750 -10.326 1.00 0.00 N ATOM 582 NH2 ARG A 43 -9.660 -21.818 -9.838 1.00 0.00 N ATOM 0 H ARG A 43 -5.053 -19.762 -6.820 1.00 0.00 H new ATOM 0 HA ARG A 43 -6.233 -21.492 -4.796 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -4.166 -21.761 -6.986 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -4.276 -22.979 -5.730 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -5.686 -23.907 -7.294 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.850 -22.981 -6.366 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -6.143 -21.059 -8.119 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -5.746 -22.451 -9.106 1.00 0.00 H new ATOM 0 HE ARG A 43 -8.325 -22.937 -8.061 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.698 -20.592 -10.139 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -8.152 -20.242 -11.079 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -10.190 -22.483 -9.274 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -10.120 -21.308 -10.592 1.00 0.00 H new ATOM 596 N PRO A 44 -4.323 -21.759 -3.133 1.00 0.00 N ATOM 597 CA PRO A 44 -3.378 -21.683 -2.016 1.00 0.00 C ATOM 598 C PRO A 44 -1.980 -22.152 -2.406 1.00 0.00 C ATOM 599 O PRO A 44 -1.706 -23.350 -2.445 1.00 0.00 O ATOM 600 CB PRO A 44 -3.986 -22.623 -0.972 1.00 0.00 C ATOM 601 CG PRO A 44 -4.803 -23.587 -1.761 1.00 0.00 C ATOM 602 CD PRO A 44 -5.330 -22.816 -2.939 1.00 0.00 C ATOM 0 HA PRO A 44 -3.246 -20.660 -1.663 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -3.211 -23.135 -0.401 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -4.600 -22.076 -0.257 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -4.200 -24.434 -2.087 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -5.619 -23.989 -1.161 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.425 -23.447 -3.822 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.317 -22.399 -2.737 1.00 0.00 H new ATOM 610 N GLY A 45 -1.100 -21.198 -2.693 1.00 0.00 N ATOM 611 CA GLY A 45 0.259 -21.534 -3.076 1.00 0.00 C ATOM 612 C GLY A 45 0.682 -20.861 -4.367 1.00 0.00 C ATOM 613 O GLY A 45 1.657 -21.269 -4.997 1.00 0.00 O ATOM 0 H GLY A 45 -1.304 -20.199 -2.667 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.941 -21.242 -2.277 1.00 0.00 H new ATOM 0 HA3 GLY A 45 0.345 -22.615 -3.189 1.00 0.00 H new ATOM 617 N GLU A 46 -0.056 -19.827 -4.762 1.00 0.00 N ATOM 618 CA GLU A 46 0.247 -19.098 -5.988 1.00 0.00 C ATOM 619 C GLU A 46 0.784 -17.704 -5.673 1.00 0.00 C ATOM 620 O GLU A 46 0.339 -17.056 -4.726 1.00 0.00 O ATOM 621 CB GLU A 46 -1.001 -18.990 -6.865 1.00 0.00 C ATOM 622 CG GLU A 46 -1.489 -20.327 -7.397 1.00 0.00 C ATOM 623 CD GLU A 46 -0.735 -20.773 -8.635 1.00 0.00 C ATOM 624 OE1 GLU A 46 0.311 -21.438 -8.485 1.00 0.00 O ATOM 625 OE2 GLU A 46 -1.192 -20.457 -9.753 1.00 0.00 O ATOM 0 H GLU A 46 -0.866 -19.476 -4.251 1.00 0.00 H new ATOM 0 HA GLU A 46 1.015 -19.651 -6.529 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.800 -18.524 -6.289 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.788 -18.330 -7.706 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.383 -21.084 -6.620 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -2.552 -20.255 -7.629 1.00 0.00 H new ATOM 632 N ASP A 47 1.741 -17.251 -6.475 1.00 0.00 N ATOM 633 CA ASP A 47 2.338 -15.934 -6.283 1.00 0.00 C ATOM 634 C ASP A 47 1.400 -14.835 -6.772 1.00 0.00 C ATOM 635 O ASP A 47 1.131 -14.720 -7.968 1.00 0.00 O ATOM 636 CB ASP A 47 3.675 -15.845 -7.020 1.00 0.00 C ATOM 637 CG ASP A 47 4.206 -14.427 -7.087 1.00 0.00 C ATOM 638 OD1 ASP A 47 3.771 -13.591 -6.267 1.00 0.00 O ATOM 639 OD2 ASP A 47 5.057 -14.153 -7.959 1.00 0.00 O ATOM 0 H ASP A 47 2.120 -17.775 -7.264 1.00 0.00 H new ATOM 0 HA ASP A 47 2.509 -15.792 -5.216 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.406 -16.480 -6.519 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.555 -16.233 -8.031 1.00 0.00 H new ATOM 644 N VAL A 48 0.902 -14.030 -5.839 1.00 0.00 N ATOM 645 CA VAL A 48 -0.007 -12.941 -6.175 1.00 0.00 C ATOM 646 C VAL A 48 0.740 -11.615 -6.280 1.00 0.00 C ATOM 647 O VAL A 48 1.629 -11.325 -5.479 1.00 0.00 O ATOM 648 CB VAL A 48 -1.129 -12.803 -5.128 1.00 0.00 C ATOM 649 CG1 VAL A 48 -0.547 -12.473 -3.762 1.00 0.00 C ATOM 650 CG2 VAL A 48 -2.132 -11.745 -5.560 1.00 0.00 C ATOM 0 H VAL A 48 1.113 -14.112 -4.844 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.449 -13.184 -7.141 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.652 -13.757 -5.052 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.354 -12.379 -3.036 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.129 -13.270 -3.452 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.002 -11.533 -3.818 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.918 -11.660 -4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.626 -10.785 -5.665 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.572 -12.030 -6.516 1.00 0.00 H new ATOM 660 N LEU A 49 0.372 -10.814 -7.274 1.00 0.00 N ATOM 661 CA LEU A 49 1.006 -9.517 -7.485 1.00 0.00 C ATOM 662 C LEU A 49 0.064 -8.381 -7.102 1.00 0.00 C ATOM 663 O LEU A 49 -1.143 -8.456 -7.334 1.00 0.00 O ATOM 664 CB LEU A 49 1.434 -9.369 -8.946 1.00 0.00 C ATOM 665 CG LEU A 49 2.630 -10.215 -9.385 1.00 0.00 C ATOM 666 CD1 LEU A 49 3.933 -9.563 -8.950 1.00 0.00 C ATOM 667 CD2 LEU A 49 2.522 -11.624 -8.820 1.00 0.00 C ATOM 0 H LEU A 49 -0.361 -11.039 -7.946 1.00 0.00 H new ATOM 0 HA LEU A 49 1.888 -9.463 -6.847 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.584 -9.621 -9.580 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.669 -8.321 -9.130 1.00 0.00 H new ATOM 0 HG LEU A 49 2.625 -10.280 -10.473 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.773 -10.179 -9.271 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.014 -8.575 -9.402 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.947 -9.467 -7.864 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.381 -12.212 -9.142 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.501 -11.579 -7.731 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.606 -12.092 -9.181 1.00 0.00 H new ATOM 679 N PHE A 50 0.623 -7.328 -6.514 1.00 0.00 N ATOM 680 CA PHE A 50 -0.167 -6.175 -6.100 1.00 0.00 C ATOM 681 C PHE A 50 0.306 -4.908 -6.807 1.00 0.00 C ATOM 682 O PHE A 50 1.392 -4.398 -6.530 1.00 0.00 O ATOM 683 CB PHE A 50 -0.080 -5.989 -4.583 1.00 0.00 C ATOM 684 CG PHE A 50 -1.117 -6.765 -3.823 1.00 0.00 C ATOM 685 CD1 PHE A 50 -0.962 -8.124 -3.605 1.00 0.00 C ATOM 686 CD2 PHE A 50 -2.247 -6.135 -3.327 1.00 0.00 C ATOM 687 CE1 PHE A 50 -1.916 -8.841 -2.907 1.00 0.00 C ATOM 688 CE2 PHE A 50 -3.204 -6.846 -2.628 1.00 0.00 C ATOM 689 CZ PHE A 50 -3.037 -8.201 -2.417 1.00 0.00 C ATOM 0 H PHE A 50 1.620 -7.250 -6.314 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.205 -6.359 -6.378 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.910 -6.293 -4.244 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.186 -4.930 -4.348 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -0.086 -8.629 -3.985 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -2.382 -5.076 -3.489 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.785 -9.901 -2.745 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -4.081 -6.343 -2.247 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.782 -8.759 -1.870 1.00 0.00 H new ATOM 699 N VAL A 51 -0.516 -4.406 -7.722 1.00 0.00 N ATOM 700 CA VAL A 51 -0.183 -3.199 -8.470 1.00 0.00 C ATOM 701 C VAL A 51 -0.597 -1.947 -7.704 1.00 0.00 C ATOM 702 O VAL A 51 -1.719 -1.853 -7.207 1.00 0.00 O ATOM 703 CB VAL A 51 -0.862 -3.190 -9.852 1.00 0.00 C ATOM 704 CG1 VAL A 51 -0.595 -1.875 -10.569 1.00 0.00 C ATOM 705 CG2 VAL A 51 -0.384 -4.369 -10.688 1.00 0.00 C ATOM 0 H VAL A 51 -1.418 -4.816 -7.964 1.00 0.00 H new ATOM 0 HA VAL A 51 0.899 -3.198 -8.605 1.00 0.00 H new ATOM 0 HB VAL A 51 -1.938 -3.287 -9.710 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.082 -1.887 -11.544 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.990 -1.050 -9.976 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.479 -1.745 -10.702 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.874 -4.347 -11.661 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.696 -4.305 -10.824 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -0.631 -5.300 -10.178 1.00 0.00 H new ATOM 715 N VAL A 52 0.317 -0.986 -7.614 1.00 0.00 N ATOM 716 CA VAL A 52 0.047 0.262 -6.911 1.00 0.00 C ATOM 717 C VAL A 52 -0.046 1.432 -7.884 1.00 0.00 C ATOM 718 O VAL A 52 0.719 1.515 -8.845 1.00 0.00 O ATOM 719 CB VAL A 52 1.137 0.564 -5.865 1.00 0.00 C ATOM 720 CG1 VAL A 52 2.504 0.648 -6.526 1.00 0.00 C ATOM 721 CG2 VAL A 52 0.816 1.849 -5.118 1.00 0.00 C ATOM 0 H VAL A 52 1.251 -1.048 -8.019 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.910 0.139 -6.403 1.00 0.00 H new ATOM 0 HB VAL A 52 1.160 -0.253 -5.143 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.261 0.862 -5.771 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.733 -0.301 -7.010 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.500 1.444 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.596 2.047 -4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.764 2.677 -5.825 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.143 1.745 -4.610 1.00 0.00 H new ATOM 731 N ARG A 53 -0.987 2.334 -7.627 1.00 0.00 N ATOM 732 CA ARG A 53 -1.181 3.500 -8.481 1.00 0.00 C ATOM 733 C ARG A 53 -1.913 4.608 -7.730 1.00 0.00 C ATOM 734 O ARG A 53 -2.923 4.361 -7.072 1.00 0.00 O ATOM 735 CB ARG A 53 -1.966 3.115 -9.736 1.00 0.00 C ATOM 736 CG ARG A 53 -2.106 4.248 -10.738 1.00 0.00 C ATOM 737 CD ARG A 53 -2.455 3.727 -12.124 1.00 0.00 C ATOM 738 NE ARG A 53 -1.299 3.137 -12.793 1.00 0.00 N ATOM 739 CZ ARG A 53 -0.407 3.844 -13.478 1.00 0.00 C ATOM 740 NH1 ARG A 53 -0.537 5.159 -13.583 1.00 0.00 N ATOM 741 NH2 ARG A 53 0.618 3.234 -14.060 1.00 0.00 N ATOM 0 H ARG A 53 -1.627 2.280 -6.835 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.199 3.871 -8.775 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.471 2.273 -10.220 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.960 2.776 -9.443 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.880 4.938 -10.402 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.174 4.812 -10.784 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -3.246 2.982 -12.043 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -2.847 4.544 -12.730 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.169 2.127 -12.731 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -1.324 5.631 -13.137 1.00 0.00 H new ATOM 0 HH12 ARG A 53 0.150 5.699 -14.110 1.00 0.00 H new ATOM 0 HH21 ARG A 53 0.721 2.222 -13.981 1.00 0.00 H new ATOM 0 HH22 ARG A 53 1.303 3.777 -14.586 1.00 0.00 H new ATOM 755 N GLN A 54 -1.396 5.828 -7.833 1.00 0.00 N ATOM 756 CA GLN A 54 -2.000 6.973 -7.163 1.00 0.00 C ATOM 757 C GLN A 54 -2.282 8.097 -8.153 1.00 0.00 C ATOM 758 O GLN A 54 -1.525 8.306 -9.101 1.00 0.00 O ATOM 759 CB GLN A 54 -1.085 7.478 -6.046 1.00 0.00 C ATOM 760 CG GLN A 54 -1.828 8.181 -4.921 1.00 0.00 C ATOM 761 CD GLN A 54 -1.026 8.235 -3.636 1.00 0.00 C ATOM 762 OE1 GLN A 54 -0.413 7.247 -3.231 1.00 0.00 O ATOM 763 NE2 GLN A 54 -1.024 9.394 -2.988 1.00 0.00 N ATOM 0 H GLN A 54 -0.560 6.049 -8.374 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.947 6.650 -6.729 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -0.531 6.635 -5.633 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.352 8.164 -6.470 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -2.076 9.196 -5.233 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.770 7.665 -4.735 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -1.546 10.187 -3.360 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -0.500 9.491 -2.118 1.00 0.00 H new ATOM 772 N GLU A 55 -3.377 8.818 -7.928 1.00 0.00 N ATOM 773 CA GLU A 55 -3.758 9.921 -8.802 1.00 0.00 C ATOM 774 C GLU A 55 -2.716 11.034 -8.760 1.00 0.00 C ATOM 775 O GLU A 55 -2.291 11.539 -9.799 1.00 0.00 O ATOM 776 CB GLU A 55 -5.127 10.472 -8.396 1.00 0.00 C ATOM 777 CG GLU A 55 -6.290 9.792 -9.098 1.00 0.00 C ATOM 778 CD GLU A 55 -7.625 10.101 -8.448 1.00 0.00 C ATOM 779 OE1 GLU A 55 -7.762 11.200 -7.870 1.00 0.00 O ATOM 780 OE2 GLU A 55 -8.531 9.246 -8.518 1.00 0.00 O ATOM 0 H GLU A 55 -4.015 8.658 -7.148 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.815 9.540 -9.822 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -5.249 10.361 -7.319 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -5.158 11.540 -8.612 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.316 10.109 -10.141 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.130 8.714 -9.096 1.00 0.00 H new ATOM 787 N GLN A 56 -2.309 11.411 -7.553 1.00 0.00 N ATOM 788 CA GLN A 56 -1.318 12.466 -7.375 1.00 0.00 C ATOM 789 C GLN A 56 -0.125 11.961 -6.571 1.00 0.00 C ATOM 790 O GLN A 56 0.692 12.747 -6.093 1.00 0.00 O ATOM 791 CB GLN A 56 -1.946 13.673 -6.677 1.00 0.00 C ATOM 792 CG GLN A 56 -3.326 14.031 -7.203 1.00 0.00 C ATOM 793 CD GLN A 56 -3.270 14.920 -8.430 1.00 0.00 C ATOM 794 OE1 GLN A 56 -3.550 14.477 -9.545 1.00 0.00 O ATOM 795 NE2 GLN A 56 -2.906 16.181 -8.232 1.00 0.00 N ATOM 0 H GLN A 56 -2.650 11.002 -6.683 1.00 0.00 H new ATOM 0 HA GLN A 56 -0.966 12.770 -8.361 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -2.016 13.469 -5.609 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -1.287 14.533 -6.795 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -3.867 13.116 -7.446 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -3.890 14.536 -6.419 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -2.683 16.506 -7.291 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -2.850 16.825 -9.021 1.00 0.00 H new ATOM 804 N GLY A 57 -0.030 10.643 -6.425 1.00 0.00 N ATOM 805 CA GLY A 57 1.066 10.056 -5.677 1.00 0.00 C ATOM 806 C GLY A 57 2.132 9.465 -6.578 1.00 0.00 C ATOM 807 O GLY A 57 3.035 8.770 -6.110 1.00 0.00 O ATOM 0 H GLY A 57 -0.693 9.971 -6.812 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.515 10.817 -5.039 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.678 9.278 -5.020 1.00 0.00 H new ATOM 811 N ASP A 58 2.028 9.740 -7.873 1.00 0.00 N ATOM 812 CA ASP A 58 2.991 9.230 -8.843 1.00 0.00 C ATOM 813 C ASP A 58 4.099 10.247 -9.095 1.00 0.00 C ATOM 814 O ASP A 58 5.180 9.898 -9.571 1.00 0.00 O ATOM 815 CB ASP A 58 2.289 8.885 -10.158 1.00 0.00 C ATOM 816 CG ASP A 58 3.248 8.353 -11.204 1.00 0.00 C ATOM 817 OD1 ASP A 58 4.340 7.880 -10.823 1.00 0.00 O ATOM 818 OD2 ASP A 58 2.907 8.408 -12.404 1.00 0.00 O ATOM 0 H ASP A 58 1.287 10.313 -8.276 1.00 0.00 H new ATOM 0 HA ASP A 58 3.440 8.326 -8.432 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.514 8.142 -9.969 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.791 9.774 -10.545 1.00 0.00 H new ATOM 823 N VAL A 59 3.823 11.507 -8.774 1.00 0.00 N ATOM 824 CA VAL A 59 4.797 12.575 -8.965 1.00 0.00 C ATOM 825 C VAL A 59 5.565 12.855 -7.678 1.00 0.00 C ATOM 826 O VAL A 59 6.769 13.118 -7.706 1.00 0.00 O ATOM 827 CB VAL A 59 4.118 13.875 -9.438 1.00 0.00 C ATOM 828 CG1 VAL A 59 3.033 14.297 -8.459 1.00 0.00 C ATOM 829 CG2 VAL A 59 5.149 14.980 -9.614 1.00 0.00 C ATOM 0 H VAL A 59 2.933 11.813 -8.381 1.00 0.00 H new ATOM 0 HA VAL A 59 5.492 12.236 -9.733 1.00 0.00 H new ATOM 0 HB VAL A 59 3.649 13.690 -10.404 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.565 15.217 -8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 59 2.281 13.511 -8.388 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.475 14.466 -7.477 1.00 0.00 H new ATOM 0 HG21 VAL A 59 4.653 15.891 -9.948 1.00 0.00 H new ATOM 0 HG22 VAL A 59 5.648 15.167 -8.663 1.00 0.00 H new ATOM 0 HG23 VAL A 59 5.886 14.675 -10.357 1.00 0.00 H new ATOM 839 N LEU A 60 4.864 12.797 -6.552 1.00 0.00 N ATOM 840 CA LEU A 60 5.480 13.044 -5.253 1.00 0.00 C ATOM 841 C LEU A 60 6.023 11.751 -4.654 1.00 0.00 C ATOM 842 O LEU A 60 5.758 10.659 -5.159 1.00 0.00 O ATOM 843 CB LEU A 60 4.466 13.676 -4.298 1.00 0.00 C ATOM 844 CG LEU A 60 3.200 12.862 -4.028 1.00 0.00 C ATOM 845 CD1 LEU A 60 3.400 11.943 -2.833 1.00 0.00 C ATOM 846 CD2 LEU A 60 2.011 13.785 -3.800 1.00 0.00 C ATOM 0 H LEU A 60 3.868 12.581 -6.512 1.00 0.00 H new ATOM 0 HA LEU A 60 6.312 13.733 -5.398 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.962 13.865 -3.346 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.172 14.645 -4.702 1.00 0.00 H new ATOM 0 HG LEU A 60 2.994 12.246 -4.903 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.488 11.372 -2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.224 11.258 -3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.631 12.539 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.119 13.189 -3.609 1.00 0.00 H new ATOM 0 HD22 LEU A 60 2.208 14.427 -2.942 1.00 0.00 H new ATOM 0 HD23 LEU A 60 1.853 14.401 -4.685 1.00 0.00 H new ATOM 858 N THR A 61 6.784 11.880 -3.571 1.00 0.00 N ATOM 859 CA THR A 61 7.364 10.723 -2.902 1.00 0.00 C ATOM 860 C THR A 61 6.672 10.454 -1.570 1.00 0.00 C ATOM 861 O THR A 61 6.748 11.263 -0.645 1.00 0.00 O ATOM 862 CB THR A 61 8.872 10.914 -2.654 1.00 0.00 C ATOM 863 OG1 THR A 61 9.333 9.969 -1.682 1.00 0.00 O ATOM 864 CG2 THR A 61 9.167 12.327 -2.175 1.00 0.00 C ATOM 0 H THR A 61 7.013 12.775 -3.139 1.00 0.00 H new ATOM 0 HA THR A 61 7.218 9.870 -3.564 1.00 0.00 H new ATOM 0 HB THR A 61 9.396 10.750 -3.596 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.207 9.060 -2.024 1.00 0.00 H new ATOM 0 HG21 THR A 61 10.238 12.438 -2.007 1.00 0.00 H new ATOM 0 HG22 THR A 61 8.842 13.042 -2.931 1.00 0.00 H new ATOM 0 HG23 THR A 61 8.632 12.515 -1.244 1.00 0.00 H new ATOM 872 N THR A 62 5.998 9.312 -1.479 1.00 0.00 N ATOM 873 CA THR A 62 5.292 8.937 -0.260 1.00 0.00 C ATOM 874 C THR A 62 5.613 7.501 0.142 1.00 0.00 C ATOM 875 O THR A 62 5.732 6.619 -0.709 1.00 0.00 O ATOM 876 CB THR A 62 3.768 9.082 -0.426 1.00 0.00 C ATOM 877 OG1 THR A 62 3.403 10.467 -0.404 1.00 0.00 O ATOM 878 CG2 THR A 62 3.030 8.341 0.678 1.00 0.00 C ATOM 0 H THR A 62 5.926 8.631 -2.235 1.00 0.00 H new ATOM 0 HA THR A 62 5.631 9.616 0.523 1.00 0.00 H new ATOM 0 HB THR A 62 3.486 8.647 -1.385 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.433 10.551 -0.512 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.955 8.458 0.539 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.287 7.283 0.641 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.318 8.751 1.646 1.00 0.00 H new ATOM 886 N LYS A 63 5.753 7.273 1.443 1.00 0.00 N ATOM 887 CA LYS A 63 6.059 5.944 1.959 1.00 0.00 C ATOM 888 C LYS A 63 4.785 5.126 2.144 1.00 0.00 C ATOM 889 O LYS A 63 3.801 5.609 2.705 1.00 0.00 O ATOM 890 CB LYS A 63 6.806 6.051 3.290 1.00 0.00 C ATOM 891 CG LYS A 63 8.248 6.505 3.143 1.00 0.00 C ATOM 892 CD LYS A 63 9.094 6.068 4.328 1.00 0.00 C ATOM 893 CE LYS A 63 10.548 6.477 4.156 1.00 0.00 C ATOM 894 NZ LYS A 63 11.105 6.010 2.856 1.00 0.00 N ATOM 0 H LYS A 63 5.659 7.992 2.160 1.00 0.00 H new ATOM 0 HA LYS A 63 6.694 5.437 1.233 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.278 6.750 3.938 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.788 5.081 3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 63 8.668 6.095 2.224 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.281 7.591 3.052 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.697 6.509 5.242 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.030 4.986 4.442 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.630 7.562 4.217 1.00 0.00 H new ATOM 0 HE3 LYS A 63 11.140 6.066 4.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.091 5.707 2.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 10.541 5.210 2.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.072 6.787 2.165 1.00 0.00 H new ATOM 908 N TYR A 64 4.810 3.886 1.669 1.00 0.00 N ATOM 909 CA TYR A 64 3.656 3.001 1.781 1.00 0.00 C ATOM 910 C TYR A 64 4.021 1.722 2.528 1.00 0.00 C ATOM 911 O TYR A 64 5.081 1.139 2.300 1.00 0.00 O ATOM 912 CB TYR A 64 3.114 2.657 0.393 1.00 0.00 C ATOM 913 CG TYR A 64 3.066 3.840 -0.548 1.00 0.00 C ATOM 914 CD1 TYR A 64 1.971 4.695 -0.565 1.00 0.00 C ATOM 915 CD2 TYR A 64 4.115 4.101 -1.421 1.00 0.00 C ATOM 916 CE1 TYR A 64 1.922 5.776 -1.424 1.00 0.00 C ATOM 917 CE2 TYR A 64 4.075 5.181 -2.282 1.00 0.00 C ATOM 918 CZ TYR A 64 2.977 6.015 -2.280 1.00 0.00 C ATOM 919 OH TYR A 64 2.933 7.091 -3.137 1.00 0.00 O ATOM 0 H TYR A 64 5.616 3.471 1.203 1.00 0.00 H new ATOM 0 HA TYR A 64 2.884 3.523 2.346 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.736 1.878 -0.048 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.110 2.244 0.496 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.144 4.511 0.105 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.976 3.449 -1.427 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.063 6.430 -1.425 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.900 5.371 -2.953 1.00 0.00 H new ATOM 0 HH TYR A 64 3.754 7.118 -3.671 1.00 0.00 H new ATOM 929 N GLN A 65 3.135 1.291 3.420 1.00 0.00 N ATOM 930 CA GLN A 65 3.363 0.081 4.200 1.00 0.00 C ATOM 931 C GLN A 65 2.527 -1.077 3.666 1.00 0.00 C ATOM 932 O GLN A 65 1.298 -1.043 3.714 1.00 0.00 O ATOM 933 CB GLN A 65 3.030 0.329 5.673 1.00 0.00 C ATOM 934 CG GLN A 65 3.261 -0.883 6.561 1.00 0.00 C ATOM 935 CD GLN A 65 2.890 -0.626 8.008 1.00 0.00 C ATOM 936 OE1 GLN A 65 1.783 -0.944 8.443 1.00 0.00 O ATOM 937 NE2 GLN A 65 3.816 -0.047 8.763 1.00 0.00 N ATOM 0 H GLN A 65 2.253 1.762 3.620 1.00 0.00 H new ATOM 0 HA GLN A 65 4.416 -0.185 4.112 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.635 1.158 6.039 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.987 0.635 5.755 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.676 -1.722 6.184 1.00 0.00 H new ATOM 0 HG3 GLN A 65 4.310 -1.175 6.505 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.720 0.200 8.361 1.00 0.00 H new ATOM 0 HE22 GLN A 65 3.623 0.151 9.745 1.00 0.00 H new ATOM 946 N VAL A 66 3.203 -2.102 3.156 1.00 0.00 N ATOM 947 CA VAL A 66 2.523 -3.272 2.613 1.00 0.00 C ATOM 948 C VAL A 66 2.284 -4.320 3.694 1.00 0.00 C ATOM 949 O VAL A 66 3.189 -5.074 4.053 1.00 0.00 O ATOM 950 CB VAL A 66 3.331 -3.908 1.466 1.00 0.00 C ATOM 951 CG1 VAL A 66 2.627 -5.151 0.942 1.00 0.00 C ATOM 952 CG2 VAL A 66 3.553 -2.900 0.348 1.00 0.00 C ATOM 0 H VAL A 66 4.221 -2.146 3.108 1.00 0.00 H new ATOM 0 HA VAL A 66 1.564 -2.929 2.225 1.00 0.00 H new ATOM 0 HB VAL A 66 4.305 -4.207 1.853 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.212 -5.587 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.525 -5.878 1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.639 -4.880 0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.125 -3.366 -0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.590 -2.568 -0.039 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.103 -2.042 0.735 1.00 0.00 H new ATOM 962 N ASP A 67 1.060 -4.362 4.208 1.00 0.00 N ATOM 963 CA ASP A 67 0.700 -5.319 5.248 1.00 0.00 C ATOM 964 C ASP A 67 -0.156 -6.446 4.677 1.00 0.00 C ATOM 965 O ASP A 67 -1.318 -6.239 4.326 1.00 0.00 O ATOM 966 CB ASP A 67 -0.049 -4.616 6.381 1.00 0.00 C ATOM 967 CG ASP A 67 -0.794 -5.589 7.274 1.00 0.00 C ATOM 968 OD1 ASP A 67 -0.154 -6.528 7.793 1.00 0.00 O ATOM 969 OD2 ASP A 67 -2.017 -5.412 7.454 1.00 0.00 O ATOM 0 H ASP A 67 0.300 -3.745 3.922 1.00 0.00 H new ATOM 0 HA ASP A 67 1.619 -5.751 5.644 1.00 0.00 H new ATOM 0 HB2 ASP A 67 0.659 -4.045 6.982 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.755 -3.902 5.958 1.00 0.00 H new ATOM 974 N LEU A 68 0.426 -7.636 4.587 1.00 0.00 N ATOM 975 CA LEU A 68 -0.283 -8.796 4.057 1.00 0.00 C ATOM 976 C LEU A 68 -1.303 -9.317 5.064 1.00 0.00 C ATOM 977 O LEU A 68 -2.443 -9.614 4.711 1.00 0.00 O ATOM 978 CB LEU A 68 0.709 -9.905 3.699 1.00 0.00 C ATOM 979 CG LEU A 68 1.504 -9.702 2.409 1.00 0.00 C ATOM 980 CD1 LEU A 68 0.647 -10.031 1.196 1.00 0.00 C ATOM 981 CD2 LEU A 68 2.028 -8.276 2.323 1.00 0.00 C ATOM 0 H LEU A 68 1.387 -7.824 4.874 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.814 -8.487 3.157 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.414 -10.015 4.523 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.161 -10.844 3.621 1.00 0.00 H new ATOM 0 HG LEU A 68 2.357 -10.381 2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.230 -9.881 0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.322 -11.070 1.251 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.226 -9.378 1.179 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.591 -8.150 1.398 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.190 -7.579 2.335 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.679 -8.076 3.174 1.00 0.00 H new ATOM 993 N GLY A 69 -0.885 -9.423 6.322 1.00 0.00 N ATOM 994 CA GLY A 69 -1.775 -9.906 7.362 1.00 0.00 C ATOM 995 C GLY A 69 -1.396 -11.288 7.854 1.00 0.00 C ATOM 996 O GLY A 69 -1.374 -11.541 9.058 1.00 0.00 O ATOM 0 H GLY A 69 0.054 -9.183 6.639 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.761 -9.209 8.200 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -2.796 -9.927 6.981 1.00 0.00 H new ATOM 1000 N ASP A 70 -1.099 -12.186 6.921 1.00 0.00 N ATOM 1001 CA ASP A 70 -0.719 -13.551 7.266 1.00 0.00 C ATOM 1002 C ASP A 70 0.548 -13.564 8.116 1.00 0.00 C ATOM 1003 O ASP A 70 0.776 -14.490 8.893 1.00 0.00 O ATOM 1004 CB ASP A 70 -0.506 -14.380 5.998 1.00 0.00 C ATOM 1005 CG ASP A 70 0.429 -15.552 6.223 1.00 0.00 C ATOM 1006 OD1 ASP A 70 -0.052 -16.619 6.658 1.00 0.00 O ATOM 1007 OD2 ASP A 70 1.642 -15.402 5.965 1.00 0.00 O ATOM 0 H ASP A 70 -1.114 -11.993 5.920 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.529 -13.992 7.847 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.468 -14.749 5.643 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.101 -13.741 5.213 1.00 0.00 H new ATOM 1012 N GLY A 71 1.369 -12.530 7.961 1.00 0.00 N ATOM 1013 CA GLY A 71 2.603 -12.443 8.720 1.00 0.00 C ATOM 1014 C GLY A 71 3.684 -11.677 7.984 1.00 0.00 C ATOM 1015 O GLY A 71 4.668 -11.244 8.584 1.00 0.00 O ATOM 0 H GLY A 71 1.202 -11.751 7.324 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.405 -11.958 9.676 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.961 -13.448 8.942 1.00 0.00 H new ATOM 1019 N PHE A 72 3.503 -11.510 6.678 1.00 0.00 N ATOM 1020 CA PHE A 72 4.473 -10.793 5.857 1.00 0.00 C ATOM 1021 C PHE A 72 4.223 -9.289 5.910 1.00 0.00 C ATOM 1022 O PHE A 72 3.147 -8.813 5.550 1.00 0.00 O ATOM 1023 CB PHE A 72 4.407 -11.282 4.409 1.00 0.00 C ATOM 1024 CG PHE A 72 5.556 -10.810 3.564 1.00 0.00 C ATOM 1025 CD1 PHE A 72 6.834 -11.305 3.772 1.00 0.00 C ATOM 1026 CD2 PHE A 72 5.358 -9.874 2.563 1.00 0.00 C ATOM 1027 CE1 PHE A 72 7.893 -10.872 2.997 1.00 0.00 C ATOM 1028 CE2 PHE A 72 6.414 -9.437 1.784 1.00 0.00 C ATOM 1029 CZ PHE A 72 7.683 -9.938 2.001 1.00 0.00 C ATOM 0 H PHE A 72 2.694 -11.861 6.165 1.00 0.00 H new ATOM 0 HA PHE A 72 5.468 -10.992 6.255 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.385 -12.372 4.403 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.473 -10.942 3.961 1.00 0.00 H new ATOM 0 HD1 PHE A 72 7.004 -12.037 4.548 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.367 -9.481 2.389 1.00 0.00 H new ATOM 0 HE1 PHE A 72 8.885 -11.264 3.170 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.247 -8.705 1.007 1.00 0.00 H new ATOM 0 HZ PHE A 72 8.509 -9.600 1.393 1.00 0.00 H new ATOM 1039 N LYS A 73 5.227 -8.545 6.363 1.00 0.00 N ATOM 1040 CA LYS A 73 5.119 -7.094 6.463 1.00 0.00 C ATOM 1041 C LYS A 73 6.427 -6.422 6.058 1.00 0.00 C ATOM 1042 O LYS A 73 7.503 -6.815 6.508 1.00 0.00 O ATOM 1043 CB LYS A 73 4.745 -6.687 7.890 1.00 0.00 C ATOM 1044 CG LYS A 73 3.339 -7.098 8.291 1.00 0.00 C ATOM 1045 CD LYS A 73 2.859 -6.326 9.509 1.00 0.00 C ATOM 1046 CE LYS A 73 3.306 -6.992 10.802 1.00 0.00 C ATOM 1047 NZ LYS A 73 4.733 -6.700 11.112 1.00 0.00 N ATOM 0 H LYS A 73 6.124 -8.923 6.667 1.00 0.00 H new ATOM 0 HA LYS A 73 4.335 -6.765 5.781 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.457 -7.133 8.584 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.840 -5.605 7.987 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.657 -6.926 7.458 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.318 -8.167 8.505 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.245 -5.307 9.471 1.00 0.00 H new ATOM 0 HD3 LYS A 73 1.771 -6.256 9.491 1.00 0.00 H new ATOM 0 HE2 LYS A 73 2.678 -6.648 11.624 1.00 0.00 H new ATOM 0 HE3 LYS A 73 3.165 -8.070 10.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 4.861 -6.651 12.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.334 -7.455 10.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.002 -5.790 10.686 1.00 0.00 H new ATOM 1061 N ALA A 74 6.327 -5.406 5.207 1.00 0.00 N ATOM 1062 CA ALA A 74 7.501 -4.678 4.745 1.00 0.00 C ATOM 1063 C ALA A 74 7.160 -3.224 4.436 1.00 0.00 C ATOM 1064 O ALA A 74 5.990 -2.841 4.424 1.00 0.00 O ATOM 1065 CB ALA A 74 8.092 -5.355 3.517 1.00 0.00 C ATOM 0 H ALA A 74 5.444 -5.069 4.824 1.00 0.00 H new ATOM 0 HA ALA A 74 8.242 -4.688 5.545 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.969 -4.800 3.182 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.382 -6.375 3.768 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.349 -5.375 2.720 1.00 0.00 H new ATOM 1071 N MET A 75 8.188 -2.419 4.189 1.00 0.00 N ATOM 1072 CA MET A 75 7.995 -1.007 3.880 1.00 0.00 C ATOM 1073 C MET A 75 8.449 -0.694 2.458 1.00 0.00 C ATOM 1074 O MET A 75 9.600 -0.940 2.095 1.00 0.00 O ATOM 1075 CB MET A 75 8.763 -0.136 4.876 1.00 0.00 C ATOM 1076 CG MET A 75 8.520 1.354 4.694 1.00 0.00 C ATOM 1077 SD MET A 75 9.929 2.355 5.206 1.00 0.00 S ATOM 1078 CE MET A 75 10.992 2.201 3.772 1.00 0.00 C ATOM 0 H MET A 75 9.163 -2.720 4.197 1.00 0.00 H new ATOM 0 HA MET A 75 6.931 -0.786 3.959 1.00 0.00 H new ATOM 0 HB2 MET A 75 8.480 -0.421 5.889 1.00 0.00 H new ATOM 0 HB3 MET A 75 9.830 -0.337 4.775 1.00 0.00 H new ATOM 0 HG2 MET A 75 8.297 1.556 3.646 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.642 1.648 5.269 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.909 2.768 3.936 1.00 0.00 H new ATOM 0 HE2 MET A 75 11.238 1.151 3.613 1.00 0.00 H new ATOM 0 HE3 MET A 75 10.477 2.590 2.894 1.00 0.00 H new ATOM 1088 N TYR A 76 7.539 -0.152 1.657 1.00 0.00 N ATOM 1089 CA TYR A 76 7.846 0.191 0.273 1.00 0.00 C ATOM 1090 C TYR A 76 7.779 1.700 0.059 1.00 0.00 C ATOM 1091 O TYR A 76 6.785 2.344 0.395 1.00 0.00 O ATOM 1092 CB TYR A 76 6.875 -0.513 -0.676 1.00 0.00 C ATOM 1093 CG TYR A 76 6.973 -2.022 -0.632 1.00 0.00 C ATOM 1094 CD1 TYR A 76 6.731 -2.719 0.545 1.00 0.00 C ATOM 1095 CD2 TYR A 76 7.309 -2.749 -1.767 1.00 0.00 C ATOM 1096 CE1 TYR A 76 6.820 -4.097 0.590 1.00 0.00 C ATOM 1097 CE2 TYR A 76 7.398 -4.127 -1.732 1.00 0.00 C ATOM 1098 CZ TYR A 76 7.153 -4.796 -0.551 1.00 0.00 C ATOM 1099 OH TYR A 76 7.243 -6.169 -0.511 1.00 0.00 O ATOM 0 H TYR A 76 6.583 0.059 1.942 1.00 0.00 H new ATOM 0 HA TYR A 76 8.861 -0.144 0.058 1.00 0.00 H new ATOM 0 HB2 TYR A 76 5.856 -0.216 -0.426 1.00 0.00 H new ATOM 0 HB3 TYR A 76 7.065 -0.174 -1.694 1.00 0.00 H new ATOM 0 HD1 TYR A 76 6.469 -2.174 1.440 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.504 -2.228 -2.693 1.00 0.00 H new ATOM 0 HE1 TYR A 76 6.630 -4.624 1.514 1.00 0.00 H new ATOM 0 HE2 TYR A 76 7.658 -4.677 -2.624 1.00 0.00 H new ATOM 0 HH TYR A 76 7.486 -6.507 -1.398 1.00 0.00 H new ATOM 1109 N VAL A 77 8.845 2.259 -0.505 1.00 0.00 N ATOM 1110 CA VAL A 77 8.909 3.692 -0.767 1.00 0.00 C ATOM 1111 C VAL A 77 9.019 3.973 -2.262 1.00 0.00 C ATOM 1112 O VAL A 77 9.666 3.229 -2.997 1.00 0.00 O ATOM 1113 CB VAL A 77 10.103 4.342 -0.044 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.416 3.795 -0.584 1.00 0.00 C ATOM 1115 CG2 VAL A 77 10.050 5.856 -0.184 1.00 0.00 C ATOM 0 H VAL A 77 9.676 1.741 -0.789 1.00 0.00 H new ATOM 0 HA VAL A 77 7.984 4.125 -0.386 1.00 0.00 H new ATOM 0 HB VAL A 77 10.042 4.095 1.016 1.00 0.00 H new ATOM 0 HG11 VAL A 77 12.249 4.266 -0.061 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.453 2.717 -0.428 1.00 0.00 H new ATOM 0 HG13 VAL A 77 11.489 4.010 -1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.901 6.299 0.333 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.086 6.125 -1.240 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.125 6.230 0.254 1.00 0.00 H new ATOM 1125 N ASN A 78 8.382 5.053 -2.704 1.00 0.00 N ATOM 1126 CA ASN A 78 8.408 5.433 -4.112 1.00 0.00 C ATOM 1127 C ASN A 78 7.970 4.270 -4.997 1.00 0.00 C ATOM 1128 O ASN A 78 8.464 4.106 -6.114 1.00 0.00 O ATOM 1129 CB ASN A 78 9.812 5.892 -4.511 1.00 0.00 C ATOM 1130 CG ASN A 78 10.337 6.996 -3.613 1.00 0.00 C ATOM 1131 OD1 ASN A 78 9.573 7.650 -2.904 1.00 0.00 O ATOM 1132 ND2 ASN A 78 11.648 7.207 -3.640 1.00 0.00 N ATOM 0 H ASN A 78 7.842 5.680 -2.108 1.00 0.00 H new ATOM 0 HA ASN A 78 7.709 6.257 -4.254 1.00 0.00 H new ATOM 0 HB2 ASN A 78 10.493 5.042 -4.473 1.00 0.00 H new ATOM 0 HB3 ASN A 78 9.797 6.243 -5.543 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.059 7.936 -3.057 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.243 6.640 -4.244 1.00 0.00 H new ATOM 1139 N LEU A 79 7.041 3.467 -4.492 1.00 0.00 N ATOM 1140 CA LEU A 79 6.535 2.319 -5.237 1.00 0.00 C ATOM 1141 C LEU A 79 5.909 2.759 -6.556 1.00 0.00 C ATOM 1142 O LEU A 79 6.188 2.186 -7.610 1.00 0.00 O ATOM 1143 CB LEU A 79 5.506 1.557 -4.400 1.00 0.00 C ATOM 1144 CG LEU A 79 5.267 0.099 -4.794 1.00 0.00 C ATOM 1145 CD1 LEU A 79 6.573 -0.681 -4.771 1.00 0.00 C ATOM 1146 CD2 LEU A 79 4.244 -0.543 -3.869 1.00 0.00 C ATOM 0 H LEU A 79 6.622 3.589 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 79 7.375 1.660 -5.457 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.824 1.583 -3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.556 2.088 -4.457 1.00 0.00 H new ATOM 0 HG LEU A 79 4.872 0.077 -5.810 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.383 -1.716 -5.054 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.276 -0.235 -5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 79 6.997 -0.651 -3.767 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.087 -1.580 -4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.610 -0.510 -2.843 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.301 0.000 -3.936 1.00 0.00 H new ATOM 1158 N THR A 80 5.063 3.782 -6.492 1.00 0.00 N ATOM 1159 CA THR A 80 4.399 4.301 -7.681 1.00 0.00 C ATOM 1160 C THR A 80 5.410 4.853 -8.679 1.00 0.00 C ATOM 1161 O THR A 80 5.097 5.041 -9.855 1.00 0.00 O ATOM 1162 CB THR A 80 3.390 5.408 -7.323 1.00 0.00 C ATOM 1163 OG1 THR A 80 4.073 6.525 -6.744 1.00 0.00 O ATOM 1164 CG2 THR A 80 2.340 4.890 -6.352 1.00 0.00 C ATOM 0 H THR A 80 4.821 4.268 -5.628 1.00 0.00 H new ATOM 0 HA THR A 80 3.865 3.466 -8.134 1.00 0.00 H new ATOM 0 HB THR A 80 2.890 5.723 -8.239 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.423 7.119 -6.315 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.639 5.690 -6.114 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.802 4.059 -6.808 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.826 4.550 -5.438 1.00 0.00 H new ATOM 1172 N LEU A 81 6.623 5.111 -8.203 1.00 0.00 N ATOM 1173 CA LEU A 81 7.682 5.642 -9.055 1.00 0.00 C ATOM 1174 C LEU A 81 8.408 4.518 -9.786 1.00 0.00 C ATOM 1175 O LEU A 81 8.478 4.504 -11.015 1.00 0.00 O ATOM 1176 CB LEU A 81 8.677 6.451 -8.221 1.00 0.00 C ATOM 1177 CG LEU A 81 9.601 7.387 -9.000 1.00 0.00 C ATOM 1178 CD1 LEU A 81 10.114 8.501 -8.101 1.00 0.00 C ATOM 1179 CD2 LEU A 81 10.762 6.610 -9.604 1.00 0.00 C ATOM 0 H LEU A 81 6.898 4.961 -7.232 1.00 0.00 H new ATOM 0 HA LEU A 81 7.224 6.296 -9.797 1.00 0.00 H new ATOM 0 HB2 LEU A 81 8.117 7.045 -7.499 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.294 5.755 -7.652 1.00 0.00 H new ATOM 0 HG LEU A 81 9.029 7.837 -9.812 1.00 0.00 H new ATOM 0 HD11 LEU A 81 10.770 9.157 -8.673 1.00 0.00 H new ATOM 0 HD12 LEU A 81 9.271 9.076 -7.717 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.669 8.070 -7.268 1.00 0.00 H new ATOM 0 HD21 LEU A 81 11.409 7.293 -10.155 1.00 0.00 H new ATOM 0 HD22 LEU A 81 11.333 6.132 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU A 81 10.377 5.849 -10.282 1.00 0.00 H new ATOM 1191 N THR A 82 8.947 3.573 -9.021 1.00 0.00 N ATOM 1192 CA THR A 82 9.667 2.443 -9.595 1.00 0.00 C ATOM 1193 C THR A 82 8.739 1.566 -10.428 1.00 0.00 C ATOM 1194 O THR A 82 9.171 0.922 -11.383 1.00 0.00 O ATOM 1195 CB THR A 82 10.324 1.581 -8.500 1.00 0.00 C ATOM 1196 OG1 THR A 82 9.322 0.851 -7.784 1.00 0.00 O ATOM 1197 CG2 THR A 82 11.116 2.448 -7.533 1.00 0.00 C ATOM 0 H THR A 82 8.898 3.568 -8.002 1.00 0.00 H new ATOM 0 HA THR A 82 10.445 2.857 -10.237 1.00 0.00 H new ATOM 0 HB THR A 82 11.008 0.881 -8.980 1.00 0.00 H new ATOM 0 HG1 THR A 82 9.748 0.304 -7.091 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.571 1.818 -6.769 1.00 0.00 H new ATOM 0 HG22 THR A 82 11.897 2.980 -8.077 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.449 3.168 -7.060 1.00 0.00 H new ATOM 1205 N GLY A 83 7.462 1.546 -10.059 1.00 0.00 N ATOM 1206 CA GLY A 83 6.493 0.744 -10.784 1.00 0.00 C ATOM 1207 C GLY A 83 6.519 -0.713 -10.368 1.00 0.00 C ATOM 1208 O GLY A 83 5.479 -1.368 -10.311 1.00 0.00 O ATOM 0 H GLY A 83 7.081 2.070 -9.271 1.00 0.00 H new ATOM 0 HA2 GLY A 83 5.494 1.148 -10.618 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.693 0.817 -11.853 1.00 0.00 H new ATOM 1212 N GLU A 84 7.712 -1.223 -10.076 1.00 0.00 N ATOM 1213 CA GLU A 84 7.869 -2.613 -9.666 1.00 0.00 C ATOM 1214 C GLU A 84 6.733 -3.038 -8.739 1.00 0.00 C ATOM 1215 O GLU A 84 6.468 -2.411 -7.713 1.00 0.00 O ATOM 1216 CB GLU A 84 9.215 -2.813 -8.966 1.00 0.00 C ATOM 1217 CG GLU A 84 10.390 -2.916 -9.925 1.00 0.00 C ATOM 1218 CD GLU A 84 10.652 -4.339 -10.375 1.00 0.00 C ATOM 1219 OE1 GLU A 84 9.826 -4.881 -11.139 1.00 0.00 O ATOM 1220 OE2 GLU A 84 11.683 -4.912 -9.964 1.00 0.00 O ATOM 0 H GLU A 84 8.583 -0.694 -10.116 1.00 0.00 H new ATOM 0 HA GLU A 84 7.837 -3.235 -10.561 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.387 -1.982 -8.282 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.170 -3.719 -8.361 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.197 -2.292 -10.798 1.00 0.00 H new ATOM 0 HG3 GLU A 84 11.284 -2.521 -9.442 1.00 0.00 H new ATOM 1227 N PRO A 85 6.046 -4.129 -9.107 1.00 0.00 N ATOM 1228 CA PRO A 85 4.928 -4.662 -8.323 1.00 0.00 C ATOM 1229 C PRO A 85 5.385 -5.276 -7.005 1.00 0.00 C ATOM 1230 O PRO A 85 6.567 -5.222 -6.661 1.00 0.00 O ATOM 1231 CB PRO A 85 4.335 -5.738 -9.237 1.00 0.00 C ATOM 1232 CG PRO A 85 5.466 -6.156 -10.113 1.00 0.00 C ATOM 1233 CD PRO A 85 6.307 -4.926 -10.318 1.00 0.00 C ATOM 0 HA PRO A 85 4.219 -3.883 -8.043 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.949 -6.579 -8.660 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.504 -5.346 -9.823 1.00 0.00 H new ATOM 0 HG2 PRO A 85 6.046 -6.953 -9.648 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.101 -6.542 -11.065 1.00 0.00 H new ATOM 0 HD2 PRO A 85 7.364 -5.174 -10.416 1.00 0.00 H new ATOM 0 HD3 PRO A 85 6.020 -4.389 -11.222 1.00 0.00 H new ATOM 1241 N ILE A 86 4.444 -5.860 -6.271 1.00 0.00 N ATOM 1242 CA ILE A 86 4.752 -6.485 -4.991 1.00 0.00 C ATOM 1243 C ILE A 86 4.551 -7.995 -5.054 1.00 0.00 C ATOM 1244 O ILE A 86 3.422 -8.484 -5.013 1.00 0.00 O ATOM 1245 CB ILE A 86 3.880 -5.910 -3.859 1.00 0.00 C ATOM 1246 CG1 ILE A 86 4.346 -4.499 -3.494 1.00 0.00 C ATOM 1247 CG2 ILE A 86 3.925 -6.820 -2.641 1.00 0.00 C ATOM 1248 CD1 ILE A 86 3.251 -3.634 -2.908 1.00 0.00 C ATOM 0 H ILE A 86 3.462 -5.913 -6.541 1.00 0.00 H new ATOM 0 HA ILE A 86 5.799 -6.268 -4.778 1.00 0.00 H new ATOM 0 HB ILE A 86 2.849 -5.853 -4.208 1.00 0.00 H new ATOM 0 HG12 ILE A 86 5.165 -4.569 -2.778 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.743 -4.014 -4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.304 -6.400 -1.850 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.551 -7.808 -2.911 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.953 -6.906 -2.288 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.653 -2.648 -2.673 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.441 -3.533 -3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 86 2.870 -4.097 -1.998 1.00 0.00 H new ATOM 1260 N ARG A 87 5.654 -8.730 -5.153 1.00 0.00 N ATOM 1261 CA ARG A 87 5.600 -10.185 -5.222 1.00 0.00 C ATOM 1262 C ARG A 87 5.288 -10.783 -3.853 1.00 0.00 C ATOM 1263 O ARG A 87 5.815 -10.334 -2.834 1.00 0.00 O ATOM 1264 CB ARG A 87 6.926 -10.742 -5.743 1.00 0.00 C ATOM 1265 CG ARG A 87 6.798 -12.110 -6.393 1.00 0.00 C ATOM 1266 CD ARG A 87 8.016 -12.440 -7.242 1.00 0.00 C ATOM 1267 NE ARG A 87 9.153 -12.859 -6.428 1.00 0.00 N ATOM 1268 CZ ARG A 87 10.168 -13.577 -6.896 1.00 0.00 C ATOM 1269 NH1 ARG A 87 10.186 -13.954 -8.167 1.00 0.00 N ATOM 1270 NH2 ARG A 87 11.167 -13.920 -6.093 1.00 0.00 N ATOM 0 H ARG A 87 6.596 -8.341 -5.187 1.00 0.00 H new ATOM 0 HA ARG A 87 4.802 -10.461 -5.911 1.00 0.00 H new ATOM 0 HB2 ARG A 87 7.345 -10.043 -6.467 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.633 -10.807 -4.916 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.674 -12.870 -5.622 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.902 -12.137 -7.014 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.763 -13.232 -7.946 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.294 -11.566 -7.831 1.00 0.00 H new ATOM 0 HE ARG A 87 9.169 -12.585 -5.446 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.420 -13.693 -8.787 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.966 -14.505 -8.524 1.00 0.00 H new ATOM 0 HH21 ARG A 87 11.157 -13.632 -5.114 1.00 0.00 H new ATOM 0 HH22 ARG A 87 11.945 -14.471 -6.454 1.00 0.00 H new ATOM 1284 N HIS A 88 4.428 -11.796 -3.837 1.00 0.00 N ATOM 1285 CA HIS A 88 4.047 -12.455 -2.593 1.00 0.00 C ATOM 1286 C HIS A 88 3.359 -13.788 -2.873 1.00 0.00 C ATOM 1287 O HIS A 88 2.799 -13.994 -3.950 1.00 0.00 O ATOM 1288 CB HIS A 88 3.121 -11.553 -1.776 1.00 0.00 C ATOM 1289 CG HIS A 88 2.759 -12.120 -0.438 1.00 0.00 C ATOM 1290 ND1 HIS A 88 3.579 -12.027 0.666 1.00 0.00 N ATOM 1291 CD2 HIS A 88 1.656 -12.790 -0.030 1.00 0.00 C ATOM 1292 CE1 HIS A 88 2.997 -12.616 1.695 1.00 0.00 C ATOM 1293 NE2 HIS A 88 1.828 -13.087 1.300 1.00 0.00 N ATOM 0 H HIS A 88 3.982 -12.178 -4.671 1.00 0.00 H new ATOM 0 HA HIS A 88 4.954 -12.647 -2.020 1.00 0.00 H new ATOM 0 HB2 HIS A 88 3.603 -10.586 -1.633 1.00 0.00 H new ATOM 0 HB3 HIS A 88 2.208 -11.373 -2.344 1.00 0.00 H new ATOM 0 HD2 HIS A 88 0.800 -13.044 -0.637 1.00 0.00 H new ATOM 0 HE1 HIS A 88 3.407 -12.698 2.691 1.00 0.00 H new ATOM 0 HE2 HIS A 88 1.162 -13.589 1.887 1.00 0.00 H new ATOM 1302 N ARG A 89 3.407 -14.690 -1.898 1.00 0.00 N ATOM 1303 CA ARG A 89 2.791 -16.003 -2.041 1.00 0.00 C ATOM 1304 C ARG A 89 2.174 -16.460 -0.722 1.00 0.00 C ATOM 1305 O ARG A 89 2.595 -16.034 0.353 1.00 0.00 O ATOM 1306 CB ARG A 89 3.825 -17.026 -2.514 1.00 0.00 C ATOM 1307 CG ARG A 89 3.264 -18.431 -2.670 1.00 0.00 C ATOM 1308 CD ARG A 89 4.369 -19.447 -2.911 1.00 0.00 C ATOM 1309 NE ARG A 89 4.932 -19.951 -1.661 1.00 0.00 N ATOM 1310 CZ ARG A 89 5.559 -21.117 -1.555 1.00 0.00 C ATOM 1311 NH1 ARG A 89 5.703 -21.896 -2.619 1.00 0.00 N ATOM 1312 NH2 ARG A 89 6.045 -21.507 -0.383 1.00 0.00 N ATOM 0 H ARG A 89 3.866 -14.535 -1.001 1.00 0.00 H new ATOM 0 HA ARG A 89 1.999 -15.926 -2.786 1.00 0.00 H new ATOM 0 HB2 ARG A 89 4.236 -16.700 -3.469 1.00 0.00 H new ATOM 0 HB3 ARG A 89 4.651 -17.050 -1.803 1.00 0.00 H new ATOM 0 HG2 ARG A 89 2.707 -18.703 -1.774 1.00 0.00 H new ATOM 0 HG3 ARG A 89 2.560 -18.453 -3.502 1.00 0.00 H new ATOM 0 HD2 ARG A 89 3.975 -20.280 -3.493 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.159 -18.989 -3.506 1.00 0.00 H new ATOM 0 HE ARG A 89 4.839 -19.376 -0.824 1.00 0.00 H new ATOM 0 HH11 ARG A 89 5.332 -21.600 -3.522 1.00 0.00 H new ATOM 0 HH12 ARG A 89 6.185 -22.791 -2.534 1.00 0.00 H new ATOM 0 HH21 ARG A 89 5.937 -20.911 0.438 1.00 0.00 H new ATOM 0 HH22 ARG A 89 6.526 -22.403 -0.303 1.00 0.00 H new ATOM 1326 N TYR A 90 1.173 -17.329 -0.813 1.00 0.00 N ATOM 1327 CA TYR A 90 0.496 -17.842 0.372 1.00 0.00 C ATOM 1328 C TYR A 90 0.745 -19.338 0.537 1.00 0.00 C ATOM 1329 O TYR A 90 1.009 -20.045 -0.435 1.00 0.00 O ATOM 1330 CB TYR A 90 -1.007 -17.571 0.284 1.00 0.00 C ATOM 1331 CG TYR A 90 -1.360 -16.101 0.314 1.00 0.00 C ATOM 1332 CD1 TYR A 90 -0.838 -15.261 1.291 1.00 0.00 C ATOM 1333 CD2 TYR A 90 -2.214 -15.551 -0.634 1.00 0.00 C ATOM 1334 CE1 TYR A 90 -1.158 -13.918 1.323 1.00 0.00 C ATOM 1335 CE2 TYR A 90 -2.538 -14.209 -0.610 1.00 0.00 C ATOM 1336 CZ TYR A 90 -2.008 -13.396 0.370 1.00 0.00 C ATOM 1337 OH TYR A 90 -2.329 -12.058 0.398 1.00 0.00 O ATOM 0 H TYR A 90 0.813 -17.693 -1.695 1.00 0.00 H new ATOM 0 HA TYR A 90 0.901 -17.326 1.242 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -1.394 -18.010 -0.636 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.507 -18.073 1.112 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.171 -15.666 2.038 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.632 -16.184 -1.403 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.745 -13.280 2.090 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.203 -13.798 -1.355 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.937 -11.852 -0.342 1.00 0.00 H new ATOM 1347 N GLU A 91 0.658 -19.813 1.776 1.00 0.00 N ATOM 1348 CA GLU A 91 0.874 -21.225 2.069 1.00 0.00 C ATOM 1349 C GLU A 91 -0.450 -21.984 2.092 1.00 0.00 C ATOM 1350 O GLU A 91 -0.593 -23.024 1.449 1.00 0.00 O ATOM 1351 CB GLU A 91 1.591 -21.386 3.411 1.00 0.00 C ATOM 1352 CG GLU A 91 2.100 -22.795 3.664 1.00 0.00 C ATOM 1353 CD GLU A 91 3.482 -23.028 3.085 1.00 0.00 C ATOM 1354 OE1 GLU A 91 4.345 -22.138 3.231 1.00 0.00 O ATOM 1355 OE2 GLU A 91 3.700 -24.102 2.486 1.00 0.00 O ATOM 0 H GLU A 91 0.440 -19.241 2.592 1.00 0.00 H new ATOM 0 HA GLU A 91 1.499 -21.643 1.280 1.00 0.00 H new ATOM 0 HB2 GLU A 91 2.431 -20.693 3.450 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.909 -21.106 4.214 1.00 0.00 H new ATOM 0 HG2 GLU A 91 2.124 -22.982 4.738 1.00 0.00 H new ATOM 0 HG3 GLU A 91 1.403 -23.512 3.231 1.00 0.00 H new ATOM 1362 N SER A 92 -1.415 -21.457 2.839 1.00 0.00 N ATOM 1363 CA SER A 92 -2.725 -22.087 2.951 1.00 0.00 C ATOM 1364 C SER A 92 -3.821 -21.153 2.446 1.00 0.00 C ATOM 1365 O SER A 92 -3.668 -19.932 2.418 1.00 0.00 O ATOM 1366 CB SER A 92 -3.003 -22.480 4.403 1.00 0.00 C ATOM 1367 OG SER A 92 -2.528 -21.491 5.299 1.00 0.00 O ATOM 0 H SER A 92 -1.314 -20.595 3.376 1.00 0.00 H new ATOM 0 HA SER A 92 -2.723 -22.985 2.333 1.00 0.00 H new ATOM 0 HB2 SER A 92 -4.074 -22.620 4.546 1.00 0.00 H new ATOM 0 HB3 SER A 92 -2.524 -23.434 4.623 1.00 0.00 H new ATOM 0 HG SER A 92 -2.719 -21.765 6.220 1.00 0.00 H new ATOM 1373 N PRO A 93 -4.956 -21.740 2.038 1.00 0.00 N ATOM 1374 CA PRO A 93 -6.101 -20.980 1.527 1.00 0.00 C ATOM 1375 C PRO A 93 -6.796 -20.175 2.620 1.00 0.00 C ATOM 1376 O PRO A 93 -6.529 -20.360 3.806 1.00 0.00 O ATOM 1377 CB PRO A 93 -7.035 -22.066 0.988 1.00 0.00 C ATOM 1378 CG PRO A 93 -6.683 -23.288 1.763 1.00 0.00 C ATOM 1379 CD PRO A 93 -5.209 -23.191 2.044 1.00 0.00 C ATOM 0 HA PRO A 93 -5.802 -20.246 0.779 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -8.081 -21.795 1.130 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.888 -22.219 -0.081 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -7.254 -23.340 2.690 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.913 -24.190 1.196 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.952 -23.640 3.004 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -4.620 -23.705 1.284 1.00 0.00 H new ATOM 1387 N GLY A 94 -7.689 -19.279 2.210 1.00 0.00 N ATOM 1388 CA GLY A 94 -8.409 -18.459 3.167 1.00 0.00 C ATOM 1389 C GLY A 94 -8.305 -16.979 2.856 1.00 0.00 C ATOM 1390 O GLY A 94 -7.212 -16.462 2.622 1.00 0.00 O ATOM 0 H GLY A 94 -7.926 -19.107 1.233 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.459 -18.753 3.175 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -8.018 -18.645 4.167 1.00 0.00 H new ATOM 1394 N ILE A 95 -9.444 -16.295 2.851 1.00 0.00 N ATOM 1395 CA ILE A 95 -9.476 -14.866 2.566 1.00 0.00 C ATOM 1396 C ILE A 95 -8.560 -14.096 3.510 1.00 0.00 C ATOM 1397 O ILE A 95 -8.721 -14.150 4.729 1.00 0.00 O ATOM 1398 CB ILE A 95 -10.905 -14.301 2.680 1.00 0.00 C ATOM 1399 CG1 ILE A 95 -11.856 -15.071 1.762 1.00 0.00 C ATOM 1400 CG2 ILE A 95 -10.916 -12.818 2.341 1.00 0.00 C ATOM 1401 CD1 ILE A 95 -13.190 -14.386 1.564 1.00 0.00 C ATOM 0 H ILE A 95 -10.357 -16.708 3.041 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.125 -14.741 1.542 1.00 0.00 H new ATOM 0 HB ILE A 95 -11.247 -14.421 3.708 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.379 -15.208 0.791 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -12.025 -16.064 2.178 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.932 -12.433 2.426 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -10.266 -12.282 3.032 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.558 -12.675 1.321 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.813 -14.988 0.902 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -13.687 -14.273 2.527 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.032 -13.403 1.119 1.00 0.00 H new ATOM 1413 N TYR A 96 -7.599 -13.379 2.938 1.00 0.00 N ATOM 1414 CA TYR A 96 -6.655 -12.598 3.729 1.00 0.00 C ATOM 1415 C TYR A 96 -7.038 -11.121 3.731 1.00 0.00 C ATOM 1416 O TYR A 96 -7.766 -10.656 2.854 1.00 0.00 O ATOM 1417 CB TYR A 96 -5.236 -12.768 3.183 1.00 0.00 C ATOM 1418 CG TYR A 96 -4.683 -14.164 3.360 1.00 0.00 C ATOM 1419 CD1 TYR A 96 -4.023 -14.528 4.527 1.00 0.00 C ATOM 1420 CD2 TYR A 96 -4.820 -15.119 2.359 1.00 0.00 C ATOM 1421 CE1 TYR A 96 -3.515 -15.803 4.693 1.00 0.00 C ATOM 1422 CE2 TYR A 96 -4.316 -16.395 2.517 1.00 0.00 C ATOM 1423 CZ TYR A 96 -3.665 -16.732 3.685 1.00 0.00 C ATOM 1424 OH TYR A 96 -3.161 -18.003 3.845 1.00 0.00 O ATOM 0 H TYR A 96 -7.453 -13.322 1.930 1.00 0.00 H new ATOM 0 HA TYR A 96 -6.688 -12.965 4.755 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -5.231 -12.516 2.123 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -4.576 -12.059 3.682 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -3.905 -13.802 5.318 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -5.329 -14.859 1.443 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -3.004 -16.070 5.606 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -4.431 -17.125 1.730 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.295 -18.514 3.020 1.00 0.00 H new ATOM 1434 N ARG A 97 -6.540 -10.389 4.722 1.00 0.00 N ATOM 1435 CA ARG A 97 -6.829 -8.965 4.839 1.00 0.00 C ATOM 1436 C ARG A 97 -5.578 -8.132 4.576 1.00 0.00 C ATOM 1437 O ARG A 97 -4.675 -8.067 5.410 1.00 0.00 O ATOM 1438 CB ARG A 97 -7.382 -8.648 6.230 1.00 0.00 C ATOM 1439 CG ARG A 97 -8.895 -8.756 6.324 1.00 0.00 C ATOM 1440 CD ARG A 97 -9.403 -8.299 7.682 1.00 0.00 C ATOM 1441 NE ARG A 97 -9.440 -9.393 8.649 1.00 0.00 N ATOM 1442 CZ ARG A 97 -10.230 -9.402 9.718 1.00 0.00 C ATOM 1443 NH1 ARG A 97 -11.044 -8.383 9.954 1.00 0.00 N ATOM 1444 NH2 ARG A 97 -10.207 -10.434 10.552 1.00 0.00 N ATOM 0 H ARG A 97 -5.935 -10.758 5.455 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.578 -8.710 4.090 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.932 -9.328 6.954 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -7.080 -7.639 6.510 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.353 -8.152 5.541 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.199 -9.788 6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.762 -7.503 8.060 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.402 -7.878 7.572 1.00 0.00 H new ATOM 0 HE ARG A 97 -8.826 -10.193 8.496 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.066 -7.589 9.314 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.649 -8.393 10.775 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -9.583 -11.221 10.373 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -10.813 -10.440 11.372 1.00 0.00 H new ATOM 1458 N VAL A 98 -5.531 -7.498 3.408 1.00 0.00 N ATOM 1459 CA VAL A 98 -4.391 -6.669 3.034 1.00 0.00 C ATOM 1460 C VAL A 98 -4.708 -5.188 3.206 1.00 0.00 C ATOM 1461 O VAL A 98 -5.824 -4.746 2.932 1.00 0.00 O ATOM 1462 CB VAL A 98 -3.964 -6.926 1.577 1.00 0.00 C ATOM 1463 CG1 VAL A 98 -2.784 -6.043 1.202 1.00 0.00 C ATOM 1464 CG2 VAL A 98 -3.628 -8.395 1.372 1.00 0.00 C ATOM 0 H VAL A 98 -6.269 -7.543 2.705 1.00 0.00 H new ATOM 0 HA VAL A 98 -3.571 -6.941 3.698 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.798 -6.673 0.922 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.497 -6.239 0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -3.065 -4.995 1.308 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.943 -6.261 1.860 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -3.328 -8.559 0.337 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.811 -8.677 2.035 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -4.504 -9.003 1.597 1.00 0.00 H new ATOM 1474 N SER A 99 -3.719 -4.425 3.661 1.00 0.00 N ATOM 1475 CA SER A 99 -3.894 -2.993 3.873 1.00 0.00 C ATOM 1476 C SER A 99 -2.649 -2.224 3.440 1.00 0.00 C ATOM 1477 O SER A 99 -1.576 -2.802 3.271 1.00 0.00 O ATOM 1478 CB SER A 99 -4.197 -2.707 5.345 1.00 0.00 C ATOM 1479 OG SER A 99 -4.272 -1.313 5.588 1.00 0.00 O ATOM 0 H SER A 99 -2.789 -4.775 3.890 1.00 0.00 H new ATOM 0 HA SER A 99 -4.735 -2.661 3.265 1.00 0.00 H new ATOM 0 HB2 SER A 99 -5.139 -3.179 5.624 1.00 0.00 H new ATOM 0 HB3 SER A 99 -3.421 -3.147 5.972 1.00 0.00 H new ATOM 0 HG SER A 99 -4.832 -0.891 4.903 1.00 0.00 H new ATOM 1485 N VAL A 100 -2.802 -0.916 3.261 1.00 0.00 N ATOM 1486 CA VAL A 100 -1.692 -0.066 2.848 1.00 0.00 C ATOM 1487 C VAL A 100 -1.747 1.288 3.546 1.00 0.00 C ATOM 1488 O VAL A 100 -2.630 2.102 3.275 1.00 0.00 O ATOM 1489 CB VAL A 100 -1.690 0.154 1.324 1.00 0.00 C ATOM 1490 CG1 VAL A 100 -3.015 0.746 0.868 1.00 0.00 C ATOM 1491 CG2 VAL A 100 -0.529 1.049 0.917 1.00 0.00 C ATOM 0 H VAL A 100 -3.684 -0.422 3.396 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.775 -0.582 3.134 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.564 -0.812 0.835 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.995 0.894 -0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.826 0.065 1.126 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.175 1.704 1.363 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.543 1.194 -0.163 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.622 2.015 1.414 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.411 0.580 1.208 1.00 0.00 H new ATOM 1501 N ARG A 101 -0.798 1.523 4.446 1.00 0.00 N ATOM 1502 CA ARG A 101 -0.740 2.779 5.184 1.00 0.00 C ATOM 1503 C ARG A 101 0.307 3.714 4.585 1.00 0.00 C ATOM 1504 O ARG A 101 1.380 3.276 4.172 1.00 0.00 O ATOM 1505 CB ARG A 101 -0.420 2.515 6.657 1.00 0.00 C ATOM 1506 CG ARG A 101 -0.651 3.719 7.556 1.00 0.00 C ATOM 1507 CD ARG A 101 0.589 4.596 7.643 1.00 0.00 C ATOM 1508 NE ARG A 101 0.620 5.379 8.875 1.00 0.00 N ATOM 1509 CZ ARG A 101 0.834 4.852 10.075 1.00 0.00 C ATOM 1510 NH1 ARG A 101 1.035 3.548 10.204 1.00 0.00 N ATOM 1511 NH2 ARG A 101 0.848 5.630 11.150 1.00 0.00 N ATOM 0 H ARG A 101 -0.059 0.860 4.682 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.716 3.260 5.111 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -1.033 1.686 7.010 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.620 2.202 6.744 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -1.486 4.305 7.173 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.930 3.381 8.554 1.00 0.00 H new ATOM 0 HD2 ARG A 101 1.480 3.970 7.589 1.00 0.00 H new ATOM 0 HD3 ARG A 101 0.619 5.268 6.785 1.00 0.00 H new ATOM 0 HE ARG A 101 0.469 6.386 8.810 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.026 2.947 9.380 1.00 0.00 H new ATOM 0 HH12 ARG A 101 1.199 3.146 11.127 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.694 6.634 11.055 1.00 0.00 H new ATOM 0 HH22 ARG A 101 1.012 5.224 12.071 1.00 0.00 H new ATOM 1525 N ALA A 102 -0.014 5.002 4.541 1.00 0.00 N ATOM 1526 CA ALA A 102 0.899 5.999 3.993 1.00 0.00 C ATOM 1527 C ALA A 102 0.802 7.313 4.761 1.00 0.00 C ATOM 1528 O ALA A 102 -0.292 7.819 5.006 1.00 0.00 O ATOM 1529 CB ALA A 102 0.609 6.225 2.517 1.00 0.00 C ATOM 0 H ALA A 102 -0.899 5.381 4.878 1.00 0.00 H new ATOM 0 HA ALA A 102 1.916 5.621 4.098 1.00 0.00 H new ATOM 0 HB1 ALA A 102 1.298 6.971 2.121 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.737 5.289 1.974 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.416 6.577 2.397 1.00 0.00 H new ATOM 1535 N GLU A 103 1.954 7.859 5.139 1.00 0.00 N ATOM 1536 CA GLU A 103 1.997 9.113 5.881 1.00 0.00 C ATOM 1537 C GLU A 103 3.168 9.977 5.422 1.00 0.00 C ATOM 1538 O GLU A 103 4.322 9.701 5.749 1.00 0.00 O ATOM 1539 CB GLU A 103 2.107 8.840 7.382 1.00 0.00 C ATOM 1540 CG GLU A 103 2.582 10.040 8.185 1.00 0.00 C ATOM 1541 CD GLU A 103 2.250 9.922 9.660 1.00 0.00 C ATOM 1542 OE1 GLU A 103 3.045 9.306 10.400 1.00 0.00 O ATOM 1543 OE2 GLU A 103 1.195 10.446 10.074 1.00 0.00 O ATOM 0 H GLU A 103 2.869 7.453 4.944 1.00 0.00 H new ATOM 0 HA GLU A 103 1.071 9.653 5.685 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.134 8.524 7.758 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.795 8.010 7.543 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.660 10.148 8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 103 2.125 10.945 7.785 1.00 0.00 H new ATOM 1550 N ASN A 104 2.863 11.022 4.660 1.00 0.00 N ATOM 1551 CA ASN A 104 3.890 11.926 4.155 1.00 0.00 C ATOM 1552 C ASN A 104 3.721 13.324 4.743 1.00 0.00 C ATOM 1553 O ASN A 104 2.612 13.739 5.079 1.00 0.00 O ATOM 1554 CB ASN A 104 3.833 11.993 2.628 1.00 0.00 C ATOM 1555 CG ASN A 104 2.416 11.891 2.097 1.00 0.00 C ATOM 1556 OD1 ASN A 104 1.912 12.815 1.458 1.00 0.00 O ATOM 1557 ND2 ASN A 104 1.766 10.763 2.359 1.00 0.00 N ATOM 0 H ASN A 104 1.913 11.264 4.379 1.00 0.00 H new ATOM 0 HA ASN A 104 4.862 11.538 4.459 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.278 12.930 2.291 1.00 0.00 H new ATOM 0 HB3 ASN A 104 4.434 11.186 2.209 1.00 0.00 H new ATOM 0 HD21 ASN A 104 0.810 10.636 2.027 1.00 0.00 H new ATOM 0 HD22 ASN A 104 2.223 10.023 2.892 1.00 0.00 H new ATOM 1564 N THR A 105 4.831 14.047 4.863 1.00 0.00 N ATOM 1565 CA THR A 105 4.807 15.397 5.411 1.00 0.00 C ATOM 1566 C THR A 105 3.535 16.132 5.006 1.00 0.00 C ATOM 1567 O THR A 105 2.903 16.798 5.826 1.00 0.00 O ATOM 1568 CB THR A 105 6.028 16.213 4.945 1.00 0.00 C ATOM 1569 OG1 THR A 105 6.351 17.211 5.921 1.00 0.00 O ATOM 1570 CG2 THR A 105 5.755 16.878 3.604 1.00 0.00 C ATOM 0 H THR A 105 5.757 13.720 4.588 1.00 0.00 H new ATOM 0 HA THR A 105 4.837 15.299 6.496 1.00 0.00 H new ATOM 0 HB THR A 105 6.871 15.531 4.830 1.00 0.00 H new ATOM 0 HG1 THR A 105 7.129 17.724 5.619 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.631 17.448 3.296 1.00 0.00 H new ATOM 0 HG22 THR A 105 5.538 16.115 2.857 1.00 0.00 H new ATOM 0 HG23 THR A 105 4.900 17.548 3.697 1.00 0.00 H new ATOM 1578 N ALA A 106 3.163 16.008 3.736 1.00 0.00 N ATOM 1579 CA ALA A 106 1.964 16.658 3.223 1.00 0.00 C ATOM 1580 C ALA A 106 0.714 16.139 3.926 1.00 0.00 C ATOM 1581 O ALA A 106 0.108 16.840 4.735 1.00 0.00 O ATOM 1582 CB ALA A 106 1.852 16.450 1.720 1.00 0.00 C ATOM 0 H ALA A 106 3.676 15.463 3.043 1.00 0.00 H new ATOM 0 HA ALA A 106 2.045 17.726 3.425 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.952 16.941 1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.726 16.877 1.228 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.798 15.383 1.503 1.00 0.00 H new ATOM 1588 N GLY A 107 0.334 14.904 3.611 1.00 0.00 N ATOM 1589 CA GLY A 107 -0.843 14.312 4.221 1.00 0.00 C ATOM 1590 C GLY A 107 -0.672 12.831 4.492 1.00 0.00 C ATOM 1591 O GLY A 107 0.436 12.300 4.405 1.00 0.00 O ATOM 0 H GLY A 107 0.820 14.303 2.945 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -1.061 14.827 5.157 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -1.702 14.462 3.567 1.00 0.00 H new ATOM 1595 N HIS A 108 -1.771 12.161 4.825 1.00 0.00 N ATOM 1596 CA HIS A 108 -1.737 10.731 5.111 1.00 0.00 C ATOM 1597 C HIS A 108 -2.962 10.032 4.530 1.00 0.00 C ATOM 1598 O HIS A 108 -4.073 10.561 4.579 1.00 0.00 O ATOM 1599 CB HIS A 108 -1.668 10.494 6.620 1.00 0.00 C ATOM 1600 CG HIS A 108 -2.574 11.387 7.409 1.00 0.00 C ATOM 1601 ND1 HIS A 108 -3.937 11.445 7.207 1.00 0.00 N ATOM 1602 CD2 HIS A 108 -2.306 12.261 8.408 1.00 0.00 C ATOM 1603 CE1 HIS A 108 -4.467 12.317 8.046 1.00 0.00 C ATOM 1604 NE2 HIS A 108 -3.499 12.826 8.786 1.00 0.00 N ATOM 0 H HIS A 108 -2.695 12.585 4.903 1.00 0.00 H new ATOM 0 HA HIS A 108 -0.846 10.312 4.643 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -1.924 9.455 6.828 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -0.642 10.643 6.956 1.00 0.00 H new ATOM 0 HD1 HIS A 108 -4.455 10.900 6.518 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -1.335 12.474 8.829 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -5.515 12.571 8.115 1.00 0.00 H new ATOM 1613 N ASP A 109 -2.752 8.841 3.980 1.00 0.00 N ATOM 1614 CA ASP A 109 -3.839 8.069 3.389 1.00 0.00 C ATOM 1615 C ASP A 109 -3.653 6.578 3.655 1.00 0.00 C ATOM 1616 O ASP A 109 -2.559 6.131 3.997 1.00 0.00 O ATOM 1617 CB ASP A 109 -3.916 8.326 1.884 1.00 0.00 C ATOM 1618 CG ASP A 109 -5.306 8.088 1.326 1.00 0.00 C ATOM 1619 OD1 ASP A 109 -5.663 6.912 1.106 1.00 0.00 O ATOM 1620 OD2 ASP A 109 -6.036 9.077 1.109 1.00 0.00 O ATOM 0 H ASP A 109 -1.839 8.389 3.931 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.773 8.389 3.852 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.616 9.353 1.678 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.206 7.678 1.371 1.00 0.00 H new ATOM 1625 N GLU A 110 -4.730 5.815 3.494 1.00 0.00 N ATOM 1626 CA GLU A 110 -4.685 4.375 3.719 1.00 0.00 C ATOM 1627 C GLU A 110 -5.776 3.665 2.921 1.00 0.00 C ATOM 1628 O GLU A 110 -6.825 4.242 2.636 1.00 0.00 O ATOM 1629 CB GLU A 110 -4.843 4.063 5.208 1.00 0.00 C ATOM 1630 CG GLU A 110 -5.016 2.583 5.505 1.00 0.00 C ATOM 1631 CD GLU A 110 -6.465 2.141 5.443 1.00 0.00 C ATOM 1632 OE1 GLU A 110 -7.356 3.004 5.593 1.00 0.00 O ATOM 1633 OE2 GLU A 110 -6.708 0.933 5.244 1.00 0.00 O ATOM 0 H GLU A 110 -5.643 6.170 3.209 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.715 4.011 3.380 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.968 4.432 5.743 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.706 4.606 5.595 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.432 2.002 4.791 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.616 2.366 6.495 1.00 0.00 H new ATOM 1640 N ALA A 111 -5.519 2.411 2.564 1.00 0.00 N ATOM 1641 CA ALA A 111 -6.478 1.622 1.801 1.00 0.00 C ATOM 1642 C ALA A 111 -6.484 0.169 2.263 1.00 0.00 C ATOM 1643 O ALA A 111 -5.627 -0.249 3.042 1.00 0.00 O ATOM 1644 CB ALA A 111 -6.165 1.705 0.315 1.00 0.00 C ATOM 0 H ALA A 111 -4.654 1.920 2.791 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.472 2.035 1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.889 1.111 -0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.219 2.744 -0.011 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -5.162 1.320 0.132 1.00 0.00 H new ATOM 1650 N VAL A 112 -7.456 -0.597 1.778 1.00 0.00 N ATOM 1651 CA VAL A 112 -7.574 -2.004 2.141 1.00 0.00 C ATOM 1652 C VAL A 112 -8.020 -2.844 0.949 1.00 0.00 C ATOM 1653 O VAL A 112 -8.669 -2.341 0.030 1.00 0.00 O ATOM 1654 CB VAL A 112 -8.570 -2.204 3.298 1.00 0.00 C ATOM 1655 CG1 VAL A 112 -8.635 -3.670 3.700 1.00 0.00 C ATOM 1656 CG2 VAL A 112 -8.188 -1.334 4.486 1.00 0.00 C ATOM 0 H VAL A 112 -8.173 -0.267 1.132 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.585 -2.332 2.463 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.560 -1.901 2.958 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -9.344 -3.792 4.519 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -8.959 -4.267 2.848 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -7.648 -4.003 4.022 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -8.903 -1.488 5.294 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.189 -1.604 4.828 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.198 -0.286 4.188 1.00 0.00 H new ATOM 1666 N LEU A 113 -7.670 -4.125 0.971 1.00 0.00 N ATOM 1667 CA LEU A 113 -8.036 -5.036 -0.108 1.00 0.00 C ATOM 1668 C LEU A 113 -8.121 -6.473 0.397 1.00 0.00 C ATOM 1669 O LEU A 113 -7.232 -6.946 1.105 1.00 0.00 O ATOM 1670 CB LEU A 113 -7.019 -4.944 -1.247 1.00 0.00 C ATOM 1671 CG LEU A 113 -7.511 -5.388 -2.625 1.00 0.00 C ATOM 1672 CD1 LEU A 113 -6.594 -4.857 -3.716 1.00 0.00 C ATOM 1673 CD2 LEU A 113 -7.603 -6.906 -2.694 1.00 0.00 C ATOM 0 H LEU A 113 -7.134 -4.556 1.724 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.017 -4.742 -0.480 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.679 -3.911 -1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.151 -5.548 -0.982 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.507 -4.976 -2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.960 -5.183 -4.690 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -6.579 -3.768 -3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.585 -5.239 -3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -7.955 -7.205 -3.682 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.619 -7.339 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.301 -7.263 -1.937 1.00 0.00 H new ATOM 1685 N PHE A 114 -9.195 -7.162 0.028 1.00 0.00 N ATOM 1686 CA PHE A 114 -9.396 -8.545 0.443 1.00 0.00 C ATOM 1687 C PHE A 114 -9.008 -9.510 -0.674 1.00 0.00 C ATOM 1688 O PHE A 114 -9.423 -9.348 -1.822 1.00 0.00 O ATOM 1689 CB PHE A 114 -10.855 -8.773 0.845 1.00 0.00 C ATOM 1690 CG PHE A 114 -11.168 -8.325 2.244 1.00 0.00 C ATOM 1691 CD1 PHE A 114 -11.188 -6.978 2.566 1.00 0.00 C ATOM 1692 CD2 PHE A 114 -11.441 -9.252 3.237 1.00 0.00 C ATOM 1693 CE1 PHE A 114 -11.476 -6.563 3.853 1.00 0.00 C ATOM 1694 CE2 PHE A 114 -11.729 -8.843 4.525 1.00 0.00 C ATOM 1695 CZ PHE A 114 -11.746 -7.497 4.834 1.00 0.00 C ATOM 0 H PHE A 114 -9.940 -6.785 -0.558 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.755 -8.736 1.304 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -11.503 -8.241 0.148 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -11.088 -9.834 0.751 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -10.976 -6.244 1.803 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -11.429 -10.306 3.002 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.490 -5.510 4.091 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -11.941 -9.576 5.290 1.00 0.00 H new ATOM 0 HZ PHE A 114 -11.970 -7.176 5.840 1.00 0.00 H new ATOM 1705 N VAL A 115 -8.209 -10.514 -0.329 1.00 0.00 N ATOM 1706 CA VAL A 115 -7.764 -11.506 -1.302 1.00 0.00 C ATOM 1707 C VAL A 115 -8.484 -12.835 -1.099 1.00 0.00 C ATOM 1708 O VAL A 115 -8.293 -13.506 -0.085 1.00 0.00 O ATOM 1709 CB VAL A 115 -6.245 -11.738 -1.212 1.00 0.00 C ATOM 1710 CG1 VAL A 115 -5.855 -13.015 -1.941 1.00 0.00 C ATOM 1711 CG2 VAL A 115 -5.489 -10.543 -1.772 1.00 0.00 C ATOM 0 H VAL A 115 -7.856 -10.663 0.616 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.005 -11.112 -2.289 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.974 -11.850 -0.162 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.778 -13.162 -1.866 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.369 -13.863 -1.489 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.139 -12.936 -2.991 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.417 -10.725 -1.700 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -5.763 -10.396 -2.817 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.745 -9.650 -1.201 1.00 0.00 H new ATOM 1721 N GLN A 116 -9.310 -13.209 -2.071 1.00 0.00 N ATOM 1722 CA GLN A 116 -10.058 -14.458 -1.998 1.00 0.00 C ATOM 1723 C GLN A 116 -9.225 -15.623 -2.525 1.00 0.00 C ATOM 1724 O GLN A 116 -8.946 -15.709 -3.721 1.00 0.00 O ATOM 1725 CB GLN A 116 -11.359 -14.345 -2.794 1.00 0.00 C ATOM 1726 CG GLN A 116 -12.498 -15.173 -2.220 1.00 0.00 C ATOM 1727 CD GLN A 116 -12.444 -16.622 -2.659 1.00 0.00 C ATOM 1728 OE1 GLN A 116 -11.397 -17.266 -2.592 1.00 0.00 O ATOM 1729 NE2 GLN A 116 -13.577 -17.146 -3.113 1.00 0.00 N ATOM 0 H GLN A 116 -9.478 -12.665 -2.917 1.00 0.00 H new ATOM 0 HA GLN A 116 -10.296 -14.649 -0.952 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -11.664 -13.299 -2.830 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -11.175 -14.659 -3.822 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -12.464 -15.126 -1.132 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -13.449 -14.739 -2.528 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -14.423 -16.577 -3.152 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -13.601 -18.118 -3.423 1.00 0.00 H new ATOM 1738 N VAL A 117 -8.831 -16.517 -1.624 1.00 0.00 N ATOM 1739 CA VAL A 117 -8.031 -17.677 -1.998 1.00 0.00 C ATOM 1740 C VAL A 117 -8.750 -18.976 -1.651 1.00 0.00 C ATOM 1741 O VAL A 117 -8.849 -19.349 -0.482 1.00 0.00 O ATOM 1742 CB VAL A 117 -6.658 -17.660 -1.300 1.00 0.00 C ATOM 1743 CG1 VAL A 117 -6.817 -17.369 0.185 1.00 0.00 C ATOM 1744 CG2 VAL A 117 -5.934 -18.980 -1.518 1.00 0.00 C ATOM 0 H VAL A 117 -9.053 -16.460 -0.630 1.00 0.00 H new ATOM 0 HA VAL A 117 -7.883 -17.625 -3.077 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.056 -16.864 -1.739 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.837 -17.361 0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.292 -16.397 0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.436 -18.140 0.643 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.966 -18.951 -1.018 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.530 -19.794 -1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.786 -19.142 -2.586 1.00 0.00 H new ATOM 1754 N SER A 118 -9.250 -19.661 -2.674 1.00 0.00 N ATOM 1755 CA SER A 118 -9.963 -20.917 -2.477 1.00 0.00 C ATOM 1756 C SER A 118 -9.058 -22.108 -2.775 1.00 0.00 C ATOM 1757 O SER A 118 -8.268 -22.081 -3.717 1.00 0.00 O ATOM 1758 CB SER A 118 -11.204 -20.969 -3.371 1.00 0.00 C ATOM 1759 OG SER A 118 -10.847 -20.919 -4.742 1.00 0.00 O ATOM 0 H SER A 118 -9.174 -19.367 -3.648 1.00 0.00 H new ATOM 0 HA SER A 118 -10.273 -20.970 -1.433 1.00 0.00 H new ATOM 0 HB2 SER A 118 -11.763 -21.883 -3.170 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.863 -20.134 -3.133 1.00 0.00 H new ATOM 0 HG SER A 118 -11.657 -20.955 -5.292 1.00 0.00 H new ATOM 1765 N GLY A 119 -9.180 -23.154 -1.963 1.00 0.00 N ATOM 1766 CA GLY A 119 -8.367 -24.341 -2.154 1.00 0.00 C ATOM 1767 C GLY A 119 -8.717 -25.084 -3.428 1.00 0.00 C ATOM 1768 O GLY A 119 -9.428 -24.574 -4.294 1.00 0.00 O ATOM 0 H GLY A 119 -9.828 -23.200 -1.176 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -7.315 -24.057 -2.180 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -8.496 -25.007 -1.301 1.00 0.00 H new ATOM 1772 N PRO A 120 -8.210 -26.319 -3.556 1.00 0.00 N ATOM 1773 CA PRO A 120 -8.459 -27.159 -4.731 1.00 0.00 C ATOM 1774 C PRO A 120 -9.904 -27.639 -4.805 1.00 0.00 C ATOM 1775 O PRO A 120 -10.614 -27.658 -3.799 1.00 0.00 O ATOM 1776 CB PRO A 120 -7.512 -28.344 -4.526 1.00 0.00 C ATOM 1777 CG PRO A 120 -7.301 -28.411 -3.053 1.00 0.00 C ATOM 1778 CD PRO A 120 -7.355 -26.991 -2.563 1.00 0.00 C ATOM 0 HA PRO A 120 -8.292 -26.617 -5.662 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -7.947 -29.268 -4.906 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -6.570 -28.194 -5.054 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -8.070 -29.018 -2.576 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.341 -28.869 -2.817 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -7.778 -26.928 -1.560 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -6.362 -26.543 -2.519 1.00 0.00 H new ATOM 1786 N SER A 121 -10.334 -28.028 -6.001 1.00 0.00 N ATOM 1787 CA SER A 121 -11.696 -28.505 -6.206 1.00 0.00 C ATOM 1788 C SER A 121 -11.727 -30.026 -6.324 1.00 0.00 C ATOM 1789 O SER A 121 -10.890 -30.624 -7.000 1.00 0.00 O ATOM 1790 CB SER A 121 -12.297 -27.872 -7.463 1.00 0.00 C ATOM 1791 OG SER A 121 -12.466 -26.475 -7.299 1.00 0.00 O ATOM 0 H SER A 121 -9.758 -28.022 -6.843 1.00 0.00 H new ATOM 0 HA SER A 121 -12.291 -28.213 -5.341 1.00 0.00 H new ATOM 0 HB2 SER A 121 -11.648 -28.065 -8.317 1.00 0.00 H new ATOM 0 HB3 SER A 121 -13.259 -28.335 -7.683 1.00 0.00 H new ATOM 0 HG SER A 121 -12.850 -26.094 -8.116 1.00 0.00 H new ATOM 1797 N SER A 122 -12.699 -30.644 -5.661 1.00 0.00 N ATOM 1798 CA SER A 122 -12.838 -32.096 -5.688 1.00 0.00 C ATOM 1799 C SER A 122 -14.153 -32.504 -6.345 1.00 0.00 C ATOM 1800 O SER A 122 -14.986 -33.171 -5.733 1.00 0.00 O ATOM 1801 CB SER A 122 -12.767 -32.662 -4.268 1.00 0.00 C ATOM 1802 OG SER A 122 -13.853 -32.204 -3.482 1.00 0.00 O ATOM 0 H SER A 122 -13.401 -30.163 -5.099 1.00 0.00 H new ATOM 0 HA SER A 122 -12.016 -32.504 -6.276 1.00 0.00 H new ATOM 0 HB2 SER A 122 -12.776 -33.751 -4.306 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.827 -32.367 -3.802 1.00 0.00 H new ATOM 0 HG SER A 122 -14.691 -32.567 -3.838 1.00 0.00 H new ATOM 1808 N GLY A 123 -14.333 -32.096 -7.598 1.00 0.00 N ATOM 1809 CA GLY A 123 -15.549 -32.427 -8.319 1.00 0.00 C ATOM 1810 C GLY A 123 -15.518 -31.950 -9.757 1.00 0.00 C ATOM 1811 O GLY A 123 -15.041 -30.852 -10.044 1.00 0.00 O ATOM 0 H GLY A 123 -13.659 -31.542 -8.126 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -15.696 -33.507 -8.301 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.403 -31.980 -7.810 1.00 0.00 H new TER 1815 GLY A 123