USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 828 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 31 CYS SG : rot 32:sc= -0.645 USER MOD Set 1.2: A 52 SER OG : rot -101:sc= 0.691 USER MOD Set 1.3: A 54 SER OG : rot -129:sc= -0.348 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.307 K(o=-0.31,f=-2.4) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= -1.07 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.59 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0129 X(o=-0.013,f=0) USER MOD Single : A 40 LYS NZ :NH3+ -142:sc= -0.0644 (180deg=-0.33) USER MOD Single : A 46 SER OG : rot 180:sc= -0.437 USER MOD Single : A 47 HIS : no HD1:sc= -1.49 K(o=-1.5,f=-3.4!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -6.63! C(o=-6.6!,f=-6.5!) USER MOD Single : A 69 ASN : amide:sc= -7.23! C(o=-7.2!,f=-8!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.0661 K(o=-0.066,f=-0.65) USER MOD Single : A 78 HIS : no HD1:sc= -0.866 K(o=-0.87,f=-2.1!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc=-0.00032 X(o=-0.00032,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0.0666 USER MOD Single : A 92 THR OG1 : rot -53:sc= -0.767 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc=0.000142 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.126 23.945 -41.096 1.00 0.00 N ATOM 2 CA GLY A 1 3.814 23.267 -42.182 1.00 0.00 C ATOM 3 C GLY A 1 4.228 21.852 -41.770 1.00 0.00 C ATOM 4 O GLY A 1 5.409 21.585 -41.555 1.00 0.00 O ATOM 0 H1 GLY A 1 2.856 24.902 -41.400 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.272 23.410 -40.838 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.757 24.009 -40.272 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.164 23.220 -43.056 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.696 23.838 -42.471 1.00 0.00 H new ATOM 8 N SER A 2 3.232 20.984 -41.673 1.00 0.00 N ATOM 9 CA SER A 2 3.477 19.603 -41.291 1.00 0.00 C ATOM 10 C SER A 2 2.179 18.799 -41.372 1.00 0.00 C ATOM 11 O SER A 2 1.090 19.371 -41.386 1.00 0.00 O ATOM 12 CB SER A 2 4.067 19.519 -39.882 1.00 0.00 C ATOM 13 OG SER A 2 5.268 18.752 -39.851 1.00 0.00 O ATOM 0 H SER A 2 2.254 21.210 -41.852 1.00 0.00 H new ATOM 0 HA SER A 2 4.202 19.179 -41.986 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.269 20.525 -39.513 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.335 19.074 -39.208 1.00 0.00 H new ATOM 0 HG SER A 2 5.614 18.724 -38.935 1.00 0.00 H new ATOM 19 N SER A 3 2.336 17.485 -41.424 1.00 0.00 N ATOM 20 CA SER A 3 1.190 16.596 -41.503 1.00 0.00 C ATOM 21 C SER A 3 1.631 15.150 -41.270 1.00 0.00 C ATOM 22 O SER A 3 2.806 14.823 -41.428 1.00 0.00 O ATOM 23 CB SER A 3 0.485 16.725 -42.855 1.00 0.00 C ATOM 24 OG SER A 3 -0.909 16.980 -42.709 1.00 0.00 O ATOM 0 H SER A 3 3.241 17.014 -41.413 1.00 0.00 H new ATOM 0 HA SER A 3 0.482 16.882 -40.725 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.943 17.532 -43.427 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.628 15.808 -43.427 1.00 0.00 H new ATOM 0 HG SER A 3 -1.322 17.057 -43.594 1.00 0.00 H new ATOM 30 N GLY A 4 0.665 14.322 -40.899 1.00 0.00 N ATOM 31 CA GLY A 4 0.940 12.918 -40.643 1.00 0.00 C ATOM 32 C GLY A 4 1.755 12.744 -39.360 1.00 0.00 C ATOM 33 O GLY A 4 1.830 13.657 -38.539 1.00 0.00 O ATOM 0 H GLY A 4 -0.309 14.596 -40.770 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.002 12.369 -40.559 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.485 12.491 -41.485 1.00 0.00 H new ATOM 37 N SER A 5 2.345 11.566 -39.227 1.00 0.00 N ATOM 38 CA SER A 5 3.152 11.260 -38.057 1.00 0.00 C ATOM 39 C SER A 5 2.390 11.633 -36.784 1.00 0.00 C ATOM 40 O SER A 5 2.633 12.687 -36.198 1.00 0.00 O ATOM 41 CB SER A 5 4.494 11.993 -38.107 1.00 0.00 C ATOM 42 OG SER A 5 5.556 11.198 -37.588 1.00 0.00 O ATOM 0 H SER A 5 2.281 10.811 -39.910 1.00 0.00 H new ATOM 0 HA SER A 5 3.354 10.189 -38.051 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.718 12.269 -39.137 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.423 12.919 -37.537 1.00 0.00 H new ATOM 0 HG SER A 5 6.396 11.700 -37.639 1.00 0.00 H new ATOM 48 N SER A 6 1.484 10.749 -36.394 1.00 0.00 N ATOM 49 CA SER A 6 0.686 10.972 -35.201 1.00 0.00 C ATOM 50 C SER A 6 1.072 9.965 -34.116 1.00 0.00 C ATOM 51 O SER A 6 0.897 10.229 -32.928 1.00 0.00 O ATOM 52 CB SER A 6 -0.809 10.871 -35.512 1.00 0.00 C ATOM 53 OG SER A 6 -1.501 12.078 -35.205 1.00 0.00 O ATOM 0 H SER A 6 1.285 9.877 -36.883 1.00 0.00 H new ATOM 0 HA SER A 6 0.887 11.980 -34.839 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.945 10.634 -36.567 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.243 10.049 -34.942 1.00 0.00 H new ATOM 0 HG SER A 6 -2.452 11.974 -35.419 1.00 0.00 H new ATOM 59 N GLY A 7 1.591 8.831 -34.565 1.00 0.00 N ATOM 60 CA GLY A 7 2.003 7.782 -33.647 1.00 0.00 C ATOM 61 C GLY A 7 0.792 7.021 -33.105 1.00 0.00 C ATOM 62 O GLY A 7 -0.137 7.624 -32.569 1.00 0.00 O ATOM 0 H GLY A 7 1.736 8.616 -35.552 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.673 7.090 -34.157 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.564 8.217 -32.820 1.00 0.00 H new ATOM 66 N SER A 8 0.841 5.706 -33.262 1.00 0.00 N ATOM 67 CA SER A 8 -0.241 4.856 -32.795 1.00 0.00 C ATOM 68 C SER A 8 0.181 4.127 -31.517 1.00 0.00 C ATOM 69 O SER A 8 1.353 3.798 -31.344 1.00 0.00 O ATOM 70 CB SER A 8 -0.652 3.847 -33.869 1.00 0.00 C ATOM 71 OG SER A 8 -1.992 4.052 -34.309 1.00 0.00 O ATOM 0 H SER A 8 1.613 5.209 -33.706 1.00 0.00 H new ATOM 0 HA SER A 8 -1.103 5.487 -32.579 1.00 0.00 H new ATOM 0 HB2 SER A 8 0.025 3.927 -34.719 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.551 2.836 -33.474 1.00 0.00 H new ATOM 0 HG SER A 8 -2.216 3.389 -34.995 1.00 0.00 H new ATOM 77 N PRO A 9 -0.824 3.891 -30.632 1.00 0.00 N ATOM 78 CA PRO A 9 -0.569 3.208 -29.375 1.00 0.00 C ATOM 79 C PRO A 9 -0.367 1.708 -29.597 1.00 0.00 C ATOM 80 O PRO A 9 -0.951 1.128 -30.511 1.00 0.00 O ATOM 81 CB PRO A 9 -1.776 3.522 -28.505 1.00 0.00 C ATOM 82 CG PRO A 9 -2.869 3.978 -29.457 1.00 0.00 C ATOM 83 CD PRO A 9 -2.225 4.267 -30.803 1.00 0.00 C ATOM 0 HA PRO A 9 0.350 3.542 -28.894 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -2.090 2.643 -27.942 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -1.542 4.300 -27.778 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -3.634 3.208 -29.557 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -3.364 4.869 -29.071 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -2.696 3.690 -31.599 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -2.323 5.319 -31.071 1.00 0.00 H new ATOM 91 N GLY A 10 0.463 1.123 -28.746 1.00 0.00 N ATOM 92 CA GLY A 10 0.750 -0.298 -28.839 1.00 0.00 C ATOM 93 C GLY A 10 0.848 -0.929 -27.448 1.00 0.00 C ATOM 94 O GLY A 10 1.784 -1.675 -27.165 1.00 0.00 O ATOM 0 H GLY A 10 0.946 1.607 -27.989 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.033 -0.794 -29.413 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.685 -0.449 -29.378 1.00 0.00 H new ATOM 98 N ASN A 11 -0.133 -0.608 -26.617 1.00 0.00 N ATOM 99 CA ASN A 11 -0.170 -1.134 -25.263 1.00 0.00 C ATOM 100 C ASN A 11 -1.490 -0.734 -24.601 1.00 0.00 C ATOM 101 O ASN A 11 -1.946 0.398 -24.752 1.00 0.00 O ATOM 102 CB ASN A 11 0.973 -0.565 -24.420 1.00 0.00 C ATOM 103 CG ASN A 11 1.051 -1.262 -23.061 1.00 0.00 C ATOM 104 OD1 ASN A 11 0.166 -1.156 -22.228 1.00 0.00 O ATOM 105 ND2 ASN A 11 2.158 -1.978 -22.883 1.00 0.00 N ATOM 0 H ASN A 11 -0.909 0.010 -26.856 1.00 0.00 H new ATOM 0 HA ASN A 11 -0.072 -2.218 -25.319 1.00 0.00 H new ATOM 0 HB2 ASN A 11 1.917 -0.688 -24.951 1.00 0.00 H new ATOM 0 HB3 ASN A 11 0.826 0.505 -24.276 1.00 0.00 H new ATOM 0 HD21 ASN A 11 2.305 -2.480 -22.008 1.00 0.00 H new ATOM 0 HD22 ASN A 11 2.860 -2.025 -23.622 1.00 0.00 H new ATOM 112 N ARG A 12 -2.066 -1.686 -23.882 1.00 0.00 N ATOM 113 CA ARG A 12 -3.324 -1.448 -23.196 1.00 0.00 C ATOM 114 C ARG A 12 -3.716 -2.671 -22.365 1.00 0.00 C ATOM 115 O ARG A 12 -3.432 -3.804 -22.751 1.00 0.00 O ATOM 116 CB ARG A 12 -4.444 -1.136 -24.192 1.00 0.00 C ATOM 117 CG ARG A 12 -5.407 -0.091 -23.624 1.00 0.00 C ATOM 118 CD ARG A 12 -5.223 1.259 -24.321 1.00 0.00 C ATOM 119 NE ARG A 12 -6.422 1.579 -25.127 1.00 0.00 N ATOM 120 CZ ARG A 12 -6.580 1.227 -26.411 1.00 0.00 C ATOM 121 NH1 ARG A 12 -5.617 0.541 -27.041 1.00 0.00 N ATOM 122 NH2 ARG A 12 -7.702 1.560 -27.064 1.00 0.00 N ATOM 0 H ARG A 12 -1.684 -2.624 -23.760 1.00 0.00 H new ATOM 0 HA ARG A 12 -3.186 -0.588 -22.540 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.015 -0.771 -25.125 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -4.990 -2.049 -24.428 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -6.435 -0.432 -23.749 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.237 0.022 -22.553 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -5.053 2.040 -23.580 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -4.341 1.230 -24.961 1.00 0.00 H new ATOM 0 HE ARG A 12 -7.175 2.100 -24.678 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -4.764 0.286 -26.544 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -5.737 0.273 -28.018 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.436 2.081 -26.584 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -7.822 1.292 -28.041 1.00 0.00 H new ATOM 136 N GLU A 13 -4.362 -2.401 -21.241 1.00 0.00 N ATOM 137 CA GLU A 13 -4.796 -3.466 -20.352 1.00 0.00 C ATOM 138 C GLU A 13 -5.884 -2.957 -19.405 1.00 0.00 C ATOM 139 O GLU A 13 -5.925 -1.770 -19.081 1.00 0.00 O ATOM 140 CB GLU A 13 -3.614 -4.043 -19.570 1.00 0.00 C ATOM 141 CG GLU A 13 -3.233 -5.428 -20.096 1.00 0.00 C ATOM 142 CD GLU A 13 -2.400 -6.195 -19.067 1.00 0.00 C ATOM 143 OE1 GLU A 13 -3.021 -6.758 -18.140 1.00 0.00 O ATOM 144 OE2 GLU A 13 -1.161 -6.202 -19.232 1.00 0.00 O ATOM 0 H GLU A 13 -4.596 -1.460 -20.925 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.216 -4.269 -20.957 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -2.759 -3.372 -19.649 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.870 -4.109 -18.513 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -4.135 -5.992 -20.332 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.669 -5.326 -21.023 1.00 0.00 H new ATOM 151 N ASN A 14 -6.738 -3.879 -18.986 1.00 0.00 N ATOM 152 CA ASN A 14 -7.824 -3.538 -18.082 1.00 0.00 C ATOM 153 C ASN A 14 -7.414 -3.879 -16.648 1.00 0.00 C ATOM 154 O ASN A 14 -7.421 -3.014 -15.774 1.00 0.00 O ATOM 155 CB ASN A 14 -9.088 -4.333 -18.414 1.00 0.00 C ATOM 156 CG ASN A 14 -9.828 -3.716 -19.602 1.00 0.00 C ATOM 157 OD1 ASN A 14 -9.606 -4.060 -20.752 1.00 0.00 O ATOM 158 ND2 ASN A 14 -10.717 -2.787 -19.263 1.00 0.00 N ATOM 0 H ASN A 14 -6.700 -4.862 -19.256 1.00 0.00 H new ATOM 0 HA ASN A 14 -8.030 -2.473 -18.189 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.823 -5.365 -18.643 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -9.745 -4.358 -17.545 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.262 -2.315 -19.985 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -10.854 -2.546 -18.281 1.00 0.00 H new ATOM 165 N LYS A 15 -7.065 -5.142 -16.451 1.00 0.00 N ATOM 166 CA LYS A 15 -6.653 -5.608 -15.138 1.00 0.00 C ATOM 167 C LYS A 15 -5.190 -5.226 -14.902 1.00 0.00 C ATOM 168 O LYS A 15 -4.510 -4.767 -15.818 1.00 0.00 O ATOM 169 CB LYS A 15 -6.928 -7.106 -14.990 1.00 0.00 C ATOM 170 CG LYS A 15 -8.415 -7.368 -14.744 1.00 0.00 C ATOM 171 CD LYS A 15 -9.080 -7.967 -15.986 1.00 0.00 C ATOM 172 CE LYS A 15 -8.703 -9.440 -16.153 1.00 0.00 C ATOM 173 NZ LYS A 15 -9.301 -9.991 -17.390 1.00 0.00 N ATOM 0 H LYS A 15 -7.059 -5.857 -17.179 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.240 -5.121 -14.360 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.607 -7.629 -15.891 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -6.343 -7.507 -14.163 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -8.533 -8.048 -13.900 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -8.912 -6.436 -14.475 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -10.163 -7.872 -15.905 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -8.777 -7.408 -16.871 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.618 -9.542 -16.190 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -9.048 -10.010 -15.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.035 -10.992 -17.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.337 -9.911 -17.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -8.952 -9.458 -18.212 1.00 0.00 H new ATOM 187 N GLU A 16 -4.750 -5.429 -13.669 1.00 0.00 N ATOM 188 CA GLU A 16 -3.381 -5.111 -13.301 1.00 0.00 C ATOM 189 C GLU A 16 -3.015 -3.706 -13.782 1.00 0.00 C ATOM 190 O GLU A 16 -2.539 -3.534 -14.904 1.00 0.00 O ATOM 191 CB GLU A 16 -2.408 -6.152 -13.857 1.00 0.00 C ATOM 192 CG GLU A 16 -2.354 -7.388 -12.956 1.00 0.00 C ATOM 193 CD GLU A 16 -1.757 -8.584 -13.702 1.00 0.00 C ATOM 194 OE1 GLU A 16 -2.363 -8.977 -14.722 1.00 0.00 O ATOM 195 OE2 GLU A 16 -0.708 -9.078 -13.234 1.00 0.00 O ATOM 0 H GLU A 16 -5.318 -5.810 -12.912 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.303 -5.133 -12.214 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.716 -6.443 -14.861 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.413 -5.716 -13.942 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.756 -7.171 -12.071 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.358 -7.635 -12.610 1.00 0.00 H new ATOM 202 N LYS A 17 -3.249 -2.736 -12.911 1.00 0.00 N ATOM 203 CA LYS A 17 -2.950 -1.351 -13.233 1.00 0.00 C ATOM 204 C LYS A 17 -1.842 -0.845 -12.307 1.00 0.00 C ATOM 205 O LYS A 17 -1.793 -1.211 -11.134 1.00 0.00 O ATOM 206 CB LYS A 17 -4.223 -0.504 -13.190 1.00 0.00 C ATOM 207 CG LYS A 17 -4.682 -0.277 -11.749 1.00 0.00 C ATOM 208 CD LYS A 17 -5.302 1.112 -11.583 1.00 0.00 C ATOM 209 CE LYS A 17 -6.808 1.014 -11.333 1.00 0.00 C ATOM 210 NZ LYS A 17 -7.547 1.008 -12.615 1.00 0.00 N ATOM 0 H LYS A 17 -3.643 -2.882 -11.981 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.575 -1.269 -14.253 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.042 0.456 -13.673 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.013 -1.000 -13.753 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.410 -1.039 -11.471 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.834 -0.384 -11.072 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -4.825 1.630 -10.751 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.116 1.706 -12.478 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.031 0.106 -10.774 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.136 1.854 -10.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.568 0.941 -12.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.348 1.886 -13.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.246 0.192 -13.185 1.00 0.00 H new ATOM 224 N LYS A 18 -0.981 -0.009 -12.869 1.00 0.00 N ATOM 225 CA LYS A 18 0.123 0.551 -12.109 1.00 0.00 C ATOM 226 C LYS A 18 -0.324 1.865 -11.463 1.00 0.00 C ATOM 227 O LYS A 18 -0.766 2.781 -12.154 1.00 0.00 O ATOM 228 CB LYS A 18 1.365 0.691 -12.991 1.00 0.00 C ATOM 229 CG LYS A 18 2.574 1.143 -12.168 1.00 0.00 C ATOM 230 CD LYS A 18 2.869 2.627 -12.397 1.00 0.00 C ATOM 231 CE LYS A 18 3.601 2.842 -13.723 1.00 0.00 C ATOM 232 NZ LYS A 18 2.809 3.716 -14.617 1.00 0.00 N ATOM 0 H LYS A 18 -1.026 0.294 -13.842 1.00 0.00 H new ATOM 0 HA LYS A 18 0.409 -0.122 -11.301 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.584 -0.263 -13.471 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.172 1.411 -13.786 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.385 0.965 -11.109 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.446 0.549 -12.440 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.936 3.191 -12.397 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.475 3.012 -11.577 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.577 3.290 -13.538 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.778 1.882 -14.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.320 3.851 -15.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.888 3.273 -14.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.662 4.638 -14.160 1.00 0.00 H new ATOM 246 N VAL A 19 -0.192 1.914 -10.146 1.00 0.00 N ATOM 247 CA VAL A 19 -0.577 3.100 -9.399 1.00 0.00 C ATOM 248 C VAL A 19 0.598 3.554 -8.530 1.00 0.00 C ATOM 249 O VAL A 19 1.158 2.761 -7.774 1.00 0.00 O ATOM 250 CB VAL A 19 -1.846 2.821 -8.591 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.091 2.917 -9.474 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.767 1.459 -7.899 1.00 0.00 C ATOM 0 H VAL A 19 0.176 1.152 -9.577 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.814 3.919 -10.078 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.925 3.585 -7.818 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.979 2.714 -8.875 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.160 3.919 -9.898 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.023 2.186 -10.280 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.681 1.286 -7.332 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.651 0.676 -8.649 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.912 1.443 -7.223 1.00 0.00 H new ATOM 262 N PHE A 20 0.937 4.827 -8.667 1.00 0.00 N ATOM 263 CA PHE A 20 2.035 5.396 -7.905 1.00 0.00 C ATOM 264 C PHE A 20 1.515 6.292 -6.779 1.00 0.00 C ATOM 265 O PHE A 20 0.857 7.299 -7.037 1.00 0.00 O ATOM 266 CB PHE A 20 2.862 6.243 -8.874 1.00 0.00 C ATOM 267 CG PHE A 20 4.374 6.123 -8.671 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.900 6.195 -7.419 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.192 5.944 -9.743 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.303 6.084 -7.230 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.595 5.833 -9.554 1.00 0.00 C ATOM 272 CZ PHE A 20 7.121 5.905 -8.302 1.00 0.00 C ATOM 0 H PHE A 20 0.470 5.481 -9.295 1.00 0.00 H new ATOM 0 HA PHE A 20 2.627 4.599 -7.455 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.619 5.950 -9.895 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.573 7.288 -8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.250 6.337 -6.568 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.775 5.886 -10.737 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.720 6.142 -6.236 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.245 5.691 -10.405 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.188 5.820 -8.159 1.00 0.00 H new ATOM 282 N ILE A 21 1.829 5.894 -5.555 1.00 0.00 N ATOM 283 CA ILE A 21 1.401 6.648 -4.390 1.00 0.00 C ATOM 284 C ILE A 21 2.610 7.359 -3.776 1.00 0.00 C ATOM 285 O ILE A 21 3.472 6.719 -3.176 1.00 0.00 O ATOM 286 CB ILE A 21 0.657 5.741 -3.408 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.596 5.146 -4.053 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.335 6.486 -2.110 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.728 6.173 -4.103 1.00 0.00 C ATOM 0 H ILE A 21 2.375 5.059 -5.345 1.00 0.00 H new ATOM 0 HA ILE A 21 0.688 7.421 -4.677 1.00 0.00 H new ATOM 0 HB ILE A 21 1.311 4.909 -3.148 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.363 4.807 -5.062 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.919 4.271 -3.489 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.194 5.819 -1.429 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.261 6.821 -1.643 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.292 7.349 -2.332 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.607 5.724 -4.566 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.975 6.492 -3.090 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.411 7.036 -4.688 1.00 0.00 H new ATOM 301 N SER A 22 2.634 8.672 -3.948 1.00 0.00 N ATOM 302 CA SER A 22 3.722 9.477 -3.418 1.00 0.00 C ATOM 303 C SER A 22 3.256 10.231 -2.171 1.00 0.00 C ATOM 304 O SER A 22 2.336 11.044 -2.240 1.00 0.00 O ATOM 305 CB SER A 22 4.243 10.459 -4.469 1.00 0.00 C ATOM 306 OG SER A 22 5.393 11.166 -4.015 1.00 0.00 O ATOM 0 H SER A 22 1.917 9.199 -4.447 1.00 0.00 H new ATOM 0 HA SER A 22 4.540 8.810 -3.146 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.488 9.916 -5.382 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.457 11.170 -4.722 1.00 0.00 H new ATOM 0 HG SER A 22 5.696 11.781 -4.715 1.00 0.00 H new ATOM 312 N LEU A 23 3.914 9.934 -1.060 1.00 0.00 N ATOM 313 CA LEU A 23 3.579 10.574 0.201 1.00 0.00 C ATOM 314 C LEU A 23 4.218 11.963 0.249 1.00 0.00 C ATOM 315 O LEU A 23 5.248 12.155 0.892 1.00 0.00 O ATOM 316 CB LEU A 23 3.969 9.677 1.378 1.00 0.00 C ATOM 317 CG LEU A 23 3.065 8.469 1.629 1.00 0.00 C ATOM 318 CD1 LEU A 23 1.679 8.910 2.104 1.00 0.00 C ATOM 319 CD2 LEU A 23 2.988 7.574 0.390 1.00 0.00 C ATOM 0 H LEU A 23 4.677 9.259 -1.007 1.00 0.00 H new ATOM 0 HA LEU A 23 2.501 10.715 0.281 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.985 9.318 1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.988 10.286 2.282 1.00 0.00 H new ATOM 0 HG LEU A 23 3.505 7.874 2.429 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.056 8.032 2.275 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.775 9.473 3.032 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.217 9.540 1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.339 6.723 0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.584 8.144 -0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.986 7.216 0.137 1.00 0.00 H new ATOM 331 N VAL A 24 3.580 12.897 -0.442 1.00 0.00 N ATOM 332 CA VAL A 24 4.073 14.263 -0.487 1.00 0.00 C ATOM 333 C VAL A 24 2.898 15.230 -0.324 1.00 0.00 C ATOM 334 O VAL A 24 1.744 14.846 -0.503 1.00 0.00 O ATOM 335 CB VAL A 24 4.862 14.493 -1.777 1.00 0.00 C ATOM 336 CG1 VAL A 24 5.807 13.322 -2.057 1.00 0.00 C ATOM 337 CG2 VAL A 24 3.921 14.733 -2.960 1.00 0.00 C ATOM 0 H VAL A 24 2.726 12.734 -0.975 1.00 0.00 H new ATOM 0 HA VAL A 24 4.763 14.447 0.337 1.00 0.00 H new ATOM 0 HB VAL A 24 5.468 15.389 -1.644 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.356 13.510 -2.980 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.510 13.217 -1.231 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.228 12.404 -2.160 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.507 14.894 -3.865 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.277 13.864 -3.095 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.308 15.612 -2.764 1.00 0.00 H new ATOM 347 N GLY A 25 3.234 16.467 0.014 1.00 0.00 N ATOM 348 CA GLY A 25 2.222 17.492 0.202 1.00 0.00 C ATOM 349 C GLY A 25 1.303 17.146 1.376 1.00 0.00 C ATOM 350 O GLY A 25 1.706 16.435 2.296 1.00 0.00 O ATOM 0 H GLY A 25 4.193 16.782 0.162 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.702 18.454 0.383 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.632 17.597 -0.708 1.00 0.00 H new ATOM 354 N SER A 26 0.086 17.664 1.306 1.00 0.00 N ATOM 355 CA SER A 26 -0.893 17.419 2.351 1.00 0.00 C ATOM 356 C SER A 26 -1.582 16.072 2.118 1.00 0.00 C ATOM 357 O SER A 26 -2.809 15.991 2.116 1.00 0.00 O ATOM 358 CB SER A 26 -1.930 18.542 2.409 1.00 0.00 C ATOM 359 OG SER A 26 -1.428 19.699 3.072 1.00 0.00 O ATOM 0 H SER A 26 -0.245 18.253 0.541 1.00 0.00 H new ATOM 0 HA SER A 26 -0.372 17.393 3.308 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.234 18.808 1.396 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.821 18.186 2.926 1.00 0.00 H new ATOM 0 HG SER A 26 -2.119 20.393 3.087 1.00 0.00 H new ATOM 365 N ARG A 27 -0.761 15.050 1.926 1.00 0.00 N ATOM 366 CA ARG A 27 -1.276 13.711 1.692 1.00 0.00 C ATOM 367 C ARG A 27 -0.453 12.683 2.470 1.00 0.00 C ATOM 368 O ARG A 27 0.773 12.773 2.520 1.00 0.00 O ATOM 369 CB ARG A 27 -1.242 13.360 0.203 1.00 0.00 C ATOM 370 CG ARG A 27 -2.167 14.279 -0.598 1.00 0.00 C ATOM 371 CD ARG A 27 -3.487 13.579 -0.924 1.00 0.00 C ATOM 372 NE ARG A 27 -4.434 14.541 -1.532 1.00 0.00 N ATOM 373 CZ ARG A 27 -5.031 15.534 -0.859 1.00 0.00 C ATOM 374 NH1 ARG A 27 -4.785 15.702 0.447 1.00 0.00 N ATOM 375 NH2 ARG A 27 -5.876 16.359 -1.493 1.00 0.00 N ATOM 0 H ARG A 27 0.256 15.122 1.928 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.310 13.689 2.035 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -0.222 13.448 -0.172 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -1.544 12.322 0.063 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.364 15.188 -0.029 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -1.674 14.582 -1.522 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -3.309 12.750 -1.608 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.918 13.156 -0.016 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.645 14.442 -2.525 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.143 15.074 0.930 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -5.240 16.458 0.959 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.064 16.231 -2.487 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -6.331 17.115 -0.981 1.00 0.00 H new ATOM 389 N GLY A 28 -1.160 11.729 3.058 1.00 0.00 N ATOM 390 CA GLY A 28 -0.510 10.684 3.831 1.00 0.00 C ATOM 391 C GLY A 28 -1.316 9.384 3.783 1.00 0.00 C ATOM 392 O GLY A 28 -1.422 8.678 4.785 1.00 0.00 O ATOM 0 H GLY A 28 -2.177 11.658 3.015 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.493 10.509 3.441 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.398 11.008 4.866 1.00 0.00 H new ATOM 396 N LEU A 29 -1.864 9.108 2.609 1.00 0.00 N ATOM 397 CA LEU A 29 -2.657 7.906 2.418 1.00 0.00 C ATOM 398 C LEU A 29 -3.881 7.956 3.335 1.00 0.00 C ATOM 399 O LEU A 29 -3.753 7.838 4.553 1.00 0.00 O ATOM 400 CB LEU A 29 -1.794 6.658 2.611 1.00 0.00 C ATOM 401 CG LEU A 29 -2.296 5.383 1.931 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.526 5.111 0.637 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.243 4.192 2.891 1.00 0.00 C ATOM 0 H LEU A 29 -1.774 9.696 1.781 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.028 7.853 1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.792 6.873 2.241 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.704 6.465 3.680 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.341 5.531 1.658 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.903 4.199 0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.659 5.948 -0.049 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.466 4.992 0.862 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.605 3.298 2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.215 4.033 3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.871 4.396 3.758 1.00 0.00 H new ATOM 415 N GLY A 30 -5.039 8.131 2.715 1.00 0.00 N ATOM 416 CA GLY A 30 -6.284 8.197 3.461 1.00 0.00 C ATOM 417 C GLY A 30 -7.105 6.921 3.272 1.00 0.00 C ATOM 418 O GLY A 30 -8.268 6.862 3.670 1.00 0.00 O ATOM 0 H GLY A 30 -5.141 8.229 1.705 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.070 8.342 4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.864 9.059 3.132 1.00 0.00 H new ATOM 422 N CYS A 31 -6.469 5.930 2.664 1.00 0.00 N ATOM 423 CA CYS A 31 -7.127 4.659 2.417 1.00 0.00 C ATOM 424 C CYS A 31 -6.621 3.648 3.448 1.00 0.00 C ATOM 425 O CYS A 31 -5.474 3.722 3.884 1.00 0.00 O ATOM 426 CB CYS A 31 -6.900 4.173 0.984 1.00 0.00 C ATOM 427 SG CYS A 31 -5.116 3.881 0.697 1.00 0.00 S ATOM 0 H CYS A 31 -5.505 5.982 2.335 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.205 4.778 2.524 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.460 3.254 0.810 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.274 4.913 0.277 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.557 3.491 1.804 1.00 0.00 H new ATOM 433 N SER A 32 -7.503 2.727 3.809 1.00 0.00 N ATOM 434 CA SER A 32 -7.161 1.703 4.781 1.00 0.00 C ATOM 435 C SER A 32 -6.921 0.368 4.073 1.00 0.00 C ATOM 436 O SER A 32 -7.649 0.013 3.147 1.00 0.00 O ATOM 437 CB SER A 32 -8.260 1.555 5.835 1.00 0.00 C ATOM 438 OG SER A 32 -7.754 1.706 7.159 1.00 0.00 O ATOM 0 H SER A 32 -8.454 2.669 3.445 1.00 0.00 H new ATOM 0 HA SER A 32 -6.246 2.007 5.290 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.036 2.299 5.656 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.728 0.576 5.735 1.00 0.00 H new ATOM 0 HG SER A 32 -8.486 1.606 7.802 1.00 0.00 H new ATOM 444 N ILE A 33 -5.898 -0.335 4.535 1.00 0.00 N ATOM 445 CA ILE A 33 -5.553 -1.623 3.957 1.00 0.00 C ATOM 446 C ILE A 33 -5.941 -2.735 4.933 1.00 0.00 C ATOM 447 O ILE A 33 -5.881 -2.549 6.148 1.00 0.00 O ATOM 448 CB ILE A 33 -4.078 -1.649 3.549 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.172 -1.370 4.750 1.00 0.00 C ATOM 450 CG2 ILE A 33 -3.812 -0.684 2.393 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.768 -1.932 4.520 1.00 0.00 C ATOM 0 H ILE A 33 -5.297 -0.037 5.303 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.117 -1.793 3.040 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.840 -2.651 3.192 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.113 -0.296 4.924 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.603 -1.815 5.647 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.757 -0.722 2.123 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.417 -0.971 1.533 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.072 0.330 2.698 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.144 -1.720 5.389 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.828 -3.010 4.371 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.330 -1.467 3.637 1.00 0.00 H new ATOM 463 N SER A 34 -6.330 -3.867 4.366 1.00 0.00 N ATOM 464 CA SER A 34 -6.728 -5.010 5.171 1.00 0.00 C ATOM 465 C SER A 34 -6.177 -6.299 4.558 1.00 0.00 C ATOM 466 O SER A 34 -6.081 -6.419 3.338 1.00 0.00 O ATOM 467 CB SER A 34 -8.251 -5.091 5.297 1.00 0.00 C ATOM 468 OG SER A 34 -8.799 -3.927 5.909 1.00 0.00 O ATOM 0 H SER A 34 -6.378 -4.018 3.358 1.00 0.00 H new ATOM 0 HA SER A 34 -6.314 -4.885 6.171 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.690 -5.221 4.308 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.520 -5.970 5.883 1.00 0.00 H new ATOM 0 HG SER A 34 -9.773 -4.017 5.970 1.00 0.00 H new ATOM 474 N SER A 35 -5.829 -7.230 5.434 1.00 0.00 N ATOM 475 CA SER A 35 -5.289 -8.506 4.995 1.00 0.00 C ATOM 476 C SER A 35 -6.426 -9.502 4.761 1.00 0.00 C ATOM 477 O SER A 35 -7.366 -9.573 5.551 1.00 0.00 O ATOM 478 CB SER A 35 -4.296 -9.064 6.015 1.00 0.00 C ATOM 479 OG SER A 35 -3.124 -8.260 6.115 1.00 0.00 O ATOM 0 H SER A 35 -5.910 -7.126 6.445 1.00 0.00 H new ATOM 0 HA SER A 35 -4.755 -8.347 4.058 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.776 -9.127 6.991 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.016 -10.079 5.731 1.00 0.00 H new ATOM 0 HG SER A 35 -2.516 -8.649 6.778 1.00 0.00 H new ATOM 485 N GLY A 36 -6.303 -10.247 3.672 1.00 0.00 N ATOM 486 CA GLY A 36 -7.309 -11.236 3.325 1.00 0.00 C ATOM 487 C GLY A 36 -7.153 -12.499 4.173 1.00 0.00 C ATOM 488 O GLY A 36 -6.242 -12.590 4.995 1.00 0.00 O ATOM 0 H GLY A 36 -5.522 -10.185 3.019 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.304 -10.815 3.473 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.224 -11.491 2.269 1.00 0.00 H new ATOM 492 N PRO A 37 -8.078 -13.468 3.939 1.00 0.00 N ATOM 493 CA PRO A 37 -8.051 -14.722 4.672 1.00 0.00 C ATOM 494 C PRO A 37 -6.925 -15.628 4.169 1.00 0.00 C ATOM 495 O PRO A 37 -6.086 -15.200 3.378 1.00 0.00 O ATOM 496 CB PRO A 37 -9.432 -15.324 4.472 1.00 0.00 C ATOM 497 CG PRO A 37 -10.023 -14.620 3.262 1.00 0.00 C ATOM 498 CD PRO A 37 -9.170 -13.395 2.973 1.00 0.00 C ATOM 0 HA PRO A 37 -7.841 -14.585 5.733 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.369 -16.399 4.306 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -10.055 -15.174 5.354 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.036 -15.288 2.401 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.055 -14.329 3.456 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.795 -13.406 1.950 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.744 -12.476 3.092 1.00 0.00 H new ATOM 506 N ILE A 38 -6.944 -16.863 4.648 1.00 0.00 N ATOM 507 CA ILE A 38 -5.935 -17.832 4.257 1.00 0.00 C ATOM 508 C ILE A 38 -6.207 -18.294 2.824 1.00 0.00 C ATOM 509 O ILE A 38 -5.280 -18.644 2.094 1.00 0.00 O ATOM 510 CB ILE A 38 -5.870 -18.977 5.270 1.00 0.00 C ATOM 511 CG1 ILE A 38 -4.908 -20.070 4.802 1.00 0.00 C ATOM 512 CG2 ILE A 38 -7.267 -19.529 5.563 1.00 0.00 C ATOM 513 CD1 ILE A 38 -4.330 -20.839 5.992 1.00 0.00 C ATOM 0 H ILE A 38 -7.642 -17.215 5.303 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.945 -17.375 4.263 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.476 -18.582 6.207 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.430 -20.759 4.138 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.098 -19.624 4.225 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.193 -20.342 6.286 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.893 -18.736 5.972 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.711 -19.903 4.641 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.649 -21.610 5.631 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.788 -20.151 6.641 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.141 -21.304 6.553 1.00 0.00 H new ATOM 525 N GLN A 39 -7.481 -18.280 2.463 1.00 0.00 N ATOM 526 CA GLN A 39 -7.887 -18.694 1.131 1.00 0.00 C ATOM 527 C GLN A 39 -7.603 -17.580 0.120 1.00 0.00 C ATOM 528 O GLN A 39 -7.323 -17.852 -1.046 1.00 0.00 O ATOM 529 CB GLN A 39 -9.363 -19.093 1.106 1.00 0.00 C ATOM 530 CG GLN A 39 -10.262 -17.890 1.396 1.00 0.00 C ATOM 531 CD GLN A 39 -11.665 -18.340 1.808 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.344 -19.069 1.102 1.00 0.00 O ATOM 533 NE2 GLN A 39 -12.061 -17.867 2.986 1.00 0.00 N ATOM 0 H GLN A 39 -8.247 -17.988 3.070 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.303 -19.571 0.851 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.613 -19.512 0.131 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -9.545 -19.874 1.845 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -9.822 -17.286 2.190 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.325 -17.257 0.511 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.443 -17.261 3.526 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -12.983 -18.110 3.349 1.00 0.00 H new ATOM 542 N LYS A 40 -7.685 -16.350 0.606 1.00 0.00 N ATOM 543 CA LYS A 40 -7.441 -15.194 -0.241 1.00 0.00 C ATOM 544 C LYS A 40 -6.575 -14.186 0.518 1.00 0.00 C ATOM 545 O LYS A 40 -7.003 -13.061 0.771 1.00 0.00 O ATOM 546 CB LYS A 40 -8.762 -14.612 -0.747 1.00 0.00 C ATOM 547 CG LYS A 40 -8.524 -13.334 -1.554 1.00 0.00 C ATOM 548 CD LYS A 40 -9.107 -13.459 -2.963 1.00 0.00 C ATOM 549 CE LYS A 40 -9.761 -12.148 -3.404 1.00 0.00 C ATOM 550 NZ LYS A 40 -11.163 -12.382 -3.818 1.00 0.00 N ATOM 0 H LYS A 40 -7.917 -16.129 1.574 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.886 -15.485 -1.133 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.274 -15.348 -1.367 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.416 -14.396 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -8.979 -12.486 -1.042 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.455 -13.132 -1.616 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.318 -13.730 -3.664 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.843 -14.263 -2.986 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.732 -11.427 -2.587 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.199 -11.714 -4.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.387 -11.784 -4.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.287 -13.382 -4.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.801 -12.145 -3.032 1.00 0.00 H new ATOM 564 N PRO A 41 -5.341 -14.638 0.869 1.00 0.00 N ATOM 565 CA PRO A 41 -4.411 -13.788 1.593 1.00 0.00 C ATOM 566 C PRO A 41 -3.800 -12.732 0.670 1.00 0.00 C ATOM 567 O PRO A 41 -3.584 -12.987 -0.513 1.00 0.00 O ATOM 568 CB PRO A 41 -3.377 -14.740 2.173 1.00 0.00 C ATOM 569 CG PRO A 41 -3.500 -16.026 1.371 1.00 0.00 C ATOM 570 CD PRO A 41 -4.800 -15.964 0.586 1.00 0.00 C ATOM 0 HA PRO A 41 -4.894 -13.215 2.385 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.373 -14.323 2.092 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.562 -14.921 3.232 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.652 -16.137 0.696 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.495 -16.891 2.034 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.625 -16.101 -0.481 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.489 -16.748 0.899 1.00 0.00 H new ATOM 578 N GLY A 42 -3.539 -11.568 1.247 1.00 0.00 N ATOM 579 CA GLY A 42 -2.957 -10.472 0.491 1.00 0.00 C ATOM 580 C GLY A 42 -3.282 -9.125 1.140 1.00 0.00 C ATOM 581 O GLY A 42 -3.724 -9.075 2.287 1.00 0.00 O ATOM 0 H GLY A 42 -3.720 -11.360 2.229 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.876 -10.600 0.432 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.336 -10.488 -0.531 1.00 0.00 H new ATOM 585 N ILE A 43 -3.050 -8.066 0.378 1.00 0.00 N ATOM 586 CA ILE A 43 -3.312 -6.723 0.864 1.00 0.00 C ATOM 587 C ILE A 43 -4.393 -6.073 -0.002 1.00 0.00 C ATOM 588 O ILE A 43 -4.160 -5.778 -1.174 1.00 0.00 O ATOM 589 CB ILE A 43 -2.014 -5.916 0.936 1.00 0.00 C ATOM 590 CG1 ILE A 43 -1.000 -6.589 1.863 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.290 -4.467 1.345 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.429 -6.466 3.327 1.00 0.00 C ATOM 0 H ILE A 43 -2.683 -8.112 -0.573 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.697 -6.756 1.883 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.573 -5.891 -0.060 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.901 -7.641 1.597 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.020 -6.132 1.728 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.351 -3.916 1.388 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.950 -4.002 0.613 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.766 -4.450 2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.691 -6.953 3.965 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.504 -5.413 3.597 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.399 -6.945 3.464 1.00 0.00 H new ATOM 604 N PHE A 44 -5.552 -5.870 0.607 1.00 0.00 N ATOM 605 CA PHE A 44 -6.669 -5.260 -0.095 1.00 0.00 C ATOM 606 C PHE A 44 -7.171 -4.019 0.646 1.00 0.00 C ATOM 607 O PHE A 44 -7.242 -4.012 1.874 1.00 0.00 O ATOM 608 CB PHE A 44 -7.790 -6.301 -0.140 1.00 0.00 C ATOM 609 CG PHE A 44 -7.318 -7.708 -0.514 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.527 -8.409 0.341 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.691 -8.256 -1.701 1.00 0.00 C ATOM 612 CE1 PHE A 44 -6.089 -9.715 -0.007 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.253 -9.562 -2.049 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.462 -10.263 -1.194 1.00 0.00 C ATOM 0 H PHE A 44 -5.742 -6.117 1.578 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.358 -4.953 -1.093 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.276 -6.339 0.835 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.543 -5.978 -0.859 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.232 -7.973 1.284 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.320 -7.699 -2.379 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.460 -10.272 0.671 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.548 -9.998 -2.992 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.130 -11.256 -1.458 1.00 0.00 H new ATOM 624 N ILE A 45 -7.505 -3.000 -0.131 1.00 0.00 N ATOM 625 CA ILE A 45 -7.998 -1.757 0.436 1.00 0.00 C ATOM 626 C ILE A 45 -9.367 -2.000 1.075 1.00 0.00 C ATOM 627 O ILE A 45 -10.204 -2.702 0.510 1.00 0.00 O ATOM 628 CB ILE A 45 -8.000 -0.650 -0.620 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.588 -0.109 -0.851 1.00 0.00 C ATOM 630 CG2 ILE A 45 -8.986 0.461 -0.249 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.607 1.082 -1.810 1.00 0.00 C ATOM 0 H ILE A 45 -7.444 -3.010 -1.149 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.334 -1.410 1.227 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.338 -1.079 -1.563 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.150 0.193 0.101 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -5.955 -0.898 -1.257 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.968 1.235 -1.016 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.991 0.046 -0.176 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.702 0.894 0.710 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.591 1.447 -1.957 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.023 0.771 -2.768 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.221 1.878 -1.389 1.00 0.00 H new ATOM 643 N SER A 46 -9.553 -1.405 2.244 1.00 0.00 N ATOM 644 CA SER A 46 -10.806 -1.549 2.966 1.00 0.00 C ATOM 645 C SER A 46 -11.675 -0.307 2.757 1.00 0.00 C ATOM 646 O SER A 46 -12.895 -0.412 2.639 1.00 0.00 O ATOM 647 CB SER A 46 -10.559 -1.778 4.459 1.00 0.00 C ATOM 648 OG SER A 46 -10.708 -0.579 5.215 1.00 0.00 O ATOM 0 H SER A 46 -8.857 -0.822 2.709 1.00 0.00 H new ATOM 0 HA SER A 46 -11.328 -2.422 2.574 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.255 -2.530 4.831 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.554 -2.175 4.603 1.00 0.00 H new ATOM 0 HG SER A 46 -10.544 -0.767 6.163 1.00 0.00 H new ATOM 654 N HIS A 47 -11.013 0.840 2.716 1.00 0.00 N ATOM 655 CA HIS A 47 -11.711 2.100 2.523 1.00 0.00 C ATOM 656 C HIS A 47 -10.788 3.094 1.816 1.00 0.00 C ATOM 657 O HIS A 47 -9.576 2.890 1.760 1.00 0.00 O ATOM 658 CB HIS A 47 -12.248 2.633 3.853 1.00 0.00 C ATOM 659 CG HIS A 47 -13.180 3.813 3.710 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.727 5.105 3.511 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.542 3.882 3.738 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.777 5.908 3.426 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.901 5.148 3.567 1.00 0.00 N ATOM 0 H HIS A 47 -10.001 0.923 2.813 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.580 1.945 1.883 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.773 1.829 4.370 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.407 2.922 4.483 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.214 3.048 3.876 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.748 6.977 3.272 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.860 5.496 3.545 1.00 0.00 H new ATOM 671 N VAL A 48 -11.396 4.148 1.293 1.00 0.00 N ATOM 672 CA VAL A 48 -10.644 5.175 0.591 1.00 0.00 C ATOM 673 C VAL A 48 -11.288 6.539 0.849 1.00 0.00 C ATOM 674 O VAL A 48 -12.444 6.761 0.491 1.00 0.00 O ATOM 675 CB VAL A 48 -10.549 4.830 -0.896 1.00 0.00 C ATOM 676 CG1 VAL A 48 -9.873 5.957 -1.679 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.818 3.502 -1.105 1.00 0.00 C ATOM 0 H VAL A 48 -12.401 4.314 1.341 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.621 5.223 0.965 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.563 4.718 -1.279 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -9.818 5.686 -2.733 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.452 6.874 -1.570 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.866 6.115 -1.293 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.764 3.280 -2.171 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.809 3.574 -0.698 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -10.359 2.705 -0.595 1.00 0.00 H new ATOM 687 N LYS A 49 -10.512 7.416 1.468 1.00 0.00 N ATOM 688 CA LYS A 49 -10.992 8.752 1.777 1.00 0.00 C ATOM 689 C LYS A 49 -11.195 9.531 0.476 1.00 0.00 C ATOM 690 O LYS A 49 -10.581 9.216 -0.542 1.00 0.00 O ATOM 691 CB LYS A 49 -10.053 9.444 2.767 1.00 0.00 C ATOM 692 CG LYS A 49 -10.652 9.455 4.175 1.00 0.00 C ATOM 693 CD LYS A 49 -10.072 10.599 5.009 1.00 0.00 C ATOM 694 CE LYS A 49 -10.274 10.345 6.504 1.00 0.00 C ATOM 695 NZ LYS A 49 -10.248 11.621 7.254 1.00 0.00 N ATOM 0 H LYS A 49 -9.554 7.228 1.764 1.00 0.00 H new ATOM 0 HA LYS A 49 -11.961 8.702 2.274 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.091 8.931 2.781 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.864 10.467 2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.735 9.559 4.112 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.451 8.503 4.667 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.009 10.707 4.795 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.550 11.537 4.728 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -11.226 9.839 6.668 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.493 9.682 6.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.386 11.431 8.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.330 12.089 7.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.009 12.241 6.911 1.00 0.00 H new ATOM 709 N PRO A 50 -12.081 10.560 0.553 1.00 0.00 N ATOM 710 CA PRO A 50 -12.372 11.386 -0.606 1.00 0.00 C ATOM 711 C PRO A 50 -11.222 12.353 -0.893 1.00 0.00 C ATOM 712 O PRO A 50 -10.787 13.086 -0.006 1.00 0.00 O ATOM 713 CB PRO A 50 -13.674 12.094 -0.267 1.00 0.00 C ATOM 714 CG PRO A 50 -13.819 11.999 1.243 1.00 0.00 C ATOM 715 CD PRO A 50 -12.827 10.962 1.742 1.00 0.00 C ATOM 0 HA PRO A 50 -12.477 10.804 -1.522 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.649 13.134 -0.592 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.518 11.622 -0.771 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -13.626 12.966 1.707 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.836 11.714 1.512 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.166 11.380 2.502 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -13.337 10.112 2.196 1.00 0.00 H new ATOM 723 N GLY A 51 -10.762 12.323 -2.135 1.00 0.00 N ATOM 724 CA GLY A 51 -9.670 13.188 -2.550 1.00 0.00 C ATOM 725 C GLY A 51 -8.377 12.828 -1.816 1.00 0.00 C ATOM 726 O GLY A 51 -7.450 13.634 -1.753 1.00 0.00 O ATOM 0 H GLY A 51 -11.125 11.713 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.519 13.098 -3.626 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.929 14.228 -2.350 1.00 0.00 H new ATOM 730 N SER A 52 -8.355 11.616 -1.281 1.00 0.00 N ATOM 731 CA SER A 52 -7.190 11.140 -0.554 1.00 0.00 C ATOM 732 C SER A 52 -6.001 10.997 -1.507 1.00 0.00 C ATOM 733 O SER A 52 -5.982 11.605 -2.576 1.00 0.00 O ATOM 734 CB SER A 52 -7.480 9.806 0.137 1.00 0.00 C ATOM 735 OG SER A 52 -7.371 8.705 -0.760 1.00 0.00 O ATOM 0 H SER A 52 -9.125 10.949 -1.336 1.00 0.00 H new ATOM 0 HA SER A 52 -6.944 11.871 0.216 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.785 9.669 0.966 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.483 9.829 0.563 1.00 0.00 H new ATOM 0 HG SER A 52 -8.266 8.425 -1.044 1.00 0.00 H new ATOM 741 N LEU A 53 -5.039 10.190 -1.084 1.00 0.00 N ATOM 742 CA LEU A 53 -3.850 9.959 -1.887 1.00 0.00 C ATOM 743 C LEU A 53 -4.112 8.807 -2.859 1.00 0.00 C ATOM 744 O LEU A 53 -3.469 8.713 -3.903 1.00 0.00 O ATOM 745 CB LEU A 53 -2.632 9.740 -0.988 1.00 0.00 C ATOM 746 CG LEU A 53 -1.309 9.467 -1.706 1.00 0.00 C ATOM 747 CD1 LEU A 53 -1.110 10.431 -2.877 1.00 0.00 C ATOM 748 CD2 LEU A 53 -0.134 9.505 -0.726 1.00 0.00 C ATOM 0 H LEU A 53 -5.059 9.688 -0.196 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.620 10.838 -2.489 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.506 10.621 -0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.842 8.902 -0.324 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.349 8.460 -2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.162 10.215 -3.369 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.925 10.310 -3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.101 11.456 -2.507 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.794 9.308 -1.263 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.081 10.489 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.277 8.746 0.043 1.00 0.00 H new ATOM 760 N SER A 54 -5.057 7.959 -2.481 1.00 0.00 N ATOM 761 CA SER A 54 -5.411 6.817 -3.307 1.00 0.00 C ATOM 762 C SER A 54 -6.609 7.164 -4.193 1.00 0.00 C ATOM 763 O SER A 54 -6.748 6.629 -5.292 1.00 0.00 O ATOM 764 CB SER A 54 -5.724 5.591 -2.446 1.00 0.00 C ATOM 765 OG SER A 54 -5.838 5.923 -1.065 1.00 0.00 O ATOM 0 H SER A 54 -5.588 8.040 -1.614 1.00 0.00 H new ATOM 0 HA SER A 54 -4.558 6.574 -3.940 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.654 5.136 -2.787 1.00 0.00 H new ATOM 0 HB3 SER A 54 -4.939 4.847 -2.576 1.00 0.00 H new ATOM 0 HG SER A 54 -5.275 5.320 -0.536 1.00 0.00 H new ATOM 771 N ALA A 55 -7.445 8.056 -3.681 1.00 0.00 N ATOM 772 CA ALA A 55 -8.627 8.480 -4.412 1.00 0.00 C ATOM 773 C ALA A 55 -8.204 9.363 -5.588 1.00 0.00 C ATOM 774 O ALA A 55 -8.980 9.577 -6.518 1.00 0.00 O ATOM 775 CB ALA A 55 -9.586 9.196 -3.460 1.00 0.00 C ATOM 0 H ALA A 55 -7.327 8.497 -2.769 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.156 7.619 -4.820 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.473 9.514 -4.008 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.879 8.517 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.091 10.068 -3.033 1.00 0.00 H new ATOM 781 N GLU A 56 -6.976 9.853 -5.507 1.00 0.00 N ATOM 782 CA GLU A 56 -6.441 10.708 -6.553 1.00 0.00 C ATOM 783 C GLU A 56 -5.960 9.864 -7.735 1.00 0.00 C ATOM 784 O GLU A 56 -6.062 10.286 -8.886 1.00 0.00 O ATOM 785 CB GLU A 56 -5.313 11.592 -6.015 1.00 0.00 C ATOM 786 CG GLU A 56 -4.254 10.753 -5.297 1.00 0.00 C ATOM 787 CD GLU A 56 -2.863 11.369 -5.463 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.668 12.482 -4.928 1.00 0.00 O ATOM 789 OE2 GLU A 56 -2.026 10.712 -6.120 1.00 0.00 O ATOM 0 H GLU A 56 -6.336 9.674 -4.733 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.238 11.365 -6.902 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.852 12.140 -6.837 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.723 12.333 -5.328 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.499 10.680 -4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.257 9.738 -5.696 1.00 0.00 H new ATOM 796 N VAL A 57 -5.445 8.687 -7.410 1.00 0.00 N ATOM 797 CA VAL A 57 -4.948 7.780 -8.430 1.00 0.00 C ATOM 798 C VAL A 57 -6.122 7.014 -9.042 1.00 0.00 C ATOM 799 O VAL A 57 -6.025 6.510 -10.159 1.00 0.00 O ATOM 800 CB VAL A 57 -3.878 6.861 -7.837 1.00 0.00 C ATOM 801 CG1 VAL A 57 -2.747 7.674 -7.203 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.489 5.890 -6.825 1.00 0.00 C ATOM 0 H VAL A 57 -5.361 8.341 -6.454 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.469 8.337 -9.235 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.453 6.273 -8.651 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.000 6.997 -6.789 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.284 8.306 -7.961 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.151 8.299 -6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.707 5.248 -6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -4.954 6.453 -6.015 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.242 5.276 -7.319 1.00 0.00 H new ATOM 812 N GLY A 58 -7.206 6.951 -8.282 1.00 0.00 N ATOM 813 CA GLY A 58 -8.398 6.254 -8.734 1.00 0.00 C ATOM 814 C GLY A 58 -8.548 4.906 -8.027 1.00 0.00 C ATOM 815 O GLY A 58 -9.245 4.018 -8.515 1.00 0.00 O ATOM 0 H GLY A 58 -7.283 7.371 -7.356 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.277 6.869 -8.542 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.346 6.099 -9.812 1.00 0.00 H new ATOM 819 N LEU A 59 -7.882 4.795 -6.886 1.00 0.00 N ATOM 820 CA LEU A 59 -7.932 3.571 -6.106 1.00 0.00 C ATOM 821 C LEU A 59 -9.313 3.438 -5.461 1.00 0.00 C ATOM 822 O LEU A 59 -9.916 4.436 -5.068 1.00 0.00 O ATOM 823 CB LEU A 59 -6.777 3.526 -5.103 1.00 0.00 C ATOM 824 CG LEU A 59 -5.435 3.035 -5.648 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.315 3.259 -4.630 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.524 1.573 -6.089 1.00 0.00 C ATOM 0 H LEU A 59 -7.305 5.534 -6.484 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.796 2.703 -6.751 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.637 4.527 -4.695 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.067 2.882 -4.273 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.190 3.624 -6.532 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.372 2.901 -5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.233 4.323 -4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.541 2.713 -3.714 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.556 1.249 -6.472 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.803 0.952 -5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.276 1.474 -6.872 1.00 0.00 H new ATOM 838 N GLU A 60 -9.773 2.199 -5.371 1.00 0.00 N ATOM 839 CA GLU A 60 -11.071 1.924 -4.780 1.00 0.00 C ATOM 840 C GLU A 60 -11.006 0.659 -3.921 1.00 0.00 C ATOM 841 O GLU A 60 -9.991 -0.035 -3.908 1.00 0.00 O ATOM 842 CB GLU A 60 -12.149 1.798 -5.858 1.00 0.00 C ATOM 843 CG GLU A 60 -12.302 3.107 -6.636 1.00 0.00 C ATOM 844 CD GLU A 60 -13.571 3.092 -7.491 1.00 0.00 C ATOM 845 OE1 GLU A 60 -13.477 2.604 -8.638 1.00 0.00 O ATOM 846 OE2 GLU A 60 -14.607 3.569 -6.978 1.00 0.00 O ATOM 0 H GLU A 60 -9.270 1.374 -5.698 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.341 2.763 -4.138 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -11.890 0.991 -6.544 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.100 1.531 -5.397 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.338 3.945 -5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.431 3.259 -7.274 1.00 0.00 H new ATOM 853 N ILE A 61 -12.102 0.399 -3.223 1.00 0.00 N ATOM 854 CA ILE A 61 -12.181 -0.769 -2.363 1.00 0.00 C ATOM 855 C ILE A 61 -12.084 -2.034 -3.218 1.00 0.00 C ATOM 856 O ILE A 61 -12.849 -2.208 -4.165 1.00 0.00 O ATOM 857 CB ILE A 61 -13.439 -0.709 -1.493 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.311 0.370 -0.417 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.757 -2.081 -0.895 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.676 0.972 -0.079 1.00 0.00 C ATOM 0 H ILE A 61 -12.942 0.977 -3.236 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.341 -0.789 -1.668 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.281 -0.431 -2.128 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.866 -0.058 0.481 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.639 1.155 -0.763 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.655 -2.011 -0.281 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.922 -2.799 -1.699 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.921 -2.412 -0.279 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.556 1.737 0.689 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.107 1.421 -0.974 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -15.338 0.188 0.289 1.00 0.00 H new ATOM 872 N GLY A 62 -11.136 -2.885 -2.853 1.00 0.00 N ATOM 873 CA GLY A 62 -10.929 -4.129 -3.574 1.00 0.00 C ATOM 874 C GLY A 62 -9.515 -4.197 -4.155 1.00 0.00 C ATOM 875 O GLY A 62 -8.891 -5.256 -4.157 1.00 0.00 O ATOM 0 H GLY A 62 -10.503 -2.737 -2.067 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.092 -4.973 -2.904 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.661 -4.214 -4.377 1.00 0.00 H new ATOM 879 N ASP A 63 -9.051 -3.052 -4.635 1.00 0.00 N ATOM 880 CA ASP A 63 -7.723 -2.968 -5.217 1.00 0.00 C ATOM 881 C ASP A 63 -6.733 -3.726 -4.331 1.00 0.00 C ATOM 882 O ASP A 63 -6.240 -3.187 -3.342 1.00 0.00 O ATOM 883 CB ASP A 63 -7.254 -1.514 -5.313 1.00 0.00 C ATOM 884 CG ASP A 63 -8.117 -0.613 -6.198 1.00 0.00 C ATOM 885 OD1 ASP A 63 -8.907 -1.179 -6.985 1.00 0.00 O ATOM 886 OD2 ASP A 63 -7.967 0.621 -6.069 1.00 0.00 O ATOM 0 H ASP A 63 -9.572 -2.175 -4.632 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.766 -3.400 -6.217 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.224 -1.091 -4.309 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.233 -1.502 -5.694 1.00 0.00 H new ATOM 891 N GLN A 64 -6.472 -4.966 -4.718 1.00 0.00 N ATOM 892 CA GLN A 64 -5.550 -5.805 -3.971 1.00 0.00 C ATOM 893 C GLN A 64 -4.107 -5.509 -4.387 1.00 0.00 C ATOM 894 O GLN A 64 -3.751 -5.661 -5.554 1.00 0.00 O ATOM 895 CB GLN A 64 -5.882 -7.287 -4.157 1.00 0.00 C ATOM 896 CG GLN A 64 -4.849 -8.172 -3.457 1.00 0.00 C ATOM 897 CD GLN A 64 -5.040 -9.642 -3.837 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.806 -9.987 -4.722 1.00 0.00 O ATOM 899 NE2 GLN A 64 -4.304 -10.486 -3.120 1.00 0.00 N ATOM 0 H GLN A 64 -6.883 -5.410 -5.539 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.657 -5.574 -2.911 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.874 -7.494 -3.757 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.911 -7.526 -5.220 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.844 -7.850 -3.730 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.939 -8.057 -2.377 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.683 -10.130 -2.393 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -4.361 -11.489 -3.297 1.00 0.00 H new ATOM 908 N ILE A 65 -3.317 -5.092 -3.409 1.00 0.00 N ATOM 909 CA ILE A 65 -1.921 -4.774 -3.659 1.00 0.00 C ATOM 910 C ILE A 65 -1.131 -6.072 -3.839 1.00 0.00 C ATOM 911 O ILE A 65 -0.899 -6.800 -2.876 1.00 0.00 O ATOM 912 CB ILE A 65 -1.372 -3.868 -2.555 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.273 -2.650 -2.346 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.076 -3.467 -2.844 1.00 0.00 C ATOM 915 CD1 ILE A 65 -1.946 -1.944 -1.029 1.00 0.00 C ATOM 0 H ILE A 65 -3.617 -4.967 -2.442 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.819 -4.207 -4.585 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.370 -4.431 -1.621 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.148 -1.955 -3.176 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.317 -2.962 -2.346 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.442 -2.823 -2.044 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.696 -4.361 -2.903 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.123 -2.930 -3.792 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.601 -1.082 -0.906 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.095 -2.635 -0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.908 -1.612 -1.042 1.00 0.00 H new ATOM 927 N VAL A 66 -0.740 -6.322 -5.080 1.00 0.00 N ATOM 928 CA VAL A 66 0.019 -7.519 -5.399 1.00 0.00 C ATOM 929 C VAL A 66 1.511 -7.180 -5.424 1.00 0.00 C ATOM 930 O VAL A 66 2.353 -8.054 -5.223 1.00 0.00 O ATOM 931 CB VAL A 66 -0.480 -8.120 -6.715 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.989 -8.366 -6.668 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.107 -7.228 -7.901 1.00 0.00 C ATOM 0 H VAL A 66 -0.935 -5.716 -5.877 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.129 -8.280 -4.633 1.00 0.00 H new ATOM 0 HB VAL A 66 0.012 -9.083 -6.852 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.318 -8.793 -7.615 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.220 -9.058 -5.858 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.506 -7.422 -6.497 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.473 -7.678 -8.824 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.559 -6.244 -7.773 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.977 -7.126 -7.952 1.00 0.00 H new ATOM 943 N GLU A 67 1.792 -5.909 -5.673 1.00 0.00 N ATOM 944 CA GLU A 67 3.168 -5.445 -5.727 1.00 0.00 C ATOM 945 C GLU A 67 3.246 -3.971 -5.323 1.00 0.00 C ATOM 946 O GLU A 67 2.269 -3.235 -5.454 1.00 0.00 O ATOM 947 CB GLU A 67 3.767 -5.665 -7.117 1.00 0.00 C ATOM 948 CG GLU A 67 5.135 -4.991 -7.237 1.00 0.00 C ATOM 949 CD GLU A 67 5.731 -5.204 -8.631 1.00 0.00 C ATOM 950 OE1 GLU A 67 6.308 -6.293 -8.841 1.00 0.00 O ATOM 951 OE2 GLU A 67 5.596 -4.274 -9.454 1.00 0.00 O ATOM 0 H GLU A 67 1.091 -5.187 -5.839 1.00 0.00 H new ATOM 0 HA GLU A 67 3.756 -6.028 -5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.866 -6.733 -7.309 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.093 -5.266 -7.875 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.037 -3.924 -7.039 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.811 -5.395 -6.483 1.00 0.00 H new ATOM 958 N VAL A 68 4.417 -3.584 -4.839 1.00 0.00 N ATOM 959 CA VAL A 68 4.636 -2.212 -4.415 1.00 0.00 C ATOM 960 C VAL A 68 6.119 -1.866 -4.567 1.00 0.00 C ATOM 961 O VAL A 68 6.979 -2.551 -4.016 1.00 0.00 O ATOM 962 CB VAL A 68 4.119 -2.016 -2.989 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.427 -0.606 -2.482 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.621 -2.315 -2.902 1.00 0.00 C ATOM 0 H VAL A 68 5.225 -4.197 -4.731 1.00 0.00 H new ATOM 0 HA VAL A 68 4.075 -1.523 -5.047 1.00 0.00 H new ATOM 0 HB VAL A 68 4.640 -2.724 -2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.048 -0.494 -1.466 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.505 -0.445 -2.488 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.947 0.127 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.280 -2.168 -1.877 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.077 -1.643 -3.566 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.438 -3.347 -3.201 1.00 0.00 H new ATOM 974 N ASN A 69 6.372 -0.803 -5.316 1.00 0.00 N ATOM 975 CA ASN A 69 7.735 -0.358 -5.547 1.00 0.00 C ATOM 976 C ASN A 69 8.609 -1.564 -5.898 1.00 0.00 C ATOM 977 O ASN A 69 9.782 -1.613 -5.533 1.00 0.00 O ATOM 978 CB ASN A 69 8.320 0.300 -4.295 1.00 0.00 C ATOM 979 CG ASN A 69 8.848 1.702 -4.608 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.827 2.164 -5.737 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.323 2.350 -3.548 1.00 0.00 N ATOM 0 H ASN A 69 5.656 -0.237 -5.771 1.00 0.00 H new ATOM 0 HA ASN A 69 7.719 0.366 -6.362 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.555 0.360 -3.520 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.127 -0.316 -3.899 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.700 3.292 -3.653 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.311 1.905 -2.630 1.00 0.00 H new ATOM 988 N GLY A 70 8.002 -2.507 -6.604 1.00 0.00 N ATOM 989 CA GLY A 70 8.710 -3.710 -7.009 1.00 0.00 C ATOM 990 C GLY A 70 8.887 -4.666 -5.827 1.00 0.00 C ATOM 991 O GLY A 70 9.900 -5.357 -5.730 1.00 0.00 O ATOM 0 H GLY A 70 7.029 -2.462 -6.906 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.159 -4.209 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.686 -3.443 -7.415 1.00 0.00 H new ATOM 995 N VAL A 71 7.886 -4.675 -4.959 1.00 0.00 N ATOM 996 CA VAL A 71 7.918 -5.534 -3.788 1.00 0.00 C ATOM 997 C VAL A 71 6.865 -6.634 -3.939 1.00 0.00 C ATOM 998 O VAL A 71 5.815 -6.414 -4.540 1.00 0.00 O ATOM 999 CB VAL A 71 7.732 -4.699 -2.520 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.783 -5.580 -1.270 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.772 -3.579 -2.444 1.00 0.00 C ATOM 0 H VAL A 71 7.047 -4.101 -5.044 1.00 0.00 H new ATOM 0 HA VAL A 71 8.889 -6.022 -3.700 1.00 0.00 H new ATOM 0 HB VAL A 71 6.745 -4.238 -2.564 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.648 -4.961 -0.383 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.988 -6.325 -1.317 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.749 -6.083 -1.218 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.618 -3.000 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.772 -4.012 -2.434 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.668 -2.926 -3.311 1.00 0.00 H new ATOM 1011 N ASP A 72 7.184 -7.794 -3.384 1.00 0.00 N ATOM 1012 CA ASP A 72 6.278 -8.929 -3.449 1.00 0.00 C ATOM 1013 C ASP A 72 5.219 -8.794 -2.354 1.00 0.00 C ATOM 1014 O ASP A 72 5.386 -9.321 -1.255 1.00 0.00 O ATOM 1015 CB ASP A 72 7.026 -10.244 -3.223 1.00 0.00 C ATOM 1016 CG ASP A 72 6.560 -11.411 -4.096 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.326 -11.553 -4.241 1.00 0.00 O ATOM 1018 OD2 ASP A 72 7.447 -12.135 -4.597 1.00 0.00 O ATOM 0 H ASP A 72 8.057 -7.973 -2.887 1.00 0.00 H new ATOM 0 HA ASP A 72 5.821 -8.939 -4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.088 -10.076 -3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.922 -10.529 -2.176 1.00 0.00 H new ATOM 1023 N PHE A 73 4.152 -8.084 -2.691 1.00 0.00 N ATOM 1024 CA PHE A 73 3.065 -7.873 -1.750 1.00 0.00 C ATOM 1025 C PHE A 73 1.987 -8.948 -1.907 1.00 0.00 C ATOM 1026 O PHE A 73 0.853 -8.764 -1.467 1.00 0.00 O ATOM 1027 CB PHE A 73 2.456 -6.506 -2.069 1.00 0.00 C ATOM 1028 CG PHE A 73 3.031 -5.359 -1.234 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.369 -5.120 -1.238 1.00 0.00 C ATOM 1030 CD2 PHE A 73 2.202 -4.579 -0.490 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.903 -4.056 -0.464 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.736 -3.515 0.285 1.00 0.00 C ATOM 1033 CZ PHE A 73 4.074 -3.275 0.281 1.00 0.00 C ATOM 0 H PHE A 73 4.017 -7.647 -3.603 1.00 0.00 H new ATOM 0 HA PHE A 73 3.443 -7.922 -0.729 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.613 -6.287 -3.125 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.379 -6.553 -1.910 1.00 0.00 H new ATOM 0 HD1 PHE A 73 5.026 -5.740 -1.830 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.139 -4.768 -0.488 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.966 -3.867 -0.467 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.079 -2.896 0.878 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.479 -2.465 0.869 1.00 0.00 H new ATOM 1043 N SER A 74 2.379 -10.046 -2.536 1.00 0.00 N ATOM 1044 CA SER A 74 1.460 -11.150 -2.757 1.00 0.00 C ATOM 1045 C SER A 74 1.216 -11.898 -1.445 1.00 0.00 C ATOM 1046 O SER A 74 0.084 -12.271 -1.141 1.00 0.00 O ATOM 1047 CB SER A 74 1.997 -12.108 -3.822 1.00 0.00 C ATOM 1048 OG SER A 74 0.983 -12.509 -4.739 1.00 0.00 O ATOM 0 H SER A 74 3.320 -10.195 -2.900 1.00 0.00 H new ATOM 0 HA SER A 74 0.515 -10.742 -3.117 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.809 -11.626 -4.367 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.417 -12.990 -3.338 1.00 0.00 H new ATOM 0 HG SER A 74 1.366 -13.119 -5.404 1.00 0.00 H new ATOM 1054 N ASN A 75 2.296 -12.094 -0.703 1.00 0.00 N ATOM 1055 CA ASN A 75 2.212 -12.791 0.569 1.00 0.00 C ATOM 1056 C ASN A 75 2.908 -11.958 1.648 1.00 0.00 C ATOM 1057 O ASN A 75 3.753 -12.468 2.382 1.00 0.00 O ATOM 1058 CB ASN A 75 2.910 -14.151 0.499 1.00 0.00 C ATOM 1059 CG ASN A 75 4.076 -14.119 -0.491 1.00 0.00 C ATOM 1060 OD1 ASN A 75 4.962 -13.283 -0.419 1.00 0.00 O ATOM 1061 ND2 ASN A 75 4.026 -15.073 -1.416 1.00 0.00 N ATOM 0 H ASN A 75 3.233 -11.783 -0.958 1.00 0.00 H new ATOM 0 HA ASN A 75 1.158 -12.938 0.804 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.276 -14.427 1.488 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.194 -14.916 0.199 1.00 0.00 H new ATOM 0 HD21 ASN A 75 4.758 -15.137 -2.123 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.255 -15.741 -1.418 1.00 0.00 H new ATOM 1068 N LEU A 76 2.526 -10.691 1.710 1.00 0.00 N ATOM 1069 CA LEU A 76 3.102 -9.783 2.687 1.00 0.00 C ATOM 1070 C LEU A 76 2.275 -9.833 3.973 1.00 0.00 C ATOM 1071 O LEU A 76 1.456 -10.732 4.154 1.00 0.00 O ATOM 1072 CB LEU A 76 3.238 -8.377 2.097 1.00 0.00 C ATOM 1073 CG LEU A 76 4.640 -7.978 1.630 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.689 -6.499 1.245 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.690 -8.331 2.686 1.00 0.00 C ATOM 0 H LEU A 76 1.825 -10.272 1.100 1.00 0.00 H new ATOM 0 HA LEU A 76 4.114 -10.094 2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.557 -8.292 1.250 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.907 -7.657 2.845 1.00 0.00 H new ATOM 0 HG LEU A 76 4.878 -8.552 0.734 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.696 -6.242 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.984 -6.310 0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.422 -5.889 2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.677 -8.037 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.466 -7.802 3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.675 -9.405 2.869 1.00 0.00 H new ATOM 1087 N ASP A 77 2.519 -8.855 4.833 1.00 0.00 N ATOM 1088 CA ASP A 77 1.807 -8.776 6.098 1.00 0.00 C ATOM 1089 C ASP A 77 1.280 -7.353 6.293 1.00 0.00 C ATOM 1090 O ASP A 77 1.644 -6.444 5.548 1.00 0.00 O ATOM 1091 CB ASP A 77 2.731 -9.104 7.272 1.00 0.00 C ATOM 1092 CG ASP A 77 2.071 -9.044 8.651 1.00 0.00 C ATOM 1093 OD1 ASP A 77 1.247 -9.943 8.925 1.00 0.00 O ATOM 1094 OD2 ASP A 77 2.405 -8.100 9.399 1.00 0.00 O ATOM 0 H ASP A 77 3.199 -8.111 4.679 1.00 0.00 H new ATOM 0 HA ASP A 77 0.990 -9.497 6.071 1.00 0.00 H new ATOM 0 HB2 ASP A 77 3.140 -10.104 7.125 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.572 -8.410 7.258 1.00 0.00 H new ATOM 1099 N HIS A 78 0.432 -7.203 7.300 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.148 -5.906 7.603 1.00 0.00 C ATOM 1101 C HIS A 78 0.926 -4.987 8.189 1.00 0.00 C ATOM 1102 O HIS A 78 0.686 -3.799 8.398 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.364 -6.055 8.520 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.075 -4.756 8.814 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.613 -3.844 9.748 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.216 -4.225 8.289 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.448 -2.815 9.775 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.441 -3.053 8.871 1.00 0.00 N ATOM 0 H HIS A 78 0.133 -7.959 7.916 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.512 -5.444 6.685 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.070 -6.748 8.061 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.044 -6.503 9.461 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.832 -4.681 7.528 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.358 -1.941 10.403 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -4.227 -2.433 8.674 1.00 0.00 H new ATOM 1116 N LYS A 79 2.089 -5.573 8.437 1.00 0.00 N ATOM 1117 CA LYS A 79 3.201 -4.822 8.994 1.00 0.00 C ATOM 1118 C LYS A 79 4.276 -4.639 7.920 1.00 0.00 C ATOM 1119 O LYS A 79 4.910 -3.587 7.845 1.00 0.00 O ATOM 1120 CB LYS A 79 3.714 -5.492 10.270 1.00 0.00 C ATOM 1121 CG LYS A 79 2.646 -5.477 11.365 1.00 0.00 C ATOM 1122 CD LYS A 79 3.246 -5.064 12.711 1.00 0.00 C ATOM 1123 CE LYS A 79 2.623 -3.759 13.211 1.00 0.00 C ATOM 1124 NZ LYS A 79 2.866 -3.591 14.661 1.00 0.00 N ATOM 0 H LYS A 79 2.285 -6.559 8.262 1.00 0.00 H new ATOM 0 HA LYS A 79 2.876 -3.826 9.293 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.004 -6.520 10.054 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.608 -4.976 10.622 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.849 -4.786 11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.195 -6.466 11.452 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.082 -5.854 13.444 1.00 0.00 H new ATOM 0 HD3 LYS A 79 4.324 -4.941 12.610 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.045 -2.915 12.665 1.00 0.00 H new ATOM 0 HE3 LYS A 79 1.551 -3.762 13.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.437 -2.701 14.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 2.442 -4.387 15.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.890 -3.567 14.841 1.00 0.00 H new ATOM 1138 N GLU A 80 4.448 -5.678 7.117 1.00 0.00 N ATOM 1139 CA GLU A 80 5.435 -5.645 6.051 1.00 0.00 C ATOM 1140 C GLU A 80 4.916 -4.819 4.873 1.00 0.00 C ATOM 1141 O GLU A 80 5.678 -4.092 4.237 1.00 0.00 O ATOM 1142 CB GLU A 80 5.808 -7.060 5.606 1.00 0.00 C ATOM 1143 CG GLU A 80 6.432 -7.851 6.758 1.00 0.00 C ATOM 1144 CD GLU A 80 7.738 -8.518 6.322 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.708 -7.766 6.086 1.00 0.00 O ATOM 1146 OE2 GLU A 80 7.736 -9.765 6.234 1.00 0.00 O ATOM 0 H GLU A 80 3.920 -6.548 7.183 1.00 0.00 H new ATOM 0 HA GLU A 80 6.338 -5.169 6.433 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.919 -7.577 5.244 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.509 -7.010 4.773 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.623 -7.185 7.599 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.730 -8.610 7.105 1.00 0.00 H new ATOM 1153 N ALA A 81 3.624 -4.957 4.618 1.00 0.00 N ATOM 1154 CA ALA A 81 2.994 -4.232 3.527 1.00 0.00 C ATOM 1155 C ALA A 81 2.935 -2.744 3.877 1.00 0.00 C ATOM 1156 O ALA A 81 2.932 -1.893 2.988 1.00 0.00 O ATOM 1157 CB ALA A 81 1.610 -4.822 3.253 1.00 0.00 C ATOM 0 H ALA A 81 2.995 -5.560 5.148 1.00 0.00 H new ATOM 0 HA ALA A 81 3.577 -4.333 2.612 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.138 -4.278 2.435 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.710 -5.873 2.980 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.994 -4.737 4.148 1.00 0.00 H new ATOM 1163 N VAL A 82 2.888 -2.475 5.173 1.00 0.00 N ATOM 1164 CA VAL A 82 2.829 -1.104 5.652 1.00 0.00 C ATOM 1165 C VAL A 82 4.251 -0.564 5.816 1.00 0.00 C ATOM 1166 O VAL A 82 4.508 0.609 5.547 1.00 0.00 O ATOM 1167 CB VAL A 82 2.010 -1.035 6.942 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.178 0.323 7.626 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.534 -1.334 6.672 1.00 0.00 C ATOM 0 H VAL A 82 2.890 -3.183 5.907 1.00 0.00 H new ATOM 0 HA VAL A 82 2.322 -0.468 4.927 1.00 0.00 H new ATOM 0 HB VAL A 82 2.388 -1.801 7.620 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.585 0.346 8.541 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.229 0.480 7.870 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.840 1.113 6.955 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.025 -1.278 7.606 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.138 -0.603 5.967 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.437 -2.334 6.250 1.00 0.00 H new ATOM 1179 N ASN A 83 5.137 -1.445 6.256 1.00 0.00 N ATOM 1180 CA ASN A 83 6.526 -1.071 6.459 1.00 0.00 C ATOM 1181 C ASN A 83 7.155 -0.708 5.112 1.00 0.00 C ATOM 1182 O ASN A 83 7.923 0.248 5.018 1.00 0.00 O ATOM 1183 CB ASN A 83 7.327 -2.229 7.058 1.00 0.00 C ATOM 1184 CG ASN A 83 8.778 -1.818 7.315 1.00 0.00 C ATOM 1185 OD1 ASN A 83 9.074 -0.981 8.152 1.00 0.00 O ATOM 1186 ND2 ASN A 83 9.663 -2.451 6.551 1.00 0.00 N ATOM 0 H ASN A 83 4.920 -2.417 6.478 1.00 0.00 H new ATOM 0 HA ASN A 83 6.550 -0.224 7.144 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.866 -2.550 7.992 1.00 0.00 H new ATOM 0 HB3 ASN A 83 7.302 -3.082 6.380 1.00 0.00 H new ATOM 0 HD21 ASN A 83 10.658 -2.247 6.646 1.00 0.00 H new ATOM 0 HD22 ASN A 83 9.347 -3.141 5.869 1.00 0.00 H new ATOM 1193 N VAL A 84 6.805 -1.492 4.102 1.00 0.00 N ATOM 1194 CA VAL A 84 7.325 -1.265 2.764 1.00 0.00 C ATOM 1195 C VAL A 84 6.632 -0.047 2.152 1.00 0.00 C ATOM 1196 O VAL A 84 7.236 0.690 1.374 1.00 0.00 O ATOM 1197 CB VAL A 84 7.166 -2.531 1.920 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.530 -2.264 0.458 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.999 -3.680 2.492 1.00 0.00 C ATOM 0 H VAL A 84 6.168 -2.285 4.184 1.00 0.00 H new ATOM 0 HA VAL A 84 8.392 -1.047 2.800 1.00 0.00 H new ATOM 0 HB VAL A 84 6.118 -2.828 1.955 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.408 -3.180 -0.120 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.875 -1.491 0.055 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.566 -1.931 0.396 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.868 -4.568 1.873 1.00 0.00 H new ATOM 0 HG22 VAL A 84 9.051 -3.397 2.502 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.672 -3.895 3.509 1.00 0.00 H new ATOM 1209 N LEU A 85 5.372 0.128 2.525 1.00 0.00 N ATOM 1210 CA LEU A 85 4.590 1.244 2.022 1.00 0.00 C ATOM 1211 C LEU A 85 5.033 2.529 2.725 1.00 0.00 C ATOM 1212 O LEU A 85 5.099 3.589 2.104 1.00 0.00 O ATOM 1213 CB LEU A 85 3.094 0.954 2.157 1.00 0.00 C ATOM 1214 CG LEU A 85 2.463 0.144 1.023 1.00 0.00 C ATOM 1215 CD1 LEU A 85 1.022 -0.242 1.360 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.559 0.895 -0.307 1.00 0.00 C ATOM 0 H LEU A 85 4.874 -0.485 3.170 1.00 0.00 H new ATOM 0 HA LEU A 85 4.769 1.385 0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.931 0.420 3.093 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.566 1.904 2.236 1.00 0.00 H new ATOM 0 HG LEU A 85 3.026 -0.782 0.911 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.597 -0.817 0.537 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.010 -0.845 2.268 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.430 0.660 1.515 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.103 0.297 -1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.036 1.848 -0.225 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.607 1.076 -0.548 1.00 0.00 H new ATOM 1228 N LYS A 86 5.326 2.393 4.010 1.00 0.00 N ATOM 1229 CA LYS A 86 5.760 3.529 4.803 1.00 0.00 C ATOM 1230 C LYS A 86 7.274 3.699 4.657 1.00 0.00 C ATOM 1231 O LYS A 86 7.854 4.634 5.207 1.00 0.00 O ATOM 1232 CB LYS A 86 5.296 3.380 6.253 1.00 0.00 C ATOM 1233 CG LYS A 86 6.364 2.689 7.103 1.00 0.00 C ATOM 1234 CD LYS A 86 5.895 2.529 8.550 1.00 0.00 C ATOM 1235 CE LYS A 86 4.798 1.466 8.656 1.00 0.00 C ATOM 1236 NZ LYS A 86 4.983 0.652 9.878 1.00 0.00 N ATOM 0 H LYS A 86 5.271 1.512 4.521 1.00 0.00 H new ATOM 0 HA LYS A 86 5.298 4.446 4.438 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.074 4.362 6.670 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.372 2.803 6.285 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.593 1.710 6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.286 3.270 7.078 1.00 0.00 H new ATOM 0 HD2 LYS A 86 6.739 2.250 9.181 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.520 3.482 8.922 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.819 1.945 8.676 1.00 0.00 H new ATOM 0 HE3 LYS A 86 4.820 0.823 7.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 4.231 -0.064 9.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.909 0.180 9.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.939 1.268 10.715 1.00 0.00 H new ATOM 1250 N SER A 87 7.871 2.780 3.912 1.00 0.00 N ATOM 1251 CA SER A 87 9.306 2.816 3.686 1.00 0.00 C ATOM 1252 C SER A 87 9.716 4.186 3.141 1.00 0.00 C ATOM 1253 O SER A 87 10.390 4.954 3.826 1.00 0.00 O ATOM 1254 CB SER A 87 9.740 1.710 2.723 1.00 0.00 C ATOM 1255 OG SER A 87 11.150 1.701 2.521 1.00 0.00 O ATOM 0 H SER A 87 7.387 2.006 3.457 1.00 0.00 H new ATOM 0 HA SER A 87 9.806 2.647 4.639 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.424 0.743 3.115 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.237 1.845 1.765 1.00 0.00 H new ATOM 0 HG SER A 87 11.387 0.980 1.902 1.00 0.00 H new ATOM 1261 N SER A 88 9.291 4.450 1.915 1.00 0.00 N ATOM 1262 CA SER A 88 9.605 5.714 1.270 1.00 0.00 C ATOM 1263 C SER A 88 8.318 6.492 0.987 1.00 0.00 C ATOM 1264 O SER A 88 7.236 6.082 1.406 1.00 0.00 O ATOM 1265 CB SER A 88 10.386 5.491 -0.027 1.00 0.00 C ATOM 1266 OG SER A 88 11.337 6.526 -0.261 1.00 0.00 O ATOM 0 H SER A 88 8.732 3.810 1.351 1.00 0.00 H new ATOM 0 HA SER A 88 10.232 6.296 1.945 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.899 4.531 0.019 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.691 5.441 -0.865 1.00 0.00 H new ATOM 0 HG SER A 88 11.816 6.347 -1.097 1.00 0.00 H new ATOM 1272 N ARG A 89 8.477 7.600 0.279 1.00 0.00 N ATOM 1273 CA ARG A 89 7.342 8.439 -0.064 1.00 0.00 C ATOM 1274 C ARG A 89 6.754 8.012 -1.410 1.00 0.00 C ATOM 1275 O ARG A 89 5.557 7.750 -1.514 1.00 0.00 O ATOM 1276 CB ARG A 89 7.747 9.912 -0.137 1.00 0.00 C ATOM 1277 CG ARG A 89 8.567 10.317 1.090 1.00 0.00 C ATOM 1278 CD ARG A 89 7.671 10.475 2.321 1.00 0.00 C ATOM 1279 NE ARG A 89 8.446 10.196 3.550 1.00 0.00 N ATOM 1280 CZ ARG A 89 9.296 11.064 4.116 1.00 0.00 C ATOM 1281 NH1 ARG A 89 9.485 12.271 3.566 1.00 0.00 N ATOM 1282 NH2 ARG A 89 9.956 10.725 5.231 1.00 0.00 N ATOM 0 H ARG A 89 9.376 7.936 -0.067 1.00 0.00 H new ATOM 0 HA ARG A 89 6.593 8.319 0.719 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.329 10.088 -1.042 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.855 10.535 -0.205 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.331 9.564 1.286 1.00 0.00 H new ATOM 0 HG3 ARG A 89 9.087 11.254 0.891 1.00 0.00 H new ATOM 0 HD2 ARG A 89 7.266 11.486 2.359 1.00 0.00 H new ATOM 0 HD3 ARG A 89 6.823 9.794 2.254 1.00 0.00 H new ATOM 0 HE ARG A 89 8.326 9.286 3.994 1.00 0.00 H new ATOM 0 HH11 ARG A 89 8.982 12.529 2.717 1.00 0.00 H new ATOM 0 HH12 ARG A 89 10.132 12.932 3.996 1.00 0.00 H new ATOM 0 HH21 ARG A 89 9.812 9.806 5.650 1.00 0.00 H new ATOM 0 HH22 ARG A 89 10.603 11.386 5.662 1.00 0.00 H new ATOM 1296 N SER A 90 7.624 7.954 -2.408 1.00 0.00 N ATOM 1297 CA SER A 90 7.207 7.563 -3.744 1.00 0.00 C ATOM 1298 C SER A 90 7.302 6.044 -3.898 1.00 0.00 C ATOM 1299 O SER A 90 8.396 5.482 -3.874 1.00 0.00 O ATOM 1300 CB SER A 90 8.053 8.259 -4.811 1.00 0.00 C ATOM 1301 OG SER A 90 9.273 8.767 -4.278 1.00 0.00 O ATOM 0 H SER A 90 8.616 8.171 -2.318 1.00 0.00 H new ATOM 0 HA SER A 90 6.171 7.872 -3.883 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.273 7.556 -5.614 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.481 9.076 -5.251 1.00 0.00 H new ATOM 0 HG SER A 90 9.785 9.202 -4.991 1.00 0.00 H new ATOM 1307 N LEU A 91 6.142 5.423 -4.053 1.00 0.00 N ATOM 1308 CA LEU A 91 6.081 3.980 -4.211 1.00 0.00 C ATOM 1309 C LEU A 91 5.139 3.637 -5.367 1.00 0.00 C ATOM 1310 O LEU A 91 4.164 4.347 -5.609 1.00 0.00 O ATOM 1311 CB LEU A 91 5.700 3.311 -2.889 1.00 0.00 C ATOM 1312 CG LEU A 91 6.569 3.670 -1.681 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.708 4.142 -0.508 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.477 2.502 -1.293 1.00 0.00 C ATOM 0 H LEU A 91 5.237 5.893 -4.073 1.00 0.00 H new ATOM 0 HA LEU A 91 7.063 3.584 -4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.667 3.570 -2.658 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.734 2.230 -3.028 1.00 0.00 H new ATOM 0 HG LEU A 91 7.216 4.501 -1.960 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.350 4.391 0.337 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.141 5.024 -0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.019 3.348 -0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 91 8.084 2.783 -0.432 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.867 1.635 -1.039 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.129 2.254 -2.131 1.00 0.00 H new ATOM 1326 N THR A 92 5.463 2.549 -6.050 1.00 0.00 N ATOM 1327 CA THR A 92 4.658 2.104 -7.175 1.00 0.00 C ATOM 1328 C THR A 92 3.857 0.857 -6.796 1.00 0.00 C ATOM 1329 O THR A 92 4.394 -0.250 -6.780 1.00 0.00 O ATOM 1330 CB THR A 92 5.590 1.888 -8.368 1.00 0.00 C ATOM 1331 OG1 THR A 92 5.952 3.207 -8.769 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.861 1.316 -9.585 1.00 0.00 C ATOM 0 H THR A 92 6.272 1.962 -5.846 1.00 0.00 H new ATOM 0 HA THR A 92 3.919 2.855 -7.454 1.00 0.00 H new ATOM 0 HB THR A 92 6.398 1.215 -8.080 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.142 3.742 -8.903 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.569 1.182 -10.403 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.420 0.354 -9.326 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.074 2.004 -9.894 1.00 0.00 H new ATOM 1340 N ILE A 93 2.584 1.077 -6.502 1.00 0.00 N ATOM 1341 CA ILE A 93 1.703 -0.016 -6.125 1.00 0.00 C ATOM 1342 C ILE A 93 1.052 -0.598 -7.381 1.00 0.00 C ATOM 1343 O ILE A 93 0.591 0.145 -8.246 1.00 0.00 O ATOM 1344 CB ILE A 93 0.697 0.447 -5.069 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.411 1.053 -3.859 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.242 -0.693 -4.669 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.548 2.127 -3.194 1.00 0.00 C ATOM 0 H ILE A 93 2.141 1.996 -6.517 1.00 0.00 H new ATOM 0 HA ILE A 93 2.272 -0.820 -5.659 1.00 0.00 H new ATOM 0 HB ILE A 93 0.081 1.233 -5.506 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.641 0.269 -3.138 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.361 1.487 -4.172 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -0.947 -0.337 -3.917 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.790 -1.038 -5.546 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.341 -1.517 -4.258 1.00 0.00 H new ATOM 0 HD11 ILE A 93 1.079 2.541 -2.337 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.340 2.922 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.390 1.684 -2.860 1.00 0.00 H new ATOM 1359 N SER A 94 1.037 -1.921 -7.442 1.00 0.00 N ATOM 1360 CA SER A 94 0.450 -2.611 -8.578 1.00 0.00 C ATOM 1361 C SER A 94 -0.805 -3.368 -8.140 1.00 0.00 C ATOM 1362 O SER A 94 -0.711 -4.448 -7.557 1.00 0.00 O ATOM 1363 CB SER A 94 1.454 -3.573 -9.217 1.00 0.00 C ATOM 1364 OG SER A 94 1.734 -3.231 -10.571 1.00 0.00 O ATOM 0 H SER A 94 1.422 -2.534 -6.723 1.00 0.00 H new ATOM 0 HA SER A 94 0.175 -1.866 -9.325 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.380 -3.565 -8.642 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.061 -4.589 -9.174 1.00 0.00 H new ATOM 0 HG SER A 94 2.380 -3.868 -10.942 1.00 0.00 H new ATOM 1370 N ILE A 95 -1.950 -2.773 -8.436 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.223 -3.377 -8.080 1.00 0.00 C ATOM 1372 C ILE A 95 -3.821 -4.059 -9.312 1.00 0.00 C ATOM 1373 O ILE A 95 -3.334 -3.874 -10.426 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.148 -2.341 -7.440 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.309 -1.117 -8.344 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.661 -1.960 -6.041 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.787 -0.793 -8.572 1.00 0.00 C ATOM 0 H ILE A 95 -2.024 -1.878 -8.919 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.080 -4.150 -7.325 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.135 -2.789 -7.326 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.811 -0.259 -7.892 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -3.822 -1.301 -9.301 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.337 -1.222 -5.609 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.641 -2.848 -5.409 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.658 -1.539 -6.107 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.872 0.081 -9.218 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.277 -1.644 -9.046 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.266 -0.585 -7.615 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.869 -4.833 -9.070 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.539 -5.543 -10.146 1.00 0.00 C ATOM 1391 C VAL A 96 -6.955 -4.988 -10.314 1.00 0.00 C ATOM 1392 O VAL A 96 -7.882 -5.730 -10.634 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.516 -7.049 -9.873 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.356 -7.806 -10.905 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -4.081 -7.578 -9.840 1.00 0.00 C ATOM 0 H VAL A 96 -5.270 -4.984 -8.145 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.015 -5.389 -11.089 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.958 -7.219 -8.891 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.323 -8.874 -10.688 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.388 -7.458 -10.860 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.956 -7.626 -11.903 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.093 -8.650 -9.644 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.602 -7.390 -10.801 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.525 -7.071 -9.051 1.00 0.00 H new ATOM 1405 N ALA A 97 -7.076 -3.688 -10.091 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.363 -3.024 -10.213 1.00 0.00 C ATOM 1407 C ALA A 97 -9.427 -3.847 -9.484 1.00 0.00 C ATOM 1408 O ALA A 97 -9.993 -4.780 -10.052 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.695 -2.822 -11.693 1.00 0.00 C ATOM 0 H ALA A 97 -6.304 -3.076 -9.826 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.332 -2.038 -9.748 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.660 -2.324 -11.785 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.924 -2.208 -12.158 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.737 -3.790 -12.192 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.668 -3.471 -8.236 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.655 -4.162 -7.424 1.00 0.00 C ATOM 1417 C ALA A 98 -10.502 -5.672 -7.619 1.00 0.00 C ATOM 1418 O ALA A 98 -11.437 -6.343 -8.053 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.055 -3.666 -7.789 1.00 0.00 C ATOM 0 H ALA A 98 -9.197 -2.697 -7.768 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.499 -3.948 -6.367 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.795 -4.185 -7.180 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.121 -2.594 -7.605 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.248 -3.866 -8.843 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.316 -6.162 -7.288 1.00 0.00 N ATOM 1426 CA ALA A 99 -9.030 -7.581 -7.421 1.00 0.00 C ATOM 1427 C ALA A 99 -9.980 -8.375 -6.523 1.00 0.00 C ATOM 1428 O ALA A 99 -10.813 -9.135 -7.014 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.559 -7.838 -7.086 1.00 0.00 C ATOM 0 H ALA A 99 -8.543 -5.602 -6.928 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.194 -7.911 -8.447 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.344 -8.902 -7.185 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.926 -7.274 -7.771 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.358 -7.521 -6.063 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.822 -8.173 -5.223 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.656 -8.861 -4.252 1.00 0.00 C ATOM 1437 C GLY A 100 -11.639 -7.894 -3.590 1.00 0.00 C ATOM 1438 O GLY A 100 -11.620 -7.720 -2.372 1.00 0.00 O ATOM 0 H GLY A 100 -9.129 -7.543 -4.820 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.206 -9.664 -4.743 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.028 -9.324 -3.491 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.475 -7.288 -4.421 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.464 -6.343 -3.932 1.00 0.00 C ATOM 1444 C ARG A 101 -14.610 -7.084 -3.241 1.00 0.00 C ATOM 1445 O ARG A 101 -15.378 -6.485 -2.490 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.028 -5.496 -5.074 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.367 -6.366 -6.286 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.384 -5.669 -7.193 1.00 0.00 C ATOM 1449 NE ARG A 101 -16.413 -6.636 -7.635 1.00 0.00 N ATOM 1450 CZ ARG A 101 -17.405 -6.341 -8.487 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -17.507 -5.104 -8.993 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -18.295 -7.282 -8.832 1.00 0.00 N ATOM 0 H ARG A 101 -12.487 -7.434 -5.430 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.969 -5.685 -3.217 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -14.922 -4.973 -4.736 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -13.302 -4.735 -5.360 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.459 -6.581 -6.849 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -14.768 -7.322 -5.951 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.854 -4.843 -6.659 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -14.879 -5.242 -8.059 1.00 0.00 H new ATOM 0 HE ARG A 101 -16.365 -7.587 -7.268 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -16.830 -4.388 -8.730 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.262 -4.879 -9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -18.218 -8.223 -8.446 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -19.050 -7.057 -9.480 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.690 -8.377 -3.520 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.729 -9.206 -2.935 1.00 0.00 C ATOM 1468 C GLU A 102 -15.497 -9.366 -1.431 1.00 0.00 C ATOM 1469 O GLU A 102 -16.450 -9.442 -0.656 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.799 -10.569 -3.627 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.642 -11.468 -3.185 1.00 0.00 C ATOM 1472 CD GLU A 102 -14.793 -12.877 -3.761 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -14.587 -13.015 -4.986 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -15.110 -13.785 -2.963 1.00 0.00 O ATOM 0 H GLU A 102 -14.052 -8.871 -4.144 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.688 -8.710 -3.084 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.748 -11.051 -3.394 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -15.767 -10.434 -4.708 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.696 -11.037 -3.512 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.610 -11.517 -2.097 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.225 -9.414 -1.063 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.855 -9.564 0.334 1.00 0.00 C ATOM 1483 C LEU A 103 -14.696 -8.609 1.185 1.00 0.00 C ATOM 1484 O LEU A 103 -15.111 -8.958 2.289 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.347 -9.380 0.512 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.456 -10.327 -0.294 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -9.976 -10.050 -0.025 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.824 -11.788 -0.026 1.00 0.00 C ATOM 0 H LEU A 103 -13.438 -9.352 -1.708 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.072 -10.575 0.679 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.092 -8.355 0.242 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.109 -9.500 1.569 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.631 -10.140 -1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.365 -10.737 -0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.741 -9.024 -0.308 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.766 -10.191 1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.175 -12.440 -0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.697 -12.007 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.862 -11.960 -0.310 1.00 0.00 H new ATOM 1500 N PHE A 104 -14.921 -7.424 0.639 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.704 -6.416 1.334 1.00 0.00 C ATOM 1502 C PHE A 104 -17.088 -6.264 0.699 1.00 0.00 C ATOM 1503 O PHE A 104 -17.502 -5.155 0.362 1.00 0.00 O ATOM 1504 CB PHE A 104 -14.948 -5.093 1.203 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.442 -5.211 1.445 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -12.956 -5.231 2.715 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.588 -5.295 0.390 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.558 -5.341 2.940 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.190 -5.404 0.614 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.705 -5.425 1.884 1.00 0.00 C ATOM 0 H PHE A 104 -14.575 -7.138 -0.277 1.00 0.00 H new ATOM 0 HA PHE A 104 -15.841 -6.704 2.376 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.115 -4.688 0.205 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.364 -4.377 1.911 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.634 -5.163 3.553 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.973 -5.279 -0.619 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.173 -5.358 3.949 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.512 -5.470 -0.224 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.642 -5.508 2.054 1.00 0.00 H new ATOM 1520 N MET A 105 -17.766 -7.393 0.556 1.00 0.00 N ATOM 1521 CA MET A 105 -19.095 -7.399 -0.032 1.00 0.00 C ATOM 1522 C MET A 105 -20.058 -6.532 0.781 1.00 0.00 C ATOM 1523 O MET A 105 -20.120 -6.646 2.004 1.00 0.00 O ATOM 1524 CB MET A 105 -19.622 -8.834 -0.088 1.00 0.00 C ATOM 1525 CG MET A 105 -19.475 -9.418 -1.495 1.00 0.00 C ATOM 1526 SD MET A 105 -21.052 -10.022 -2.073 1.00 0.00 S ATOM 1527 CE MET A 105 -21.004 -9.445 -3.762 1.00 0.00 C ATOM 0 H MET A 105 -17.420 -8.310 0.837 1.00 0.00 H new ATOM 0 HA MET A 105 -19.028 -6.988 -1.039 1.00 0.00 H new ATOM 0 HB2 MET A 105 -19.078 -9.453 0.625 1.00 0.00 H new ATOM 0 HB3 MET A 105 -20.671 -8.852 0.209 1.00 0.00 H new ATOM 0 HG2 MET A 105 -19.096 -8.656 -2.176 1.00 0.00 H new ATOM 0 HG3 MET A 105 -18.747 -10.229 -1.487 1.00 0.00 H new ATOM 0 HE1 MET A 105 -21.921 -9.739 -4.273 1.00 0.00 H new ATOM 0 HE2 MET A 105 -20.915 -8.359 -3.773 1.00 0.00 H new ATOM 0 HE3 MET A 105 -20.147 -9.885 -4.272 1.00 0.00 H new ATOM 1537 N THR A 106 -20.786 -5.685 0.068 1.00 0.00 N ATOM 1538 CA THR A 106 -21.743 -4.799 0.709 1.00 0.00 C ATOM 1539 C THR A 106 -22.691 -5.597 1.606 1.00 0.00 C ATOM 1540 O THR A 106 -22.981 -6.760 1.329 1.00 0.00 O ATOM 1541 CB THR A 106 -22.463 -4.009 -0.387 1.00 0.00 C ATOM 1542 OG1 THR A 106 -22.963 -2.858 0.287 1.00 0.00 O ATOM 1543 CG2 THR A 106 -23.720 -4.721 -0.891 1.00 0.00 C ATOM 0 H THR A 106 -20.732 -5.594 -0.946 1.00 0.00 H new ATOM 0 HA THR A 106 -21.245 -4.088 1.368 1.00 0.00 H new ATOM 0 HB THR A 106 -21.782 -3.841 -1.221 1.00 0.00 H new ATOM 0 HG1 THR A 106 -23.443 -2.289 -0.350 1.00 0.00 H new ATOM 0 HG21 THR A 106 -24.193 -4.119 -1.667 1.00 0.00 H new ATOM 0 HG22 THR A 106 -23.448 -5.693 -1.302 1.00 0.00 H new ATOM 0 HG23 THR A 106 -24.416 -4.859 -0.064 1.00 0.00 H new ATOM 1551 N ASP A 107 -23.149 -4.940 2.662 1.00 0.00 N ATOM 1552 CA ASP A 107 -24.058 -5.574 3.601 1.00 0.00 C ATOM 1553 C ASP A 107 -24.165 -4.713 4.861 1.00 0.00 C ATOM 1554 O ASP A 107 -23.247 -3.959 5.181 1.00 0.00 O ATOM 1555 CB ASP A 107 -23.548 -6.956 4.014 1.00 0.00 C ATOM 1556 CG ASP A 107 -24.534 -8.104 3.786 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -25.077 -8.171 2.662 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -24.723 -8.888 4.742 1.00 0.00 O ATOM 0 H ASP A 107 -22.907 -3.975 2.888 1.00 0.00 H new ATOM 0 HA ASP A 107 -25.027 -5.679 3.114 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -22.632 -7.169 3.462 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -23.284 -6.928 5.071 1.00 0.00 H new ATOM 1563 N ARG A 108 -25.292 -4.855 5.543 1.00 0.00 N ATOM 1564 CA ARG A 108 -25.530 -4.100 6.761 1.00 0.00 C ATOM 1565 C ARG A 108 -24.349 -4.254 7.721 1.00 0.00 C ATOM 1566 O ARG A 108 -23.934 -5.371 8.026 1.00 0.00 O ATOM 1567 CB ARG A 108 -26.809 -4.568 7.458 1.00 0.00 C ATOM 1568 CG ARG A 108 -27.276 -3.543 8.493 1.00 0.00 C ATOM 1569 CD ARG A 108 -28.599 -3.971 9.131 1.00 0.00 C ATOM 1570 NE ARG A 108 -28.673 -3.477 10.524 1.00 0.00 N ATOM 1571 CZ ARG A 108 -27.884 -3.910 11.517 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -26.957 -4.847 11.277 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -28.021 -3.405 12.751 1.00 0.00 N ATOM 0 H ARG A 108 -26.051 -5.482 5.275 1.00 0.00 H new ATOM 0 HA ARG A 108 -25.643 -3.052 6.484 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -27.594 -4.726 6.718 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -26.632 -5.527 7.945 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -26.516 -3.429 9.266 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -27.396 -2.570 8.018 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -29.435 -3.578 8.552 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -28.684 -5.058 9.117 1.00 0.00 H new ATOM 0 HE ARG A 108 -29.368 -2.763 10.742 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -26.851 -5.231 10.338 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -26.357 -5.176 12.033 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -28.726 -2.691 12.934 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -27.420 -3.735 13.507 1.00 0.00 H new ATOM 1587 N SER A 109 -23.840 -3.116 8.170 1.00 0.00 N ATOM 1588 CA SER A 109 -22.714 -3.111 9.089 1.00 0.00 C ATOM 1589 C SER A 109 -22.726 -1.829 9.923 1.00 0.00 C ATOM 1590 O SER A 109 -23.703 -1.082 9.906 1.00 0.00 O ATOM 1591 CB SER A 109 -21.389 -3.242 8.336 1.00 0.00 C ATOM 1592 OG SER A 109 -20.428 -3.993 9.074 1.00 0.00 O ATOM 0 H SER A 109 -24.186 -2.191 7.915 1.00 0.00 H new ATOM 0 HA SER A 109 -22.810 -3.970 9.753 1.00 0.00 H new ATOM 0 HB2 SER A 109 -21.565 -3.724 7.374 1.00 0.00 H new ATOM 0 HB3 SER A 109 -20.991 -2.249 8.127 1.00 0.00 H new ATOM 0 HG SER A 109 -19.596 -4.056 8.559 1.00 0.00 H new ATOM 1598 N GLY A 110 -21.629 -1.613 10.634 1.00 0.00 N ATOM 1599 CA GLY A 110 -21.501 -0.434 11.473 1.00 0.00 C ATOM 1600 C GLY A 110 -22.643 -0.357 12.488 1.00 0.00 C ATOM 1601 O GLY A 110 -23.600 0.392 12.296 1.00 0.00 O ATOM 0 H GLY A 110 -20.821 -2.235 10.646 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -20.545 -0.458 11.997 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -21.501 0.461 10.851 1.00 0.00 H new ATOM 1605 N PRO A 111 -22.502 -1.163 13.575 1.00 0.00 N ATOM 1606 CA PRO A 111 -23.511 -1.193 14.620 1.00 0.00 C ATOM 1607 C PRO A 111 -23.431 0.060 15.496 1.00 0.00 C ATOM 1608 O PRO A 111 -22.767 0.056 16.531 1.00 0.00 O ATOM 1609 CB PRO A 111 -23.240 -2.474 15.391 1.00 0.00 C ATOM 1610 CG PRO A 111 -21.816 -2.876 15.045 1.00 0.00 C ATOM 1611 CD PRO A 111 -21.383 -2.063 13.836 1.00 0.00 C ATOM 0 HA PRO A 111 -24.527 -1.189 14.224 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -23.351 -2.315 16.464 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -23.946 -3.256 15.110 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -21.151 -2.690 15.888 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -21.763 -3.943 14.827 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -20.467 -1.508 14.039 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -21.183 -2.705 12.978 1.00 0.00 H new ATOM 1619 N SER A 112 -24.116 1.101 15.047 1.00 0.00 N ATOM 1620 CA SER A 112 -24.131 2.358 15.777 1.00 0.00 C ATOM 1621 C SER A 112 -25.325 2.394 16.732 1.00 0.00 C ATOM 1622 O SER A 112 -25.150 2.448 17.949 1.00 0.00 O ATOM 1623 CB SER A 112 -24.182 3.550 14.819 1.00 0.00 C ATOM 1624 OG SER A 112 -24.344 4.784 15.511 1.00 0.00 O ATOM 0 H SER A 112 -24.665 1.100 14.187 1.00 0.00 H new ATOM 0 HA SER A 112 -23.209 2.429 16.355 1.00 0.00 H new ATOM 0 HB2 SER A 112 -23.265 3.582 14.231 1.00 0.00 H new ATOM 0 HB3 SER A 112 -25.006 3.417 14.118 1.00 0.00 H new ATOM 0 HG SER A 112 -24.370 5.520 14.865 1.00 0.00 H new ATOM 1630 N SER A 113 -26.513 2.363 16.146 1.00 0.00 N ATOM 1631 CA SER A 113 -27.736 2.391 16.930 1.00 0.00 C ATOM 1632 C SER A 113 -28.437 1.033 16.857 1.00 0.00 C ATOM 1633 O SER A 113 -28.223 0.271 15.915 1.00 0.00 O ATOM 1634 CB SER A 113 -28.674 3.499 16.448 1.00 0.00 C ATOM 1635 OG SER A 113 -28.830 4.528 17.422 1.00 0.00 O ATOM 0 H SER A 113 -26.655 2.319 15.137 1.00 0.00 H new ATOM 0 HA SER A 113 -27.472 2.601 17.967 1.00 0.00 H new ATOM 0 HB2 SER A 113 -28.283 3.929 15.526 1.00 0.00 H new ATOM 0 HB3 SER A 113 -29.649 3.072 16.213 1.00 0.00 H new ATOM 0 HG SER A 113 -29.435 5.217 17.076 1.00 0.00 H new ATOM 1641 N GLY A 114 -29.259 0.772 17.863 1.00 0.00 N ATOM 1642 CA GLY A 114 -29.992 -0.481 17.924 1.00 0.00 C ATOM 1643 C GLY A 114 -31.373 -0.340 17.280 1.00 0.00 C ATOM 1644 O GLY A 114 -31.638 -0.931 16.234 1.00 0.00 O ATOM 0 H GLY A 114 -29.433 1.407 18.642 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -29.427 -1.262 17.415 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -30.101 -0.792 18.963 1.00 0.00 H new TER 1648 GLY A 114