USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=27 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 180:sc= -2.46 USER MOD Set 1.2: A 52 SER OG : rot -89:sc= 1.02 USER MOD Set 1.3: A 54 SER OG : rot 58:sc= -0.404 USER MOD Set 2.1: A 22 SER OG : rot 180:sc= -0.827 USER MOD Set 2.2: A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -142:sc= 0.0763 (180deg=0) USER MOD Single : A 2 SER OG : rot 40:sc= 0.204 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= -0.577 X(o=-0.58,f=-1.1) USER MOD Single : A 14 ASN :FLIP amide:sc= 1.03 F(o=-0.57,f=1) 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 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 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0121 X(o=-0.012,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -2.66 K(o=-2.7,f=-3.3!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -1.3 K(o=-1.3,f=-2.5) USER MOD Single : A 69 ASN : amide:sc= -7.32! C(o=-7.3!,f=-8.1!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.126 X(o=-0.13,f=-0.12) USER MOD Single : A 78 HIS : no HE2:sc= -0.893 K(o=-0.89,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 X(o=0,f=-0.31) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 66:sc= 0.229 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -53:sc= -2.87! 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 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 18:sc= 0.967 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.629 -16.990 -26.186 1.00 0.00 N ATOM 2 CA GLY A 1 13.563 -17.341 -25.264 1.00 0.00 C ATOM 3 C GLY A 1 12.494 -18.186 -25.958 1.00 0.00 C ATOM 4 O GLY A 1 12.744 -18.765 -27.014 1.00 0.00 O ATOM 0 H1 GLY A 1 15.542 -17.023 -25.690 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.640 -17.665 -26.977 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.469 -16.030 -26.553 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.975 -17.892 -24.419 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.111 -16.434 -24.863 1.00 0.00 H new ATOM 8 N SER A 2 11.324 -18.230 -25.337 1.00 0.00 N ATOM 9 CA SER A 2 10.215 -18.994 -25.882 1.00 0.00 C ATOM 10 C SER A 2 8.894 -18.489 -25.299 1.00 0.00 C ATOM 11 O SER A 2 8.581 -18.755 -24.140 1.00 0.00 O ATOM 12 CB SER A 2 10.384 -20.488 -25.598 1.00 0.00 C ATOM 13 OG SER A 2 10.966 -21.179 -26.700 1.00 0.00 O ATOM 0 H SER A 2 11.120 -17.749 -24.461 1.00 0.00 H new ATOM 0 HA SER A 2 10.203 -18.856 -26.963 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.010 -20.621 -24.716 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.412 -20.925 -25.368 1.00 0.00 H new ATOM 0 HG SER A 2 11.670 -20.626 -27.098 1.00 0.00 H new ATOM 19 N SER A 3 8.155 -17.768 -26.129 1.00 0.00 N ATOM 20 CA SER A 3 6.875 -17.222 -25.710 1.00 0.00 C ATOM 21 C SER A 3 5.854 -17.355 -26.842 1.00 0.00 C ATOM 22 O SER A 3 6.216 -17.662 -27.977 1.00 0.00 O ATOM 23 CB SER A 3 7.012 -15.758 -25.288 1.00 0.00 C ATOM 24 OG SER A 3 7.587 -14.957 -26.316 1.00 0.00 O ATOM 0 H SER A 3 8.418 -17.549 -27.090 1.00 0.00 H new ATOM 0 HA SER A 3 6.527 -17.789 -24.847 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.030 -15.363 -25.027 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.629 -15.695 -24.392 1.00 0.00 H new ATOM 0 HG SER A 3 7.656 -14.029 -26.008 1.00 0.00 H new ATOM 30 N GLY A 4 4.598 -17.118 -26.493 1.00 0.00 N ATOM 31 CA GLY A 4 3.522 -17.207 -27.466 1.00 0.00 C ATOM 32 C GLY A 4 2.231 -16.599 -26.913 1.00 0.00 C ATOM 33 O GLY A 4 2.273 -15.647 -26.135 1.00 0.00 O ATOM 0 H GLY A 4 4.301 -16.865 -25.551 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.810 -16.688 -28.380 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.352 -18.250 -27.731 1.00 0.00 H new ATOM 37 N SER A 5 1.115 -17.174 -27.336 1.00 0.00 N ATOM 38 CA SER A 5 -0.185 -16.701 -26.893 1.00 0.00 C ATOM 39 C SER A 5 -1.124 -17.887 -26.666 1.00 0.00 C ATOM 40 O SER A 5 -0.852 -18.995 -27.125 1.00 0.00 O ATOM 41 CB SER A 5 -0.793 -15.730 -27.907 1.00 0.00 C ATOM 42 OG SER A 5 -1.094 -16.369 -29.144 1.00 0.00 O ATOM 0 H SER A 5 1.084 -17.963 -27.981 1.00 0.00 H new ATOM 0 HA SER A 5 -0.052 -16.166 -25.953 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.703 -15.296 -27.493 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.099 -14.908 -28.083 1.00 0.00 H new ATOM 0 HG SER A 5 -1.482 -15.716 -29.764 1.00 0.00 H new ATOM 48 N SER A 6 -2.210 -17.614 -25.958 1.00 0.00 N ATOM 49 CA SER A 6 -3.191 -18.645 -25.664 1.00 0.00 C ATOM 50 C SER A 6 -4.459 -18.411 -26.488 1.00 0.00 C ATOM 51 O SER A 6 -5.189 -19.353 -26.792 1.00 0.00 O ATOM 52 CB SER A 6 -3.527 -18.676 -24.172 1.00 0.00 C ATOM 53 OG SER A 6 -3.792 -19.999 -23.712 1.00 0.00 O ATOM 0 H SER A 6 -2.432 -16.693 -25.579 1.00 0.00 H new ATOM 0 HA SER A 6 -2.763 -19.611 -25.933 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.697 -18.254 -23.605 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.396 -18.045 -23.983 1.00 0.00 H new ATOM 0 HG SER A 6 -4.001 -19.977 -22.755 1.00 0.00 H new ATOM 59 N GLY A 7 -4.682 -17.150 -26.827 1.00 0.00 N ATOM 60 CA GLY A 7 -5.848 -16.780 -27.611 1.00 0.00 C ATOM 61 C GLY A 7 -7.012 -16.376 -26.704 1.00 0.00 C ATOM 62 O GLY A 7 -7.918 -17.171 -26.459 1.00 0.00 O ATOM 0 H GLY A 7 -4.075 -16.371 -26.573 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.596 -15.954 -28.276 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.147 -17.617 -28.242 1.00 0.00 H new ATOM 66 N SER A 8 -6.950 -15.140 -26.230 1.00 0.00 N ATOM 67 CA SER A 8 -7.987 -14.621 -25.355 1.00 0.00 C ATOM 68 C SER A 8 -8.446 -13.247 -25.846 1.00 0.00 C ATOM 69 O SER A 8 -7.651 -12.479 -26.386 1.00 0.00 O ATOM 70 CB SER A 8 -7.495 -14.531 -23.909 1.00 0.00 C ATOM 71 OG SER A 8 -7.021 -15.786 -23.427 1.00 0.00 O ATOM 0 H SER A 8 -6.197 -14.483 -26.436 1.00 0.00 H new ATOM 0 HA SER A 8 -8.831 -15.310 -25.380 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.696 -13.792 -23.843 1.00 0.00 H new ATOM 0 HB3 SER A 8 -8.306 -14.181 -23.271 1.00 0.00 H new ATOM 0 HG SER A 8 -6.714 -15.686 -22.502 1.00 0.00 H new ATOM 77 N PRO A 9 -9.761 -12.971 -25.635 1.00 0.00 N ATOM 78 CA PRO A 9 -10.335 -11.702 -26.050 1.00 0.00 C ATOM 79 C PRO A 9 -9.912 -10.574 -25.107 1.00 0.00 C ATOM 80 O PRO A 9 -9.909 -10.746 -23.889 1.00 0.00 O ATOM 81 CB PRO A 9 -11.837 -11.935 -26.060 1.00 0.00 C ATOM 82 CG PRO A 9 -12.073 -13.172 -25.209 1.00 0.00 C ATOM 83 CD PRO A 9 -10.732 -13.856 -24.998 1.00 0.00 C ATOM 0 HA PRO A 9 -9.987 -11.385 -27.033 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -12.368 -11.074 -25.654 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -12.202 -12.085 -27.076 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -12.516 -12.898 -24.252 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.772 -13.847 -25.702 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -10.515 -13.984 -23.937 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -10.718 -14.849 -25.448 1.00 0.00 H new ATOM 91 N GLY A 10 -9.563 -9.445 -25.707 1.00 0.00 N ATOM 92 CA GLY A 10 -9.139 -8.289 -24.936 1.00 0.00 C ATOM 93 C GLY A 10 -7.851 -8.586 -24.165 1.00 0.00 C ATOM 94 O GLY A 10 -7.700 -9.666 -23.596 1.00 0.00 O ATOM 0 H GLY A 10 -9.565 -9.307 -26.718 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.981 -7.441 -25.602 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.927 -8.004 -24.239 1.00 0.00 H new ATOM 98 N ASN A 11 -6.956 -7.609 -24.172 1.00 0.00 N ATOM 99 CA ASN A 11 -5.686 -7.753 -23.481 1.00 0.00 C ATOM 100 C ASN A 11 -5.170 -6.370 -23.078 1.00 0.00 C ATOM 101 O ASN A 11 -5.179 -5.441 -23.884 1.00 0.00 O ATOM 102 CB ASN A 11 -4.638 -8.404 -24.385 1.00 0.00 C ATOM 103 CG ASN A 11 -4.556 -9.911 -24.133 1.00 0.00 C ATOM 104 OD1 ASN A 11 -5.481 -10.661 -24.399 1.00 0.00 O ATOM 105 ND2 ASN A 11 -3.402 -10.310 -23.608 1.00 0.00 N ATOM 0 H ASN A 11 -7.085 -6.715 -24.645 1.00 0.00 H new ATOM 0 HA ASN A 11 -5.848 -8.382 -22.606 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -4.889 -8.220 -25.430 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -3.664 -7.948 -24.206 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -3.249 -11.297 -23.403 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -2.669 -9.629 -23.410 1.00 0.00 H new ATOM 112 N ARG A 12 -4.734 -6.277 -21.830 1.00 0.00 N ATOM 113 CA ARG A 12 -4.216 -5.023 -21.311 1.00 0.00 C ATOM 114 C ARG A 12 -5.306 -3.949 -21.328 1.00 0.00 C ATOM 115 O ARG A 12 -6.286 -4.067 -22.062 1.00 0.00 O ATOM 116 CB ARG A 12 -3.020 -4.538 -22.133 1.00 0.00 C ATOM 117 CG ARG A 12 -1.778 -5.386 -21.846 1.00 0.00 C ATOM 118 CD ARG A 12 -0.499 -4.608 -22.162 1.00 0.00 C ATOM 119 NE ARG A 12 0.259 -4.352 -20.917 1.00 0.00 N ATOM 120 CZ ARG A 12 1.459 -3.758 -20.876 1.00 0.00 C ATOM 121 NH1 ARG A 12 2.046 -3.355 -22.012 1.00 0.00 N ATOM 122 NH2 ARG A 12 2.072 -3.566 -19.700 1.00 0.00 N ATOM 0 H ARG A 12 -4.729 -7.049 -21.164 1.00 0.00 H new ATOM 0 HA ARG A 12 -3.891 -5.199 -20.286 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -3.260 -4.586 -23.195 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -2.813 -3.493 -21.900 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -1.774 -5.689 -20.799 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.810 -6.298 -22.442 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.116 -5.173 -22.862 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.748 -3.664 -22.646 1.00 0.00 H new ATOM 0 HE ARG A 12 -0.159 -4.646 -20.034 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.579 -3.501 -22.907 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.960 -2.903 -21.981 1.00 0.00 H new ATOM 0 HH21 ARG A 12 1.625 -3.872 -18.836 1.00 0.00 H new ATOM 0 HH22 ARG A 12 2.986 -3.114 -19.669 1.00 0.00 H new ATOM 136 N GLU A 13 -5.099 -2.927 -20.511 1.00 0.00 N ATOM 137 CA GLU A 13 -6.052 -1.834 -20.424 1.00 0.00 C ATOM 138 C GLU A 13 -7.376 -2.330 -19.839 1.00 0.00 C ATOM 139 O GLU A 13 -8.411 -2.272 -20.501 1.00 0.00 O ATOM 140 CB GLU A 13 -6.266 -1.182 -21.791 1.00 0.00 C ATOM 141 CG GLU A 13 -7.051 0.124 -21.659 1.00 0.00 C ATOM 142 CD GLU A 13 -7.936 0.358 -22.885 1.00 0.00 C ATOM 143 OE1 GLU A 13 -7.416 0.164 -24.005 1.00 0.00 O ATOM 144 OE2 GLU A 13 -9.112 0.726 -22.675 1.00 0.00 O ATOM 0 H GLU A 13 -4.285 -2.833 -19.903 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.644 -1.075 -19.757 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -5.301 -0.985 -22.259 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -6.803 -1.869 -22.445 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -7.668 0.092 -20.761 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -6.359 0.958 -21.541 1.00 0.00 H new ATOM 151 N ASN A 14 -7.301 -2.806 -18.605 1.00 0.00 N ATOM 152 CA ASN A 14 -8.480 -3.312 -17.924 1.00 0.00 C ATOM 153 C ASN A 14 -8.105 -3.723 -16.499 1.00 0.00 C ATOM 154 O ASN A 14 -8.441 -3.030 -15.540 1.00 0.00 O ATOM 155 CB ASN A 14 -9.044 -4.542 -18.638 1.00 0.00 C ATOM 156 CG ASN A 14 -10.447 -4.266 -19.182 1.00 0.00 C ATOM 157 OD1 ASN A 14 -11.370 -5.124 -18.759 1.00 0.00 O flip ATOM 158 ND2 ASN A 14 -10.676 -3.334 -19.936 1.00 0.00 N flip ATOM 0 H ASN A 14 -6.441 -2.852 -18.059 1.00 0.00 H new ATOM 0 HA ASN A 14 -9.231 -2.522 -17.920 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.383 -4.827 -19.456 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -9.077 -5.384 -17.947 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -9.920 -2.712 -20.222 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -11.623 -3.177 -20.280 1.00 0.00 H new ATOM 165 N LYS A 15 -7.412 -4.848 -16.406 1.00 0.00 N ATOM 166 CA LYS A 15 -6.986 -5.360 -15.114 1.00 0.00 C ATOM 167 C LYS A 15 -5.518 -4.996 -14.884 1.00 0.00 C ATOM 168 O LYS A 15 -4.842 -4.522 -15.796 1.00 0.00 O ATOM 169 CB LYS A 15 -7.271 -6.860 -15.012 1.00 0.00 C ATOM 170 CG LYS A 15 -6.281 -7.665 -15.857 1.00 0.00 C ATOM 171 CD LYS A 15 -6.974 -8.281 -17.074 1.00 0.00 C ATOM 172 CE LYS A 15 -7.203 -9.781 -16.873 1.00 0.00 C ATOM 173 NZ LYS A 15 -6.462 -10.559 -17.891 1.00 0.00 N ATOM 0 H LYS A 15 -7.135 -5.420 -17.204 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.559 -4.894 -14.312 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -7.207 -7.176 -13.971 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.289 -7.064 -15.345 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.468 -7.018 -16.186 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.836 -8.453 -15.250 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.929 -7.783 -17.244 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.366 -8.118 -17.964 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -6.878 -10.074 -15.875 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.268 -10.005 -16.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.628 -11.575 -17.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.792 -10.291 -18.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -5.445 -10.359 -17.808 1.00 0.00 H new ATOM 187 N GLU A 16 -5.068 -5.230 -13.660 1.00 0.00 N ATOM 188 CA GLU A 16 -3.693 -4.932 -13.299 1.00 0.00 C ATOM 189 C GLU A 16 -3.311 -3.529 -13.773 1.00 0.00 C ATOM 190 O GLU A 16 -2.792 -3.362 -14.876 1.00 0.00 O ATOM 191 CB GLU A 16 -2.737 -5.983 -13.868 1.00 0.00 C ATOM 192 CG GLU A 16 -2.650 -7.201 -12.947 1.00 0.00 C ATOM 193 CD GLU A 16 -2.048 -8.401 -13.681 1.00 0.00 C ATOM 194 OE1 GLU A 16 -1.142 -8.165 -14.508 1.00 0.00 O ATOM 195 OE2 GLU A 16 -2.509 -9.529 -13.399 1.00 0.00 O ATOM 0 H GLU A 16 -5.632 -5.623 -12.906 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.609 -4.962 -12.213 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.078 -6.293 -14.856 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.746 -5.547 -13.995 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.041 -6.960 -12.076 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.644 -7.456 -12.580 1.00 0.00 H new ATOM 202 N LYS A 17 -3.583 -2.555 -12.918 1.00 0.00 N ATOM 203 CA LYS A 17 -3.275 -1.171 -13.236 1.00 0.00 C ATOM 204 C LYS A 17 -2.119 -0.695 -12.354 1.00 0.00 C ATOM 205 O LYS A 17 -1.988 -1.127 -11.210 1.00 0.00 O ATOM 206 CB LYS A 17 -4.530 -0.303 -13.126 1.00 0.00 C ATOM 207 CG LYS A 17 -4.888 -0.039 -11.662 1.00 0.00 C ATOM 208 CD LYS A 17 -5.381 1.396 -11.468 1.00 0.00 C ATOM 209 CE LYS A 17 -6.763 1.418 -10.812 1.00 0.00 C ATOM 210 NZ LYS A 17 -7.794 1.835 -11.789 1.00 0.00 N ATOM 0 H LYS A 17 -4.014 -2.697 -12.004 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.945 -1.083 -14.271 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.368 0.644 -13.641 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.364 -0.798 -13.624 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.659 -0.739 -11.341 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.015 -0.216 -11.033 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -4.672 1.947 -10.850 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.424 1.903 -12.432 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.002 0.429 -10.422 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.759 2.103 -9.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.726 1.845 -11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.573 2.788 -12.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.809 1.166 -12.585 1.00 0.00 H new ATOM 224 N LYS A 18 -1.311 0.190 -12.919 1.00 0.00 N ATOM 225 CA LYS A 18 -0.171 0.730 -12.198 1.00 0.00 C ATOM 226 C LYS A 18 -0.559 2.068 -11.566 1.00 0.00 C ATOM 227 O LYS A 18 -1.084 2.950 -12.244 1.00 0.00 O ATOM 228 CB LYS A 18 1.051 0.814 -13.114 1.00 0.00 C ATOM 229 CG LYS A 18 2.308 1.176 -12.321 1.00 0.00 C ATOM 230 CD LYS A 18 2.944 2.461 -12.856 1.00 0.00 C ATOM 231 CE LYS A 18 4.208 2.153 -13.660 1.00 0.00 C ATOM 232 NZ LYS A 18 4.669 3.360 -14.384 1.00 0.00 N ATOM 0 H LYS A 18 -1.423 0.547 -13.868 1.00 0.00 H new ATOM 0 HA LYS A 18 0.115 0.064 -11.384 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.198 -0.141 -13.619 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.878 1.561 -13.889 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.054 1.303 -11.269 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.027 0.359 -12.379 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.229 2.991 -13.485 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.189 3.123 -12.025 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.994 1.800 -12.992 1.00 0.00 H new ATOM 0 HE3 LYS A 18 4.008 1.350 -14.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.528 3.134 -14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.924 3.680 -15.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.879 4.115 -13.701 1.00 0.00 H new ATOM 246 N VAL A 19 -0.287 2.177 -10.274 1.00 0.00 N ATOM 247 CA VAL A 19 -0.601 3.392 -9.542 1.00 0.00 C ATOM 248 C VAL A 19 0.662 3.906 -8.849 1.00 0.00 C ATOM 249 O VAL A 19 1.587 3.139 -8.588 1.00 0.00 O ATOM 250 CB VAL A 19 -1.755 3.135 -8.570 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.053 2.843 -9.325 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.414 1.997 -7.605 1.00 0.00 C ATOM 0 H VAL A 19 0.148 1.443 -9.715 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.937 4.173 -10.225 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.906 4.040 -7.982 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.857 2.664 -8.611 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.309 3.697 -9.953 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.920 1.960 -9.950 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.250 1.834 -6.925 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.223 1.085 -8.171 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.525 2.260 -7.031 1.00 0.00 H new ATOM 262 N PHE A 20 0.659 5.201 -8.568 1.00 0.00 N ATOM 263 CA PHE A 20 1.794 5.826 -7.910 1.00 0.00 C ATOM 264 C PHE A 20 1.337 6.683 -6.727 1.00 0.00 C ATOM 265 O PHE A 20 0.698 7.718 -6.915 1.00 0.00 O ATOM 266 CB PHE A 20 2.471 6.726 -8.945 1.00 0.00 C ATOM 267 CG PHE A 20 3.994 6.793 -8.810 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.772 5.862 -9.425 1.00 0.00 C ATOM 269 CD2 PHE A 20 4.569 7.782 -8.075 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.185 5.924 -9.299 1.00 0.00 C ATOM 271 CE2 PHE A 20 5.982 7.844 -7.950 1.00 0.00 C ATOM 272 CZ PHE A 20 6.760 6.913 -8.565 1.00 0.00 C ATOM 0 H PHE A 20 -0.111 5.834 -8.784 1.00 0.00 H new ATOM 0 HA PHE A 20 2.472 5.062 -7.530 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.220 6.367 -9.943 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.064 7.733 -8.857 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.315 5.076 -10.009 1.00 0.00 H new ATOM 0 HD2 PHE A 20 3.951 8.520 -7.586 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.803 5.185 -9.787 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.439 8.630 -7.367 1.00 0.00 H new ATOM 0 HZ PHE A 20 7.835 6.960 -8.470 1.00 0.00 H new ATOM 282 N ILE A 21 1.682 6.221 -5.535 1.00 0.00 N ATOM 283 CA ILE A 21 1.315 6.932 -4.322 1.00 0.00 C ATOM 284 C ILE A 21 2.475 7.833 -3.893 1.00 0.00 C ATOM 285 O ILE A 21 3.455 7.359 -3.320 1.00 0.00 O ATOM 286 CB ILE A 21 0.868 5.948 -3.238 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.657 5.924 -3.115 1.00 0.00 C ATOM 288 CG2 ILE A 21 1.546 6.258 -1.902 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.292 5.204 -4.306 1.00 0.00 C ATOM 0 H ILE A 21 2.212 5.363 -5.383 1.00 0.00 H new ATOM 0 HA ILE A 21 0.458 7.580 -4.505 1.00 0.00 H new ATOM 0 HB ILE A 21 1.183 4.947 -3.534 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.943 5.425 -2.189 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.037 6.944 -3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 21 1.211 5.544 -1.150 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.627 6.183 -2.017 1.00 0.00 H new ATOM 0 HG23 ILE A 21 1.284 7.268 -1.586 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.376 5.201 -4.194 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.024 5.720 -5.228 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.929 4.177 -4.346 1.00 0.00 H new ATOM 301 N SER A 22 2.326 9.116 -4.188 1.00 0.00 N ATOM 302 CA SER A 22 3.350 10.087 -3.841 1.00 0.00 C ATOM 303 C SER A 22 3.013 10.745 -2.502 1.00 0.00 C ATOM 304 O SER A 22 2.066 11.525 -2.410 1.00 0.00 O ATOM 305 CB SER A 22 3.494 11.149 -4.933 1.00 0.00 C ATOM 306 OG SER A 22 4.577 12.038 -4.673 1.00 0.00 O ATOM 0 H SER A 22 1.512 9.506 -4.663 1.00 0.00 H new ATOM 0 HA SER A 22 4.302 9.564 -3.753 1.00 0.00 H new ATOM 0 HB2 SER A 22 3.648 10.661 -5.895 1.00 0.00 H new ATOM 0 HB3 SER A 22 2.568 11.718 -5.009 1.00 0.00 H new ATOM 0 HG SER A 22 4.637 12.700 -5.393 1.00 0.00 H new ATOM 312 N LEU A 23 3.807 10.407 -1.496 1.00 0.00 N ATOM 313 CA LEU A 23 3.605 10.956 -0.166 1.00 0.00 C ATOM 314 C LEU A 23 4.281 12.326 -0.076 1.00 0.00 C ATOM 315 O LEU A 23 5.308 12.473 0.586 1.00 0.00 O ATOM 316 CB LEU A 23 4.078 9.965 0.900 1.00 0.00 C ATOM 317 CG LEU A 23 3.005 9.043 1.482 1.00 0.00 C ATOM 318 CD1 LEU A 23 3.084 7.648 0.860 1.00 0.00 C ATOM 319 CD2 LEU A 23 3.093 8.996 3.009 1.00 0.00 C ATOM 0 H LEU A 23 4.591 9.760 -1.576 1.00 0.00 H new ATOM 0 HA LEU A 23 2.543 11.111 0.025 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.865 9.347 0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.527 10.529 1.718 1.00 0.00 H new ATOM 0 HG LEU A 23 2.028 9.453 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.310 7.013 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.935 7.721 -0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 23 4.064 7.215 1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.319 8.334 3.398 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.073 8.623 3.306 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.949 9.998 3.413 1.00 0.00 H new ATOM 331 N VAL A 24 3.678 13.293 -0.750 1.00 0.00 N ATOM 332 CA VAL A 24 4.209 14.646 -0.755 1.00 0.00 C ATOM 333 C VAL A 24 3.093 15.628 -0.395 1.00 0.00 C ATOM 334 O VAL A 24 1.916 15.272 -0.418 1.00 0.00 O ATOM 335 CB VAL A 24 4.859 14.948 -2.106 1.00 0.00 C ATOM 336 CG1 VAL A 24 5.754 13.791 -2.555 1.00 0.00 C ATOM 337 CG2 VAL A 24 3.801 15.266 -3.165 1.00 0.00 C ATOM 0 H VAL A 24 2.826 13.167 -1.297 1.00 0.00 H new ATOM 0 HA VAL A 24 4.991 14.753 -0.003 1.00 0.00 H new ATOM 0 HB VAL A 24 5.488 15.830 -1.985 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.204 14.032 -3.518 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.540 13.632 -1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.156 12.884 -2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.290 15.477 -4.116 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.134 14.411 -3.281 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.224 16.136 -2.853 1.00 0.00 H new ATOM 347 N GLY A 25 3.502 16.846 -0.071 1.00 0.00 N ATOM 348 CA GLY A 25 2.551 17.883 0.293 1.00 0.00 C ATOM 349 C GLY A 25 2.039 17.681 1.720 1.00 0.00 C ATOM 350 O GLY A 25 2.647 18.161 2.676 1.00 0.00 O ATOM 0 H GLY A 25 4.479 17.138 -0.053 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.024 18.861 0.208 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.712 17.873 -0.403 1.00 0.00 H new ATOM 354 N SER A 26 0.926 16.968 1.821 1.00 0.00 N ATOM 355 CA SER A 26 0.326 16.697 3.115 1.00 0.00 C ATOM 356 C SER A 26 -0.657 15.529 3.002 1.00 0.00 C ATOM 357 O SER A 26 -1.870 15.731 3.013 1.00 0.00 O ATOM 358 CB SER A 26 -0.384 17.936 3.665 1.00 0.00 C ATOM 359 OG SER A 26 -0.105 18.142 5.047 1.00 0.00 O ATOM 0 H SER A 26 0.425 16.570 1.027 1.00 0.00 H new ATOM 0 HA SER A 26 1.121 16.429 3.810 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.073 18.813 3.098 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.460 17.830 3.524 1.00 0.00 H new ATOM 0 HG SER A 26 -0.575 18.943 5.360 1.00 0.00 H new ATOM 365 N ARG A 27 -0.096 14.334 2.894 1.00 0.00 N ATOM 366 CA ARG A 27 -0.908 13.134 2.779 1.00 0.00 C ATOM 367 C ARG A 27 -0.110 11.908 3.226 1.00 0.00 C ATOM 368 O ARG A 27 1.086 12.006 3.497 1.00 0.00 O ATOM 369 CB ARG A 27 -1.384 12.928 1.339 1.00 0.00 C ATOM 370 CG ARG A 27 -2.884 13.200 1.213 1.00 0.00 C ATOM 371 CD ARG A 27 -3.294 13.345 -0.254 1.00 0.00 C ATOM 372 NE ARG A 27 -4.374 14.349 -0.381 1.00 0.00 N ATOM 373 CZ ARG A 27 -4.858 14.787 -1.551 1.00 0.00 C ATOM 374 NH1 ARG A 27 -4.361 14.313 -2.701 1.00 0.00 N ATOM 375 NH2 ARG A 27 -5.839 15.700 -1.570 1.00 0.00 N ATOM 0 H ARG A 27 0.911 14.171 2.884 1.00 0.00 H new ATOM 0 HA ARG A 27 -1.778 13.259 3.423 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -0.833 13.591 0.672 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -1.168 11.907 1.023 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.445 12.386 1.672 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.139 14.109 1.757 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -2.434 13.646 -0.852 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.632 12.384 -0.642 1.00 0.00 H new ATOM 0 HE ARG A 27 -4.775 14.731 0.476 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -3.614 13.619 -2.686 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.730 14.646 -3.592 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.217 16.061 -0.694 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -6.208 16.034 -2.460 1.00 0.00 H new ATOM 389 N GLY A 28 -0.803 10.780 3.288 1.00 0.00 N ATOM 390 CA GLY A 28 -0.173 9.536 3.697 1.00 0.00 C ATOM 391 C GLY A 28 -1.130 8.355 3.524 1.00 0.00 C ATOM 392 O GLY A 28 -1.418 7.639 4.482 1.00 0.00 O ATOM 0 H GLY A 28 -1.795 10.702 3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.728 9.369 3.106 1.00 0.00 H new ATOM 0 HA3 GLY A 28 0.138 9.607 4.739 1.00 0.00 H new ATOM 396 N LEU A 29 -1.596 8.187 2.295 1.00 0.00 N ATOM 397 CA LEU A 29 -2.515 7.105 1.984 1.00 0.00 C ATOM 398 C LEU A 29 -3.805 7.291 2.785 1.00 0.00 C ATOM 399 O LEU A 29 -3.822 7.086 3.998 1.00 0.00 O ATOM 400 CB LEU A 29 -1.841 5.750 2.209 1.00 0.00 C ATOM 401 CG LEU A 29 -2.323 4.605 1.316 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.372 4.393 0.136 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.525 3.324 2.127 1.00 0.00 C ATOM 0 H LEU A 29 -1.354 8.782 1.503 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.789 7.128 0.929 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.768 5.872 2.063 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.990 5.461 3.249 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.293 4.880 0.902 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.737 3.574 -0.483 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.323 5.304 -0.460 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.377 4.150 0.510 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.868 2.526 1.468 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.581 3.033 2.589 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.270 3.498 2.903 1.00 0.00 H new ATOM 415 N GLY A 30 -4.854 7.678 2.075 1.00 0.00 N ATOM 416 CA GLY A 30 -6.146 7.894 2.704 1.00 0.00 C ATOM 417 C GLY A 30 -7.083 6.710 2.454 1.00 0.00 C ATOM 418 O GLY A 30 -8.270 6.898 2.194 1.00 0.00 O ATOM 0 H GLY A 30 -4.836 7.848 1.069 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.013 8.037 3.776 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.596 8.807 2.314 1.00 0.00 H new ATOM 422 N CYS A 31 -6.513 5.517 2.540 1.00 0.00 N ATOM 423 CA CYS A 31 -7.282 4.303 2.326 1.00 0.00 C ATOM 424 C CYS A 31 -6.844 3.268 3.364 1.00 0.00 C ATOM 425 O CYS A 31 -5.663 3.182 3.700 1.00 0.00 O ATOM 426 CB CYS A 31 -7.127 3.780 0.897 1.00 0.00 C ATOM 427 SG CYS A 31 -5.371 3.390 0.560 1.00 0.00 S ATOM 0 H CYS A 31 -5.528 5.365 2.755 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.344 4.515 2.452 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.739 2.889 0.759 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.485 4.526 0.187 1.00 0.00 H new ATOM 0 HG CYS A 31 -5.251 2.945 -0.655 1.00 0.00 H new ATOM 433 N SER A 32 -7.817 2.508 3.843 1.00 0.00 N ATOM 434 CA SER A 32 -7.547 1.481 4.835 1.00 0.00 C ATOM 435 C SER A 32 -7.176 0.168 4.143 1.00 0.00 C ATOM 436 O SER A 32 -7.848 -0.253 3.203 1.00 0.00 O ATOM 437 CB SER A 32 -8.751 1.274 5.756 1.00 0.00 C ATOM 438 OG SER A 32 -8.370 1.208 7.127 1.00 0.00 O ATOM 0 H SER A 32 -8.795 2.583 3.562 1.00 0.00 H new ATOM 0 HA SER A 32 -6.708 1.811 5.448 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.459 2.091 5.616 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.266 0.354 5.478 1.00 0.00 H new ATOM 0 HG SER A 32 -9.167 1.077 7.682 1.00 0.00 H new ATOM 444 N ILE A 33 -6.108 -0.441 4.634 1.00 0.00 N ATOM 445 CA ILE A 33 -5.639 -1.698 4.074 1.00 0.00 C ATOM 446 C ILE A 33 -5.831 -2.813 5.104 1.00 0.00 C ATOM 447 O ILE A 33 -5.655 -2.594 6.302 1.00 0.00 O ATOM 448 CB ILE A 33 -4.199 -1.560 3.578 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.265 -1.143 4.716 1.00 0.00 C ATOM 450 CG2 ILE A 33 -4.118 -0.600 2.389 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.833 -1.613 4.450 1.00 0.00 C ATOM 0 H ILE A 33 -5.553 -0.088 5.414 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.228 -1.968 3.198 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.864 -2.536 3.227 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.281 -0.059 4.826 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.621 -1.564 5.656 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -3.083 -0.520 2.056 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.734 -0.979 1.573 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.479 0.383 2.690 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.190 -1.304 5.274 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.817 -2.700 4.365 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.471 -1.171 3.522 1.00 0.00 H new ATOM 463 N SER A 34 -6.188 -3.985 4.601 1.00 0.00 N ATOM 464 CA SER A 34 -6.406 -5.135 5.462 1.00 0.00 C ATOM 465 C SER A 34 -5.788 -6.385 4.832 1.00 0.00 C ATOM 466 O SER A 34 -5.439 -6.382 3.653 1.00 0.00 O ATOM 467 CB SER A 34 -7.897 -5.353 5.724 1.00 0.00 C ATOM 468 OG SER A 34 -8.139 -5.886 7.023 1.00 0.00 O ATOM 0 H SER A 34 -6.332 -4.163 3.607 1.00 0.00 H new ATOM 0 HA SER A 34 -5.922 -4.942 6.419 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.426 -4.406 5.616 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.302 -6.031 4.973 1.00 0.00 H new ATOM 0 HG SER A 34 -9.103 -6.009 7.152 1.00 0.00 H new ATOM 474 N SER A 35 -5.673 -7.424 5.646 1.00 0.00 N ATOM 475 CA SER A 35 -5.103 -8.678 5.183 1.00 0.00 C ATOM 476 C SER A 35 -6.215 -9.705 4.958 1.00 0.00 C ATOM 477 O SER A 35 -7.091 -9.872 5.804 1.00 0.00 O ATOM 478 CB SER A 35 -4.076 -9.218 6.180 1.00 0.00 C ATOM 479 OG SER A 35 -2.985 -8.319 6.361 1.00 0.00 O ATOM 0 H SER A 35 -5.965 -7.423 6.623 1.00 0.00 H new ATOM 0 HA SER A 35 -4.590 -8.493 4.239 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.561 -9.397 7.139 1.00 0.00 H new ATOM 0 HB3 SER A 35 -3.700 -10.179 5.829 1.00 0.00 H new ATOM 0 HG SER A 35 -2.352 -8.698 7.006 1.00 0.00 H new ATOM 485 N GLY A 36 -6.142 -10.366 3.812 1.00 0.00 N ATOM 486 CA GLY A 36 -7.131 -11.373 3.465 1.00 0.00 C ATOM 487 C GLY A 36 -6.937 -12.642 4.297 1.00 0.00 C ATOM 488 O GLY A 36 -6.013 -12.724 5.104 1.00 0.00 O ATOM 0 H GLY A 36 -5.414 -10.224 3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.133 -10.976 3.629 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.054 -11.614 2.405 1.00 0.00 H new ATOM 492 N PRO A 37 -7.848 -13.625 4.066 1.00 0.00 N ATOM 493 CA PRO A 37 -7.787 -14.886 4.785 1.00 0.00 C ATOM 494 C PRO A 37 -6.652 -15.765 4.254 1.00 0.00 C ATOM 495 O PRO A 37 -5.839 -15.315 3.448 1.00 0.00 O ATOM 496 CB PRO A 37 -9.159 -15.512 4.599 1.00 0.00 C ATOM 497 CG PRO A 37 -9.781 -14.806 3.405 1.00 0.00 C ATOM 498 CD PRO A 37 -8.956 -13.562 3.117 1.00 0.00 C ATOM 0 HA PRO A 37 -7.564 -14.756 5.844 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.078 -16.584 4.420 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.771 -15.383 5.491 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -9.794 -15.465 2.537 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.816 -14.537 3.617 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.596 -13.555 2.088 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.545 -12.655 3.255 1.00 0.00 H new ATOM 506 N ILE A 38 -6.634 -17.002 4.728 1.00 0.00 N ATOM 507 CA ILE A 38 -5.612 -17.948 4.312 1.00 0.00 C ATOM 508 C ILE A 38 -5.896 -18.401 2.878 1.00 0.00 C ATOM 509 O ILE A 38 -4.974 -18.722 2.130 1.00 0.00 O ATOM 510 CB ILE A 38 -5.510 -19.101 5.312 1.00 0.00 C ATOM 511 CG1 ILE A 38 -4.526 -20.166 4.823 1.00 0.00 C ATOM 512 CG2 ILE A 38 -6.889 -19.690 5.613 1.00 0.00 C ATOM 513 CD1 ILE A 38 -3.923 -20.937 5.998 1.00 0.00 C ATOM 0 H ILE A 38 -7.311 -17.371 5.396 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.631 -17.472 4.308 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.117 -18.706 6.249 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.037 -20.858 4.153 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.730 -19.694 4.247 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -6.788 -20.508 6.326 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.530 -18.917 6.036 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.333 -20.066 4.691 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.227 -21.687 5.622 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.392 -20.246 6.653 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.719 -21.428 6.558 1.00 0.00 H new ATOM 525 N GLN A 39 -7.177 -18.413 2.538 1.00 0.00 N ATOM 526 CA GLN A 39 -7.594 -18.821 1.208 1.00 0.00 C ATOM 527 C GLN A 39 -7.349 -17.692 0.205 1.00 0.00 C ATOM 528 O GLN A 39 -7.102 -17.947 -0.973 1.00 0.00 O ATOM 529 CB GLN A 39 -9.063 -19.250 1.202 1.00 0.00 C ATOM 530 CG GLN A 39 -9.981 -18.068 1.519 1.00 0.00 C ATOM 531 CD GLN A 39 -11.371 -18.551 1.940 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.046 -19.277 1.228 1.00 0.00 O ATOM 533 NE2 GLN A 39 -11.759 -18.108 3.132 1.00 0.00 N ATOM 0 H GLN A 39 -7.939 -18.147 3.161 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.996 -19.682 0.909 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.321 -19.664 0.227 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -9.217 -20.042 1.935 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -9.544 -17.467 2.316 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.066 -17.424 0.644 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.144 -17.503 3.676 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -12.672 -18.373 3.502 1.00 0.00 H new ATOM 542 N LYS A 40 -7.425 -16.469 0.708 1.00 0.00 N ATOM 543 CA LYS A 40 -7.214 -15.301 -0.129 1.00 0.00 C ATOM 544 C LYS A 40 -6.357 -14.284 0.628 1.00 0.00 C ATOM 545 O LYS A 40 -6.806 -13.173 0.906 1.00 0.00 O ATOM 546 CB LYS A 40 -8.553 -14.738 -0.611 1.00 0.00 C ATOM 547 CG LYS A 40 -8.361 -13.839 -1.835 1.00 0.00 C ATOM 548 CD LYS A 40 -9.656 -13.101 -2.180 1.00 0.00 C ATOM 549 CE LYS A 40 -9.430 -12.101 -3.316 1.00 0.00 C ATOM 550 NZ LYS A 40 -9.749 -12.720 -4.623 1.00 0.00 N ATOM 0 H LYS A 40 -7.630 -16.262 1.685 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.665 -15.573 -1.031 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.228 -15.557 -0.859 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.023 -14.170 0.192 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.568 -13.117 -1.640 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.043 -14.441 -2.686 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.422 -13.820 -2.470 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.027 -12.578 -1.298 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.053 -11.220 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.394 -11.763 -3.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.590 -12.028 -5.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -9.137 -13.547 -4.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.745 -13.021 -4.631 1.00 0.00 H new ATOM 564 N PRO A 41 -5.106 -14.712 0.948 1.00 0.00 N ATOM 565 CA PRO A 41 -4.182 -13.851 1.667 1.00 0.00 C ATOM 566 C PRO A 41 -3.614 -12.768 0.748 1.00 0.00 C ATOM 567 O PRO A 41 -3.423 -12.998 -0.445 1.00 0.00 O ATOM 568 CB PRO A 41 -3.116 -14.788 2.211 1.00 0.00 C ATOM 569 CG PRO A 41 -3.224 -16.064 1.393 1.00 0.00 C ATOM 570 CD PRO A 41 -4.541 -16.021 0.634 1.00 0.00 C ATOM 0 HA PRO A 41 -4.662 -13.301 2.477 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.124 -14.347 2.117 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.276 -14.989 3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.387 -16.145 0.700 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.186 -16.938 2.043 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.384 -16.138 -0.438 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.206 -16.825 0.949 1.00 0.00 H new ATOM 578 N GLY A 42 -3.359 -11.610 1.340 1.00 0.00 N ATOM 579 CA GLY A 42 -2.817 -10.490 0.589 1.00 0.00 C ATOM 580 C GLY A 42 -3.181 -9.159 1.251 1.00 0.00 C ATOM 581 O GLY A 42 -3.655 -9.135 2.386 1.00 0.00 O ATOM 0 H GLY A 42 -3.518 -11.423 2.330 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.733 -10.583 0.522 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.202 -10.511 -0.431 1.00 0.00 H new ATOM 585 N ILE A 43 -2.946 -8.084 0.512 1.00 0.00 N ATOM 586 CA ILE A 43 -3.243 -6.753 1.013 1.00 0.00 C ATOM 587 C ILE A 43 -4.308 -6.105 0.126 1.00 0.00 C ATOM 588 O ILE A 43 -4.067 -5.848 -1.053 1.00 0.00 O ATOM 589 CB ILE A 43 -1.961 -5.928 1.136 1.00 0.00 C ATOM 590 CG1 ILE A 43 -0.915 -6.663 1.977 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.258 -4.531 1.684 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.287 -6.636 3.461 1.00 0.00 C ATOM 0 H ILE A 43 -2.554 -8.108 -0.429 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.656 -6.809 2.020 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.541 -5.800 0.139 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.831 -7.696 1.638 1.00 0.00 H new ATOM 0 HG13 ILE A 43 0.062 -6.200 1.835 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.329 -3.966 1.761 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.942 -4.014 1.011 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.714 -4.616 2.670 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.527 -7.165 4.036 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.346 -5.603 3.802 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.253 -7.121 3.603 1.00 0.00 H new ATOM 604 N PHE A 44 -5.464 -5.860 0.726 1.00 0.00 N ATOM 605 CA PHE A 44 -6.566 -5.247 0.005 1.00 0.00 C ATOM 606 C PHE A 44 -7.038 -3.972 0.706 1.00 0.00 C ATOM 607 O PHE A 44 -6.810 -3.795 1.902 1.00 0.00 O ATOM 608 CB PHE A 44 -7.712 -6.262 -0.007 1.00 0.00 C ATOM 609 CG PHE A 44 -7.289 -7.672 -0.422 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.464 -8.398 0.380 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.738 -8.201 -1.592 1.00 0.00 C ATOM 612 CE1 PHE A 44 -6.071 -9.708 -0.005 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.346 -9.510 -1.976 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.521 -10.236 -1.175 1.00 0.00 C ATOM 0 H PHE A 44 -5.661 -6.075 1.703 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.248 -4.979 -1.003 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.156 -6.305 0.987 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.488 -5.911 -0.688 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.108 -7.979 1.309 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.393 -7.625 -2.229 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.415 -10.284 0.631 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.703 -9.930 -2.905 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.223 -11.232 -1.468 1.00 0.00 H new ATOM 624 N ILE A 45 -7.688 -3.115 -0.068 1.00 0.00 N ATOM 625 CA ILE A 45 -8.194 -1.861 0.463 1.00 0.00 C ATOM 626 C ILE A 45 -9.581 -2.090 1.066 1.00 0.00 C ATOM 627 O ILE A 45 -10.373 -2.867 0.533 1.00 0.00 O ATOM 628 CB ILE A 45 -8.162 -0.772 -0.611 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.733 -0.280 -0.852 1.00 0.00 C ATOM 630 CG2 ILE A 45 -9.111 0.375 -0.258 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.712 0.870 -1.860 1.00 0.00 C ATOM 0 H ILE A 45 -7.876 -3.265 -1.059 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.552 -1.501 1.267 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.515 -1.206 -1.547 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.294 0.049 0.090 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.119 -1.102 -1.220 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.069 1.135 -1.038 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -10.129 -0.007 -0.178 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.812 0.815 0.694 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.685 1.201 -2.013 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.129 0.530 -2.808 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.307 1.699 -1.478 1.00 0.00 H new ATOM 643 N SER A 46 -9.834 -1.400 2.168 1.00 0.00 N ATOM 644 CA SER A 46 -11.112 -1.518 2.849 1.00 0.00 C ATOM 645 C SER A 46 -11.956 -0.267 2.599 1.00 0.00 C ATOM 646 O SER A 46 -13.173 -0.355 2.444 1.00 0.00 O ATOM 647 CB SER A 46 -10.918 -1.737 4.350 1.00 0.00 C ATOM 648 OG SER A 46 -11.963 -1.143 5.116 1.00 0.00 O ATOM 0 H SER A 46 -9.175 -0.757 2.607 1.00 0.00 H new ATOM 0 HA SER A 46 -11.634 -2.386 2.448 1.00 0.00 H new ATOM 0 HB2 SER A 46 -10.879 -2.806 4.558 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.960 -1.317 4.657 1.00 0.00 H new ATOM 0 HG SER A 46 -11.803 -1.306 6.069 1.00 0.00 H new ATOM 654 N HIS A 47 -11.276 0.870 2.568 1.00 0.00 N ATOM 655 CA HIS A 47 -11.948 2.138 2.340 1.00 0.00 C ATOM 656 C HIS A 47 -10.985 3.114 1.662 1.00 0.00 C ATOM 657 O HIS A 47 -9.780 2.873 1.617 1.00 0.00 O ATOM 658 CB HIS A 47 -12.528 2.687 3.645 1.00 0.00 C ATOM 659 CG HIS A 47 -13.315 3.966 3.477 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.722 5.216 3.475 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.652 4.173 3.305 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.669 6.128 3.309 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.864 5.480 3.205 1.00 0.00 N ATOM 0 H HIS A 47 -10.267 0.939 2.697 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.794 1.991 1.668 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -13.174 1.930 4.090 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.713 2.863 4.347 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.409 3.405 3.258 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.520 7.197 3.264 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.772 5.926 3.072 1.00 0.00 H new ATOM 671 N VAL A 48 -11.553 4.197 1.151 1.00 0.00 N ATOM 672 CA VAL A 48 -10.760 5.211 0.477 1.00 0.00 C ATOM 673 C VAL A 48 -11.326 6.595 0.804 1.00 0.00 C ATOM 674 O VAL A 48 -12.541 6.781 0.835 1.00 0.00 O ATOM 675 CB VAL A 48 -10.711 4.924 -1.025 1.00 0.00 C ATOM 676 CG1 VAL A 48 -10.280 6.167 -1.806 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.792 3.740 -1.327 1.00 0.00 C ATOM 0 H VAL A 48 -12.553 4.394 1.190 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.730 5.189 0.832 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.717 4.657 -1.349 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -10.253 5.936 -2.871 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.991 6.974 -1.627 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -9.288 6.478 -1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.775 3.557 -2.401 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.783 3.965 -0.981 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -10.162 2.852 -0.814 1.00 0.00 H new ATOM 687 N LYS A 49 -10.417 7.530 1.039 1.00 0.00 N ATOM 688 CA LYS A 49 -10.810 8.891 1.362 1.00 0.00 C ATOM 689 C LYS A 49 -10.970 9.691 0.068 1.00 0.00 C ATOM 690 O LYS A 49 -10.373 9.354 -0.953 1.00 0.00 O ATOM 691 CB LYS A 49 -9.823 9.513 2.352 1.00 0.00 C ATOM 692 CG LYS A 49 -10.366 9.451 3.781 1.00 0.00 C ATOM 693 CD LYS A 49 -9.931 10.677 4.586 1.00 0.00 C ATOM 694 CE LYS A 49 -9.907 10.367 6.085 1.00 0.00 C ATOM 695 NZ LYS A 49 -9.628 11.595 6.863 1.00 0.00 N ATOM 0 H LYS A 49 -9.410 7.372 1.012 1.00 0.00 H new ATOM 0 HA LYS A 49 -11.777 8.900 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.869 8.988 2.299 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.631 10.550 2.077 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.454 9.394 3.758 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.009 8.545 4.270 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.941 10.998 4.261 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.614 11.505 4.393 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -10.864 9.945 6.391 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.146 9.615 6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.615 11.368 7.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.704 11.981 6.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -10.369 12.300 6.676 1.00 0.00 H new ATOM 709 N PRO A 50 -11.801 10.764 0.155 1.00 0.00 N ATOM 710 CA PRO A 50 -12.047 11.616 -0.996 1.00 0.00 C ATOM 711 C PRO A 50 -10.848 12.524 -1.273 1.00 0.00 C ATOM 712 O PRO A 50 -10.618 13.493 -0.551 1.00 0.00 O ATOM 713 CB PRO A 50 -13.310 12.389 -0.651 1.00 0.00 C ATOM 714 CG PRO A 50 -13.462 12.287 0.858 1.00 0.00 C ATOM 715 CD PRO A 50 -12.525 11.194 1.348 1.00 0.00 C ATOM 0 HA PRO A 50 -12.182 11.049 -1.917 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.229 13.429 -0.966 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.177 11.968 -1.160 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -13.219 13.238 1.331 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.493 12.053 1.123 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.843 11.570 2.111 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -13.079 10.368 1.794 1.00 0.00 H new ATOM 723 N GLY A 51 -10.113 12.178 -2.320 1.00 0.00 N ATOM 724 CA GLY A 51 -8.943 12.950 -2.702 1.00 0.00 C ATOM 725 C GLY A 51 -7.733 12.571 -1.845 1.00 0.00 C ATOM 726 O GLY A 51 -7.095 13.437 -1.248 1.00 0.00 O ATOM 0 H GLY A 51 -10.305 11.373 -2.916 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.716 12.777 -3.754 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.153 14.014 -2.591 1.00 0.00 H new ATOM 730 N SER A 52 -7.454 11.276 -1.812 1.00 0.00 N ATOM 731 CA SER A 52 -6.333 10.772 -1.038 1.00 0.00 C ATOM 732 C SER A 52 -5.249 10.236 -1.976 1.00 0.00 C ATOM 733 O SER A 52 -5.329 10.415 -3.190 1.00 0.00 O ATOM 734 CB SER A 52 -6.781 9.679 -0.066 1.00 0.00 C ATOM 735 OG SER A 52 -7.372 8.572 -0.742 1.00 0.00 O ATOM 0 H SER A 52 -7.985 10.561 -2.309 1.00 0.00 H new ATOM 0 HA SER A 52 -5.924 11.595 -0.452 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.924 9.335 0.512 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.497 10.095 0.643 1.00 0.00 H new ATOM 0 HG SER A 52 -8.335 8.724 -0.839 1.00 0.00 H new ATOM 741 N LEU A 53 -4.259 9.590 -1.376 1.00 0.00 N ATOM 742 CA LEU A 53 -3.160 9.028 -2.143 1.00 0.00 C ATOM 743 C LEU A 53 -3.674 7.849 -2.972 1.00 0.00 C ATOM 744 O LEU A 53 -3.003 7.400 -3.901 1.00 0.00 O ATOM 745 CB LEU A 53 -1.993 8.669 -1.222 1.00 0.00 C ATOM 746 CG LEU A 53 -0.629 9.242 -1.613 1.00 0.00 C ATOM 747 CD1 LEU A 53 -0.750 10.707 -2.036 1.00 0.00 C ATOM 748 CD2 LEU A 53 0.389 9.053 -0.487 1.00 0.00 C ATOM 0 H LEU A 53 -4.195 9.444 -0.369 1.00 0.00 H new ATOM 0 HA LEU A 53 -2.768 9.765 -2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.233 9.010 -0.215 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.910 7.583 -1.180 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.261 8.687 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.234 11.089 -2.309 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.420 10.784 -2.893 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.150 11.293 -1.209 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.349 9.469 -0.791 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.039 9.565 0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.505 7.990 -0.276 1.00 0.00 H new ATOM 760 N SER A 54 -4.858 7.381 -2.607 1.00 0.00 N ATOM 761 CA SER A 54 -5.469 6.263 -3.305 1.00 0.00 C ATOM 762 C SER A 54 -6.410 6.779 -4.397 1.00 0.00 C ATOM 763 O SER A 54 -6.391 6.282 -5.522 1.00 0.00 O ATOM 764 CB SER A 54 -6.229 5.356 -2.335 1.00 0.00 C ATOM 765 OG SER A 54 -6.394 5.962 -1.056 1.00 0.00 O ATOM 0 H SER A 54 -5.411 7.756 -1.836 1.00 0.00 H new ATOM 0 HA SER A 54 -4.676 5.673 -3.765 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.207 5.118 -2.752 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.692 4.414 -2.223 1.00 0.00 H new ATOM 0 HG SER A 54 -6.875 6.810 -1.155 1.00 0.00 H new ATOM 771 N ALA A 55 -7.209 7.768 -4.026 1.00 0.00 N ATOM 772 CA ALA A 55 -8.154 8.356 -4.959 1.00 0.00 C ATOM 773 C ALA A 55 -7.387 9.080 -6.067 1.00 0.00 C ATOM 774 O ALA A 55 -7.696 8.920 -7.247 1.00 0.00 O ATOM 775 CB ALA A 55 -9.105 9.287 -4.204 1.00 0.00 C ATOM 0 H ALA A 55 -7.221 8.177 -3.092 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.761 7.582 -5.430 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.814 9.728 -4.904 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.647 8.718 -3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.532 10.078 -3.721 1.00 0.00 H new ATOM 781 N GLU A 56 -6.402 9.861 -5.648 1.00 0.00 N ATOM 782 CA GLU A 56 -5.589 10.610 -6.591 1.00 0.00 C ATOM 783 C GLU A 56 -5.193 9.722 -7.773 1.00 0.00 C ATOM 784 O GLU A 56 -5.069 10.202 -8.899 1.00 0.00 O ATOM 785 CB GLU A 56 -4.351 11.192 -5.905 1.00 0.00 C ATOM 786 CG GLU A 56 -3.412 10.081 -5.433 1.00 0.00 C ATOM 787 CD GLU A 56 -2.004 10.625 -5.177 1.00 0.00 C ATOM 788 OE1 GLU A 56 -1.919 11.781 -4.709 1.00 0.00 O ATOM 789 OE2 GLU A 56 -1.046 9.872 -5.455 1.00 0.00 O ATOM 0 H GLU A 56 -6.149 9.991 -4.669 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.181 11.443 -6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -3.824 11.850 -6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.655 11.802 -5.054 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.804 9.632 -4.520 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -3.370 9.292 -6.184 1.00 0.00 H new ATOM 796 N VAL A 57 -5.007 8.444 -7.477 1.00 0.00 N ATOM 797 CA VAL A 57 -4.629 7.486 -8.501 1.00 0.00 C ATOM 798 C VAL A 57 -5.885 6.796 -9.037 1.00 0.00 C ATOM 799 O VAL A 57 -5.902 6.325 -10.173 1.00 0.00 O ATOM 800 CB VAL A 57 -3.599 6.502 -7.942 1.00 0.00 C ATOM 801 CG1 VAL A 57 -2.325 7.230 -7.507 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.187 5.689 -6.787 1.00 0.00 C ATOM 0 H VAL A 57 -5.111 8.050 -6.542 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.153 7.993 -9.341 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.333 5.807 -8.739 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.610 6.508 -7.114 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -1.889 7.743 -8.364 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -2.568 7.958 -6.733 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.434 4.998 -6.408 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -4.496 6.363 -5.988 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.051 5.126 -7.141 1.00 0.00 H new ATOM 812 N GLY A 58 -6.906 6.758 -8.193 1.00 0.00 N ATOM 813 CA GLY A 58 -8.163 6.133 -8.567 1.00 0.00 C ATOM 814 C GLY A 58 -8.303 4.752 -7.923 1.00 0.00 C ATOM 815 O GLY A 58 -8.845 3.831 -8.531 1.00 0.00 O ATOM 0 H GLY A 58 -6.888 7.150 -7.251 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -8.994 6.767 -8.259 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.218 6.039 -9.652 1.00 0.00 H new ATOM 819 N LEU A 59 -7.805 4.653 -6.699 1.00 0.00 N ATOM 820 CA LEU A 59 -7.867 3.400 -5.965 1.00 0.00 C ATOM 821 C LEU A 59 -9.250 3.257 -5.326 1.00 0.00 C ATOM 822 O LEU A 59 -9.794 4.223 -4.793 1.00 0.00 O ATOM 823 CB LEU A 59 -6.714 3.308 -4.964 1.00 0.00 C ATOM 824 CG LEU A 59 -5.378 2.813 -5.523 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.293 2.830 -4.445 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.530 1.431 -6.162 1.00 0.00 C ATOM 0 H LEU A 59 -7.357 5.420 -6.197 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.739 2.555 -6.641 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.559 4.294 -4.527 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.015 2.644 -4.154 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.061 3.498 -6.309 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.354 2.474 -4.868 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.162 3.847 -4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.589 2.181 -3.621 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.566 1.102 -6.551 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.880 0.721 -5.413 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.252 1.484 -6.977 1.00 0.00 H new ATOM 838 N GLU A 60 -9.778 2.045 -5.400 1.00 0.00 N ATOM 839 CA GLU A 60 -11.087 1.763 -4.835 1.00 0.00 C ATOM 840 C GLU A 60 -11.051 0.457 -4.038 1.00 0.00 C ATOM 841 O GLU A 60 -10.091 -0.306 -4.133 1.00 0.00 O ATOM 842 CB GLU A 60 -12.156 1.710 -5.928 1.00 0.00 C ATOM 843 CG GLU A 60 -12.242 3.041 -6.676 1.00 0.00 C ATOM 844 CD GLU A 60 -13.275 2.971 -7.803 1.00 0.00 C ATOM 845 OE1 GLU A 60 -12.896 2.486 -8.891 1.00 0.00 O ATOM 846 OE2 GLU A 60 -14.420 3.404 -7.551 1.00 0.00 O ATOM 0 H GLU A 60 -9.323 1.246 -5.843 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.350 2.573 -4.155 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -11.924 0.909 -6.630 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.123 1.475 -5.484 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.510 3.836 -5.981 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.265 3.294 -7.088 1.00 0.00 H new ATOM 853 N ILE A 61 -12.109 0.240 -3.271 1.00 0.00 N ATOM 854 CA ILE A 61 -12.211 -0.961 -2.459 1.00 0.00 C ATOM 855 C ILE A 61 -12.092 -2.192 -3.359 1.00 0.00 C ATOM 856 O ILE A 61 -12.702 -2.247 -4.426 1.00 0.00 O ATOM 857 CB ILE A 61 -13.491 -0.933 -1.620 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.456 0.210 -0.604 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.737 -2.287 -0.952 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.871 0.651 -0.226 1.00 0.00 C ATOM 0 H ILE A 61 -12.903 0.875 -3.194 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.390 -1.009 -1.744 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.333 -0.745 -2.286 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.920 -0.109 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.907 1.055 -1.020 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.652 -2.241 -0.362 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.837 -3.057 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.897 -2.529 -0.301 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.817 1.465 0.497 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.396 0.993 -1.118 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -15.409 -0.189 0.212 1.00 0.00 H new ATOM 872 N GLY A 62 -11.303 -3.150 -2.896 1.00 0.00 N ATOM 873 CA GLY A 62 -11.096 -4.377 -3.646 1.00 0.00 C ATOM 874 C GLY A 62 -9.696 -4.414 -4.262 1.00 0.00 C ATOM 875 O GLY A 62 -9.111 -5.485 -4.419 1.00 0.00 O ATOM 0 H GLY A 62 -10.799 -3.101 -2.010 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.231 -5.236 -2.989 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.846 -4.457 -4.433 1.00 0.00 H new ATOM 879 N ASP A 63 -9.199 -3.232 -4.594 1.00 0.00 N ATOM 880 CA ASP A 63 -7.879 -3.115 -5.189 1.00 0.00 C ATOM 881 C ASP A 63 -6.855 -3.812 -4.290 1.00 0.00 C ATOM 882 O ASP A 63 -6.385 -3.232 -3.313 1.00 0.00 O ATOM 883 CB ASP A 63 -7.464 -1.649 -5.328 1.00 0.00 C ATOM 884 CG ASP A 63 -8.364 -0.806 -6.234 1.00 0.00 C ATOM 885 OD1 ASP A 63 -9.328 -1.388 -6.777 1.00 0.00 O ATOM 886 OD2 ASP A 63 -8.069 0.402 -6.362 1.00 0.00 O ATOM 0 H ASP A 63 -9.687 -2.346 -4.462 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.913 -3.575 -6.176 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.446 -1.196 -4.337 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.446 -1.610 -5.715 1.00 0.00 H new ATOM 891 N GLN A 64 -6.541 -5.048 -4.652 1.00 0.00 N ATOM 892 CA GLN A 64 -5.583 -5.830 -3.890 1.00 0.00 C ATOM 893 C GLN A 64 -4.155 -5.479 -4.315 1.00 0.00 C ATOM 894 O GLN A 64 -3.818 -5.558 -5.495 1.00 0.00 O ATOM 895 CB GLN A 64 -5.849 -7.328 -4.047 1.00 0.00 C ATOM 896 CG GLN A 64 -4.774 -8.154 -3.338 1.00 0.00 C ATOM 897 CD GLN A 64 -4.779 -9.601 -3.833 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.616 -10.013 -4.619 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.799 -10.348 -3.332 1.00 0.00 N ATOM 0 H GLN A 64 -6.933 -5.526 -5.463 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.699 -5.583 -2.835 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.829 -7.572 -3.637 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.873 -7.588 -5.105 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.794 -7.709 -3.513 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.946 -8.134 -2.262 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.131 -9.941 -2.678 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.716 -11.328 -3.602 1.00 0.00 H new ATOM 908 N ILE A 65 -3.355 -5.100 -3.329 1.00 0.00 N ATOM 909 CA ILE A 65 -1.971 -4.738 -3.585 1.00 0.00 C ATOM 910 C ILE A 65 -1.151 -6.008 -3.818 1.00 0.00 C ATOM 911 O ILE A 65 -0.893 -6.764 -2.883 1.00 0.00 O ATOM 912 CB ILE A 65 -1.432 -3.854 -2.459 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.339 -2.644 -2.229 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.016 -3.441 -2.732 1.00 0.00 C ATOM 915 CD1 ILE A 65 -2.199 -2.117 -0.799 1.00 0.00 C ATOM 0 H ILE A 65 -3.639 -5.036 -2.351 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.895 -4.139 -4.493 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.433 -4.436 -1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.086 -1.855 -2.937 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.376 -2.921 -2.418 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.375 -2.813 -1.917 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.640 -4.331 -2.807 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.065 -2.884 -3.668 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.854 -1.257 -0.662 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.477 -2.900 -0.094 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.166 -1.818 -0.621 1.00 0.00 H new ATOM 927 N VAL A 66 -0.763 -6.203 -5.070 1.00 0.00 N ATOM 928 CA VAL A 66 0.024 -7.368 -5.437 1.00 0.00 C ATOM 929 C VAL A 66 1.499 -6.974 -5.530 1.00 0.00 C ATOM 930 O VAL A 66 2.380 -7.827 -5.437 1.00 0.00 O ATOM 931 CB VAL A 66 -0.516 -7.976 -6.733 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.997 -8.334 -6.596 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.286 -7.035 -7.917 1.00 0.00 C ATOM 0 H VAL A 66 -0.979 -5.574 -5.843 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.057 -8.140 -4.672 1.00 0.00 H new ATOM 0 HB VAL A 66 0.034 -8.897 -6.925 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.355 -8.764 -7.531 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.123 -9.058 -5.791 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.569 -7.435 -6.368 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.679 -7.491 -8.826 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.797 -6.090 -7.735 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.782 -6.853 -8.035 1.00 0.00 H new ATOM 943 N GLU A 67 1.722 -5.680 -5.712 1.00 0.00 N ATOM 944 CA GLU A 67 3.076 -5.162 -5.819 1.00 0.00 C ATOM 945 C GLU A 67 3.122 -3.701 -5.367 1.00 0.00 C ATOM 946 O GLU A 67 2.124 -2.989 -5.455 1.00 0.00 O ATOM 947 CB GLU A 67 3.609 -5.312 -7.245 1.00 0.00 C ATOM 948 CG GLU A 67 4.949 -4.592 -7.408 1.00 0.00 C ATOM 949 CD GLU A 67 5.435 -4.658 -8.857 1.00 0.00 C ATOM 950 OE1 GLU A 67 4.725 -4.098 -9.720 1.00 0.00 O ATOM 951 OE2 GLU A 67 6.505 -5.268 -9.070 1.00 0.00 O ATOM 0 H GLU A 67 0.988 -4.975 -5.788 1.00 0.00 H new ATOM 0 HA GLU A 67 3.721 -5.746 -5.162 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.729 -6.369 -7.483 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.886 -4.906 -7.952 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.846 -3.551 -7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.691 -5.045 -6.751 1.00 0.00 H new ATOM 958 N VAL A 68 4.292 -3.299 -4.892 1.00 0.00 N ATOM 959 CA VAL A 68 4.482 -1.936 -4.426 1.00 0.00 C ATOM 960 C VAL A 68 5.953 -1.547 -4.585 1.00 0.00 C ATOM 961 O VAL A 68 6.825 -2.127 -3.940 1.00 0.00 O ATOM 962 CB VAL A 68 3.980 -1.800 -2.987 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.211 -0.384 -2.457 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.504 -2.191 -2.882 1.00 0.00 C ATOM 0 H VAL A 68 5.118 -3.893 -4.820 1.00 0.00 H new ATOM 0 HA VAL A 68 3.895 -1.242 -5.028 1.00 0.00 H new ATOM 0 HB VAL A 68 4.554 -2.488 -2.366 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.845 -0.315 -1.433 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.277 -0.157 -2.478 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.676 0.330 -3.082 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.172 -2.085 -1.849 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.909 -1.540 -3.523 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.378 -3.226 -3.199 1.00 0.00 H new ATOM 974 N ASN A 69 6.184 -0.569 -5.448 1.00 0.00 N ATOM 975 CA ASN A 69 7.534 -0.096 -5.700 1.00 0.00 C ATOM 976 C ASN A 69 8.406 -1.271 -6.146 1.00 0.00 C ATOM 977 O ASN A 69 9.627 -1.235 -5.996 1.00 0.00 O ATOM 978 CB ASN A 69 8.155 0.499 -4.434 1.00 0.00 C ATOM 979 CG ASN A 69 8.606 1.942 -4.670 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.516 2.477 -5.763 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.094 2.540 -3.588 1.00 0.00 N ATOM 0 H ASN A 69 5.458 -0.091 -5.982 1.00 0.00 H new ATOM 0 HA ASN A 69 7.484 0.672 -6.472 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.430 0.469 -3.621 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.007 -0.106 -4.124 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.421 3.505 -3.642 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.141 2.034 -2.703 1.00 0.00 H new ATOM 988 N GLY A 70 7.746 -2.284 -6.687 1.00 0.00 N ATOM 989 CA GLY A 70 8.446 -3.468 -7.157 1.00 0.00 C ATOM 990 C GLY A 70 8.584 -4.503 -6.038 1.00 0.00 C ATOM 991 O GLY A 70 9.417 -5.405 -6.122 1.00 0.00 O ATOM 0 H GLY A 70 6.734 -2.310 -6.811 1.00 0.00 H new ATOM 0 HA2 GLY A 70 7.906 -3.905 -7.997 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.434 -3.189 -7.524 1.00 0.00 H new ATOM 995 N VAL A 71 7.756 -4.338 -5.017 1.00 0.00 N ATOM 996 CA VAL A 71 7.776 -5.247 -3.884 1.00 0.00 C ATOM 997 C VAL A 71 6.742 -6.353 -4.104 1.00 0.00 C ATOM 998 O VAL A 71 5.805 -6.185 -4.883 1.00 0.00 O ATOM 999 CB VAL A 71 7.552 -4.469 -2.585 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.542 -5.408 -1.378 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.602 -3.369 -2.417 1.00 0.00 C ATOM 0 H VAL A 71 7.067 -3.589 -4.951 1.00 0.00 H new ATOM 0 HA VAL A 71 8.751 -5.726 -3.796 1.00 0.00 H new ATOM 0 HB VAL A 71 6.574 -3.992 -2.645 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.381 -4.830 -0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.740 -6.137 -1.491 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.498 -5.928 -1.313 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.420 -2.831 -1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.596 -3.816 -2.390 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.539 -2.675 -3.255 1.00 0.00 H new ATOM 1011 N ASP A 72 6.947 -7.459 -3.404 1.00 0.00 N ATOM 1012 CA ASP A 72 6.045 -8.592 -3.514 1.00 0.00 C ATOM 1013 C ASP A 72 4.966 -8.486 -2.434 1.00 0.00 C ATOM 1014 O ASP A 72 5.111 -9.049 -1.350 1.00 0.00 O ATOM 1015 CB ASP A 72 6.790 -9.912 -3.309 1.00 0.00 C ATOM 1016 CG ASP A 72 6.245 -11.095 -4.113 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.137 -10.938 -4.671 1.00 0.00 O ATOM 1018 OD2 ASP A 72 6.947 -12.128 -4.150 1.00 0.00 O ATOM 0 H ASP A 72 7.725 -7.594 -2.758 1.00 0.00 H new ATOM 0 HA ASP A 72 5.606 -8.577 -4.512 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.837 -9.765 -3.572 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.760 -10.168 -2.250 1.00 0.00 H new ATOM 1023 N PHE A 73 3.909 -7.760 -2.767 1.00 0.00 N ATOM 1024 CA PHE A 73 2.807 -7.573 -1.839 1.00 0.00 C ATOM 1025 C PHE A 73 1.714 -8.619 -2.067 1.00 0.00 C ATOM 1026 O PHE A 73 0.549 -8.384 -1.752 1.00 0.00 O ATOM 1027 CB PHE A 73 2.228 -6.182 -2.107 1.00 0.00 C ATOM 1028 CG PHE A 73 2.826 -5.080 -1.230 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.162 -4.830 -1.269 1.00 0.00 C ATOM 1030 CD2 PHE A 73 2.021 -4.350 -0.411 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.717 -3.807 -0.455 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.576 -3.327 0.402 1.00 0.00 C ATOM 1033 CZ PHE A 73 3.912 -3.077 0.363 1.00 0.00 C ATOM 0 H PHE A 73 3.792 -7.294 -3.667 1.00 0.00 H new ATOM 0 HA PHE A 73 3.163 -7.676 -0.814 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.391 -5.927 -3.154 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.150 -6.212 -1.950 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.801 -5.409 -1.919 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.960 -4.549 -0.379 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.778 -3.609 -0.486 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.937 -2.747 1.052 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.334 -2.299 0.982 1.00 0.00 H new ATOM 1043 N SER A 74 2.130 -9.753 -2.613 1.00 0.00 N ATOM 1044 CA SER A 74 1.201 -10.836 -2.886 1.00 0.00 C ATOM 1045 C SER A 74 0.940 -11.637 -1.609 1.00 0.00 C ATOM 1046 O SER A 74 -0.169 -12.122 -1.392 1.00 0.00 O ATOM 1047 CB SER A 74 1.735 -11.754 -3.988 1.00 0.00 C ATOM 1048 OG SER A 74 0.704 -12.173 -4.879 1.00 0.00 O ATOM 0 H SER A 74 3.097 -9.945 -2.873 1.00 0.00 H new ATOM 0 HA SER A 74 0.263 -10.403 -3.233 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.510 -11.233 -4.550 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.202 -12.629 -3.536 1.00 0.00 H new ATOM 0 HG SER A 74 1.085 -12.756 -5.569 1.00 0.00 H new ATOM 1054 N ASN A 75 1.981 -11.751 -0.797 1.00 0.00 N ATOM 1055 CA ASN A 75 1.878 -12.485 0.453 1.00 0.00 C ATOM 1056 C ASN A 75 2.575 -11.695 1.562 1.00 0.00 C ATOM 1057 O ASN A 75 3.343 -12.257 2.341 1.00 0.00 O ATOM 1058 CB ASN A 75 2.558 -13.851 0.347 1.00 0.00 C ATOM 1059 CG ASN A 75 2.089 -14.602 -0.901 1.00 0.00 C ATOM 1060 OD1 ASN A 75 2.859 -14.923 -1.791 1.00 0.00 O ATOM 1061 ND2 ASN A 75 0.785 -14.864 -0.916 1.00 0.00 N ATOM 0 H ASN A 75 2.900 -11.347 -0.980 1.00 0.00 H new ATOM 0 HA ASN A 75 0.820 -12.625 0.676 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.640 -13.721 0.312 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.336 -14.442 1.236 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.374 -15.362 -1.706 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.196 -14.567 -0.138 1.00 0.00 H new ATOM 1068 N LEU A 76 2.283 -10.403 1.598 1.00 0.00 N ATOM 1069 CA LEU A 76 2.872 -9.530 2.598 1.00 0.00 C ATOM 1070 C LEU A 76 2.045 -9.602 3.883 1.00 0.00 C ATOM 1071 O LEU A 76 1.206 -10.489 4.036 1.00 0.00 O ATOM 1072 CB LEU A 76 3.028 -8.111 2.047 1.00 0.00 C ATOM 1073 CG LEU A 76 4.429 -7.729 1.564 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.499 -6.243 1.208 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.490 -8.123 2.593 1.00 0.00 C ATOM 0 H LEU A 76 1.646 -9.940 0.950 1.00 0.00 H new ATOM 0 HA LEU A 76 3.880 -9.863 2.847 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.333 -7.986 1.217 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.728 -7.406 2.823 1.00 0.00 H new ATOM 0 HG LEU A 76 4.641 -8.289 0.653 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.505 -5.997 0.868 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.784 -6.025 0.415 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.258 -5.646 2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.476 -7.840 2.225 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.293 -7.609 3.534 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.458 -9.201 2.754 1.00 0.00 H new ATOM 1087 N ASP A 77 2.310 -8.658 4.774 1.00 0.00 N ATOM 1088 CA ASP A 77 1.600 -8.604 6.041 1.00 0.00 C ATOM 1089 C ASP A 77 1.130 -7.171 6.296 1.00 0.00 C ATOM 1090 O ASP A 77 1.520 -6.249 5.582 1.00 0.00 O ATOM 1091 CB ASP A 77 2.510 -9.017 7.200 1.00 0.00 C ATOM 1092 CG ASP A 77 1.834 -9.050 8.572 1.00 0.00 C ATOM 1093 OD1 ASP A 77 0.882 -9.846 8.717 1.00 0.00 O ATOM 1094 OD2 ASP A 77 2.285 -8.278 9.445 1.00 0.00 O ATOM 0 H ASP A 77 3.007 -7.924 4.644 1.00 0.00 H new ATOM 0 HA ASP A 77 0.755 -9.290 5.984 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.917 -10.006 6.988 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.353 -8.328 7.244 1.00 0.00 H new ATOM 1099 N HIS A 78 0.297 -7.028 7.317 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.231 -5.723 7.676 1.00 0.00 C ATOM 1101 C HIS A 78 0.880 -4.873 8.295 1.00 0.00 C ATOM 1102 O HIS A 78 0.682 -3.690 8.568 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.450 -5.862 8.590 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.150 -4.557 8.882 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.678 -3.644 9.808 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.292 -4.022 8.361 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.505 -2.609 9.836 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.505 -2.846 8.939 1.00 0.00 N ATOM 0 H HIS A 78 -0.025 -7.795 7.907 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.579 -5.209 6.780 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.160 -6.548 8.129 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.136 -6.313 9.531 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -0.836 -3.750 10.374 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.916 -4.478 7.607 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.405 -1.733 10.459 1.00 0.00 H new ATOM 1116 N LYS A 79 2.025 -5.508 8.498 1.00 0.00 N ATOM 1117 CA LYS A 79 3.168 -4.825 9.079 1.00 0.00 C ATOM 1118 C LYS A 79 4.242 -4.633 8.007 1.00 0.00 C ATOM 1119 O LYS A 79 4.920 -3.607 7.979 1.00 0.00 O ATOM 1120 CB LYS A 79 3.664 -5.571 10.320 1.00 0.00 C ATOM 1121 CG LYS A 79 2.601 -5.571 11.420 1.00 0.00 C ATOM 1122 CD LYS A 79 3.128 -4.903 12.692 1.00 0.00 C ATOM 1123 CE LYS A 79 2.178 -5.136 13.868 1.00 0.00 C ATOM 1124 NZ LYS A 79 2.699 -4.488 15.092 1.00 0.00 N ATOM 0 H LYS A 79 2.186 -6.489 8.270 1.00 0.00 H new ATOM 0 HA LYS A 79 2.882 -3.832 9.425 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.918 -6.597 10.055 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.576 -5.102 10.690 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.712 -5.046 11.071 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.301 -6.595 11.641 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.115 -5.299 12.933 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.247 -3.833 12.522 1.00 0.00 H new ATOM 0 HE2 LYS A 79 1.192 -4.738 13.630 1.00 0.00 H new ATOM 0 HE3 LYS A 79 2.057 -6.206 14.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.042 -4.656 15.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.630 -4.887 15.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 2.791 -3.465 14.931 1.00 0.00 H new ATOM 1138 N GLU A 80 4.363 -5.637 7.150 1.00 0.00 N ATOM 1139 CA GLU A 80 5.344 -5.592 6.078 1.00 0.00 C ATOM 1140 C GLU A 80 4.844 -4.700 4.939 1.00 0.00 C ATOM 1141 O GLU A 80 5.630 -3.996 4.307 1.00 0.00 O ATOM 1142 CB GLU A 80 5.668 -6.998 5.572 1.00 0.00 C ATOM 1143 CG GLU A 80 6.289 -7.850 6.681 1.00 0.00 C ATOM 1144 CD GLU A 80 7.309 -8.837 6.108 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.420 -8.374 5.773 1.00 0.00 O ATOM 1146 OE2 GLU A 80 6.953 -10.032 6.017 1.00 0.00 O ATOM 0 H GLU A 80 3.798 -6.486 7.176 1.00 0.00 H new ATOM 0 HA GLU A 80 6.265 -5.163 6.472 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.759 -7.476 5.207 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.355 -6.935 4.728 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.774 -7.204 7.413 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.506 -8.395 7.207 1.00 0.00 H new ATOM 1153 N ALA A 81 3.540 -4.761 4.712 1.00 0.00 N ATOM 1154 CA ALA A 81 2.926 -3.968 3.660 1.00 0.00 C ATOM 1155 C ALA A 81 2.908 -2.497 4.081 1.00 0.00 C ATOM 1156 O ALA A 81 3.002 -1.606 3.239 1.00 0.00 O ATOM 1157 CB ALA A 81 1.525 -4.508 3.365 1.00 0.00 C ATOM 0 H ALA A 81 2.892 -5.347 5.238 1.00 0.00 H new ATOM 0 HA ALA A 81 3.503 -4.040 2.738 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.065 -3.913 2.576 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.596 -5.547 3.042 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.915 -4.449 4.267 1.00 0.00 H new ATOM 1163 N VAL A 82 2.785 -2.289 5.384 1.00 0.00 N ATOM 1164 CA VAL A 82 2.753 -0.941 5.926 1.00 0.00 C ATOM 1165 C VAL A 82 4.183 -0.411 6.048 1.00 0.00 C ATOM 1166 O VAL A 82 4.442 0.757 5.760 1.00 0.00 O ATOM 1167 CB VAL A 82 1.997 -0.931 7.256 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.298 0.343 8.048 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.492 -1.094 7.033 1.00 0.00 C ATOM 0 H VAL A 82 2.706 -3.031 6.080 1.00 0.00 H new ATOM 0 HA VAL A 82 2.214 -0.272 5.255 1.00 0.00 H new ATOM 0 HB VAL A 82 2.343 -1.781 7.844 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.748 0.325 8.989 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.367 0.400 8.253 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.994 1.213 7.467 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.022 -1.084 7.994 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.125 -0.274 6.416 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.299 -2.041 6.529 1.00 0.00 H new ATOM 1179 N ASN A 83 5.074 -1.294 6.474 1.00 0.00 N ATOM 1180 CA ASN A 83 6.471 -0.929 6.637 1.00 0.00 C ATOM 1181 C ASN A 83 7.048 -0.521 5.281 1.00 0.00 C ATOM 1182 O ASN A 83 7.778 0.465 5.184 1.00 0.00 O ATOM 1183 CB ASN A 83 7.290 -2.109 7.164 1.00 0.00 C ATOM 1184 CG ASN A 83 8.769 -1.736 7.292 1.00 0.00 C ATOM 1185 OD1 ASN A 83 9.127 -0.625 7.646 1.00 0.00 O ATOM 1186 ND2 ASN A 83 9.604 -2.724 6.986 1.00 0.00 N ATOM 0 H ASN A 83 4.856 -2.262 6.711 1.00 0.00 H new ATOM 0 HA ASN A 83 6.524 -0.106 7.350 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.904 -2.419 8.135 1.00 0.00 H new ATOM 0 HB3 ASN A 83 7.183 -2.960 6.491 1.00 0.00 H new ATOM 0 HD21 ASN A 83 10.612 -2.575 7.041 1.00 0.00 H new ATOM 0 HD22 ASN A 83 9.237 -3.631 6.697 1.00 0.00 H new ATOM 1193 N VAL A 84 6.700 -1.299 4.266 1.00 0.00 N ATOM 1194 CA VAL A 84 7.175 -1.031 2.920 1.00 0.00 C ATOM 1195 C VAL A 84 6.430 0.180 2.353 1.00 0.00 C ATOM 1196 O VAL A 84 6.977 0.925 1.542 1.00 0.00 O ATOM 1197 CB VAL A 84 7.027 -2.283 2.053 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.390 -1.988 0.597 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.870 -3.434 2.606 1.00 0.00 C ATOM 0 H VAL A 84 6.094 -2.115 4.350 1.00 0.00 H new ATOM 0 HA VAL A 84 8.237 -0.784 2.932 1.00 0.00 H new ATOM 0 HB VAL A 84 5.981 -2.589 2.081 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.276 -2.895 0.003 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.730 -1.213 0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.423 -1.645 0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.747 -4.312 1.972 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.920 -3.141 2.621 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.544 -3.670 3.619 1.00 0.00 H new ATOM 1209 N LEU A 85 5.194 0.338 2.803 1.00 0.00 N ATOM 1210 CA LEU A 85 4.368 1.444 2.351 1.00 0.00 C ATOM 1211 C LEU A 85 4.812 2.727 3.057 1.00 0.00 C ATOM 1212 O LEU A 85 4.708 3.817 2.496 1.00 0.00 O ATOM 1213 CB LEU A 85 2.885 1.119 2.540 1.00 0.00 C ATOM 1214 CG LEU A 85 2.229 0.308 1.421 1.00 0.00 C ATOM 1215 CD1 LEU A 85 0.820 -0.136 1.821 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.233 1.086 0.104 1.00 0.00 C ATOM 0 H LEU A 85 4.744 -0.282 3.477 1.00 0.00 H new ATOM 0 HA LEU A 85 4.500 1.606 1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.770 0.571 3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.339 2.056 2.651 1.00 0.00 H new ATOM 0 HG LEU A 85 2.819 -0.595 1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.375 -0.711 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.874 -0.755 2.716 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.206 0.741 2.023 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.761 0.486 -0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.681 2.017 0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.260 1.310 -0.183 1.00 0.00 H new ATOM 1228 N LYS A 86 5.296 2.555 4.278 1.00 0.00 N ATOM 1229 CA LYS A 86 5.756 3.686 5.067 1.00 0.00 C ATOM 1230 C LYS A 86 7.263 3.860 4.871 1.00 0.00 C ATOM 1231 O LYS A 86 7.838 4.856 5.307 1.00 0.00 O ATOM 1232 CB LYS A 86 5.340 3.522 6.530 1.00 0.00 C ATOM 1233 CG LYS A 86 6.427 2.804 7.332 1.00 0.00 C ATOM 1234 CD LYS A 86 6.007 2.630 8.793 1.00 0.00 C ATOM 1235 CE LYS A 86 4.809 1.686 8.910 1.00 0.00 C ATOM 1236 NZ LYS A 86 4.699 1.156 10.287 1.00 0.00 N ATOM 0 H LYS A 86 5.380 1.650 4.741 1.00 0.00 H new ATOM 0 HA LYS A 86 5.282 4.607 4.726 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.146 4.501 6.969 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.409 2.958 6.586 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.626 1.828 6.889 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.356 3.372 7.282 1.00 0.00 H new ATOM 0 HD2 LYS A 86 6.843 2.236 9.371 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.753 3.600 9.220 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.894 2.215 8.644 1.00 0.00 H new ATOM 0 HE3 LYS A 86 4.917 0.862 8.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 3.881 0.517 10.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.565 0.633 10.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.574 1.944 10.953 1.00 0.00 H new ATOM 1250 N SER A 87 7.860 2.875 4.216 1.00 0.00 N ATOM 1251 CA SER A 87 9.289 2.906 3.958 1.00 0.00 C ATOM 1252 C SER A 87 9.667 4.217 3.265 1.00 0.00 C ATOM 1253 O SER A 87 10.429 5.014 3.809 1.00 0.00 O ATOM 1254 CB SER A 87 9.722 1.711 3.105 1.00 0.00 C ATOM 1255 OG SER A 87 10.419 0.733 3.872 1.00 0.00 O ATOM 0 H SER A 87 7.380 2.050 3.856 1.00 0.00 H new ATOM 0 HA SER A 87 9.810 2.843 4.913 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.844 1.255 2.648 1.00 0.00 H new ATOM 0 HB3 SER A 87 10.361 2.058 2.293 1.00 0.00 H new ATOM 0 HG SER A 87 9.810 0.339 4.530 1.00 0.00 H new ATOM 1261 N SER A 88 9.116 4.399 2.073 1.00 0.00 N ATOM 1262 CA SER A 88 9.386 5.600 1.300 1.00 0.00 C ATOM 1263 C SER A 88 8.079 6.343 1.015 1.00 0.00 C ATOM 1264 O SER A 88 6.995 5.784 1.176 1.00 0.00 O ATOM 1265 CB SER A 88 10.101 5.262 -0.010 1.00 0.00 C ATOM 1266 OG SER A 88 11.175 6.159 -0.278 1.00 0.00 O ATOM 0 H SER A 88 8.485 3.735 1.624 1.00 0.00 H new ATOM 0 HA SER A 88 10.043 6.244 1.885 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.483 4.242 0.038 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.386 5.296 -0.832 1.00 0.00 H new ATOM 0 HG SER A 88 11.607 5.909 -1.121 1.00 0.00 H new ATOM 1272 N ARG A 89 8.225 7.592 0.598 1.00 0.00 N ATOM 1273 CA ARG A 89 7.070 8.418 0.289 1.00 0.00 C ATOM 1274 C ARG A 89 6.444 7.980 -1.037 1.00 0.00 C ATOM 1275 O ARG A 89 5.308 7.510 -1.065 1.00 0.00 O ATOM 1276 CB ARG A 89 7.457 9.895 0.199 1.00 0.00 C ATOM 1277 CG ARG A 89 8.264 10.326 1.425 1.00 0.00 C ATOM 1278 CD ARG A 89 7.387 10.352 2.678 1.00 0.00 C ATOM 1279 NE ARG A 89 7.984 11.244 3.697 1.00 0.00 N ATOM 1280 CZ ARG A 89 8.994 10.891 4.504 1.00 0.00 C ATOM 1281 NH1 ARG A 89 9.524 9.664 4.417 1.00 0.00 N ATOM 1282 NH2 ARG A 89 9.473 11.766 5.399 1.00 0.00 N ATOM 0 H ARG A 89 9.126 8.052 0.467 1.00 0.00 H new ATOM 0 HA ARG A 89 6.347 8.292 1.095 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.042 10.067 -0.705 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.558 10.506 0.118 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.098 9.641 1.575 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.690 11.315 1.255 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.385 10.697 2.423 1.00 0.00 H new ATOM 0 HD3 ARG A 89 7.284 9.344 3.081 1.00 0.00 H new ATOM 0 HE ARG A 89 7.603 12.186 3.791 1.00 0.00 H new ATOM 0 HH11 ARG A 89 9.159 8.998 3.736 1.00 0.00 H new ATOM 0 HH12 ARG A 89 10.293 9.396 5.031 1.00 0.00 H new ATOM 0 HH21 ARG A 89 9.069 12.700 5.466 1.00 0.00 H new ATOM 0 HH22 ARG A 89 10.242 11.498 6.013 1.00 0.00 H new ATOM 1296 N SER A 90 7.213 8.150 -2.102 1.00 0.00 N ATOM 1297 CA SER A 90 6.748 7.779 -3.428 1.00 0.00 C ATOM 1298 C SER A 90 6.925 6.274 -3.642 1.00 0.00 C ATOM 1299 O SER A 90 8.035 5.755 -3.534 1.00 0.00 O ATOM 1300 CB SER A 90 7.492 8.560 -4.512 1.00 0.00 C ATOM 1301 OG SER A 90 7.809 9.885 -4.093 1.00 0.00 O ATOM 0 H SER A 90 8.155 8.540 -2.074 1.00 0.00 H new ATOM 0 HA SER A 90 5.689 8.029 -3.501 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.410 8.033 -4.773 1.00 0.00 H new ATOM 0 HB3 SER A 90 6.881 8.601 -5.413 1.00 0.00 H new ATOM 0 HG SER A 90 8.285 10.350 -4.812 1.00 0.00 H new ATOM 1307 N LEU A 91 5.814 5.616 -3.942 1.00 0.00 N ATOM 1308 CA LEU A 91 5.833 4.182 -4.172 1.00 0.00 C ATOM 1309 C LEU A 91 4.888 3.843 -5.327 1.00 0.00 C ATOM 1310 O LEU A 91 3.885 4.524 -5.533 1.00 0.00 O ATOM 1311 CB LEU A 91 5.520 3.427 -2.879 1.00 0.00 C ATOM 1312 CG LEU A 91 6.424 3.739 -1.684 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.603 4.227 -0.489 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.296 2.534 -1.327 1.00 0.00 C ATOM 0 H LEU A 91 4.895 6.050 -4.031 1.00 0.00 H new ATOM 0 HA LEU A 91 6.830 3.857 -4.469 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.490 3.643 -2.596 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.577 2.358 -3.083 1.00 0.00 H new ATOM 0 HG LEU A 91 7.096 4.550 -1.966 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.269 4.442 0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.063 5.133 -0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.891 3.455 -0.197 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.929 2.782 -0.475 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.659 1.687 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 91 7.922 2.273 -2.180 1.00 0.00 H new ATOM 1326 N THR A 92 5.242 2.790 -6.049 1.00 0.00 N ATOM 1327 CA THR A 92 4.438 2.352 -7.177 1.00 0.00 C ATOM 1328 C THR A 92 3.646 1.095 -6.812 1.00 0.00 C ATOM 1329 O THR A 92 4.192 -0.008 -6.810 1.00 0.00 O ATOM 1330 CB THR A 92 5.370 2.157 -8.374 1.00 0.00 C ATOM 1331 OG1 THR A 92 5.722 3.482 -8.760 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.642 1.594 -9.597 1.00 0.00 C ATOM 0 H THR A 92 6.075 2.227 -5.875 1.00 0.00 H new ATOM 0 HA THR A 92 3.693 3.100 -7.446 1.00 0.00 H new ATOM 0 HB THR A 92 6.183 1.487 -8.095 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.908 4.010 -8.898 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.349 1.475 -10.418 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.208 0.626 -9.348 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.850 2.280 -9.897 1.00 0.00 H new ATOM 1340 N ILE A 93 2.373 1.302 -6.511 1.00 0.00 N ATOM 1341 CA ILE A 93 1.501 0.199 -6.145 1.00 0.00 C ATOM 1342 C ILE A 93 0.856 -0.376 -7.407 1.00 0.00 C ATOM 1343 O ILE A 93 0.489 0.367 -8.315 1.00 0.00 O ATOM 1344 CB ILE A 93 0.490 0.644 -5.086 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.199 1.129 -3.820 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.518 -0.468 -4.789 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.352 2.166 -3.080 1.00 0.00 C ATOM 0 H ILE A 93 1.924 2.218 -6.513 1.00 0.00 H new ATOM 0 HA ILE A 93 2.076 -0.605 -5.686 1.00 0.00 H new ATOM 0 HB ILE A 93 -0.071 1.489 -5.484 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.399 0.282 -3.164 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.164 1.563 -4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.225 -0.126 -4.033 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -1.057 -0.723 -5.701 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.009 -1.348 -4.421 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.879 2.494 -2.184 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.175 3.022 -3.731 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.602 1.722 -2.797 1.00 0.00 H new ATOM 1359 N SER A 94 0.738 -1.696 -7.424 1.00 0.00 N ATOM 1360 CA SER A 94 0.144 -2.380 -8.560 1.00 0.00 C ATOM 1361 C SER A 94 -1.072 -3.190 -8.106 1.00 0.00 C ATOM 1362 O SER A 94 -0.925 -4.257 -7.512 1.00 0.00 O ATOM 1363 CB SER A 94 1.162 -3.292 -9.248 1.00 0.00 C ATOM 1364 OG SER A 94 1.374 -2.925 -10.608 1.00 0.00 O ATOM 0 H SER A 94 1.044 -2.310 -6.669 1.00 0.00 H new ATOM 0 HA SER A 94 -0.177 -1.629 -9.282 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.109 -3.250 -8.709 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.814 -4.324 -9.201 1.00 0.00 H new ATOM 0 HG SER A 94 2.031 -3.530 -11.011 1.00 0.00 H new ATOM 1370 N ILE A 95 -2.246 -2.651 -8.402 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.486 -3.310 -8.032 1.00 0.00 C ATOM 1372 C ILE A 95 -4.054 -4.041 -9.250 1.00 0.00 C ATOM 1373 O ILE A 95 -3.609 -3.818 -10.375 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.459 -2.309 -7.407 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.698 -1.121 -8.340 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.976 -1.864 -6.025 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -6.193 -0.920 -8.601 1.00 0.00 C ATOM 0 H ILE A 95 -2.364 -1.765 -8.894 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.303 -4.063 -7.265 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.418 -2.807 -7.268 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.278 -0.217 -7.899 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.179 -1.286 -9.284 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.686 -1.153 -5.603 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.899 -2.732 -5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.999 -1.390 -6.116 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -6.335 -0.069 -9.267 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.605 -1.816 -9.064 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.705 -0.731 -7.657 1.00 0.00 H new ATOM 1389 N VAL A 96 -5.028 -4.899 -8.985 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.661 -5.664 -10.046 1.00 0.00 C ATOM 1391 C VAL A 96 -7.077 -5.130 -10.278 1.00 0.00 C ATOM 1392 O VAL A 96 -7.975 -5.885 -10.650 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.633 -7.155 -9.705 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.437 -7.966 -10.723 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -4.195 -7.668 -9.608 1.00 0.00 C ATOM 0 H VAL A 96 -5.394 -5.081 -8.051 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.112 -5.548 -10.980 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.102 -7.284 -8.729 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.401 -9.022 -10.457 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.473 -7.627 -10.722 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.011 -7.827 -11.717 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.203 -8.730 -9.365 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.690 -7.518 -10.562 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.665 -7.121 -8.828 1.00 0.00 H new ATOM 1405 N ALA A 97 -7.231 -3.835 -10.050 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.522 -3.192 -10.229 1.00 0.00 C ATOM 1407 C ALA A 97 -9.605 -4.033 -9.549 1.00 0.00 C ATOM 1408 O ALA A 97 -10.113 -4.987 -10.135 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.790 -2.993 -11.722 1.00 0.00 C ATOM 0 H ALA A 97 -6.483 -3.213 -9.743 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.528 -2.207 -9.762 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.758 -2.511 -11.857 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -8.009 -2.365 -12.151 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.794 -3.961 -12.223 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.925 -3.647 -8.323 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.938 -4.353 -7.557 1.00 0.00 C ATOM 1417 C ALA A 98 -10.700 -5.860 -7.672 1.00 0.00 C ATOM 1418 O ALA A 98 -11.576 -6.599 -8.118 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.328 -3.944 -8.048 1.00 0.00 C ATOM 0 H ALA A 98 -9.501 -2.854 -7.841 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.874 -4.088 -6.502 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -13.087 -4.474 -7.473 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.458 -2.870 -7.918 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.430 -4.197 -9.103 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.509 -6.272 -7.262 1.00 0.00 N ATOM 1426 CA ALA A 99 -9.144 -7.677 -7.314 1.00 0.00 C ATOM 1427 C ALA A 99 -10.054 -8.471 -6.374 1.00 0.00 C ATOM 1428 O ALA A 99 -10.791 -9.352 -6.815 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.664 -7.834 -6.961 1.00 0.00 C ATOM 0 H ALA A 99 -8.784 -5.657 -6.892 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.283 -8.072 -8.320 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.390 -8.888 -7.000 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -7.058 -7.275 -7.675 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.487 -7.450 -5.956 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.973 -8.130 -5.096 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.781 -8.800 -4.090 1.00 0.00 C ATOM 1437 C GLY A 100 -11.838 -7.854 -3.517 1.00 0.00 C ATOM 1438 O GLY A 100 -11.854 -7.590 -2.316 1.00 0.00 O ATOM 0 H GLY A 100 -9.361 -7.399 -4.734 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.267 -9.671 -4.530 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.140 -9.164 -3.287 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.695 -7.370 -4.404 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.754 -6.459 -4.001 1.00 0.00 C ATOM 1444 C ARG A 101 -14.829 -7.210 -3.214 1.00 0.00 C ATOM 1445 O ARG A 101 -15.546 -6.614 -2.412 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.396 -5.789 -5.218 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.204 -4.272 -5.173 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.408 -3.549 -5.781 1.00 0.00 C ATOM 1449 NE ARG A 101 -16.085 -2.736 -4.745 1.00 0.00 N ATOM 1450 CZ ARG A 101 -17.228 -2.067 -4.945 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -17.829 -2.109 -6.142 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -17.771 -1.355 -3.948 1.00 0.00 N ATOM 0 H ARG A 101 -12.678 -7.591 -5.400 1.00 0.00 H new ATOM 0 HA ARG A 101 -13.308 -5.690 -3.370 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.956 -6.188 -6.132 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.460 -6.024 -5.248 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.065 -3.950 -4.141 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.299 -4.000 -5.717 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.083 -2.910 -6.602 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -16.106 -4.275 -6.199 1.00 0.00 H new ATOM 0 HE ARG A 101 -15.654 -2.682 -3.822 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.416 -2.651 -6.901 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.699 -1.599 -6.294 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -17.314 -1.322 -3.037 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -18.641 -0.846 -4.100 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.908 -8.508 -3.470 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.884 -9.346 -2.795 1.00 0.00 C ATOM 1468 C GLU A 102 -15.507 -9.519 -1.322 1.00 0.00 C ATOM 1469 O GLU A 102 -16.363 -9.817 -0.490 1.00 0.00 O ATOM 1470 CB GLU A 102 -16.014 -10.703 -3.490 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.665 -11.421 -3.550 1.00 0.00 C ATOM 1472 CD GLU A 102 -14.366 -11.910 -4.968 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -14.967 -12.936 -5.353 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -13.543 -11.247 -5.636 1.00 0.00 O ATOM 0 H GLU A 102 -14.312 -9.000 -4.136 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.855 -8.853 -2.846 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.735 -11.321 -2.956 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -16.400 -10.563 -4.500 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.875 -10.746 -3.220 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.669 -12.267 -2.863 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.226 -9.324 -1.045 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.726 -9.454 0.313 1.00 0.00 C ATOM 1483 C LEU A 103 -14.412 -8.417 1.205 1.00 0.00 C ATOM 1484 O LEU A 103 -14.461 -8.578 2.424 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.199 -9.368 0.332 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.451 -10.652 -0.032 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -9.937 -10.437 0.016 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.892 -11.815 0.860 1.00 0.00 C ATOM 0 H LEU A 103 -13.519 -9.077 -1.738 1.00 0.00 H new ATOM 0 HA LEU A 103 -13.972 -10.436 0.718 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -11.890 -8.583 -0.358 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.885 -9.058 1.329 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.707 -10.917 -1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.429 -11.365 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.658 -9.657 -0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.644 -10.135 1.022 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.345 -12.716 0.580 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.684 -11.573 1.902 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.961 -11.986 0.733 1.00 0.00 H new ATOM 1500 N PHE A 104 -14.922 -7.376 0.564 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.603 -6.313 1.285 1.00 0.00 C ATOM 1502 C PHE A 104 -17.063 -6.198 0.842 1.00 0.00 C ATOM 1503 O PHE A 104 -17.542 -5.102 0.554 1.00 0.00 O ATOM 1504 CB PHE A 104 -14.875 -5.010 0.950 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.366 -5.058 1.196 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -12.867 -4.748 2.422 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.524 -5.411 0.188 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.466 -4.793 2.651 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.123 -5.456 0.417 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.624 -5.146 1.643 1.00 0.00 C ATOM 0 H PHE A 104 -14.878 -7.245 -0.447 1.00 0.00 H new ATOM 0 HA PHE A 104 -15.592 -6.522 2.355 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.054 -4.765 -0.097 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.304 -4.203 1.544 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.536 -4.467 3.222 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.920 -5.657 -0.786 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.070 -4.547 3.625 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.454 -5.737 -0.383 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.559 -5.180 1.817 1.00 0.00 H new ATOM 1520 N MET A 105 -17.728 -7.343 0.801 1.00 0.00 N ATOM 1521 CA MET A 105 -19.123 -7.383 0.398 1.00 0.00 C ATOM 1522 C MET A 105 -20.028 -6.822 1.497 1.00 0.00 C ATOM 1523 O MET A 105 -20.286 -7.491 2.496 1.00 0.00 O ATOM 1524 CB MET A 105 -19.525 -8.828 0.095 1.00 0.00 C ATOM 1525 CG MET A 105 -19.600 -9.071 -1.414 1.00 0.00 C ATOM 1526 SD MET A 105 -21.162 -9.825 -1.835 1.00 0.00 S ATOM 1527 CE MET A 105 -22.213 -8.382 -1.831 1.00 0.00 C ATOM 0 H MET A 105 -17.327 -8.250 1.040 1.00 0.00 H new ATOM 0 HA MET A 105 -19.242 -6.768 -0.494 1.00 0.00 H new ATOM 0 HB2 MET A 105 -18.803 -9.511 0.542 1.00 0.00 H new ATOM 0 HB3 MET A 105 -20.492 -9.043 0.550 1.00 0.00 H new ATOM 0 HG2 MET A 105 -19.487 -8.128 -1.948 1.00 0.00 H new ATOM 0 HG3 MET A 105 -18.779 -9.716 -1.728 1.00 0.00 H new ATOM 0 HE1 MET A 105 -23.234 -8.675 -2.077 1.00 0.00 H new ATOM 0 HE2 MET A 105 -22.195 -7.922 -0.843 1.00 0.00 H new ATOM 0 HE3 MET A 105 -21.853 -7.667 -2.571 1.00 0.00 H new ATOM 1537 N THR A 106 -20.485 -5.598 1.275 1.00 0.00 N ATOM 1538 CA THR A 106 -21.355 -4.939 2.234 1.00 0.00 C ATOM 1539 C THR A 106 -20.647 -4.789 3.582 1.00 0.00 C ATOM 1540 O THR A 106 -19.774 -5.586 3.920 1.00 0.00 O ATOM 1541 CB THR A 106 -22.658 -5.737 2.317 1.00 0.00 C ATOM 1542 OG1 THR A 106 -23.281 -5.517 1.054 1.00 0.00 O ATOM 1543 CG2 THR A 106 -23.643 -5.146 3.327 1.00 0.00 C ATOM 0 H THR A 106 -20.269 -5.046 0.445 1.00 0.00 H new ATOM 0 HA THR A 106 -21.598 -3.925 1.916 1.00 0.00 H new ATOM 0 HB THR A 106 -22.435 -6.769 2.589 1.00 0.00 H new ATOM 0 HG1 THR A 106 -24.133 -6.000 1.021 1.00 0.00 H new ATOM 0 HG21 THR A 106 -24.550 -5.750 3.347 1.00 0.00 H new ATOM 0 HG22 THR A 106 -23.189 -5.141 4.318 1.00 0.00 H new ATOM 0 HG23 THR A 106 -23.893 -4.125 3.037 1.00 0.00 H new ATOM 1551 N ASP A 107 -21.051 -3.762 4.315 1.00 0.00 N ATOM 1552 CA ASP A 107 -20.466 -3.498 5.618 1.00 0.00 C ATOM 1553 C ASP A 107 -21.179 -2.305 6.260 1.00 0.00 C ATOM 1554 O ASP A 107 -21.751 -1.470 5.561 1.00 0.00 O ATOM 1555 CB ASP A 107 -18.981 -3.151 5.496 1.00 0.00 C ATOM 1556 CG ASP A 107 -18.681 -1.835 4.775 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -18.812 -0.783 5.437 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -18.329 -1.911 3.578 1.00 0.00 O ATOM 0 H ASP A 107 -21.776 -3.103 4.031 1.00 0.00 H new ATOM 0 HA ASP A 107 -20.577 -4.396 6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -18.551 -3.106 6.496 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -18.476 -3.960 4.968 1.00 0.00 H new ATOM 1563 N ARG A 108 -21.121 -2.264 7.583 1.00 0.00 N ATOM 1564 CA ARG A 108 -21.753 -1.187 8.326 1.00 0.00 C ATOM 1565 C ARG A 108 -20.696 -0.218 8.859 1.00 0.00 C ATOM 1566 O ARG A 108 -19.595 -0.631 9.220 1.00 0.00 O ATOM 1567 CB ARG A 108 -22.571 -1.734 9.498 1.00 0.00 C ATOM 1568 CG ARG A 108 -23.864 -0.937 9.683 1.00 0.00 C ATOM 1569 CD ARG A 108 -23.811 -0.094 10.958 1.00 0.00 C ATOM 1570 NE ARG A 108 -25.150 -0.042 11.587 1.00 0.00 N ATOM 1571 CZ ARG A 108 -25.368 0.292 12.866 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -24.336 0.606 13.661 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -26.617 0.312 13.350 1.00 0.00 N ATOM 0 H ARG A 108 -20.646 -2.959 8.159 1.00 0.00 H new ATOM 0 HA ARG A 108 -22.422 -0.661 7.644 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -22.808 -2.783 9.322 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -21.978 -1.690 10.412 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -24.022 -0.289 8.821 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -24.713 -1.620 9.729 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -23.089 -0.519 11.655 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -23.471 0.915 10.723 1.00 0.00 H new ATOM 0 HE ARG A 108 -25.958 -0.275 11.010 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -23.385 0.591 13.292 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -24.501 0.860 14.635 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -27.402 0.073 12.745 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -26.783 0.566 14.324 1.00 0.00 H new ATOM 1587 N SER A 109 -21.068 1.053 8.892 1.00 0.00 N ATOM 1588 CA SER A 109 -20.166 2.085 9.374 1.00 0.00 C ATOM 1589 C SER A 109 -20.968 3.252 9.954 1.00 0.00 C ATOM 1590 O SER A 109 -21.588 4.013 9.213 1.00 0.00 O ATOM 1591 CB SER A 109 -19.245 2.578 8.257 1.00 0.00 C ATOM 1592 OG SER A 109 -18.172 3.370 8.760 1.00 0.00 O ATOM 0 H SER A 109 -21.982 1.392 8.593 1.00 0.00 H new ATOM 0 HA SER A 109 -19.543 1.655 10.158 1.00 0.00 H new ATOM 0 HB2 SER A 109 -18.841 1.722 7.716 1.00 0.00 H new ATOM 0 HB3 SER A 109 -19.823 3.163 7.542 1.00 0.00 H new ATOM 0 HG SER A 109 -17.606 3.664 8.016 1.00 0.00 H new ATOM 1598 N GLY A 110 -20.930 3.356 11.275 1.00 0.00 N ATOM 1599 CA GLY A 110 -21.645 4.417 11.963 1.00 0.00 C ATOM 1600 C GLY A 110 -20.706 5.209 12.875 1.00 0.00 C ATOM 1601 O GLY A 110 -19.498 4.982 12.876 1.00 0.00 O ATOM 0 H GLY A 110 -20.415 2.723 11.887 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -22.099 5.087 11.233 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -22.456 3.991 12.553 1.00 0.00 H new ATOM 1605 N PRO A 111 -21.314 6.147 13.651 1.00 0.00 N ATOM 1606 CA PRO A 111 -20.546 6.973 14.566 1.00 0.00 C ATOM 1607 C PRO A 111 -20.123 6.176 15.801 1.00 0.00 C ATOM 1608 O PRO A 111 -20.724 5.151 16.119 1.00 0.00 O ATOM 1609 CB PRO A 111 -21.457 8.144 14.898 1.00 0.00 C ATOM 1610 CG PRO A 111 -22.862 7.696 14.529 1.00 0.00 C ATOM 1611 CD PRO A 111 -22.744 6.443 13.677 1.00 0.00 C ATOM 0 HA PRO A 111 -19.610 7.324 14.131 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -21.394 8.400 15.956 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -21.170 9.033 14.337 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -23.446 7.493 15.427 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -23.382 8.482 13.981 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -23.312 5.617 14.106 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -23.133 6.609 12.672 1.00 0.00 H new ATOM 1619 N SER A 112 -19.092 6.678 16.465 1.00 0.00 N ATOM 1620 CA SER A 112 -18.581 6.025 17.659 1.00 0.00 C ATOM 1621 C SER A 112 -17.548 6.922 18.344 1.00 0.00 C ATOM 1622 O SER A 112 -16.655 7.457 17.691 1.00 0.00 O ATOM 1623 CB SER A 112 -17.964 4.666 17.322 1.00 0.00 C ATOM 1624 OG SER A 112 -16.659 4.796 16.763 1.00 0.00 O ATOM 0 H SER A 112 -18.597 7.529 16.199 1.00 0.00 H new ATOM 0 HA SER A 112 -19.415 5.856 18.340 1.00 0.00 H new ATOM 0 HB2 SER A 112 -17.913 4.057 18.225 1.00 0.00 H new ATOM 0 HB3 SER A 112 -18.609 4.139 16.619 1.00 0.00 H new ATOM 0 HG SER A 112 -16.299 3.907 16.563 1.00 0.00 H new ATOM 1630 N SER A 113 -17.706 7.058 19.653 1.00 0.00 N ATOM 1631 CA SER A 113 -16.798 7.880 20.434 1.00 0.00 C ATOM 1632 C SER A 113 -16.887 7.498 21.913 1.00 0.00 C ATOM 1633 O SER A 113 -17.965 7.537 22.504 1.00 0.00 O ATOM 1634 CB SER A 113 -17.107 9.368 20.251 1.00 0.00 C ATOM 1635 OG SER A 113 -16.619 9.865 19.009 1.00 0.00 O ATOM 0 H SER A 113 -18.449 6.613 20.192 1.00 0.00 H new ATOM 0 HA SER A 113 -15.783 7.700 20.079 1.00 0.00 H new ATOM 0 HB2 SER A 113 -18.184 9.524 20.306 1.00 0.00 H new ATOM 0 HB3 SER A 113 -16.661 9.934 21.069 1.00 0.00 H new ATOM 0 HG SER A 113 -16.446 9.115 18.402 1.00 0.00 H new ATOM 1641 N GLY A 114 -15.739 7.137 22.468 1.00 0.00 N ATOM 1642 CA GLY A 114 -15.674 6.748 23.866 1.00 0.00 C ATOM 1643 C GLY A 114 -15.256 7.929 24.745 1.00 0.00 C ATOM 1644 O GLY A 114 -15.658 8.017 25.904 1.00 0.00 O ATOM 0 H GLY A 114 -14.847 7.106 21.975 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -16.646 6.376 24.189 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -14.963 5.930 23.987 1.00 0.00 H new TER 1648 GLY A 114