USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 885 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 14:sc= 0.865 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 10 ASN : amide:sc= 0.294 K(o=0.29,f=-4.2!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -142:sc=-0.00146 (180deg=-0.346) USER MOD Single : A 21 GLN : amide:sc= -0.0219 K(o=-0.022,f=-1.2) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 ASN : amide:sc= -0.29 K(o=-0.29,f=-1.5) USER MOD Single : A 31 SER OG : rot 53:sc= -0.57! USER MOD Single : A 33 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0289) USER MOD Single : A 40 MET CE :methyl 156:sc= -2.14 (180deg=-3.83!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.872 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -3.24! C(o=-3.2!,f=-3.7!) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -140:sc= -1.79 (180deg=-5.44!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc=3.22e-05 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot -170:sc=0.000399 USER MOD Single : A 80 MET CE :methyl -138:sc= -2.48 (180deg=-3.89!) USER MOD Single : A 86 SER OG : rot -23:sc= -0.425! USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0418 X(o=-0.042,f=0) USER MOD Single : A 105 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.029) USER MOD Single : A 106 GLN : amide:sc= -0.265 X(o=-0.26,f=-0.11) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc=-0.00597 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.730 2.001 -33.937 1.00 0.00 N ATOM 2 CA GLY A 1 20.420 2.629 -33.978 1.00 0.00 C ATOM 3 C GLY A 1 19.641 2.357 -32.690 1.00 0.00 C ATOM 4 O GLY A 1 19.895 2.984 -31.663 1.00 0.00 O ATOM 0 H1 GLY A 1 22.238 2.200 -34.822 1.00 0.00 H new ATOM 0 H2 GLY A 1 22.271 2.380 -33.134 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.619 0.973 -33.826 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.532 3.704 -34.119 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.859 2.252 -34.833 1.00 0.00 H new ATOM 8 N SER A 2 18.708 1.422 -32.787 1.00 0.00 N ATOM 9 CA SER A 2 17.890 1.059 -31.642 1.00 0.00 C ATOM 10 C SER A 2 17.216 2.306 -31.065 1.00 0.00 C ATOM 11 O SER A 2 17.613 2.798 -30.010 1.00 0.00 O ATOM 12 CB SER A 2 18.726 0.362 -30.567 1.00 0.00 C ATOM 13 OG SER A 2 19.721 1.224 -30.022 1.00 0.00 O ATOM 0 H SER A 2 18.500 0.904 -33.641 1.00 0.00 H new ATOM 0 HA SER A 2 17.123 0.361 -31.977 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.071 0.013 -29.768 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.204 -0.519 -30.995 1.00 0.00 H new ATOM 0 HG SER A 2 19.530 2.149 -30.282 1.00 0.00 H new ATOM 19 N SER A 3 16.208 2.780 -31.782 1.00 0.00 N ATOM 20 CA SER A 3 15.475 3.960 -31.354 1.00 0.00 C ATOM 21 C SER A 3 15.047 3.808 -29.893 1.00 0.00 C ATOM 22 O SER A 3 14.764 2.702 -29.437 1.00 0.00 O ATOM 23 CB SER A 3 14.253 4.201 -32.243 1.00 0.00 C ATOM 24 OG SER A 3 14.595 4.224 -33.626 1.00 0.00 O ATOM 0 H SER A 3 15.881 2.369 -32.656 1.00 0.00 H new ATOM 0 HA SER A 3 16.133 4.824 -31.445 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.515 3.419 -32.065 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.786 5.147 -31.969 1.00 0.00 H new ATOM 0 HG SER A 3 13.788 4.378 -34.160 1.00 0.00 H new ATOM 30 N GLY A 4 15.014 4.937 -29.199 1.00 0.00 N ATOM 31 CA GLY A 4 14.626 4.944 -27.799 1.00 0.00 C ATOM 32 C GLY A 4 14.764 6.344 -27.199 1.00 0.00 C ATOM 33 O GLY A 4 15.840 6.939 -27.243 1.00 0.00 O ATOM 0 H GLY A 4 15.250 5.853 -29.581 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.595 4.603 -27.702 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.248 4.243 -27.242 1.00 0.00 H new ATOM 37 N SER A 5 13.660 6.830 -26.651 1.00 0.00 N ATOM 38 CA SER A 5 13.645 8.150 -26.042 1.00 0.00 C ATOM 39 C SER A 5 12.295 8.399 -25.368 1.00 0.00 C ATOM 40 O SER A 5 11.252 8.025 -25.902 1.00 0.00 O ATOM 41 CB SER A 5 13.930 9.238 -27.079 1.00 0.00 C ATOM 42 OG SER A 5 12.846 9.406 -27.988 1.00 0.00 O ATOM 0 H SER A 5 12.770 6.334 -26.616 1.00 0.00 H new ATOM 0 HA SER A 5 14.432 8.189 -25.289 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.126 10.182 -26.570 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.832 8.982 -27.634 1.00 0.00 H new ATOM 0 HG SER A 5 13.066 10.110 -28.633 1.00 0.00 H new ATOM 48 N SER A 6 12.357 9.031 -24.205 1.00 0.00 N ATOM 49 CA SER A 6 11.152 9.335 -23.453 1.00 0.00 C ATOM 50 C SER A 6 11.133 10.817 -23.071 1.00 0.00 C ATOM 51 O SER A 6 10.215 11.546 -23.443 1.00 0.00 O ATOM 52 CB SER A 6 11.050 8.463 -22.200 1.00 0.00 C ATOM 53 OG SER A 6 10.149 9.011 -21.240 1.00 0.00 O ATOM 0 H SER A 6 13.224 9.341 -23.765 1.00 0.00 H new ATOM 0 HA SER A 6 10.291 9.118 -24.085 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.718 7.463 -22.480 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.038 8.356 -21.751 1.00 0.00 H new ATOM 0 HG SER A 6 10.110 8.425 -20.456 1.00 0.00 H new ATOM 59 N GLY A 7 12.158 11.218 -22.334 1.00 0.00 N ATOM 60 CA GLY A 7 12.271 12.600 -21.898 1.00 0.00 C ATOM 61 C GLY A 7 11.981 12.728 -20.401 1.00 0.00 C ATOM 62 O GLY A 7 11.685 11.737 -19.735 1.00 0.00 O ATOM 0 H GLY A 7 12.918 10.611 -22.028 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.273 12.971 -22.111 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.575 13.221 -22.461 1.00 0.00 H new ATOM 66 N ASP A 8 12.076 13.957 -19.916 1.00 0.00 N ATOM 67 CA ASP A 8 11.827 14.228 -18.510 1.00 0.00 C ATOM 68 C ASP A 8 12.040 15.718 -18.236 1.00 0.00 C ATOM 69 O ASP A 8 13.091 16.268 -18.561 1.00 0.00 O ATOM 70 CB ASP A 8 12.790 13.441 -17.619 1.00 0.00 C ATOM 71 CG ASP A 8 12.188 12.932 -16.308 1.00 0.00 C ATOM 72 OD1 ASP A 8 11.563 13.760 -15.611 1.00 0.00 O ATOM 73 OD2 ASP A 8 12.367 11.726 -16.032 1.00 0.00 O ATOM 0 H ASP A 8 12.322 14.776 -20.471 1.00 0.00 H new ATOM 0 HA ASP A 8 10.803 13.930 -18.286 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.168 12.588 -18.183 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.646 14.074 -17.386 1.00 0.00 H new ATOM 78 N ASP A 9 11.026 16.329 -17.642 1.00 0.00 N ATOM 79 CA ASP A 9 11.089 17.745 -17.321 1.00 0.00 C ATOM 80 C ASP A 9 10.263 18.015 -16.062 1.00 0.00 C ATOM 81 O ASP A 9 9.038 18.110 -16.127 1.00 0.00 O ATOM 82 CB ASP A 9 10.511 18.593 -18.456 1.00 0.00 C ATOM 83 CG ASP A 9 11.410 18.723 -19.688 1.00 0.00 C ATOM 84 OD1 ASP A 9 11.483 17.730 -20.444 1.00 0.00 O ATOM 85 OD2 ASP A 9 12.003 19.812 -19.845 1.00 0.00 O ATOM 0 H ASP A 9 10.156 15.869 -17.374 1.00 0.00 H new ATOM 0 HA ASP A 9 12.135 18.010 -17.169 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.559 18.161 -18.764 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.299 19.591 -18.072 1.00 0.00 H new ATOM 90 N ASN A 10 10.966 18.131 -14.945 1.00 0.00 N ATOM 91 CA ASN A 10 10.314 18.389 -13.673 1.00 0.00 C ATOM 92 C ASN A 10 9.654 19.768 -13.713 1.00 0.00 C ATOM 93 O ASN A 10 8.564 19.955 -13.175 1.00 0.00 O ATOM 94 CB ASN A 10 11.324 18.381 -12.524 1.00 0.00 C ATOM 95 CG ASN A 10 12.545 19.238 -12.862 1.00 0.00 C ATOM 96 OD1 ASN A 10 13.280 18.976 -13.800 1.00 0.00 O ATOM 97 ND2 ASN A 10 12.721 20.275 -12.047 1.00 0.00 N ATOM 0 H ASN A 10 11.982 18.051 -14.895 1.00 0.00 H new ATOM 0 HA ASN A 10 9.575 17.605 -13.508 1.00 0.00 H new ATOM 0 HB2 ASN A 10 10.851 18.757 -11.617 1.00 0.00 H new ATOM 0 HB3 ASN A 10 11.639 17.358 -12.319 1.00 0.00 H new ATOM 0 HD21 ASN A 10 13.509 20.907 -12.189 1.00 0.00 H new ATOM 0 HD22 ASN A 10 12.068 20.438 -11.280 1.00 0.00 H new ATOM 104 N GLU A 11 10.343 20.700 -14.356 1.00 0.00 N ATOM 105 CA GLU A 11 9.838 22.057 -14.473 1.00 0.00 C ATOM 106 C GLU A 11 8.341 22.041 -14.791 1.00 0.00 C ATOM 107 O GLU A 11 7.561 22.754 -14.162 1.00 0.00 O ATOM 108 CB GLU A 11 10.615 22.842 -15.532 1.00 0.00 C ATOM 109 CG GLU A 11 11.471 23.933 -14.886 1.00 0.00 C ATOM 110 CD GLU A 11 12.255 24.713 -15.944 1.00 0.00 C ATOM 111 OE1 GLU A 11 13.089 24.072 -16.620 1.00 0.00 O ATOM 112 OE2 GLU A 11 12.003 25.932 -16.053 1.00 0.00 O ATOM 0 H GLU A 11 11.247 20.542 -14.801 1.00 0.00 H new ATOM 0 HA GLU A 11 9.981 22.561 -13.517 1.00 0.00 H new ATOM 0 HB2 GLU A 11 11.252 22.163 -16.099 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.919 23.292 -16.240 1.00 0.00 H new ATOM 0 HG2 GLU A 11 10.833 24.615 -14.324 1.00 0.00 H new ATOM 0 HG3 GLU A 11 12.163 23.483 -14.174 1.00 0.00 H new ATOM 119 N ARG A 12 7.986 21.219 -15.768 1.00 0.00 N ATOM 120 CA ARG A 12 6.597 21.100 -16.178 1.00 0.00 C ATOM 121 C ARG A 12 5.819 20.245 -15.176 1.00 0.00 C ATOM 122 O ARG A 12 4.871 20.720 -14.553 1.00 0.00 O ATOM 123 CB ARG A 12 6.484 20.473 -17.569 1.00 0.00 C ATOM 124 CG ARG A 12 5.021 20.227 -17.943 1.00 0.00 C ATOM 125 CD ARG A 12 4.915 19.364 -19.202 1.00 0.00 C ATOM 126 NE ARG A 12 4.258 18.078 -18.879 1.00 0.00 N ATOM 127 CZ ARG A 12 3.848 17.192 -19.798 1.00 0.00 C ATOM 128 NH1 ARG A 12 4.025 17.448 -21.101 1.00 0.00 N ATOM 129 NH2 ARG A 12 3.262 16.051 -19.413 1.00 0.00 N ATOM 0 H ARG A 12 8.636 20.629 -16.287 1.00 0.00 H new ATOM 0 HA ARG A 12 6.174 22.104 -16.210 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.946 21.130 -18.306 1.00 0.00 H new ATOM 0 HB3 ARG A 12 7.032 19.531 -17.593 1.00 0.00 H new ATOM 0 HG2 ARG A 12 4.508 19.735 -17.116 1.00 0.00 H new ATOM 0 HG3 ARG A 12 4.519 21.180 -18.108 1.00 0.00 H new ATOM 0 HD2 ARG A 12 4.345 19.891 -19.967 1.00 0.00 H new ATOM 0 HD3 ARG A 12 5.908 19.182 -19.613 1.00 0.00 H new ATOM 0 HE ARG A 12 4.108 17.851 -17.896 1.00 0.00 H new ATOM 0 HH11 ARG A 12 4.472 18.317 -21.394 1.00 0.00 H new ATOM 0 HH12 ARG A 12 3.713 16.774 -21.800 1.00 0.00 H new ATOM 0 HH21 ARG A 12 3.128 15.856 -18.421 1.00 0.00 H new ATOM 0 HH22 ARG A 12 2.950 15.377 -20.112 1.00 0.00 H new ATOM 143 N LEU A 13 6.249 18.998 -15.052 1.00 0.00 N ATOM 144 CA LEU A 13 5.605 18.072 -14.136 1.00 0.00 C ATOM 145 C LEU A 13 5.281 18.797 -12.828 1.00 0.00 C ATOM 146 O LEU A 13 4.213 19.391 -12.691 1.00 0.00 O ATOM 147 CB LEU A 13 6.463 16.819 -13.948 1.00 0.00 C ATOM 148 CG LEU A 13 6.689 15.967 -15.199 1.00 0.00 C ATOM 149 CD1 LEU A 13 7.792 14.933 -14.966 1.00 0.00 C ATOM 150 CD2 LEU A 13 5.383 15.319 -15.663 1.00 0.00 C ATOM 0 H LEU A 13 7.036 18.607 -15.571 1.00 0.00 H new ATOM 0 HA LEU A 13 4.659 17.723 -14.551 1.00 0.00 H new ATOM 0 HB2 LEU A 13 7.435 17.123 -13.559 1.00 0.00 H new ATOM 0 HB3 LEU A 13 5.996 16.194 -13.186 1.00 0.00 H new ATOM 0 HG LEU A 13 7.027 16.621 -16.003 1.00 0.00 H new ATOM 0 HD11 LEU A 13 7.933 14.341 -15.870 1.00 0.00 H new ATOM 0 HD12 LEU A 13 8.723 15.443 -14.718 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.508 14.277 -14.143 1.00 0.00 H new ATOM 0 HD21 LEU A 13 5.571 14.719 -16.553 1.00 0.00 H new ATOM 0 HD22 LEU A 13 4.992 14.680 -14.871 1.00 0.00 H new ATOM 0 HD23 LEU A 13 4.654 16.095 -15.896 1.00 0.00 H new ATOM 162 N SER A 14 6.224 18.724 -11.899 1.00 0.00 N ATOM 163 CA SER A 14 6.052 19.366 -10.607 1.00 0.00 C ATOM 164 C SER A 14 4.918 18.691 -9.834 1.00 0.00 C ATOM 165 O SER A 14 5.166 17.922 -8.906 1.00 0.00 O ATOM 166 CB SER A 14 5.768 20.861 -10.768 1.00 0.00 C ATOM 167 OG SER A 14 5.680 21.526 -9.511 1.00 0.00 O ATOM 0 H SER A 14 7.109 18.230 -12.016 1.00 0.00 H new ATOM 0 HA SER A 14 6.980 19.258 -10.046 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.557 21.318 -11.365 1.00 0.00 H new ATOM 0 HB3 SER A 14 4.835 20.996 -11.316 1.00 0.00 H new ATOM 0 HG SER A 14 5.500 22.478 -9.657 1.00 0.00 H new ATOM 173 N LYS A 15 3.697 19.003 -10.244 1.00 0.00 N ATOM 174 CA LYS A 15 2.524 18.435 -9.601 1.00 0.00 C ATOM 175 C LYS A 15 2.406 16.957 -9.977 1.00 0.00 C ATOM 176 O LYS A 15 2.051 16.127 -9.142 1.00 0.00 O ATOM 177 CB LYS A 15 1.278 19.257 -9.939 1.00 0.00 C ATOM 178 CG LYS A 15 0.198 19.080 -8.870 1.00 0.00 C ATOM 179 CD LYS A 15 -0.876 18.094 -9.332 1.00 0.00 C ATOM 180 CE LYS A 15 -1.976 17.947 -8.279 1.00 0.00 C ATOM 181 NZ LYS A 15 -3.030 18.965 -8.485 1.00 0.00 N ATOM 0 H LYS A 15 3.495 19.642 -11.013 1.00 0.00 H new ATOM 0 HA LYS A 15 2.624 18.481 -8.517 1.00 0.00 H new ATOM 0 HB2 LYS A 15 1.544 20.311 -10.021 1.00 0.00 H new ATOM 0 HB3 LYS A 15 0.888 18.950 -10.910 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.652 18.722 -7.946 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.260 20.044 -8.648 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -1.310 18.438 -10.271 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.423 17.122 -9.527 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -2.410 16.949 -8.335 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.549 18.053 -7.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.769 18.851 -7.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.614 19.915 -8.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.449 18.845 -9.429 1.00 0.00 H new ATOM 195 N VAL A 16 2.712 16.673 -11.235 1.00 0.00 N ATOM 196 CA VAL A 16 2.645 15.309 -11.732 1.00 0.00 C ATOM 197 C VAL A 16 3.723 14.468 -11.046 1.00 0.00 C ATOM 198 O VAL A 16 3.441 13.383 -10.539 1.00 0.00 O ATOM 199 CB VAL A 16 2.760 15.302 -13.257 1.00 0.00 C ATOM 200 CG1 VAL A 16 2.512 13.900 -13.819 1.00 0.00 C ATOM 201 CG2 VAL A 16 1.806 16.320 -13.884 1.00 0.00 C ATOM 0 H VAL A 16 3.007 17.364 -11.925 1.00 0.00 H new ATOM 0 HA VAL A 16 1.681 14.861 -11.491 1.00 0.00 H new ATOM 0 HB VAL A 16 3.778 15.593 -13.517 1.00 0.00 H new ATOM 0 HG11 VAL A 16 2.600 13.923 -14.905 1.00 0.00 H new ATOM 0 HG12 VAL A 16 3.249 13.208 -13.410 1.00 0.00 H new ATOM 0 HG13 VAL A 16 1.511 13.569 -13.543 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.908 16.294 -14.969 1.00 0.00 H new ATOM 0 HG22 VAL A 16 0.780 16.074 -13.610 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.049 17.318 -13.520 1.00 0.00 H new ATOM 211 N GLU A 17 4.937 14.999 -11.053 1.00 0.00 N ATOM 212 CA GLU A 17 6.059 14.311 -10.439 1.00 0.00 C ATOM 213 C GLU A 17 5.714 13.909 -9.003 1.00 0.00 C ATOM 214 O GLU A 17 6.203 12.898 -8.503 1.00 0.00 O ATOM 215 CB GLU A 17 7.321 15.176 -10.478 1.00 0.00 C ATOM 216 CG GLU A 17 8.343 14.610 -11.466 1.00 0.00 C ATOM 217 CD GLU A 17 9.591 14.109 -10.737 1.00 0.00 C ATOM 218 OE1 GLU A 17 9.958 14.754 -9.731 1.00 0.00 O ATOM 219 OE2 GLU A 17 10.149 13.091 -11.201 1.00 0.00 O ATOM 0 H GLU A 17 5.168 15.899 -11.475 1.00 0.00 H new ATOM 0 HA GLU A 17 6.261 13.405 -11.011 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.059 16.195 -10.764 1.00 0.00 H new ATOM 0 HB3 GLU A 17 7.762 15.227 -9.483 1.00 0.00 H new ATOM 0 HG2 GLU A 17 7.894 13.792 -12.030 1.00 0.00 H new ATOM 0 HG3 GLU A 17 8.622 15.379 -12.186 1.00 0.00 H new ATOM 226 N LYS A 18 4.874 14.723 -8.381 1.00 0.00 N ATOM 227 CA LYS A 18 4.457 14.465 -7.013 1.00 0.00 C ATOM 228 C LYS A 18 3.550 13.233 -6.984 1.00 0.00 C ATOM 229 O LYS A 18 3.724 12.350 -6.146 1.00 0.00 O ATOM 230 CB LYS A 18 3.818 15.714 -6.403 1.00 0.00 C ATOM 231 CG LYS A 18 4.841 16.515 -5.595 1.00 0.00 C ATOM 232 CD LYS A 18 5.243 15.767 -4.323 1.00 0.00 C ATOM 233 CE LYS A 18 4.457 16.278 -3.114 1.00 0.00 C ATOM 234 NZ LYS A 18 5.314 16.294 -1.908 1.00 0.00 N ATOM 0 H LYS A 18 4.471 15.562 -8.799 1.00 0.00 H new ATOM 0 HA LYS A 18 5.321 14.240 -6.388 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.405 16.339 -7.195 1.00 0.00 H new ATOM 0 HB3 LYS A 18 2.987 15.424 -5.759 1.00 0.00 H new ATOM 0 HG2 LYS A 18 5.725 16.703 -6.205 1.00 0.00 H new ATOM 0 HG3 LYS A 18 4.422 17.487 -5.333 1.00 0.00 H new ATOM 0 HD2 LYS A 18 5.064 14.700 -4.453 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.311 15.892 -4.146 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.082 17.282 -3.314 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.589 15.642 -2.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.754 16.005 -1.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.107 15.634 -2.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.684 17.254 -1.758 1.00 0.00 H new ATOM 248 N ALA A 19 2.602 13.214 -7.909 1.00 0.00 N ATOM 249 CA ALA A 19 1.668 12.105 -8.001 1.00 0.00 C ATOM 250 C ALA A 19 2.425 10.837 -8.399 1.00 0.00 C ATOM 251 O ALA A 19 2.214 9.775 -7.816 1.00 0.00 O ATOM 252 CB ALA A 19 0.555 12.456 -8.991 1.00 0.00 C ATOM 0 H ALA A 19 2.461 13.949 -8.602 1.00 0.00 H new ATOM 0 HA ALA A 19 1.198 11.918 -7.035 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -0.146 11.624 -9.060 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.029 13.346 -8.646 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.988 12.648 -9.973 1.00 0.00 H new ATOM 258 N ARG A 20 3.291 10.990 -9.390 1.00 0.00 N ATOM 259 CA ARG A 20 4.080 9.871 -9.874 1.00 0.00 C ATOM 260 C ARG A 20 4.839 9.217 -8.717 1.00 0.00 C ATOM 261 O ARG A 20 4.701 8.019 -8.478 1.00 0.00 O ATOM 262 CB ARG A 20 5.080 10.322 -10.941 1.00 0.00 C ATOM 263 CG ARG A 20 5.069 9.372 -12.140 1.00 0.00 C ATOM 264 CD ARG A 20 6.493 9.020 -12.575 1.00 0.00 C ATOM 265 NE ARG A 20 6.482 7.787 -13.393 1.00 0.00 N ATOM 266 CZ ARG A 20 6.188 6.570 -12.914 1.00 0.00 C ATOM 267 NH1 ARG A 20 5.880 6.416 -11.619 1.00 0.00 N ATOM 268 NH2 ARG A 20 6.203 5.507 -13.730 1.00 0.00 N ATOM 0 H ARG A 20 3.463 11.873 -9.871 1.00 0.00 H new ATOM 0 HA ARG A 20 3.394 9.149 -10.318 1.00 0.00 H new ATOM 0 HB2 ARG A 20 4.835 11.332 -11.270 1.00 0.00 H new ATOM 0 HB3 ARG A 20 6.082 10.361 -10.513 1.00 0.00 H new ATOM 0 HG2 ARG A 20 4.528 8.461 -11.882 1.00 0.00 H new ATOM 0 HG3 ARG A 20 4.535 9.835 -12.970 1.00 0.00 H new ATOM 0 HD2 ARG A 20 6.921 9.843 -13.148 1.00 0.00 H new ATOM 0 HD3 ARG A 20 7.126 8.879 -11.699 1.00 0.00 H new ATOM 0 HE ARG A 20 6.713 7.868 -14.383 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.869 7.225 -10.998 1.00 0.00 H new ATOM 0 HH12 ARG A 20 5.656 5.490 -11.255 1.00 0.00 H new ATOM 0 HH21 ARG A 20 6.438 5.624 -14.716 1.00 0.00 H new ATOM 0 HH22 ARG A 20 5.979 4.581 -13.365 1.00 0.00 H new ATOM 282 N GLN A 21 5.624 10.034 -8.030 1.00 0.00 N ATOM 283 CA GLN A 21 6.405 9.551 -6.904 1.00 0.00 C ATOM 284 C GLN A 21 5.490 8.900 -5.865 1.00 0.00 C ATOM 285 O GLN A 21 5.626 7.713 -5.570 1.00 0.00 O ATOM 286 CB GLN A 21 7.226 10.681 -6.280 1.00 0.00 C ATOM 287 CG GLN A 21 8.396 11.073 -7.185 1.00 0.00 C ATOM 288 CD GLN A 21 9.477 11.813 -6.394 1.00 0.00 C ATOM 289 OE1 GLN A 21 9.331 12.107 -5.220 1.00 0.00 O ATOM 290 NE2 GLN A 21 10.567 12.096 -7.102 1.00 0.00 N ATOM 0 H GLN A 21 5.736 11.028 -8.232 1.00 0.00 H new ATOM 0 HA GLN A 21 7.104 8.798 -7.268 1.00 0.00 H new ATOM 0 HB2 GLN A 21 6.587 11.548 -6.109 1.00 0.00 H new ATOM 0 HB3 GLN A 21 7.604 10.367 -5.307 1.00 0.00 H new ATOM 0 HG2 GLN A 21 8.822 10.180 -7.642 1.00 0.00 H new ATOM 0 HG3 GLN A 21 8.037 11.706 -7.996 1.00 0.00 H new ATOM 0 HE21 GLN A 21 10.624 11.821 -8.082 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.346 12.588 -6.664 1.00 0.00 H new ATOM 299 N LEU A 22 4.579 9.704 -5.338 1.00 0.00 N ATOM 300 CA LEU A 22 3.643 9.221 -4.337 1.00 0.00 C ATOM 301 C LEU A 22 3.111 7.851 -4.763 1.00 0.00 C ATOM 302 O LEU A 22 3.133 6.902 -3.980 1.00 0.00 O ATOM 303 CB LEU A 22 2.544 10.257 -4.087 1.00 0.00 C ATOM 304 CG LEU A 22 2.975 11.528 -3.353 1.00 0.00 C ATOM 305 CD1 LEU A 22 1.790 12.475 -3.154 1.00 0.00 C ATOM 306 CD2 LEU A 22 3.667 11.189 -2.031 1.00 0.00 C ATOM 0 H LEU A 22 4.469 10.687 -5.585 1.00 0.00 H new ATOM 0 HA LEU A 22 4.145 9.085 -3.379 1.00 0.00 H new ATOM 0 HB2 LEU A 22 2.117 10.543 -5.048 1.00 0.00 H new ATOM 0 HB3 LEU A 22 1.748 9.782 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 22 3.703 12.051 -3.973 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.124 13.370 -2.630 1.00 0.00 H new ATOM 0 HD12 LEU A 22 1.380 12.754 -4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.020 11.976 -2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.964 12.110 -1.529 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.980 10.633 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.551 10.582 -2.228 1.00 0.00 H new ATOM 318 N ARG A 23 2.645 7.791 -6.001 1.00 0.00 N ATOM 319 CA ARG A 23 2.109 6.553 -6.540 1.00 0.00 C ATOM 320 C ARG A 23 3.092 5.404 -6.310 1.00 0.00 C ATOM 321 O ARG A 23 2.685 4.286 -5.997 1.00 0.00 O ATOM 322 CB ARG A 23 1.826 6.681 -8.038 1.00 0.00 C ATOM 323 CG ARG A 23 0.479 7.364 -8.285 1.00 0.00 C ATOM 324 CD ARG A 23 0.145 7.393 -9.778 1.00 0.00 C ATOM 325 NE ARG A 23 0.388 6.062 -10.377 1.00 0.00 N ATOM 326 CZ ARG A 23 1.564 5.670 -10.886 1.00 0.00 C ATOM 327 NH1 ARG A 23 2.611 6.506 -10.873 1.00 0.00 N ATOM 328 NH2 ARG A 23 1.693 4.444 -11.409 1.00 0.00 N ATOM 0 H ARG A 23 2.627 8.580 -6.647 1.00 0.00 H new ATOM 0 HA ARG A 23 1.173 6.344 -6.022 1.00 0.00 H new ATOM 0 HB2 ARG A 23 2.621 7.254 -8.514 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.826 5.693 -8.498 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.306 6.836 -7.743 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.506 8.381 -7.895 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.897 7.680 -9.920 1.00 0.00 H new ATOM 0 HD3 ARG A 23 0.754 8.144 -10.281 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.389 5.401 -10.404 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.513 7.440 -10.476 1.00 0.00 H new ATOM 0 HH12 ARG A 23 3.506 6.208 -11.260 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.896 3.808 -11.420 1.00 0.00 H new ATOM 0 HH22 ARG A 23 2.588 4.146 -11.796 1.00 0.00 H new ATOM 342 N GLU A 24 4.369 5.718 -6.474 1.00 0.00 N ATOM 343 CA GLU A 24 5.414 4.726 -6.289 1.00 0.00 C ATOM 344 C GLU A 24 5.525 4.343 -4.812 1.00 0.00 C ATOM 345 O GLU A 24 5.638 3.164 -4.479 1.00 0.00 O ATOM 346 CB GLU A 24 6.754 5.233 -6.826 1.00 0.00 C ATOM 347 CG GLU A 24 6.616 5.719 -8.270 1.00 0.00 C ATOM 348 CD GLU A 24 7.795 5.244 -9.123 1.00 0.00 C ATOM 349 OE1 GLU A 24 8.933 5.634 -8.785 1.00 0.00 O ATOM 350 OE2 GLU A 24 7.531 4.501 -10.093 1.00 0.00 O ATOM 0 H GLU A 24 4.703 6.646 -6.733 1.00 0.00 H new ATOM 0 HA GLU A 24 5.147 3.835 -6.857 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.118 6.046 -6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.495 4.436 -6.776 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.683 5.349 -8.695 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.565 6.808 -8.288 1.00 0.00 H new ATOM 357 N GLN A 25 5.490 5.361 -3.965 1.00 0.00 N ATOM 358 CA GLN A 25 5.586 5.145 -2.531 1.00 0.00 C ATOM 359 C GLN A 25 4.375 4.356 -2.031 1.00 0.00 C ATOM 360 O GLN A 25 4.528 3.313 -1.397 1.00 0.00 O ATOM 361 CB GLN A 25 5.721 6.474 -1.784 1.00 0.00 C ATOM 362 CG GLN A 25 7.183 6.763 -1.438 1.00 0.00 C ATOM 363 CD GLN A 25 7.303 7.394 -0.050 1.00 0.00 C ATOM 364 OE1 GLN A 25 7.454 6.719 0.956 1.00 0.00 O ATOM 365 NE2 GLN A 25 7.228 8.721 -0.050 1.00 0.00 N ATOM 0 H GLN A 25 5.397 6.338 -4.244 1.00 0.00 H new ATOM 0 HA GLN A 25 6.484 4.560 -2.331 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.322 7.282 -2.397 1.00 0.00 H new ATOM 0 HB3 GLN A 25 5.127 6.444 -0.871 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.758 5.838 -1.472 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.612 7.432 -2.184 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.101 9.225 -0.928 1.00 0.00 H new ATOM 0 HE22 GLN A 25 7.297 9.236 0.828 1.00 0.00 H new ATOM 374 N VAL A 26 3.198 4.883 -2.335 1.00 0.00 N ATOM 375 CA VAL A 26 1.961 4.241 -1.924 1.00 0.00 C ATOM 376 C VAL A 26 1.984 2.774 -2.360 1.00 0.00 C ATOM 377 O VAL A 26 1.811 1.876 -1.537 1.00 0.00 O ATOM 378 CB VAL A 26 0.762 5.011 -2.480 1.00 0.00 C ATOM 379 CG1 VAL A 26 -0.538 4.232 -2.264 1.00 0.00 C ATOM 380 CG2 VAL A 26 0.673 6.408 -1.864 1.00 0.00 C ATOM 0 H VAL A 26 3.075 5.748 -2.861 1.00 0.00 H new ATOM 0 HA VAL A 26 1.865 4.256 -0.838 1.00 0.00 H new ATOM 0 HB VAL A 26 0.908 5.128 -3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -1.375 4.801 -2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.474 3.270 -2.772 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.692 4.069 -1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.188 6.934 -2.277 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.562 6.323 -0.783 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.582 6.965 -2.092 1.00 0.00 H new ATOM 390 N ASN A 27 2.200 2.577 -3.652 1.00 0.00 N ATOM 391 CA ASN A 27 2.248 1.235 -4.206 1.00 0.00 C ATOM 392 C ASN A 27 3.155 0.361 -3.337 1.00 0.00 C ATOM 393 O ASN A 27 2.679 -0.538 -2.646 1.00 0.00 O ATOM 394 CB ASN A 27 2.820 1.245 -5.625 1.00 0.00 C ATOM 395 CG ASN A 27 3.016 -0.179 -6.148 1.00 0.00 C ATOM 396 OD1 ASN A 27 2.435 -1.133 -5.657 1.00 0.00 O ATOM 397 ND2 ASN A 27 3.864 -0.269 -7.169 1.00 0.00 N ATOM 0 H ASN A 27 2.344 3.324 -4.331 1.00 0.00 H new ATOM 0 HA ASN A 27 1.231 0.844 -4.230 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.148 1.790 -6.288 1.00 0.00 H new ATOM 0 HB3 ASN A 27 3.773 1.773 -5.633 1.00 0.00 H new ATOM 0 HD21 ASN A 27 4.062 -1.177 -7.589 1.00 0.00 H new ATOM 0 HD22 ASN A 27 4.316 0.570 -7.532 1.00 0.00 H new ATOM 404 N ASP A 28 4.445 0.656 -3.402 1.00 0.00 N ATOM 405 CA ASP A 28 5.422 -0.092 -2.629 1.00 0.00 C ATOM 406 C ASP A 28 4.934 -0.223 -1.185 1.00 0.00 C ATOM 407 O ASP A 28 4.921 -1.318 -0.627 1.00 0.00 O ATOM 408 CB ASP A 28 6.773 0.625 -2.608 1.00 0.00 C ATOM 409 CG ASP A 28 7.992 -0.285 -2.772 1.00 0.00 C ATOM 410 OD1 ASP A 28 8.239 -1.077 -1.837 1.00 0.00 O ATOM 411 OD2 ASP A 28 8.650 -0.168 -3.829 1.00 0.00 O ATOM 0 H ASP A 28 4.836 1.402 -3.977 1.00 0.00 H new ATOM 0 HA ASP A 28 5.540 -1.071 -3.093 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.785 1.369 -3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.866 1.165 -1.666 1.00 0.00 H new ATOM 416 N LEU A 29 4.543 0.911 -0.622 1.00 0.00 N ATOM 417 CA LEU A 29 4.055 0.938 0.746 1.00 0.00 C ATOM 418 C LEU A 29 3.099 -0.237 0.965 1.00 0.00 C ATOM 419 O LEU A 29 3.385 -1.136 1.755 1.00 0.00 O ATOM 420 CB LEU A 29 3.438 2.300 1.069 1.00 0.00 C ATOM 421 CG LEU A 29 2.383 2.313 2.177 1.00 0.00 C ATOM 422 CD1 LEU A 29 2.973 1.827 3.502 1.00 0.00 C ATOM 423 CD2 LEU A 29 1.743 3.697 2.308 1.00 0.00 C ATOM 0 H LEU A 29 4.554 1.818 -1.089 1.00 0.00 H new ATOM 0 HA LEU A 29 4.881 0.814 1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 29 4.240 2.982 1.350 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.986 2.697 0.160 1.00 0.00 H new ATOM 0 HG LEU A 29 1.591 1.616 1.903 1.00 0.00 H new ATOM 0 HD11 LEU A 29 2.202 1.846 4.272 1.00 0.00 H new ATOM 0 HD12 LEU A 29 3.343 0.808 3.384 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.795 2.480 3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.997 3.679 3.102 1.00 0.00 H new ATOM 0 HD22 LEU A 29 2.511 4.432 2.548 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.264 3.967 1.367 1.00 0.00 H new ATOM 435 N PHE A 30 1.984 -0.193 0.251 1.00 0.00 N ATOM 436 CA PHE A 30 0.985 -1.243 0.357 1.00 0.00 C ATOM 437 C PHE A 30 1.615 -2.622 0.153 1.00 0.00 C ATOM 438 O PHE A 30 1.312 -3.562 0.886 1.00 0.00 O ATOM 439 CB PHE A 30 -0.042 -0.996 -0.749 1.00 0.00 C ATOM 440 CG PHE A 30 -1.017 0.145 -0.450 1.00 0.00 C ATOM 441 CD1 PHE A 30 -1.546 0.278 0.796 1.00 0.00 C ATOM 442 CD2 PHE A 30 -1.355 1.025 -1.430 1.00 0.00 C ATOM 443 CE1 PHE A 30 -2.451 1.336 1.073 1.00 0.00 C ATOM 444 CE2 PHE A 30 -2.260 2.084 -1.152 1.00 0.00 C ATOM 445 CZ PHE A 30 -2.789 2.217 0.094 1.00 0.00 C ATOM 0 H PHE A 30 1.750 0.554 -0.403 1.00 0.00 H new ATOM 0 HA PHE A 30 0.529 -1.224 1.347 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.485 -0.776 -1.677 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.610 -1.912 -0.914 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.278 -0.421 1.574 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.935 0.919 -2.420 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.871 1.441 2.062 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.528 2.784 -1.930 1.00 0.00 H new ATOM 0 HZ PHE A 30 -3.477 3.022 0.306 1.00 0.00 H new ATOM 455 N SER A 31 2.482 -2.699 -0.846 1.00 0.00 N ATOM 456 CA SER A 31 3.157 -3.948 -1.156 1.00 0.00 C ATOM 457 C SER A 31 3.947 -4.432 0.062 1.00 0.00 C ATOM 458 O SER A 31 3.757 -5.557 0.522 1.00 0.00 O ATOM 459 CB SER A 31 4.086 -3.788 -2.361 1.00 0.00 C ATOM 460 OG SER A 31 3.664 -2.736 -3.225 1.00 0.00 O ATOM 0 H SER A 31 2.733 -1.917 -1.451 1.00 0.00 H new ATOM 0 HA SER A 31 2.401 -4.691 -1.410 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.099 -3.587 -2.013 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.120 -4.724 -2.919 1.00 0.00 H new ATOM 0 HG SER A 31 3.542 -1.914 -2.705 1.00 0.00 H new ATOM 466 N ARG A 32 4.815 -3.558 0.550 1.00 0.00 N ATOM 467 CA ARG A 32 5.634 -3.882 1.705 1.00 0.00 C ATOM 468 C ARG A 32 4.764 -4.438 2.834 1.00 0.00 C ATOM 469 O ARG A 32 5.008 -5.538 3.327 1.00 0.00 O ATOM 470 CB ARG A 32 6.386 -2.649 2.211 1.00 0.00 C ATOM 471 CG ARG A 32 7.891 -2.918 2.288 1.00 0.00 C ATOM 472 CD ARG A 32 8.414 -2.701 3.709 1.00 0.00 C ATOM 473 NE ARG A 32 9.774 -3.272 3.840 1.00 0.00 N ATOM 474 CZ ARG A 32 10.564 -3.092 4.906 1.00 0.00 C ATOM 475 NH1 ARG A 32 10.136 -2.356 5.941 1.00 0.00 N ATOM 476 NH2 ARG A 32 11.783 -3.647 4.938 1.00 0.00 N ATOM 0 H ARG A 32 4.969 -2.626 0.166 1.00 0.00 H new ATOM 0 HA ARG A 32 6.359 -4.635 1.396 1.00 0.00 H new ATOM 0 HB2 ARG A 32 6.197 -1.806 1.547 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.012 -2.369 3.196 1.00 0.00 H new ATOM 0 HG2 ARG A 32 8.098 -3.941 1.973 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.418 -2.259 1.598 1.00 0.00 H new ATOM 0 HD2 ARG A 32 8.434 -1.636 3.939 1.00 0.00 H new ATOM 0 HD3 ARG A 32 7.743 -3.170 4.428 1.00 0.00 H new ATOM 0 HE ARG A 32 10.131 -3.838 3.070 1.00 0.00 H new ATOM 0 HH11 ARG A 32 9.208 -1.933 5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.738 -2.219 6.753 1.00 0.00 H new ATOM 0 HH21 ARG A 32 12.109 -4.207 4.150 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.385 -3.510 5.750 1.00 0.00 H new ATOM 490 N LYS A 33 3.765 -3.652 3.209 1.00 0.00 N ATOM 491 CA LYS A 33 2.856 -4.052 4.271 1.00 0.00 C ATOM 492 C LYS A 33 2.339 -5.464 3.988 1.00 0.00 C ATOM 493 O LYS A 33 2.694 -6.411 4.687 1.00 0.00 O ATOM 494 CB LYS A 33 1.747 -3.014 4.446 1.00 0.00 C ATOM 495 CG LYS A 33 2.302 -1.709 5.020 1.00 0.00 C ATOM 496 CD LYS A 33 2.564 -1.839 6.522 1.00 0.00 C ATOM 497 CE LYS A 33 3.308 -0.614 7.057 1.00 0.00 C ATOM 498 NZ LYS A 33 4.262 -1.009 8.118 1.00 0.00 N ATOM 0 H LYS A 33 3.565 -2.741 2.797 1.00 0.00 H new ATOM 0 HA LYS A 33 3.379 -4.089 5.227 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.272 -2.819 3.485 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.977 -3.408 5.109 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.227 -1.446 4.507 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.596 -0.898 4.839 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.618 -1.954 7.051 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.149 -2.738 6.716 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.842 -0.122 6.244 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.594 0.108 7.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.830 -0.184 8.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 3.737 -1.365 8.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.890 -1.756 7.759 1.00 0.00 H new ATOM 512 N PHE A 34 1.507 -5.560 2.961 1.00 0.00 N ATOM 513 CA PHE A 34 0.937 -6.840 2.577 1.00 0.00 C ATOM 514 C PHE A 34 1.945 -7.973 2.781 1.00 0.00 C ATOM 515 O PHE A 34 1.562 -9.105 3.072 1.00 0.00 O ATOM 516 CB PHE A 34 0.587 -6.746 1.090 1.00 0.00 C ATOM 517 CG PHE A 34 0.190 -8.082 0.459 1.00 0.00 C ATOM 518 CD1 PHE A 34 -0.886 -8.765 0.931 1.00 0.00 C ATOM 519 CD2 PHE A 34 0.915 -8.587 -0.576 1.00 0.00 C ATOM 520 CE1 PHE A 34 -1.254 -10.005 0.345 1.00 0.00 C ATOM 521 CE2 PHE A 34 0.547 -9.827 -1.162 1.00 0.00 C ATOM 522 CZ PHE A 34 -0.530 -10.510 -0.689 1.00 0.00 C ATOM 0 H PHE A 34 1.214 -4.772 2.383 1.00 0.00 H new ATOM 0 HA PHE A 34 0.061 -7.055 3.189 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.233 -6.039 0.964 1.00 0.00 H new ATOM 0 HB3 PHE A 34 1.443 -6.341 0.551 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -1.462 -8.364 1.752 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.770 -8.045 -0.952 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -2.109 -10.547 0.721 1.00 0.00 H new ATOM 0 HE2 PHE A 34 1.122 -10.228 -1.983 1.00 0.00 H new ATOM 0 HZ PHE A 34 -0.810 -11.453 -1.135 1.00 0.00 H new ATOM 532 N GLY A 35 3.214 -7.628 2.619 1.00 0.00 N ATOM 533 CA GLY A 35 4.280 -8.602 2.782 1.00 0.00 C ATOM 534 C GLY A 35 4.066 -9.445 4.040 1.00 0.00 C ATOM 535 O GLY A 35 3.782 -10.639 3.952 1.00 0.00 O ATOM 0 H GLY A 35 3.528 -6.688 2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.321 -9.251 1.908 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.240 -8.089 2.843 1.00 0.00 H new ATOM 539 N GLU A 36 4.210 -8.791 5.183 1.00 0.00 N ATOM 540 CA GLU A 36 4.035 -9.465 6.459 1.00 0.00 C ATOM 541 C GLU A 36 2.728 -10.261 6.464 1.00 0.00 C ATOM 542 O GLU A 36 2.643 -11.317 7.088 1.00 0.00 O ATOM 543 CB GLU A 36 4.074 -8.466 7.617 1.00 0.00 C ATOM 544 CG GLU A 36 3.257 -7.215 7.289 1.00 0.00 C ATOM 545 CD GLU A 36 4.160 -6.088 6.783 1.00 0.00 C ATOM 546 OE1 GLU A 36 4.844 -6.323 5.763 1.00 0.00 O ATOM 547 OE2 GLU A 36 4.145 -5.016 7.426 1.00 0.00 O ATOM 0 H GLU A 36 4.446 -7.801 5.253 1.00 0.00 H new ATOM 0 HA GLU A 36 4.862 -10.162 6.596 1.00 0.00 H new ATOM 0 HB2 GLU A 36 3.682 -8.935 8.520 1.00 0.00 H new ATOM 0 HB3 GLU A 36 5.107 -8.186 7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.508 -7.453 6.533 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.719 -6.884 8.178 1.00 0.00 H new ATOM 554 N ALA A 37 1.742 -9.722 5.762 1.00 0.00 N ATOM 555 CA ALA A 37 0.443 -10.368 5.678 1.00 0.00 C ATOM 556 C ALA A 37 0.621 -11.793 5.148 1.00 0.00 C ATOM 557 O ALA A 37 -0.221 -12.657 5.388 1.00 0.00 O ATOM 558 CB ALA A 37 -0.488 -9.531 4.800 1.00 0.00 C ATOM 0 H ALA A 37 1.816 -8.845 5.246 1.00 0.00 H new ATOM 0 HA ALA A 37 -0.016 -10.438 6.664 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -1.462 -10.016 4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -0.604 -8.539 5.235 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.062 -9.441 3.801 1.00 0.00 H new ATOM 564 N ILE A 38 1.721 -11.993 4.437 1.00 0.00 N ATOM 565 CA ILE A 38 2.019 -13.297 3.871 1.00 0.00 C ATOM 566 C ILE A 38 3.342 -13.807 4.446 1.00 0.00 C ATOM 567 O ILE A 38 3.980 -14.683 3.863 1.00 0.00 O ATOM 568 CB ILE A 38 1.996 -13.236 2.343 1.00 0.00 C ATOM 569 CG1 ILE A 38 2.590 -11.919 1.838 1.00 0.00 C ATOM 570 CG2 ILE A 38 0.583 -13.470 1.806 1.00 0.00 C ATOM 571 CD1 ILE A 38 2.462 -11.808 0.317 1.00 0.00 C ATOM 0 H ILE A 38 2.417 -11.273 4.240 1.00 0.00 H new ATOM 0 HA ILE A 38 1.250 -14.018 4.150 1.00 0.00 H new ATOM 0 HB ILE A 38 2.623 -14.041 1.960 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.080 -11.080 2.312 1.00 0.00 H new ATOM 0 HG13 ILE A 38 3.640 -11.856 2.124 1.00 0.00 H new ATOM 0 HG21 ILE A 38 0.595 -13.421 0.717 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.232 -14.452 2.122 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.086 -12.703 2.196 1.00 0.00 H new ATOM 0 HD11 ILE A 38 2.892 -10.863 -0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 38 2.994 -12.635 -0.154 1.00 0.00 H new ATOM 0 HD13 ILE A 38 1.409 -11.847 0.037 1.00 0.00 H new ATOM 583 N GLY A 39 3.715 -13.238 5.583 1.00 0.00 N ATOM 584 CA GLY A 39 4.950 -13.624 6.244 1.00 0.00 C ATOM 585 C GLY A 39 6.141 -13.513 5.288 1.00 0.00 C ATOM 586 O GLY A 39 7.192 -14.104 5.530 1.00 0.00 O ATOM 0 H GLY A 39 3.183 -12.512 6.063 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.116 -12.987 7.113 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.867 -14.647 6.610 1.00 0.00 H new ATOM 590 N MET A 40 5.935 -12.752 4.224 1.00 0.00 N ATOM 591 CA MET A 40 6.978 -12.556 3.231 1.00 0.00 C ATOM 592 C MET A 40 7.987 -11.505 3.697 1.00 0.00 C ATOM 593 O MET A 40 7.643 -10.603 4.459 1.00 0.00 O ATOM 594 CB MET A 40 6.348 -12.110 1.910 1.00 0.00 C ATOM 595 CG MET A 40 5.444 -13.203 1.337 1.00 0.00 C ATOM 596 SD MET A 40 6.433 -14.476 0.573 1.00 0.00 S ATOM 597 CE MET A 40 5.662 -14.546 -1.035 1.00 0.00 C ATOM 0 H MET A 40 5.061 -12.264 4.027 1.00 0.00 H new ATOM 0 HA MET A 40 7.504 -13.501 3.092 1.00 0.00 H new ATOM 0 HB2 MET A 40 5.769 -11.200 2.068 1.00 0.00 H new ATOM 0 HB3 MET A 40 7.132 -11.868 1.192 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.833 -13.633 2.130 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.760 -12.774 0.605 1.00 0.00 H new ATOM 0 HE1 MET A 40 6.371 -14.943 -1.761 1.00 0.00 H new ATOM 0 HE2 MET A 40 4.786 -15.194 -0.991 1.00 0.00 H new ATOM 0 HE3 MET A 40 5.357 -13.544 -1.336 1.00 0.00 H new ATOM 607 N GLY A 41 9.214 -11.657 3.220 1.00 0.00 N ATOM 608 CA GLY A 41 10.276 -10.732 3.577 1.00 0.00 C ATOM 609 C GLY A 41 10.363 -9.582 2.572 1.00 0.00 C ATOM 610 O GLY A 41 10.943 -8.538 2.867 1.00 0.00 O ATOM 0 H GLY A 41 9.496 -12.407 2.589 1.00 0.00 H new ATOM 0 HA2 GLY A 41 10.096 -10.334 4.576 1.00 0.00 H new ATOM 0 HA3 GLY A 41 11.228 -11.262 3.612 1.00 0.00 H new ATOM 614 N PHE A 42 9.778 -9.812 1.406 1.00 0.00 N ATOM 615 CA PHE A 42 9.782 -8.807 0.356 1.00 0.00 C ATOM 616 C PHE A 42 8.367 -8.294 0.083 1.00 0.00 C ATOM 617 O PHE A 42 7.387 -8.920 0.484 1.00 0.00 O ATOM 618 CB PHE A 42 10.319 -9.483 -0.907 1.00 0.00 C ATOM 619 CG PHE A 42 9.774 -10.894 -1.138 1.00 0.00 C ATOM 620 CD1 PHE A 42 8.437 -11.090 -1.290 1.00 0.00 C ATOM 621 CD2 PHE A 42 10.626 -11.952 -1.190 1.00 0.00 C ATOM 622 CE1 PHE A 42 7.931 -12.399 -1.504 1.00 0.00 C ATOM 623 CE2 PHE A 42 10.120 -13.262 -1.404 1.00 0.00 C ATOM 624 CZ PHE A 42 8.783 -13.458 -1.557 1.00 0.00 C ATOM 0 H PHE A 42 9.298 -10.679 1.165 1.00 0.00 H new ATOM 0 HA PHE A 42 10.396 -7.958 0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 42 10.074 -8.864 -1.770 1.00 0.00 H new ATOM 0 HB3 PHE A 42 11.406 -9.530 -0.847 1.00 0.00 H new ATOM 0 HD1 PHE A 42 7.760 -10.250 -1.248 1.00 0.00 H new ATOM 0 HD2 PHE A 42 11.688 -11.797 -1.069 1.00 0.00 H new ATOM 0 HE1 PHE A 42 6.869 -12.554 -1.625 1.00 0.00 H new ATOM 0 HE2 PHE A 42 10.797 -14.102 -1.445 1.00 0.00 H new ATOM 0 HZ PHE A 42 8.398 -14.454 -1.720 1.00 0.00 H new ATOM 634 N PRO A 43 8.303 -7.129 -0.615 1.00 0.00 N ATOM 635 CA PRO A 43 7.024 -6.524 -0.947 1.00 0.00 C ATOM 636 C PRO A 43 6.337 -7.283 -2.083 1.00 0.00 C ATOM 637 O PRO A 43 6.905 -7.440 -3.163 1.00 0.00 O ATOM 638 CB PRO A 43 7.352 -5.084 -1.307 1.00 0.00 C ATOM 639 CG PRO A 43 8.840 -5.059 -1.614 1.00 0.00 C ATOM 640 CD PRO A 43 9.443 -6.359 -1.106 1.00 0.00 C ATOM 0 HA PRO A 43 6.313 -6.562 -0.121 1.00 0.00 H new ATOM 0 HB2 PRO A 43 6.770 -4.755 -2.168 1.00 0.00 H new ATOM 0 HB3 PRO A 43 7.112 -4.411 -0.484 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.007 -4.954 -2.686 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.315 -4.204 -1.132 1.00 0.00 H new ATOM 0 HD2 PRO A 43 9.967 -6.890 -1.901 1.00 0.00 H new ATOM 0 HD3 PRO A 43 10.168 -6.176 -0.313 1.00 0.00 H new ATOM 648 N VAL A 44 5.123 -7.734 -1.802 1.00 0.00 N ATOM 649 CA VAL A 44 4.352 -8.472 -2.787 1.00 0.00 C ATOM 650 C VAL A 44 3.244 -7.574 -3.339 1.00 0.00 C ATOM 651 O VAL A 44 2.836 -6.613 -2.688 1.00 0.00 O ATOM 652 CB VAL A 44 3.819 -9.768 -2.170 1.00 0.00 C ATOM 653 CG1 VAL A 44 3.238 -10.688 -3.246 1.00 0.00 C ATOM 654 CG2 VAL A 44 4.909 -10.482 -1.369 1.00 0.00 C ATOM 0 H VAL A 44 4.655 -7.602 -0.906 1.00 0.00 H new ATOM 0 HA VAL A 44 4.984 -8.762 -3.627 1.00 0.00 H new ATOM 0 HB VAL A 44 3.015 -9.506 -1.482 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.866 -11.601 -2.782 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.419 -10.180 -3.755 1.00 0.00 H new ATOM 0 HG13 VAL A 44 4.015 -10.938 -3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.504 -11.399 -0.941 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.743 -10.725 -2.027 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.257 -9.831 -0.567 1.00 0.00 H new ATOM 664 N LYS A 45 2.788 -7.917 -4.535 1.00 0.00 N ATOM 665 CA LYS A 45 1.735 -7.153 -5.183 1.00 0.00 C ATOM 666 C LYS A 45 0.546 -7.023 -4.229 1.00 0.00 C ATOM 667 O LYS A 45 0.418 -7.796 -3.281 1.00 0.00 O ATOM 668 CB LYS A 45 1.375 -7.775 -6.533 1.00 0.00 C ATOM 669 CG LYS A 45 0.545 -9.047 -6.348 1.00 0.00 C ATOM 670 CD LYS A 45 0.890 -10.088 -7.415 1.00 0.00 C ATOM 671 CE LYS A 45 -0.030 -11.306 -7.309 1.00 0.00 C ATOM 672 NZ LYS A 45 0.391 -12.357 -8.263 1.00 0.00 N ATOM 0 H LYS A 45 3.129 -8.714 -5.072 1.00 0.00 H new ATOM 0 HA LYS A 45 2.078 -6.143 -5.406 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.816 -7.056 -7.131 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.286 -8.008 -7.084 1.00 0.00 H new ATOM 0 HG2 LYS A 45 0.727 -9.463 -5.357 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.516 -8.804 -6.402 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.798 -9.643 -8.406 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.928 -10.401 -7.301 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -0.008 -11.699 -6.293 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -1.059 -11.011 -7.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -0.243 -13.177 -8.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.347 -11.984 -9.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.366 -12.650 -8.049 1.00 0.00 H new ATOM 686 N VAL A 46 -0.294 -6.038 -4.514 1.00 0.00 N ATOM 687 CA VAL A 46 -1.469 -5.797 -3.693 1.00 0.00 C ATOM 688 C VAL A 46 -2.722 -5.875 -4.568 1.00 0.00 C ATOM 689 O VAL A 46 -2.925 -5.036 -5.444 1.00 0.00 O ATOM 690 CB VAL A 46 -1.332 -4.458 -2.964 1.00 0.00 C ATOM 691 CG1 VAL A 46 -2.642 -4.073 -2.275 1.00 0.00 C ATOM 692 CG2 VAL A 46 -0.175 -4.495 -1.963 1.00 0.00 C ATOM 0 H VAL A 46 -0.184 -5.398 -5.301 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.561 -6.564 -2.924 1.00 0.00 H new ATOM 0 HB VAL A 46 -1.107 -3.693 -3.707 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.518 -3.118 -1.765 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.433 -3.986 -3.020 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.910 -4.840 -1.549 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.099 -3.532 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -0.356 -5.277 -1.226 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.756 -4.703 -2.491 1.00 0.00 H new ATOM 702 N PRO A 47 -3.550 -6.918 -4.293 1.00 0.00 N ATOM 703 CA PRO A 47 -4.778 -7.117 -5.045 1.00 0.00 C ATOM 704 C PRO A 47 -5.849 -6.110 -4.623 1.00 0.00 C ATOM 705 O PRO A 47 -6.874 -6.488 -4.058 1.00 0.00 O ATOM 706 CB PRO A 47 -5.177 -8.558 -4.772 1.00 0.00 C ATOM 707 CG PRO A 47 -4.422 -8.969 -3.518 1.00 0.00 C ATOM 708 CD PRO A 47 -3.342 -7.931 -3.263 1.00 0.00 C ATOM 0 HA PRO A 47 -4.648 -6.949 -6.114 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -6.254 -8.644 -4.626 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -4.917 -9.201 -5.613 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -5.100 -9.031 -2.667 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -3.979 -9.957 -3.645 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -3.431 -7.504 -2.264 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -2.347 -8.370 -3.334 1.00 0.00 H new ATOM 716 N TYR A 48 -5.574 -4.846 -4.912 1.00 0.00 N ATOM 717 CA TYR A 48 -6.502 -3.782 -4.570 1.00 0.00 C ATOM 718 C TYR A 48 -7.912 -4.100 -5.071 1.00 0.00 C ATOM 719 O TYR A 48 -8.893 -3.863 -4.368 1.00 0.00 O ATOM 720 CB TYR A 48 -5.990 -2.530 -5.285 1.00 0.00 C ATOM 721 CG TYR A 48 -4.592 -2.091 -4.847 1.00 0.00 C ATOM 722 CD1 TYR A 48 -4.395 -1.576 -3.582 1.00 0.00 C ATOM 723 CD2 TYR A 48 -3.527 -2.209 -5.717 1.00 0.00 C ATOM 724 CE1 TYR A 48 -3.079 -1.163 -3.169 1.00 0.00 C ATOM 725 CE2 TYR A 48 -2.211 -1.795 -5.305 1.00 0.00 C ATOM 726 CZ TYR A 48 -2.052 -1.293 -4.051 1.00 0.00 C ATOM 727 OH TYR A 48 -0.808 -0.902 -3.662 1.00 0.00 O ATOM 0 H TYR A 48 -4.722 -4.535 -5.379 1.00 0.00 H new ATOM 0 HA TYR A 48 -6.556 -3.654 -3.489 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.981 -2.715 -6.359 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -6.688 -1.712 -5.108 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -5.228 -1.483 -2.901 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -3.681 -2.612 -6.707 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -2.911 -0.759 -2.181 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -1.369 -1.881 -5.976 1.00 0.00 H new ATOM 0 HH TYR A 48 -0.174 -1.054 -4.394 1.00 0.00 H new ATOM 737 N ARG A 49 -7.969 -4.633 -6.282 1.00 0.00 N ATOM 738 CA ARG A 49 -9.242 -4.987 -6.886 1.00 0.00 C ATOM 739 C ARG A 49 -10.014 -5.943 -5.974 1.00 0.00 C ATOM 740 O ARG A 49 -11.054 -5.581 -5.427 1.00 0.00 O ATOM 741 CB ARG A 49 -9.040 -5.647 -8.252 1.00 0.00 C ATOM 742 CG ARG A 49 -10.384 -5.939 -8.923 1.00 0.00 C ATOM 743 CD ARG A 49 -10.643 -4.969 -10.077 1.00 0.00 C ATOM 744 NE ARG A 49 -11.572 -5.581 -11.053 1.00 0.00 N ATOM 745 CZ ARG A 49 -12.026 -4.958 -12.150 1.00 0.00 C ATOM 746 NH1 ARG A 49 -11.639 -3.703 -12.417 1.00 0.00 N ATOM 747 NH2 ARG A 49 -12.866 -5.591 -12.980 1.00 0.00 N ATOM 0 H ARG A 49 -7.153 -4.829 -6.862 1.00 0.00 H new ATOM 0 HA ARG A 49 -9.812 -4.068 -7.021 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -8.445 -4.995 -8.891 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -8.480 -6.574 -8.133 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -10.394 -6.963 -9.295 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -11.186 -5.859 -8.189 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -11.065 -4.040 -9.694 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -9.703 -4.714 -10.567 1.00 0.00 H new ATOM 0 HE ARG A 49 -11.886 -6.536 -10.880 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -10.999 -3.221 -11.786 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -11.985 -3.229 -13.252 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -13.160 -6.546 -12.777 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -13.212 -5.117 -13.815 1.00 0.00 H new ATOM 761 N LYS A 50 -9.474 -7.146 -5.840 1.00 0.00 N ATOM 762 CA LYS A 50 -10.099 -8.157 -5.004 1.00 0.00 C ATOM 763 C LYS A 50 -10.510 -7.528 -3.671 1.00 0.00 C ATOM 764 O LYS A 50 -11.651 -7.677 -3.237 1.00 0.00 O ATOM 765 CB LYS A 50 -9.180 -9.371 -4.854 1.00 0.00 C ATOM 766 CG LYS A 50 -9.008 -10.098 -6.189 1.00 0.00 C ATOM 767 CD LYS A 50 -8.828 -11.602 -5.976 1.00 0.00 C ATOM 768 CE LYS A 50 -10.176 -12.325 -6.000 1.00 0.00 C ATOM 769 NZ LYS A 50 -10.356 -13.044 -7.281 1.00 0.00 N ATOM 0 H LYS A 50 -8.611 -7.443 -6.296 1.00 0.00 H new ATOM 0 HA LYS A 50 -11.009 -8.531 -5.474 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.207 -9.051 -4.482 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -9.594 -10.056 -4.114 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -9.879 -9.918 -6.820 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -8.143 -9.696 -6.717 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -8.180 -12.008 -6.753 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -8.332 -11.781 -5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -10.232 -13.029 -5.170 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -10.984 -11.606 -5.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -11.276 -13.529 -7.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -10.323 -12.365 -8.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -9.596 -13.744 -7.396 1.00 0.00 H new ATOM 783 N ILE A 51 -9.558 -6.839 -3.060 1.00 0.00 N ATOM 784 CA ILE A 51 -9.807 -6.187 -1.785 1.00 0.00 C ATOM 785 C ILE A 51 -10.976 -5.212 -1.936 1.00 0.00 C ATOM 786 O ILE A 51 -11.752 -5.019 -1.001 1.00 0.00 O ATOM 787 CB ILE A 51 -8.527 -5.536 -1.258 1.00 0.00 C ATOM 788 CG1 ILE A 51 -7.667 -6.550 -0.502 1.00 0.00 C ATOM 789 CG2 ILE A 51 -8.849 -4.307 -0.405 1.00 0.00 C ATOM 790 CD1 ILE A 51 -6.220 -6.522 -0.999 1.00 0.00 C ATOM 0 H ILE A 51 -8.613 -6.718 -3.424 1.00 0.00 H new ATOM 0 HA ILE A 51 -10.098 -6.920 -1.032 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.942 -5.192 -2.111 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -7.693 -6.330 0.565 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -8.080 -7.550 -0.631 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.922 -3.863 -0.043 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.390 -3.577 -1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.465 -4.604 0.444 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -5.631 -7.252 -0.445 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -6.195 -6.766 -2.061 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.802 -5.527 -0.846 1.00 0.00 H new ATOM 802 N THR A 52 -11.066 -4.624 -3.120 1.00 0.00 N ATOM 803 CA THR A 52 -12.128 -3.674 -3.405 1.00 0.00 C ATOM 804 C THR A 52 -13.474 -4.394 -3.507 1.00 0.00 C ATOM 805 O THR A 52 -14.355 -4.192 -2.672 1.00 0.00 O ATOM 806 CB THR A 52 -11.750 -2.910 -4.675 1.00 0.00 C ATOM 807 OG1 THR A 52 -11.541 -1.573 -4.226 1.00 0.00 O ATOM 808 CG2 THR A 52 -12.917 -2.794 -5.658 1.00 0.00 C ATOM 0 H THR A 52 -10.421 -4.787 -3.893 1.00 0.00 H new ATOM 0 HA THR A 52 -12.241 -2.953 -2.596 1.00 0.00 H new ATOM 0 HB THR A 52 -10.913 -3.409 -5.163 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.290 -1.008 -4.986 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.595 -2.243 -6.542 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.246 -3.791 -5.952 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.743 -2.265 -5.182 1.00 0.00 H new ATOM 816 N ILE A 53 -13.592 -5.219 -4.537 1.00 0.00 N ATOM 817 CA ILE A 53 -14.816 -5.969 -4.759 1.00 0.00 C ATOM 818 C ILE A 53 -15.268 -6.601 -3.441 1.00 0.00 C ATOM 819 O ILE A 53 -16.463 -6.778 -3.211 1.00 0.00 O ATOM 820 CB ILE A 53 -14.626 -6.980 -5.892 1.00 0.00 C ATOM 821 CG1 ILE A 53 -13.432 -7.896 -5.616 1.00 0.00 C ATOM 822 CG2 ILE A 53 -14.506 -6.273 -7.243 1.00 0.00 C ATOM 823 CD1 ILE A 53 -13.059 -8.702 -6.862 1.00 0.00 C ATOM 0 H ILE A 53 -12.859 -5.384 -5.227 1.00 0.00 H new ATOM 0 HA ILE A 53 -15.616 -5.305 -5.085 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.513 -7.613 -5.937 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -12.578 -7.299 -5.295 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.672 -8.575 -4.798 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -14.372 -7.014 -8.031 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -15.413 -5.699 -7.435 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -13.648 -5.601 -7.227 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.208 -9.345 -6.638 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -13.907 -9.316 -7.166 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -12.796 -8.020 -7.671 1.00 0.00 H new ATOM 835 N ASN A 54 -14.288 -6.923 -2.609 1.00 0.00 N ATOM 836 CA ASN A 54 -14.570 -7.531 -1.320 1.00 0.00 C ATOM 837 C ASN A 54 -13.252 -7.840 -0.607 1.00 0.00 C ATOM 838 O ASN A 54 -12.411 -8.564 -1.136 1.00 0.00 O ATOM 839 CB ASN A 54 -15.337 -8.845 -1.486 1.00 0.00 C ATOM 840 CG ASN A 54 -14.422 -9.949 -2.021 1.00 0.00 C ATOM 841 OD1 ASN A 54 -13.689 -10.592 -1.288 1.00 0.00 O ATOM 842 ND2 ASN A 54 -14.507 -10.132 -3.335 1.00 0.00 N ATOM 0 H ASN A 54 -13.298 -6.774 -2.803 1.00 0.00 H new ATOM 0 HA ASN A 54 -15.174 -6.831 -0.743 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -15.757 -9.149 -0.527 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -16.174 -8.698 -2.169 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -13.937 -10.846 -3.788 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -15.142 -9.558 -3.890 1.00 0.00 H new ATOM 849 N PRO A 55 -13.110 -7.260 0.615 1.00 0.00 N ATOM 850 CA PRO A 55 -11.908 -7.465 1.406 1.00 0.00 C ATOM 851 C PRO A 55 -11.895 -8.862 2.029 1.00 0.00 C ATOM 852 O PRO A 55 -10.832 -9.395 2.345 1.00 0.00 O ATOM 853 CB PRO A 55 -11.924 -6.353 2.441 1.00 0.00 C ATOM 854 CG PRO A 55 -13.357 -5.849 2.490 1.00 0.00 C ATOM 855 CD PRO A 55 -14.085 -6.395 1.273 1.00 0.00 C ATOM 0 HA PRO A 55 -10.998 -7.421 0.808 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -11.607 -6.723 3.416 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -11.238 -5.552 2.165 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -13.846 -6.178 3.407 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -13.379 -4.759 2.491 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -14.977 -6.951 1.562 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -14.411 -5.591 0.613 1.00 0.00 H new ATOM 863 N GLY A 56 -13.088 -9.416 2.189 1.00 0.00 N ATOM 864 CA GLY A 56 -13.227 -10.741 2.769 1.00 0.00 C ATOM 865 C GLY A 56 -11.885 -11.476 2.785 1.00 0.00 C ATOM 866 O GLY A 56 -11.342 -11.760 3.851 1.00 0.00 O ATOM 0 H GLY A 56 -13.968 -8.971 1.927 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.613 -10.658 3.785 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.955 -11.317 2.198 1.00 0.00 H new ATOM 870 N CYS A 57 -11.390 -11.763 1.590 1.00 0.00 N ATOM 871 CA CYS A 57 -10.123 -12.460 1.453 1.00 0.00 C ATOM 872 C CYS A 57 -9.064 -11.691 2.245 1.00 0.00 C ATOM 873 O CYS A 57 -8.763 -12.039 3.386 1.00 0.00 O ATOM 874 CB CYS A 57 -9.726 -12.629 -0.015 1.00 0.00 C ATOM 875 SG CYS A 57 -10.955 -13.673 -0.880 1.00 0.00 S ATOM 0 H CYS A 57 -11.844 -11.525 0.708 1.00 0.00 H new ATOM 0 HA CYS A 57 -10.215 -13.469 1.855 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -9.661 -11.654 -0.497 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -8.738 -13.084 -0.083 1.00 0.00 H new ATOM 0 HG CYS A 57 -10.609 -13.808 -2.126 1.00 0.00 H new ATOM 881 N VAL A 58 -8.527 -10.659 1.609 1.00 0.00 N ATOM 882 CA VAL A 58 -7.509 -9.838 2.241 1.00 0.00 C ATOM 883 C VAL A 58 -8.148 -8.550 2.761 1.00 0.00 C ATOM 884 O VAL A 58 -8.929 -7.911 2.056 1.00 0.00 O ATOM 885 CB VAL A 58 -6.361 -9.583 1.261 1.00 0.00 C ATOM 886 CG1 VAL A 58 -5.513 -8.391 1.709 1.00 0.00 C ATOM 887 CG2 VAL A 58 -5.499 -10.835 1.088 1.00 0.00 C ATOM 0 H VAL A 58 -8.778 -10.373 0.663 1.00 0.00 H new ATOM 0 HA VAL A 58 -7.079 -10.356 3.098 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.796 -9.340 0.292 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.704 -8.231 0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.137 -7.498 1.757 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.093 -8.593 2.694 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.691 -10.626 0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.078 -11.123 2.051 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.113 -11.649 0.702 1.00 0.00 H new ATOM 897 N VAL A 59 -7.794 -8.205 3.990 1.00 0.00 N ATOM 898 CA VAL A 59 -8.324 -7.004 4.613 1.00 0.00 C ATOM 899 C VAL A 59 -7.235 -5.929 4.647 1.00 0.00 C ATOM 900 O VAL A 59 -6.060 -6.224 4.432 1.00 0.00 O ATOM 901 CB VAL A 59 -8.880 -7.335 5.999 1.00 0.00 C ATOM 902 CG1 VAL A 59 -9.429 -6.082 6.684 1.00 0.00 C ATOM 903 CG2 VAL A 59 -9.949 -8.426 5.914 1.00 0.00 C ATOM 0 H VAL A 59 -7.146 -8.736 4.572 1.00 0.00 H new ATOM 0 HA VAL A 59 -9.155 -6.607 4.030 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.059 -7.716 6.607 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -9.818 -6.346 7.667 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -8.631 -5.348 6.794 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -10.230 -5.658 6.079 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -10.328 -8.643 6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -10.768 -8.084 5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.514 -9.330 5.487 1.00 0.00 H new ATOM 913 N VAL A 60 -7.664 -4.706 4.918 1.00 0.00 N ATOM 914 CA VAL A 60 -6.741 -3.586 4.983 1.00 0.00 C ATOM 915 C VAL A 60 -7.154 -2.655 6.125 1.00 0.00 C ATOM 916 O VAL A 60 -8.306 -2.231 6.199 1.00 0.00 O ATOM 917 CB VAL A 60 -6.680 -2.878 3.628 1.00 0.00 C ATOM 918 CG1 VAL A 60 -5.913 -1.559 3.732 1.00 0.00 C ATOM 919 CG2 VAL A 60 -6.066 -3.788 2.562 1.00 0.00 C ATOM 0 H VAL A 60 -8.639 -4.466 5.095 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.731 -3.936 5.198 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.701 -2.647 3.324 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.885 -1.077 2.755 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.412 -0.904 4.446 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.895 -1.756 4.069 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.034 -3.261 1.608 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.054 -4.064 2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.672 -4.688 2.459 1.00 0.00 H new ATOM 929 N ASP A 61 -6.190 -2.366 6.988 1.00 0.00 N ATOM 930 CA ASP A 61 -6.439 -1.494 8.123 1.00 0.00 C ATOM 931 C ASP A 61 -5.363 -0.407 8.171 1.00 0.00 C ATOM 932 O ASP A 61 -4.436 -0.410 7.362 1.00 0.00 O ATOM 933 CB ASP A 61 -6.385 -2.272 9.438 1.00 0.00 C ATOM 934 CG ASP A 61 -7.723 -2.848 9.906 1.00 0.00 C ATOM 935 OD1 ASP A 61 -8.496 -3.276 9.022 1.00 0.00 O ATOM 936 OD2 ASP A 61 -7.943 -2.846 11.136 1.00 0.00 O ATOM 0 H ASP A 61 -5.236 -2.720 6.924 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.431 -1.059 8.003 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -5.673 -3.090 9.329 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.998 -1.614 10.216 1.00 0.00 H new ATOM 941 N GLY A 62 -5.522 0.496 9.128 1.00 0.00 N ATOM 942 CA GLY A 62 -4.575 1.586 9.292 1.00 0.00 C ATOM 943 C GLY A 62 -4.985 2.799 8.455 1.00 0.00 C ATOM 944 O GLY A 62 -4.716 3.938 8.832 1.00 0.00 O ATOM 0 H GLY A 62 -6.292 0.495 9.797 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -4.518 1.868 10.343 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.579 1.255 8.996 1.00 0.00 H new ATOM 948 N MET A 63 -5.630 2.513 7.333 1.00 0.00 N ATOM 949 CA MET A 63 -6.080 3.567 6.439 1.00 0.00 C ATOM 950 C MET A 63 -6.675 4.737 7.226 1.00 0.00 C ATOM 951 O MET A 63 -7.210 4.547 8.317 1.00 0.00 O ATOM 952 CB MET A 63 -7.133 3.008 5.480 1.00 0.00 C ATOM 953 CG MET A 63 -6.544 1.901 4.604 1.00 0.00 C ATOM 954 SD MET A 63 -5.119 2.514 3.722 1.00 0.00 S ATOM 955 CE MET A 63 -5.929 3.384 2.390 1.00 0.00 C ATOM 0 H MET A 63 -5.852 1.567 7.023 1.00 0.00 H new ATOM 0 HA MET A 63 -5.221 3.932 5.876 1.00 0.00 H new ATOM 0 HB2 MET A 63 -7.977 2.617 6.049 1.00 0.00 H new ATOM 0 HB3 MET A 63 -7.518 3.810 4.850 1.00 0.00 H new ATOM 0 HG2 MET A 63 -6.261 1.049 5.222 1.00 0.00 H new ATOM 0 HG3 MET A 63 -7.295 1.547 3.897 1.00 0.00 H new ATOM 0 HE1 MET A 63 -5.382 3.218 1.462 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.949 3.015 2.282 1.00 0.00 H new ATOM 0 HE3 MET A 63 -5.951 4.451 2.612 1.00 0.00 H new ATOM 965 N PRO A 64 -6.557 5.951 6.626 1.00 0.00 N ATOM 966 CA PRO A 64 -7.077 7.152 7.258 1.00 0.00 C ATOM 967 C PRO A 64 -8.603 7.209 7.155 1.00 0.00 C ATOM 968 O PRO A 64 -9.204 6.470 6.377 1.00 0.00 O ATOM 969 CB PRO A 64 -6.390 8.303 6.542 1.00 0.00 C ATOM 970 CG PRO A 64 -5.868 7.729 5.235 1.00 0.00 C ATOM 971 CD PRO A 64 -5.929 6.213 5.334 1.00 0.00 C ATOM 0 HA PRO A 64 -6.871 7.187 8.328 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -7.087 9.121 6.359 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.576 8.707 7.144 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -6.469 8.081 4.396 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -4.845 8.059 5.055 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -6.511 5.786 4.517 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -4.933 5.772 5.281 1.00 0.00 H new ATOM 979 N PRO A 65 -9.200 8.118 7.972 1.00 0.00 N ATOM 980 CA PRO A 65 -10.644 8.282 7.980 1.00 0.00 C ATOM 981 C PRO A 65 -11.117 9.037 6.736 1.00 0.00 C ATOM 982 O PRO A 65 -10.457 9.972 6.284 1.00 0.00 O ATOM 983 CB PRO A 65 -10.949 9.018 9.274 1.00 0.00 C ATOM 984 CG PRO A 65 -9.638 9.648 9.714 1.00 0.00 C ATOM 985 CD PRO A 65 -8.520 9.010 8.906 1.00 0.00 C ATOM 0 HA PRO A 65 -11.176 7.331 7.944 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -11.715 9.778 9.120 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -11.327 8.333 10.033 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.659 10.726 9.552 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.477 9.489 10.780 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -7.933 9.762 8.379 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.831 8.461 9.548 1.00 0.00 H new ATOM 993 N GLY A 66 -12.256 8.603 6.217 1.00 0.00 N ATOM 994 CA GLY A 66 -12.825 9.227 5.034 1.00 0.00 C ATOM 995 C GLY A 66 -11.923 9.018 3.817 1.00 0.00 C ATOM 996 O GLY A 66 -11.997 9.773 2.848 1.00 0.00 O ATOM 0 H GLY A 66 -12.800 7.827 6.594 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -13.812 8.808 4.836 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.962 10.294 5.211 1.00 0.00 H new ATOM 1000 N VAL A 67 -11.091 7.991 3.906 1.00 0.00 N ATOM 1001 CA VAL A 67 -10.175 7.674 2.823 1.00 0.00 C ATOM 1002 C VAL A 67 -10.252 6.177 2.518 1.00 0.00 C ATOM 1003 O VAL A 67 -9.834 5.352 3.329 1.00 0.00 O ATOM 1004 CB VAL A 67 -8.762 8.139 3.180 1.00 0.00 C ATOM 1005 CG1 VAL A 67 -7.780 7.827 2.049 1.00 0.00 C ATOM 1006 CG2 VAL A 67 -8.746 9.630 3.524 1.00 0.00 C ATOM 0 H VAL A 67 -11.032 7.368 4.711 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.458 8.206 1.915 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.441 7.588 4.064 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.783 8.168 2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.759 6.752 1.871 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.097 8.339 1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.730 9.935 3.774 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.097 10.205 2.667 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.400 9.814 4.376 1.00 0.00 H new ATOM 1016 N SER A 68 -10.789 5.871 1.346 1.00 0.00 N ATOM 1017 CA SER A 68 -10.926 4.487 0.924 1.00 0.00 C ATOM 1018 C SER A 68 -9.582 3.959 0.417 1.00 0.00 C ATOM 1019 O SER A 68 -8.701 4.738 0.057 1.00 0.00 O ATOM 1020 CB SER A 68 -11.995 4.346 -0.162 1.00 0.00 C ATOM 1021 OG SER A 68 -13.269 4.806 0.281 1.00 0.00 O ATOM 0 H SER A 68 -11.134 6.558 0.675 1.00 0.00 H new ATOM 0 HA SER A 68 -11.240 3.896 1.785 1.00 0.00 H new ATOM 0 HB2 SER A 68 -11.692 4.910 -1.044 1.00 0.00 H new ATOM 0 HB3 SER A 68 -12.071 3.301 -0.463 1.00 0.00 H new ATOM 0 HG SER A 68 -13.924 4.701 -0.441 1.00 0.00 H new ATOM 1027 N PHE A 69 -9.468 2.639 0.406 1.00 0.00 N ATOM 1028 CA PHE A 69 -8.246 1.998 -0.051 1.00 0.00 C ATOM 1029 C PHE A 69 -8.401 1.480 -1.482 1.00 0.00 C ATOM 1030 O PHE A 69 -9.423 0.887 -1.824 1.00 0.00 O ATOM 1031 CB PHE A 69 -7.987 0.814 0.883 1.00 0.00 C ATOM 1032 CG PHE A 69 -6.929 -0.164 0.368 1.00 0.00 C ATOM 1033 CD1 PHE A 69 -5.621 0.208 0.329 1.00 0.00 C ATOM 1034 CD2 PHE A 69 -7.295 -1.405 -0.050 1.00 0.00 C ATOM 1035 CE1 PHE A 69 -4.639 -0.699 -0.148 1.00 0.00 C ATOM 1036 CE2 PHE A 69 -6.313 -2.312 -0.527 1.00 0.00 C ATOM 1037 CZ PHE A 69 -5.005 -1.940 -0.567 1.00 0.00 C ATOM 0 H PHE A 69 -10.201 1.996 0.706 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.423 2.713 -0.040 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -7.674 1.193 1.856 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -8.922 0.275 1.037 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -5.330 1.194 0.661 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.333 -1.701 -0.019 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -3.601 -0.404 -0.178 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -6.604 -3.298 -0.858 1.00 0.00 H new ATOM 0 HZ PHE A 69 -4.258 -2.630 -0.931 1.00 0.00 H new ATOM 1047 N LYS A 70 -7.372 1.723 -2.280 1.00 0.00 N ATOM 1048 CA LYS A 70 -7.380 1.288 -3.666 1.00 0.00 C ATOM 1049 C LYS A 70 -6.021 1.591 -4.300 1.00 0.00 C ATOM 1050 O LYS A 70 -5.120 2.098 -3.633 1.00 0.00 O ATOM 1051 CB LYS A 70 -8.560 1.911 -4.416 1.00 0.00 C ATOM 1052 CG LYS A 70 -8.382 3.423 -4.559 1.00 0.00 C ATOM 1053 CD LYS A 70 -9.626 4.066 -5.176 1.00 0.00 C ATOM 1054 CE LYS A 70 -10.849 3.863 -4.279 1.00 0.00 C ATOM 1055 NZ LYS A 70 -11.850 3.007 -4.954 1.00 0.00 N ATOM 0 H LYS A 70 -6.526 2.216 -1.993 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.527 0.210 -3.725 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.649 1.457 -5.403 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.487 1.699 -3.883 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.187 3.864 -3.581 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.513 3.633 -5.182 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -9.453 5.132 -5.326 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -9.815 3.633 -6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.545 3.405 -3.338 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -11.293 4.828 -4.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -12.674 2.879 -4.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.153 3.459 -5.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.428 2.080 -5.165 1.00 0.00 H new ATOM 1069 N ALA A 71 -5.915 1.266 -5.580 1.00 0.00 N ATOM 1070 CA ALA A 71 -4.680 1.497 -6.311 1.00 0.00 C ATOM 1071 C ALA A 71 -4.295 2.974 -6.198 1.00 0.00 C ATOM 1072 O ALA A 71 -5.159 3.834 -6.040 1.00 0.00 O ATOM 1073 CB ALA A 71 -4.855 1.049 -7.763 1.00 0.00 C ATOM 0 H ALA A 71 -6.664 0.845 -6.130 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.866 0.911 -5.885 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -3.929 1.222 -8.311 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -5.099 -0.013 -7.789 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.662 1.618 -8.225 1.00 0.00 H new ATOM 1079 N PRO A 72 -2.962 3.228 -6.287 1.00 0.00 N ATOM 1080 CA PRO A 72 -2.451 4.585 -6.197 1.00 0.00 C ATOM 1081 C PRO A 72 -2.720 5.359 -7.489 1.00 0.00 C ATOM 1082 O PRO A 72 -2.510 6.569 -7.547 1.00 0.00 O ATOM 1083 CB PRO A 72 -0.969 4.429 -5.896 1.00 0.00 C ATOM 1084 CG PRO A 72 -0.613 3.004 -6.286 1.00 0.00 C ATOM 1085 CD PRO A 72 -1.909 2.233 -6.475 1.00 0.00 C ATOM 0 HA PRO A 72 -2.943 5.168 -5.418 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.378 5.148 -6.462 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.764 4.608 -4.841 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -0.027 2.995 -7.205 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -0.001 2.538 -5.513 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.961 1.783 -7.466 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.997 1.422 -5.752 1.00 0.00 H new ATOM 1093 N SER A 73 -3.179 4.628 -8.494 1.00 0.00 N ATOM 1094 CA SER A 73 -3.479 5.230 -9.782 1.00 0.00 C ATOM 1095 C SER A 73 -4.747 6.080 -9.680 1.00 0.00 C ATOM 1096 O SER A 73 -4.775 7.217 -10.148 1.00 0.00 O ATOM 1097 CB SER A 73 -3.642 4.162 -10.865 1.00 0.00 C ATOM 1098 OG SER A 73 -4.531 3.124 -10.462 1.00 0.00 O ATOM 0 H SER A 73 -3.351 3.624 -8.442 1.00 0.00 H new ATOM 0 HA SER A 73 -2.642 5.869 -10.063 1.00 0.00 H new ATOM 0 HB2 SER A 73 -4.016 4.626 -11.778 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.668 3.734 -11.101 1.00 0.00 H new ATOM 0 HG SER A 73 -4.610 2.463 -11.181 1.00 0.00 H new ATOM 1104 N TYR A 74 -5.765 5.496 -9.065 1.00 0.00 N ATOM 1105 CA TYR A 74 -7.032 6.186 -8.895 1.00 0.00 C ATOM 1106 C TYR A 74 -6.924 7.276 -7.827 1.00 0.00 C ATOM 1107 O TYR A 74 -7.433 8.381 -8.009 1.00 0.00 O ATOM 1108 CB TYR A 74 -8.030 5.126 -8.426 1.00 0.00 C ATOM 1109 CG TYR A 74 -8.162 3.933 -9.375 1.00 0.00 C ATOM 1110 CD1 TYR A 74 -8.175 4.135 -10.740 1.00 0.00 C ATOM 1111 CD2 TYR A 74 -8.269 2.655 -8.865 1.00 0.00 C ATOM 1112 CE1 TYR A 74 -8.300 3.012 -11.633 1.00 0.00 C ATOM 1113 CE2 TYR A 74 -8.394 1.532 -9.758 1.00 0.00 C ATOM 1114 CZ TYR A 74 -8.403 1.766 -11.098 1.00 0.00 C ATOM 1115 OH TYR A 74 -8.521 0.705 -11.941 1.00 0.00 O ATOM 0 H TYR A 74 -5.738 4.553 -8.678 1.00 0.00 H new ATOM 0 HA TYR A 74 -7.337 6.664 -9.826 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -7.725 4.764 -7.444 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -9.008 5.591 -8.305 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -8.091 5.135 -11.139 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -8.259 2.497 -7.797 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.312 3.156 -12.703 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.479 0.527 -9.372 1.00 0.00 H new ATOM 0 HH TYR A 74 -8.584 -0.122 -11.419 1.00 0.00 H new ATOM 1125 N LEU A 75 -6.259 6.927 -6.736 1.00 0.00 N ATOM 1126 CA LEU A 75 -6.078 7.862 -5.638 1.00 0.00 C ATOM 1127 C LEU A 75 -5.321 9.093 -6.142 1.00 0.00 C ATOM 1128 O LEU A 75 -4.450 8.980 -7.003 1.00 0.00 O ATOM 1129 CB LEU A 75 -5.407 7.170 -4.450 1.00 0.00 C ATOM 1130 CG LEU A 75 -6.129 5.941 -3.894 1.00 0.00 C ATOM 1131 CD1 LEU A 75 -5.251 5.201 -2.883 1.00 0.00 C ATOM 1132 CD2 LEU A 75 -7.486 6.325 -3.302 1.00 0.00 C ATOM 0 H LEU A 75 -5.839 6.009 -6.588 1.00 0.00 H new ATOM 0 HA LEU A 75 -7.043 8.210 -5.270 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.402 6.872 -4.749 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.298 7.897 -3.646 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.320 5.254 -4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.787 4.332 -2.503 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.331 4.876 -3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.008 5.868 -2.056 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.979 5.434 -2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.341 7.041 -2.493 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -8.107 6.774 -4.077 1.00 0.00 H new ATOM 1144 N GLU A 76 -5.681 10.239 -5.583 1.00 0.00 N ATOM 1145 CA GLU A 76 -5.046 11.489 -5.964 1.00 0.00 C ATOM 1146 C GLU A 76 -3.803 11.736 -5.108 1.00 0.00 C ATOM 1147 O GLU A 76 -3.543 11.000 -4.157 1.00 0.00 O ATOM 1148 CB GLU A 76 -6.028 12.658 -5.856 1.00 0.00 C ATOM 1149 CG GLU A 76 -7.113 12.563 -6.930 1.00 0.00 C ATOM 1150 CD GLU A 76 -7.965 13.834 -6.962 1.00 0.00 C ATOM 1151 OE1 GLU A 76 -7.507 14.807 -7.599 1.00 0.00 O ATOM 1152 OE2 GLU A 76 -9.053 13.804 -6.349 1.00 0.00 O ATOM 0 H GLU A 76 -6.404 10.328 -4.869 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.736 11.413 -7.006 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.488 12.661 -4.868 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -5.490 13.600 -5.960 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -6.652 12.405 -7.905 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -7.749 11.699 -6.735 1.00 0.00 H new ATOM 1159 N ILE A 77 -3.066 12.774 -5.476 1.00 0.00 N ATOM 1160 CA ILE A 77 -1.856 13.128 -4.753 1.00 0.00 C ATOM 1161 C ILE A 77 -2.173 13.240 -3.261 1.00 0.00 C ATOM 1162 O ILE A 77 -1.514 12.612 -2.433 1.00 0.00 O ATOM 1163 CB ILE A 77 -1.228 14.391 -5.345 1.00 0.00 C ATOM 1164 CG1 ILE A 77 -0.819 14.168 -6.803 1.00 0.00 C ATOM 1165 CG2 ILE A 77 -0.056 14.873 -4.489 1.00 0.00 C ATOM 1166 CD1 ILE A 77 0.216 15.204 -7.246 1.00 0.00 C ATOM 0 H ILE A 77 -3.284 13.382 -6.266 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.105 12.346 -4.862 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.979 15.181 -5.338 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.408 13.165 -6.920 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.698 14.229 -7.445 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.373 15.772 -4.932 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.409 15.097 -3.482 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.705 14.094 -4.442 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.490 15.023 -8.285 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.207 16.204 -7.151 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.103 15.124 -6.618 1.00 0.00 H new ATOM 1178 N SER A 78 -3.183 14.044 -2.962 1.00 0.00 N ATOM 1179 CA SER A 78 -3.596 14.247 -1.583 1.00 0.00 C ATOM 1180 C SER A 78 -3.918 12.901 -0.930 1.00 0.00 C ATOM 1181 O SER A 78 -3.501 12.639 0.197 1.00 0.00 O ATOM 1182 CB SER A 78 -4.806 15.179 -1.502 1.00 0.00 C ATOM 1183 OG SER A 78 -5.862 14.760 -2.361 1.00 0.00 O ATOM 0 H SER A 78 -3.728 14.563 -3.651 1.00 0.00 H new ATOM 0 HA SER A 78 -2.773 14.717 -1.045 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.168 15.215 -0.474 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.502 16.191 -1.769 1.00 0.00 H new ATOM 0 HG SER A 78 -6.616 15.380 -2.279 1.00 0.00 H new ATOM 1189 N SER A 79 -4.657 12.084 -1.666 1.00 0.00 N ATOM 1190 CA SER A 79 -5.040 10.772 -1.173 1.00 0.00 C ATOM 1191 C SER A 79 -3.797 9.994 -0.737 1.00 0.00 C ATOM 1192 O SER A 79 -3.684 9.595 0.421 1.00 0.00 O ATOM 1193 CB SER A 79 -5.812 9.988 -2.235 1.00 0.00 C ATOM 1194 OG SER A 79 -7.039 10.624 -2.582 1.00 0.00 O ATOM 0 H SER A 79 -5.001 12.305 -2.600 1.00 0.00 H new ATOM 0 HA SER A 79 -5.696 10.908 -0.313 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.194 9.881 -3.127 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.016 8.983 -1.866 1.00 0.00 H new ATOM 0 HG SER A 79 -7.574 10.021 -3.140 1.00 0.00 H new ATOM 1200 N MET A 80 -2.895 9.801 -1.689 1.00 0.00 N ATOM 1201 CA MET A 80 -1.664 9.077 -1.418 1.00 0.00 C ATOM 1202 C MET A 80 -0.958 9.640 -0.183 1.00 0.00 C ATOM 1203 O MET A 80 -0.658 8.903 0.755 1.00 0.00 O ATOM 1204 CB MET A 80 -0.735 9.179 -2.629 1.00 0.00 C ATOM 1205 CG MET A 80 -1.317 8.433 -3.831 1.00 0.00 C ATOM 1206 SD MET A 80 -0.161 8.470 -5.190 1.00 0.00 S ATOM 1207 CE MET A 80 -0.711 9.948 -6.026 1.00 0.00 C ATOM 0 H MET A 80 -2.992 10.133 -2.648 1.00 0.00 H new ATOM 0 HA MET A 80 -1.912 8.033 -1.227 1.00 0.00 H new ATOM 0 HB2 MET A 80 -0.581 10.227 -2.887 1.00 0.00 H new ATOM 0 HB3 MET A 80 0.242 8.766 -2.378 1.00 0.00 H new ATOM 0 HG2 MET A 80 -1.537 7.401 -3.557 1.00 0.00 H new ATOM 0 HG3 MET A 80 -2.260 8.890 -4.132 1.00 0.00 H new ATOM 0 HE1 MET A 80 -0.713 9.778 -7.103 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.719 10.198 -5.697 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.037 10.772 -5.790 1.00 0.00 H new ATOM 1217 N ARG A 81 -0.713 10.942 -0.222 1.00 0.00 N ATOM 1218 CA ARG A 81 -0.047 11.612 0.882 1.00 0.00 C ATOM 1219 C ARG A 81 -0.582 11.092 2.218 1.00 0.00 C ATOM 1220 O ARG A 81 0.153 10.473 2.986 1.00 0.00 O ATOM 1221 CB ARG A 81 -0.254 13.126 0.812 1.00 0.00 C ATOM 1222 CG ARG A 81 0.157 13.673 -0.556 1.00 0.00 C ATOM 1223 CD ARG A 81 1.315 14.665 -0.425 1.00 0.00 C ATOM 1224 NE ARG A 81 1.096 15.820 -1.323 1.00 0.00 N ATOM 1225 CZ ARG A 81 1.738 16.991 -1.211 1.00 0.00 C ATOM 1226 NH1 ARG A 81 2.642 17.169 -0.238 1.00 0.00 N ATOM 1227 NH2 ARG A 81 1.475 17.985 -2.071 1.00 0.00 N ATOM 0 H ARG A 81 -0.964 11.551 -1.001 1.00 0.00 H new ATOM 0 HA ARG A 81 1.019 11.399 0.806 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -1.301 13.363 1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 81 0.330 13.613 1.593 1.00 0.00 H new ATOM 0 HG2 ARG A 81 0.451 12.850 -1.207 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -0.695 14.163 -1.026 1.00 0.00 H new ATOM 0 HD2 ARG A 81 1.397 15.007 0.607 1.00 0.00 H new ATOM 0 HD3 ARG A 81 2.256 14.174 -0.674 1.00 0.00 H new ATOM 0 HE ARG A 81 0.414 15.719 -2.074 1.00 0.00 H new ATOM 0 HH11 ARG A 81 2.841 16.413 0.417 1.00 0.00 H new ATOM 0 HH12 ARG A 81 3.131 18.060 -0.153 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.786 17.850 -2.811 1.00 0.00 H new ATOM 0 HH22 ARG A 81 1.964 18.876 -1.985 1.00 0.00 H new ATOM 1241 N ARG A 82 -1.857 11.362 2.454 1.00 0.00 N ATOM 1242 CA ARG A 82 -2.498 10.930 3.684 1.00 0.00 C ATOM 1243 C ARG A 82 -2.069 9.503 4.033 1.00 0.00 C ATOM 1244 O ARG A 82 -1.459 9.272 5.076 1.00 0.00 O ATOM 1245 CB ARG A 82 -4.022 10.980 3.558 1.00 0.00 C ATOM 1246 CG ARG A 82 -4.512 12.420 3.392 1.00 0.00 C ATOM 1247 CD ARG A 82 -6.015 12.459 3.108 1.00 0.00 C ATOM 1248 NE ARG A 82 -6.683 13.389 4.046 1.00 0.00 N ATOM 1249 CZ ARG A 82 -6.991 13.084 5.314 1.00 0.00 C ATOM 1250 NH1 ARG A 82 -6.693 11.873 5.803 1.00 0.00 N ATOM 1251 NH2 ARG A 82 -7.597 13.991 6.093 1.00 0.00 N ATOM 0 H ARG A 82 -2.464 11.875 1.814 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.188 11.611 4.476 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.339 10.383 2.703 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.478 10.537 4.443 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.294 12.988 4.296 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.972 12.900 2.576 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.191 12.777 2.080 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.439 11.460 3.210 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.924 14.320 3.706 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.232 11.183 5.210 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -6.927 11.641 6.768 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.824 14.913 5.721 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -7.832 13.759 7.058 1.00 0.00 H new ATOM 1265 N ILE A 83 -2.404 8.583 3.140 1.00 0.00 N ATOM 1266 CA ILE A 83 -2.061 7.186 3.341 1.00 0.00 C ATOM 1267 C ILE A 83 -0.635 7.088 3.886 1.00 0.00 C ATOM 1268 O ILE A 83 -0.404 6.472 4.925 1.00 0.00 O ATOM 1269 CB ILE A 83 -2.283 6.389 2.054 1.00 0.00 C ATOM 1270 CG1 ILE A 83 -3.776 6.220 1.764 1.00 0.00 C ATOM 1271 CG2 ILE A 83 -1.554 5.045 2.108 1.00 0.00 C ATOM 1272 CD1 ILE A 83 -4.080 6.475 0.286 1.00 0.00 C ATOM 0 H ILE A 83 -2.909 8.778 2.276 1.00 0.00 H new ATOM 0 HA ILE A 83 -2.719 6.736 4.085 1.00 0.00 H new ATOM 0 HB ILE A 83 -1.856 6.954 1.225 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -4.091 5.212 2.035 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.350 6.910 2.382 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -1.729 4.499 1.181 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -0.485 5.216 2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -1.929 4.461 2.949 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.148 6.348 0.107 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.786 7.492 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.523 5.767 -0.327 1.00 0.00 H new ATOM 1284 N LEU A 84 0.285 7.706 3.160 1.00 0.00 N ATOM 1285 CA LEU A 84 1.683 7.696 3.557 1.00 0.00 C ATOM 1286 C LEU A 84 1.798 8.159 5.011 1.00 0.00 C ATOM 1287 O LEU A 84 2.432 7.495 5.829 1.00 0.00 O ATOM 1288 CB LEU A 84 2.523 8.521 2.581 1.00 0.00 C ATOM 1289 CG LEU A 84 2.785 7.882 1.215 1.00 0.00 C ATOM 1290 CD1 LEU A 84 3.397 8.894 0.245 1.00 0.00 C ATOM 1291 CD2 LEU A 84 3.649 6.627 1.354 1.00 0.00 C ATOM 0 H LEU A 84 0.090 8.217 2.299 1.00 0.00 H new ATOM 0 HA LEU A 84 2.085 6.684 3.511 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.025 9.478 2.423 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.483 8.735 3.050 1.00 0.00 H new ATOM 0 HG LEU A 84 1.829 7.570 0.794 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.573 8.414 -0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.712 9.732 0.113 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.342 9.258 0.647 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.820 6.192 0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.605 6.892 1.805 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.138 5.902 1.987 1.00 0.00 H new ATOM 1303 N ASP A 85 1.175 9.295 5.288 1.00 0.00 N ATOM 1304 CA ASP A 85 1.200 9.855 6.629 1.00 0.00 C ATOM 1305 C ASP A 85 0.885 8.753 7.642 1.00 0.00 C ATOM 1306 O ASP A 85 1.283 8.840 8.803 1.00 0.00 O ATOM 1307 CB ASP A 85 0.149 10.956 6.786 1.00 0.00 C ATOM 1308 CG ASP A 85 0.350 11.875 7.992 1.00 0.00 C ATOM 1309 OD1 ASP A 85 1.518 12.253 8.229 1.00 0.00 O ATOM 1310 OD2 ASP A 85 -0.668 12.178 8.650 1.00 0.00 O ATOM 0 H ASP A 85 0.650 9.843 4.607 1.00 0.00 H new ATOM 0 HA ASP A 85 2.191 10.276 6.801 1.00 0.00 H new ATOM 0 HB2 ASP A 85 0.144 11.564 5.882 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -0.834 10.491 6.863 1.00 0.00 H new ATOM 1315 N SER A 86 0.174 7.741 7.167 1.00 0.00 N ATOM 1316 CA SER A 86 -0.198 6.623 8.017 1.00 0.00 C ATOM 1317 C SER A 86 0.350 5.318 7.436 1.00 0.00 C ATOM 1318 O SER A 86 -0.299 4.276 7.521 1.00 0.00 O ATOM 1319 CB SER A 86 -1.717 6.536 8.178 1.00 0.00 C ATOM 1320 OG SER A 86 -2.117 6.642 9.542 1.00 0.00 O ATOM 0 H SER A 86 -0.154 7.672 6.204 1.00 0.00 H new ATOM 0 HA SER A 86 0.237 6.784 9.004 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.189 7.330 7.599 1.00 0.00 H new ATOM 0 HB3 SER A 86 -2.071 5.590 7.769 1.00 0.00 H new ATOM 0 HG SER A 86 -1.373 6.379 10.123 1.00 0.00 H new ATOM 1326 N ALA A 87 1.538 5.418 6.860 1.00 0.00 N ATOM 1327 CA ALA A 87 2.181 4.258 6.265 1.00 0.00 C ATOM 1328 C ALA A 87 2.233 3.126 7.293 1.00 0.00 C ATOM 1329 O ALA A 87 1.620 2.077 7.097 1.00 0.00 O ATOM 1330 CB ALA A 87 3.571 4.649 5.758 1.00 0.00 C ATOM 0 H ALA A 87 2.073 6.284 6.792 1.00 0.00 H new ATOM 0 HA ALA A 87 1.610 3.900 5.408 1.00 0.00 H new ATOM 0 HB1 ALA A 87 4.053 3.779 5.312 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.477 5.436 5.010 1.00 0.00 H new ATOM 0 HB3 ALA A 87 4.174 5.011 6.591 1.00 0.00 H new ATOM 1336 N GLU A 88 2.969 3.376 8.365 1.00 0.00 N ATOM 1337 CA GLU A 88 3.108 2.391 9.424 1.00 0.00 C ATOM 1338 C GLU A 88 1.733 1.881 9.859 1.00 0.00 C ATOM 1339 O GLU A 88 1.545 0.681 10.054 1.00 0.00 O ATOM 1340 CB GLU A 88 3.880 2.968 10.612 1.00 0.00 C ATOM 1341 CG GLU A 88 3.160 4.187 11.194 1.00 0.00 C ATOM 1342 CD GLU A 88 4.044 4.914 12.209 1.00 0.00 C ATOM 1343 OE1 GLU A 88 4.504 4.233 13.151 1.00 0.00 O ATOM 1344 OE2 GLU A 88 4.241 6.133 12.020 1.00 0.00 O ATOM 0 H GLU A 88 3.476 4.247 8.523 1.00 0.00 H new ATOM 0 HA GLU A 88 3.680 1.548 9.036 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.992 2.205 11.383 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.884 3.251 10.295 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.886 4.870 10.390 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.233 3.872 11.674 1.00 0.00 H new ATOM 1351 N PHE A 89 0.806 2.818 9.998 1.00 0.00 N ATOM 1352 CA PHE A 89 -0.546 2.479 10.406 1.00 0.00 C ATOM 1353 C PHE A 89 -1.141 1.404 9.494 1.00 0.00 C ATOM 1354 O PHE A 89 -1.773 0.462 9.969 1.00 0.00 O ATOM 1355 CB PHE A 89 -1.383 3.754 10.285 1.00 0.00 C ATOM 1356 CG PHE A 89 -1.633 4.463 11.617 1.00 0.00 C ATOM 1357 CD1 PHE A 89 -2.451 3.899 12.546 1.00 0.00 C ATOM 1358 CD2 PHE A 89 -1.036 5.658 11.873 1.00 0.00 C ATOM 1359 CE1 PHE A 89 -2.682 4.558 13.782 1.00 0.00 C ATOM 1360 CE2 PHE A 89 -1.267 6.317 13.110 1.00 0.00 C ATOM 1361 CZ PHE A 89 -2.085 5.753 14.038 1.00 0.00 C ATOM 0 H PHE A 89 0.965 3.812 9.835 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.541 2.091 11.425 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.880 4.444 9.607 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.343 3.505 9.832 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.925 2.950 12.343 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.386 6.106 11.136 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.332 4.110 14.519 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.793 7.266 13.313 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.261 6.254 14.979 1.00 0.00 H new ATOM 1371 N ILE A 90 -0.917 1.581 8.200 1.00 0.00 N ATOM 1372 CA ILE A 90 -1.423 0.639 7.217 1.00 0.00 C ATOM 1373 C ILE A 90 -1.265 -0.785 7.754 1.00 0.00 C ATOM 1374 O ILE A 90 -0.384 -1.050 8.571 1.00 0.00 O ATOM 1375 CB ILE A 90 -0.749 0.864 5.862 1.00 0.00 C ATOM 1376 CG1 ILE A 90 -0.869 2.326 5.427 1.00 0.00 C ATOM 1377 CG2 ILE A 90 -1.304 -0.096 4.808 1.00 0.00 C ATOM 1378 CD1 ILE A 90 -2.211 2.919 5.860 1.00 0.00 C ATOM 0 H ILE A 90 -0.392 2.363 7.810 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.488 0.800 7.047 1.00 0.00 H new ATOM 0 HB ILE A 90 0.314 0.646 5.968 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.054 2.906 5.861 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -0.769 2.396 4.344 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.808 0.085 3.854 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.124 -1.124 5.122 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.376 0.067 4.696 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.270 3.959 5.538 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.023 2.352 5.405 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.297 2.870 6.945 1.00 0.00 H new ATOM 1390 N LYS A 91 -2.130 -1.665 7.272 1.00 0.00 N ATOM 1391 CA LYS A 91 -2.097 -3.055 7.693 1.00 0.00 C ATOM 1392 C LYS A 91 -2.878 -3.906 6.690 1.00 0.00 C ATOM 1393 O LYS A 91 -3.803 -3.417 6.044 1.00 0.00 O ATOM 1394 CB LYS A 91 -2.595 -3.191 9.134 1.00 0.00 C ATOM 1395 CG LYS A 91 -2.187 -4.539 9.730 1.00 0.00 C ATOM 1396 CD LYS A 91 -2.979 -4.837 11.005 1.00 0.00 C ATOM 1397 CE LYS A 91 -3.314 -6.327 11.106 1.00 0.00 C ATOM 1398 NZ LYS A 91 -2.501 -6.970 12.162 1.00 0.00 N ATOM 0 H LYS A 91 -2.858 -1.442 6.594 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.072 -3.427 7.698 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.188 -2.383 9.741 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -3.680 -3.092 9.158 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -2.356 -5.330 8.999 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.120 -4.534 9.953 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.401 -4.531 11.877 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -3.899 -4.252 11.011 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -4.374 -6.453 11.327 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -3.128 -6.813 10.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -2.740 -7.981 12.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.491 -6.865 11.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -2.699 -6.517 13.077 1.00 0.00 H new ATOM 1412 N PHE A 92 -2.477 -5.165 6.592 1.00 0.00 N ATOM 1413 CA PHE A 92 -3.128 -6.089 5.678 1.00 0.00 C ATOM 1414 C PHE A 92 -3.271 -7.475 6.310 1.00 0.00 C ATOM 1415 O PHE A 92 -2.274 -8.120 6.632 1.00 0.00 O ATOM 1416 CB PHE A 92 -2.237 -6.195 4.439 1.00 0.00 C ATOM 1417 CG PHE A 92 -2.459 -5.079 3.416 1.00 0.00 C ATOM 1418 CD1 PHE A 92 -2.084 -3.804 3.708 1.00 0.00 C ATOM 1419 CD2 PHE A 92 -3.031 -5.361 2.215 1.00 0.00 C ATOM 1420 CE1 PHE A 92 -2.290 -2.769 2.759 1.00 0.00 C ATOM 1421 CE2 PHE A 92 -3.236 -4.325 1.266 1.00 0.00 C ATOM 1422 CZ PHE A 92 -2.862 -3.051 1.558 1.00 0.00 C ATOM 0 H PHE A 92 -1.710 -5.567 7.130 1.00 0.00 H new ATOM 0 HA PHE A 92 -4.126 -5.727 5.431 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.193 -6.184 4.753 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.415 -7.156 3.957 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.630 -3.580 4.662 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.329 -6.373 1.983 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -1.992 -1.757 2.991 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.689 -4.549 0.312 1.00 0.00 H new ATOM 0 HZ PHE A 92 -3.019 -2.263 0.836 1.00 0.00 H new ATOM 1432 N THR A 93 -4.518 -7.894 6.467 1.00 0.00 N ATOM 1433 CA THR A 93 -4.804 -9.192 7.054 1.00 0.00 C ATOM 1434 C THR A 93 -5.281 -10.170 5.979 1.00 0.00 C ATOM 1435 O THR A 93 -6.214 -9.873 5.234 1.00 0.00 O ATOM 1436 CB THR A 93 -5.816 -8.988 8.183 1.00 0.00 C ATOM 1437 OG1 THR A 93 -5.269 -7.920 8.952 1.00 0.00 O ATOM 1438 CG2 THR A 93 -5.854 -10.168 9.156 1.00 0.00 C ATOM 0 H THR A 93 -5.342 -7.357 6.198 1.00 0.00 H new ATOM 0 HA THR A 93 -3.906 -9.640 7.480 1.00 0.00 H new ATOM 0 HB THR A 93 -6.808 -8.837 7.758 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.864 -7.721 9.705 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.588 -9.972 9.937 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.130 -11.075 8.618 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.870 -10.299 9.607 1.00 0.00 H new ATOM 1446 N VAL A 94 -4.619 -11.317 5.931 1.00 0.00 N ATOM 1447 CA VAL A 94 -4.964 -12.340 4.960 1.00 0.00 C ATOM 1448 C VAL A 94 -5.863 -13.385 5.623 1.00 0.00 C ATOM 1449 O VAL A 94 -5.397 -14.456 6.007 1.00 0.00 O ATOM 1450 CB VAL A 94 -3.691 -12.942 4.359 1.00 0.00 C ATOM 1451 CG1 VAL A 94 -4.020 -14.136 3.461 1.00 0.00 C ATOM 1452 CG2 VAL A 94 -2.893 -11.884 3.594 1.00 0.00 C ATOM 0 H VAL A 94 -3.845 -11.560 6.550 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.525 -11.906 4.132 1.00 0.00 H new ATOM 0 HB VAL A 94 -3.070 -13.301 5.180 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.098 -14.545 3.047 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.526 -14.903 4.047 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -4.670 -13.812 2.648 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.994 -12.337 3.177 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -3.504 -11.481 2.786 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.612 -11.079 4.273 1.00 0.00 H new ATOM 1462 N ILE A 95 -7.136 -13.036 5.737 1.00 0.00 N ATOM 1463 CA ILE A 95 -8.106 -13.930 6.347 1.00 0.00 C ATOM 1464 C ILE A 95 -8.236 -15.193 5.494 1.00 0.00 C ATOM 1465 O ILE A 95 -8.160 -16.307 6.011 1.00 0.00 O ATOM 1466 CB ILE A 95 -9.433 -13.205 6.579 1.00 0.00 C ATOM 1467 CG1 ILE A 95 -9.314 -12.196 7.723 1.00 0.00 C ATOM 1468 CG2 ILE A 95 -10.570 -14.202 6.809 1.00 0.00 C ATOM 1469 CD1 ILE A 95 -8.414 -11.023 7.328 1.00 0.00 C ATOM 0 H ILE A 95 -7.518 -12.146 5.417 1.00 0.00 H new ATOM 0 HA ILE A 95 -7.766 -14.245 7.334 1.00 0.00 H new ATOM 0 HB ILE A 95 -9.677 -12.642 5.678 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -10.304 -11.826 7.991 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -8.908 -12.689 8.607 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.502 -13.660 6.971 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -10.672 -14.846 5.935 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.348 -14.812 7.685 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -8.346 -10.321 8.159 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -7.418 -11.394 7.085 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -8.835 -10.518 6.459 1.00 0.00 H new ATOM 1481 N ARG A 96 -8.430 -14.978 4.201 1.00 0.00 N ATOM 1482 CA ARG A 96 -8.571 -16.085 3.271 1.00 0.00 C ATOM 1483 C ARG A 96 -7.771 -15.813 1.996 1.00 0.00 C ATOM 1484 O ARG A 96 -7.880 -14.737 1.409 1.00 0.00 O ATOM 1485 CB ARG A 96 -10.039 -16.314 2.906 1.00 0.00 C ATOM 1486 CG ARG A 96 -10.881 -16.577 4.156 1.00 0.00 C ATOM 1487 CD ARG A 96 -11.299 -18.046 4.236 1.00 0.00 C ATOM 1488 NE ARG A 96 -11.859 -18.341 5.574 1.00 0.00 N ATOM 1489 CZ ARG A 96 -13.109 -18.034 5.949 1.00 0.00 C ATOM 1490 NH1 ARG A 96 -13.935 -17.422 5.090 1.00 0.00 N ATOM 1491 NH2 ARG A 96 -13.531 -18.339 7.183 1.00 0.00 N ATOM 0 H ARG A 96 -8.493 -14.053 3.776 1.00 0.00 H new ATOM 0 HA ARG A 96 -8.187 -16.980 3.760 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.427 -15.442 2.379 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.120 -17.160 2.224 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -10.311 -16.308 5.046 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.768 -15.943 4.142 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.040 -18.264 3.467 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -10.440 -18.688 4.043 1.00 0.00 H new ATOM 0 HE ARG A 96 -11.257 -18.807 6.253 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.613 -17.190 4.151 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -14.886 -17.189 5.375 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -12.901 -18.805 7.837 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -14.482 -18.106 7.469 1.00 0.00 H new ATOM 1505 N PRO A 97 -6.965 -16.832 1.594 1.00 0.00 N ATOM 1506 CA PRO A 97 -6.148 -16.713 0.399 1.00 0.00 C ATOM 1507 C PRO A 97 -7.001 -16.843 -0.865 1.00 0.00 C ATOM 1508 O PRO A 97 -8.149 -17.280 -0.800 1.00 0.00 O ATOM 1509 CB PRO A 97 -5.103 -17.809 0.526 1.00 0.00 C ATOM 1510 CG PRO A 97 -5.653 -18.792 1.547 1.00 0.00 C ATOM 1511 CD PRO A 97 -6.812 -18.120 2.264 1.00 0.00 C ATOM 0 HA PRO A 97 -5.673 -15.736 0.311 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -4.931 -18.297 -0.433 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -4.146 -17.401 0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -5.987 -19.706 1.056 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -4.878 -19.077 2.258 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -7.722 -18.715 2.190 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -6.600 -17.992 3.325 1.00 0.00 H new ATOM 1519 N PHE A 98 -6.407 -16.456 -1.984 1.00 0.00 N ATOM 1520 CA PHE A 98 -7.098 -16.524 -3.260 1.00 0.00 C ATOM 1521 C PHE A 98 -6.824 -17.856 -3.962 1.00 0.00 C ATOM 1522 O PHE A 98 -5.896 -18.575 -3.595 1.00 0.00 O ATOM 1523 CB PHE A 98 -6.555 -15.384 -4.124 1.00 0.00 C ATOM 1524 CG PHE A 98 -6.192 -14.124 -3.336 1.00 0.00 C ATOM 1525 CD1 PHE A 98 -7.156 -13.442 -2.662 1.00 0.00 C ATOM 1526 CD2 PHE A 98 -4.904 -13.687 -3.310 1.00 0.00 C ATOM 1527 CE1 PHE A 98 -6.818 -12.273 -1.930 1.00 0.00 C ATOM 1528 CE2 PHE A 98 -4.567 -12.517 -2.578 1.00 0.00 C ATOM 1529 CZ PHE A 98 -5.531 -11.835 -1.903 1.00 0.00 C ATOM 0 H PHE A 98 -5.455 -16.094 -2.033 1.00 0.00 H new ATOM 0 HA PHE A 98 -8.174 -16.440 -3.105 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -5.671 -15.735 -4.656 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -7.299 -15.127 -4.878 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -8.178 -13.789 -2.683 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -4.138 -14.229 -3.845 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -7.584 -11.731 -1.394 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -3.545 -12.169 -2.557 1.00 0.00 H new ATOM 0 HZ PHE A 98 -5.274 -10.946 -1.346 1.00 0.00 H new ATOM 1539 N PRO A 99 -7.670 -18.151 -4.985 1.00 0.00 N ATOM 1540 CA PRO A 99 -7.527 -19.384 -5.741 1.00 0.00 C ATOM 1541 C PRO A 99 -6.339 -19.303 -6.702 1.00 0.00 C ATOM 1542 O PRO A 99 -6.501 -18.948 -7.868 1.00 0.00 O ATOM 1543 CB PRO A 99 -8.857 -19.563 -6.456 1.00 0.00 C ATOM 1544 CG PRO A 99 -9.523 -18.196 -6.445 1.00 0.00 C ATOM 1545 CD PRO A 99 -8.780 -17.323 -5.447 1.00 0.00 C ATOM 0 HA PRO A 99 -7.311 -20.244 -5.107 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.708 -19.917 -7.476 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -9.476 -20.303 -5.950 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.494 -17.749 -7.439 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -10.573 -18.285 -6.166 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.422 -16.405 -5.913 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -9.426 -17.029 -4.620 1.00 0.00 H new ATOM 1553 N GLY A 100 -5.170 -19.640 -6.176 1.00 0.00 N ATOM 1554 CA GLY A 100 -3.955 -19.611 -6.971 1.00 0.00 C ATOM 1555 C GLY A 100 -2.836 -18.870 -6.236 1.00 0.00 C ATOM 1556 O GLY A 100 -1.698 -18.838 -6.702 1.00 0.00 O ATOM 0 H GLY A 100 -5.039 -19.935 -5.208 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -3.637 -20.630 -7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.153 -19.124 -7.926 1.00 0.00 H new ATOM 1560 N LEU A 101 -3.199 -18.292 -5.101 1.00 0.00 N ATOM 1561 CA LEU A 101 -2.240 -17.554 -4.297 1.00 0.00 C ATOM 1562 C LEU A 101 -1.200 -18.524 -3.732 1.00 0.00 C ATOM 1563 O LEU A 101 -1.499 -19.695 -3.502 1.00 0.00 O ATOM 1564 CB LEU A 101 -2.959 -16.731 -3.226 1.00 0.00 C ATOM 1565 CG LEU A 101 -2.098 -15.721 -2.465 1.00 0.00 C ATOM 1566 CD1 LEU A 101 -1.680 -14.563 -3.372 1.00 0.00 C ATOM 1567 CD2 LEU A 101 -2.812 -15.233 -1.203 1.00 0.00 C ATOM 0 H LEU A 101 -4.144 -18.320 -4.719 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.702 -16.833 -4.913 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -3.781 -16.194 -3.700 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -3.401 -17.418 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 101 -1.185 -16.223 -2.144 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -1.069 -13.860 -2.806 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.104 -14.949 -4.213 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.569 -14.053 -3.744 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -2.178 -14.516 -0.681 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.751 -14.754 -1.479 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -3.016 -16.081 -0.549 1.00 0.00 H new ATOM 1579 N VAL A 102 -0.001 -18.001 -3.525 1.00 0.00 N ATOM 1580 CA VAL A 102 1.085 -18.806 -2.992 1.00 0.00 C ATOM 1581 C VAL A 102 1.915 -17.959 -2.025 1.00 0.00 C ATOM 1582 O VAL A 102 1.865 -16.731 -2.071 1.00 0.00 O ATOM 1583 CB VAL A 102 1.914 -19.391 -4.137 1.00 0.00 C ATOM 1584 CG1 VAL A 102 3.188 -20.053 -3.608 1.00 0.00 C ATOM 1585 CG2 VAL A 102 1.087 -20.377 -4.964 1.00 0.00 C ATOM 0 H VAL A 102 0.243 -17.029 -3.717 1.00 0.00 H new ATOM 0 HA VAL A 102 0.692 -19.652 -2.428 1.00 0.00 H new ATOM 0 HB VAL A 102 2.209 -18.570 -4.791 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.759 -20.461 -4.442 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.791 -19.313 -3.082 1.00 0.00 H new ATOM 0 HG13 VAL A 102 2.922 -20.858 -2.922 1.00 0.00 H new ATOM 0 HG21 VAL A 102 1.700 -20.778 -5.771 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.748 -21.193 -4.326 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.223 -19.863 -5.385 1.00 0.00 H new ATOM 1595 N ILE A 103 2.659 -18.649 -1.173 1.00 0.00 N ATOM 1596 CA ILE A 103 3.499 -17.975 -0.197 1.00 0.00 C ATOM 1597 C ILE A 103 4.958 -18.376 -0.423 1.00 0.00 C ATOM 1598 O ILE A 103 5.773 -17.556 -0.841 1.00 0.00 O ATOM 1599 CB ILE A 103 2.998 -18.251 1.222 1.00 0.00 C ATOM 1600 CG1 ILE A 103 1.553 -17.777 1.395 1.00 0.00 C ATOM 1601 CG2 ILE A 103 3.932 -17.633 2.264 1.00 0.00 C ATOM 1602 CD1 ILE A 103 1.091 -17.946 2.844 1.00 0.00 C ATOM 0 H ILE A 103 2.698 -19.668 -1.138 1.00 0.00 H new ATOM 0 HA ILE A 103 3.441 -16.894 -0.326 1.00 0.00 H new ATOM 0 HB ILE A 103 3.005 -19.329 1.383 1.00 0.00 H new ATOM 0 HG12 ILE A 103 1.473 -16.730 1.104 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.899 -18.343 0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 103 3.552 -17.844 3.264 1.00 0.00 H new ATOM 0 HG22 ILE A 103 4.929 -18.059 2.157 1.00 0.00 H new ATOM 0 HG23 ILE A 103 3.981 -16.554 2.115 1.00 0.00 H new ATOM 0 HD11 ILE A 103 0.061 -17.602 2.940 1.00 0.00 H new ATOM 0 HD12 ILE A 103 1.150 -18.998 3.124 1.00 0.00 H new ATOM 0 HD13 ILE A 103 1.732 -17.359 3.501 1.00 0.00 H new ATOM 1614 N ASN A 104 5.243 -19.638 -0.135 1.00 0.00 N ATOM 1615 CA ASN A 104 6.589 -20.158 -0.302 1.00 0.00 C ATOM 1616 C ASN A 104 7.544 -19.393 0.618 1.00 0.00 C ATOM 1617 O ASN A 104 7.324 -18.218 0.907 1.00 0.00 O ATOM 1618 CB ASN A 104 7.075 -19.979 -1.742 1.00 0.00 C ATOM 1619 CG ASN A 104 7.488 -21.319 -2.352 1.00 0.00 C ATOM 1620 OD1 ASN A 104 6.848 -21.847 -3.247 1.00 0.00 O ATOM 1621 ND2 ASN A 104 8.590 -21.839 -1.819 1.00 0.00 N ATOM 0 H ASN A 104 4.564 -20.315 0.213 1.00 0.00 H new ATOM 0 HA ASN A 104 6.573 -21.220 -0.057 1.00 0.00 H new ATOM 0 HB2 ASN A 104 6.284 -19.530 -2.343 1.00 0.00 H new ATOM 0 HB3 ASN A 104 7.920 -19.291 -1.761 1.00 0.00 H new ATOM 0 HD21 ASN A 104 8.948 -22.732 -2.157 1.00 0.00 H new ATOM 0 HD22 ASN A 104 9.078 -21.344 -1.072 1.00 0.00 H new ATOM 1628 N ASN A 105 8.583 -20.091 1.052 1.00 0.00 N ATOM 1629 CA ASN A 105 9.571 -19.493 1.932 1.00 0.00 C ATOM 1630 C ASN A 105 10.616 -18.755 1.092 1.00 0.00 C ATOM 1631 O ASN A 105 10.878 -19.131 -0.049 1.00 0.00 O ATOM 1632 CB ASN A 105 10.294 -20.561 2.755 1.00 0.00 C ATOM 1633 CG ASN A 105 11.481 -21.139 1.981 1.00 0.00 C ATOM 1634 OD1 ASN A 105 12.629 -20.794 2.206 1.00 0.00 O ATOM 1635 ND2 ASN A 105 11.140 -22.036 1.060 1.00 0.00 N ATOM 0 H ASN A 105 8.762 -21.066 0.810 1.00 0.00 H new ATOM 0 HA ASN A 105 9.053 -18.809 2.604 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.643 -20.128 3.693 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.599 -21.360 3.012 1.00 0.00 H new ATOM 0 HD21 ASN A 105 11.860 -22.481 0.490 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.159 -22.279 0.923 1.00 0.00 H new ATOM 1642 N GLN A 106 11.185 -17.718 1.690 1.00 0.00 N ATOM 1643 CA GLN A 106 12.195 -16.925 1.011 1.00 0.00 C ATOM 1644 C GLN A 106 12.376 -15.580 1.717 1.00 0.00 C ATOM 1645 O GLN A 106 11.520 -14.703 1.619 1.00 0.00 O ATOM 1646 CB GLN A 106 11.838 -16.727 -0.463 1.00 0.00 C ATOM 1647 CG GLN A 106 12.753 -17.556 -1.365 1.00 0.00 C ATOM 1648 CD GLN A 106 14.177 -16.994 -1.367 1.00 0.00 C ATOM 1649 OE1 GLN A 106 14.467 -15.971 -1.965 1.00 0.00 O ATOM 1650 NE2 GLN A 106 15.045 -17.718 -0.666 1.00 0.00 N ATOM 0 H GLN A 106 10.965 -17.409 2.637 1.00 0.00 H new ATOM 0 HA GLN A 106 13.141 -17.465 1.052 1.00 0.00 H new ATOM 0 HB2 GLN A 106 10.800 -17.013 -0.631 1.00 0.00 H new ATOM 0 HB3 GLN A 106 11.924 -15.672 -0.723 1.00 0.00 H new ATOM 0 HG2 GLN A 106 12.767 -18.591 -1.022 1.00 0.00 H new ATOM 0 HG3 GLN A 106 12.359 -17.562 -2.381 1.00 0.00 H new ATOM 0 HE21 GLN A 106 14.735 -18.565 -0.189 1.00 0.00 H new ATOM 0 HE22 GLN A 106 16.021 -17.426 -0.605 1.00 0.00 H new ATOM 1659 N LEU A 107 13.497 -15.459 2.414 1.00 0.00 N ATOM 1660 CA LEU A 107 13.801 -14.236 3.136 1.00 0.00 C ATOM 1661 C LEU A 107 14.699 -13.348 2.272 1.00 0.00 C ATOM 1662 O LEU A 107 14.901 -13.627 1.091 1.00 0.00 O ATOM 1663 CB LEU A 107 14.393 -14.557 4.510 1.00 0.00 C ATOM 1664 CG LEU A 107 13.429 -14.469 5.694 1.00 0.00 C ATOM 1665 CD1 LEU A 107 13.710 -15.573 6.714 1.00 0.00 C ATOM 1666 CD2 LEU A 107 13.467 -13.077 6.329 1.00 0.00 C ATOM 0 H LEU A 107 14.205 -16.188 2.494 1.00 0.00 H new ATOM 0 HA LEU A 107 12.888 -13.673 3.332 1.00 0.00 H new ATOM 0 HB2 LEU A 107 14.807 -15.565 4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 107 15.225 -13.876 4.693 1.00 0.00 H new ATOM 0 HG LEU A 107 12.416 -14.626 5.322 1.00 0.00 H new ATOM 0 HD11 LEU A 107 13.010 -15.487 7.545 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.591 -16.547 6.239 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.730 -15.474 7.086 1.00 0.00 H new ATOM 0 HD21 LEU A 107 12.773 -13.041 7.168 1.00 0.00 H new ATOM 0 HD22 LEU A 107 14.476 -12.866 6.683 1.00 0.00 H new ATOM 0 HD23 LEU A 107 13.179 -12.331 5.588 1.00 0.00 H new ATOM 1678 N VAL A 108 15.214 -12.298 2.894 1.00 0.00 N ATOM 1679 CA VAL A 108 16.086 -11.368 2.196 1.00 0.00 C ATOM 1680 C VAL A 108 17.435 -11.302 2.916 1.00 0.00 C ATOM 1681 O VAL A 108 17.490 -11.355 4.143 1.00 0.00 O ATOM 1682 CB VAL A 108 15.405 -10.003 2.076 1.00 0.00 C ATOM 1683 CG1 VAL A 108 16.399 -8.934 1.617 1.00 0.00 C ATOM 1684 CG2 VAL A 108 14.201 -10.072 1.134 1.00 0.00 C ATOM 0 H VAL A 108 15.044 -12.070 3.874 1.00 0.00 H new ATOM 0 HA VAL A 108 16.277 -11.712 1.179 1.00 0.00 H new ATOM 0 HB VAL A 108 15.042 -9.721 3.064 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.890 -7.973 1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 108 17.211 -8.857 2.340 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.805 -9.209 0.644 1.00 0.00 H new ATOM 0 HG21 VAL A 108 13.735 -9.089 1.066 1.00 0.00 H new ATOM 0 HG22 VAL A 108 14.531 -10.386 0.144 1.00 0.00 H new ATOM 0 HG23 VAL A 108 13.478 -10.790 1.520 1.00 0.00 H new ATOM 1694 N SER A 109 18.488 -11.188 2.121 1.00 0.00 N ATOM 1695 CA SER A 109 19.833 -11.114 2.667 1.00 0.00 C ATOM 1696 C SER A 109 20.155 -9.675 3.073 1.00 0.00 C ATOM 1697 O SER A 109 19.617 -8.729 2.499 1.00 0.00 O ATOM 1698 CB SER A 109 20.865 -11.625 1.659 1.00 0.00 C ATOM 1699 OG SER A 109 20.846 -13.046 1.550 1.00 0.00 O ATOM 0 H SER A 109 18.438 -11.145 1.103 1.00 0.00 H new ATOM 0 HA SER A 109 19.879 -11.752 3.549 1.00 0.00 H new ATOM 0 HB2 SER A 109 20.667 -11.184 0.682 1.00 0.00 H new ATOM 0 HB3 SER A 109 21.860 -11.298 1.961 1.00 0.00 H new ATOM 0 HG SER A 109 21.517 -13.333 0.896 1.00 0.00 H new ATOM 1705 N GLY A 110 21.031 -9.554 4.059 1.00 0.00 N ATOM 1706 CA GLY A 110 21.431 -8.245 4.549 1.00 0.00 C ATOM 1707 C GLY A 110 21.591 -7.254 3.395 1.00 0.00 C ATOM 1708 O GLY A 110 22.615 -7.249 2.714 1.00 0.00 O ATOM 0 H GLY A 110 21.475 -10.341 4.532 1.00 0.00 H new ATOM 0 HA2 GLY A 110 20.686 -7.873 5.252 1.00 0.00 H new ATOM 0 HA3 GLY A 110 22.371 -8.328 5.095 1.00 0.00 H new ATOM 1712 N PRO A 111 20.536 -6.416 3.206 1.00 0.00 N ATOM 1713 CA PRO A 111 20.550 -5.422 2.146 1.00 0.00 C ATOM 1714 C PRO A 111 21.462 -4.248 2.508 1.00 0.00 C ATOM 1715 O PRO A 111 21.890 -4.120 3.654 1.00 0.00 O ATOM 1716 CB PRO A 111 19.097 -5.014 1.971 1.00 0.00 C ATOM 1717 CG PRO A 111 18.386 -5.444 3.244 1.00 0.00 C ATOM 1718 CD PRO A 111 19.307 -6.394 3.993 1.00 0.00 C ATOM 0 HA PRO A 111 20.956 -5.808 1.211 1.00 0.00 H new ATOM 0 HB2 PRO A 111 19.009 -3.938 1.819 1.00 0.00 H new ATOM 0 HB3 PRO A 111 18.659 -5.496 1.097 1.00 0.00 H new ATOM 0 HG2 PRO A 111 18.149 -4.577 3.860 1.00 0.00 H new ATOM 0 HG3 PRO A 111 17.442 -5.935 3.007 1.00 0.00 H new ATOM 0 HD2 PRO A 111 19.494 -6.046 5.009 1.00 0.00 H new ATOM 0 HD3 PRO A 111 18.870 -7.389 4.072 1.00 0.00 H new ATOM 1726 N SER A 112 21.732 -3.421 1.509 1.00 0.00 N ATOM 1727 CA SER A 112 22.585 -2.262 1.707 1.00 0.00 C ATOM 1728 C SER A 112 22.277 -1.610 3.056 1.00 0.00 C ATOM 1729 O SER A 112 23.148 -1.524 3.921 1.00 0.00 O ATOM 1730 CB SER A 112 22.408 -1.247 0.575 1.00 0.00 C ATOM 1731 OG SER A 112 21.035 -0.957 0.328 1.00 0.00 O ATOM 0 H SER A 112 21.375 -3.531 0.560 1.00 0.00 H new ATOM 0 HA SER A 112 23.622 -2.596 1.700 1.00 0.00 H new ATOM 0 HB2 SER A 112 22.933 -0.326 0.828 1.00 0.00 H new ATOM 0 HB3 SER A 112 22.866 -1.635 -0.335 1.00 0.00 H new ATOM 0 HG SER A 112 20.964 -0.304 -0.400 1.00 0.00 H new ATOM 1737 N SER A 113 21.036 -1.168 3.194 1.00 0.00 N ATOM 1738 CA SER A 113 20.602 -0.527 4.424 1.00 0.00 C ATOM 1739 C SER A 113 20.511 -1.560 5.549 1.00 0.00 C ATOM 1740 O SER A 113 21.215 -1.455 6.552 1.00 0.00 O ATOM 1741 CB SER A 113 19.255 0.173 4.235 1.00 0.00 C ATOM 1742 OG SER A 113 19.205 1.427 4.909 1.00 0.00 O ATOM 0 H SER A 113 20.317 -1.241 2.474 1.00 0.00 H new ATOM 0 HA SER A 113 21.339 0.230 4.694 1.00 0.00 H new ATOM 0 HB2 SER A 113 19.072 0.326 3.171 1.00 0.00 H new ATOM 0 HB3 SER A 113 18.457 -0.470 4.606 1.00 0.00 H new ATOM 0 HG SER A 113 18.330 1.843 4.762 1.00 0.00 H new ATOM 1748 N GLY A 114 19.637 -2.534 5.344 1.00 0.00 N ATOM 1749 CA GLY A 114 19.444 -3.585 6.329 1.00 0.00 C ATOM 1750 C GLY A 114 18.802 -3.032 7.603 1.00 0.00 C ATOM 1751 O GLY A 114 17.729 -3.478 8.006 1.00 0.00 O ATOM 0 H GLY A 114 19.055 -2.618 4.511 1.00 0.00 H new ATOM 0 HA2 GLY A 114 18.813 -4.369 5.910 1.00 0.00 H new ATOM 0 HA3 GLY A 114 20.403 -4.043 6.570 1.00 0.00 H new TER 1755 GLY A 114