USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=26 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 Set 1.1: A 106 GLN : amide:sc= -0.598 K(o=-1.1,f=-2.2!) USER MOD Set 1.2: A 109 SER OG : rot -170:sc= -0.548 USER MOD Set 2.1: A 104 ASN : amide:sc= 0 X(o=-0.2,f=-0.2) USER MOD Set 2.2: A 105 ASN :FLIP amide:sc= -0.201 F(o=-0.76,f=-0.2) USER MOD Set 3.1: A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 73 SER OG : rot 130:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0817 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= -0.0183 X(o=-0.018,f=-0.36) USER MOD Single : A 14 SER OG : rot -110:sc= -1.14 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -0.0124 K(o=-0.012,f=-1.1) USER MOD Single : A 25 GLN : amide:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 27 ASN :FLIP amide:sc= -0.56 F(o=-3.4!,f=-0.56) USER MOD Single : A 31 SER OG : rot -150:sc= -1.88 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 149:sc= -2.02 (180deg=-3.75!) USER MOD Single : A 45 LYS NZ :NH3+ 155:sc= -0.0454 (180deg=-0.365) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0347 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= -3.1! C(o=-3.1!,f=-3.7!) USER MOD Single : A 57 CYS SG : rot 150:sc= -0.268 USER MOD Single : A 63 MET CE :methyl -138:sc= -1.88 (180deg=-5.53!) USER MOD Single : A 68 SER OG : rot 180:sc= -0.198 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 120:sc= -0.285 USER MOD Single : A 80 MET CE :methyl -148:sc= -1.03 (180deg=-3.07!) USER MOD Single : A 86 SER OG : rot 40:sc= -0.99 USER MOD Single : A 91 LYS NZ :NH3+ 170:sc= -0.29 (180deg=-0.514) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 67:sc= 0.0752 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.451 2.066 -14.656 1.00 0.00 N ATOM 2 CA GLY A 1 -3.410 1.110 -14.995 1.00 0.00 C ATOM 3 C GLY A 1 -2.059 1.807 -15.163 1.00 0.00 C ATOM 4 O GLY A 1 -1.444 2.222 -14.182 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.358 1.568 -14.547 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.208 2.542 -13.764 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.533 2.773 -15.414 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.338 0.353 -14.214 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.673 0.592 -15.917 1.00 0.00 H new ATOM 8 N SER A 2 -1.636 1.914 -16.414 1.00 0.00 N ATOM 9 CA SER A 2 -0.368 2.553 -16.723 1.00 0.00 C ATOM 10 C SER A 2 -0.416 3.158 -18.128 1.00 0.00 C ATOM 11 O SER A 2 -0.004 2.521 -19.096 1.00 0.00 O ATOM 12 CB SER A 2 0.791 1.561 -16.612 1.00 0.00 C ATOM 13 OG SER A 2 2.052 2.187 -16.833 1.00 0.00 O ATOM 0 H SER A 2 -2.149 1.569 -17.225 1.00 0.00 H new ATOM 0 HA SER A 2 -0.200 3.348 -15.997 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.782 1.102 -15.623 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.652 0.759 -17.337 1.00 0.00 H new ATOM 0 HG SER A 2 2.766 1.521 -16.752 1.00 0.00 H new ATOM 19 N SER A 3 -0.924 4.380 -18.195 1.00 0.00 N ATOM 20 CA SER A 3 -1.031 5.077 -19.465 1.00 0.00 C ATOM 21 C SER A 3 -0.798 6.575 -19.261 1.00 0.00 C ATOM 22 O SER A 3 -0.954 7.086 -18.152 1.00 0.00 O ATOM 23 CB SER A 3 -2.396 4.835 -20.113 1.00 0.00 C ATOM 24 OG SER A 3 -2.578 5.626 -21.284 1.00 0.00 O ATOM 0 H SER A 3 -1.266 4.905 -17.390 1.00 0.00 H new ATOM 0 HA SER A 3 -0.266 4.685 -20.136 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.494 3.780 -20.369 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.184 5.063 -19.395 1.00 0.00 H new ATOM 0 HG SER A 3 -3.460 5.442 -21.669 1.00 0.00 H new ATOM 30 N GLY A 4 -0.430 7.238 -20.347 1.00 0.00 N ATOM 31 CA GLY A 4 -0.174 8.668 -20.301 1.00 0.00 C ATOM 32 C GLY A 4 1.328 8.956 -20.291 1.00 0.00 C ATOM 33 O GLY A 4 2.052 8.469 -19.424 1.00 0.00 O ATOM 0 H GLY A 4 -0.303 6.811 -21.265 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.635 9.151 -21.162 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.636 9.095 -19.411 1.00 0.00 H new ATOM 37 N SER A 5 1.753 9.747 -21.266 1.00 0.00 N ATOM 38 CA SER A 5 3.156 10.106 -21.381 1.00 0.00 C ATOM 39 C SER A 5 3.324 11.242 -22.393 1.00 0.00 C ATOM 40 O SER A 5 2.960 11.098 -23.559 1.00 0.00 O ATOM 41 CB SER A 5 4.001 8.900 -21.793 1.00 0.00 C ATOM 42 OG SER A 5 5.323 8.968 -21.263 1.00 0.00 O ATOM 0 H SER A 5 1.150 10.149 -21.983 1.00 0.00 H new ATOM 0 HA SER A 5 3.504 10.443 -20.404 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.519 7.985 -21.449 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.049 8.845 -22.881 1.00 0.00 H new ATOM 0 HG SER A 5 5.830 8.179 -21.547 1.00 0.00 H new ATOM 48 N SER A 6 3.876 12.345 -21.909 1.00 0.00 N ATOM 49 CA SER A 6 4.097 13.505 -22.756 1.00 0.00 C ATOM 50 C SER A 6 4.724 14.637 -21.940 1.00 0.00 C ATOM 51 O SER A 6 4.527 14.717 -20.729 1.00 0.00 O ATOM 52 CB SER A 6 2.791 13.974 -23.400 1.00 0.00 C ATOM 53 OG SER A 6 2.923 14.153 -24.807 1.00 0.00 O ATOM 0 H SER A 6 4.177 12.460 -20.941 1.00 0.00 H new ATOM 0 HA SER A 6 4.782 13.220 -23.555 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.006 13.245 -23.200 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.478 14.913 -22.943 1.00 0.00 H new ATOM 0 HG SER A 6 2.067 14.451 -25.181 1.00 0.00 H new ATOM 59 N GLY A 7 5.466 15.485 -22.637 1.00 0.00 N ATOM 60 CA GLY A 7 6.122 16.610 -21.993 1.00 0.00 C ATOM 61 C GLY A 7 7.144 16.130 -20.960 1.00 0.00 C ATOM 62 O GLY A 7 6.777 15.523 -19.955 1.00 0.00 O ATOM 0 H GLY A 7 5.627 15.415 -23.642 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.619 17.224 -22.744 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.377 17.241 -21.507 1.00 0.00 H new ATOM 66 N ASP A 8 8.405 16.420 -21.243 1.00 0.00 N ATOM 67 CA ASP A 8 9.482 16.025 -20.351 1.00 0.00 C ATOM 68 C ASP A 8 10.173 17.277 -19.808 1.00 0.00 C ATOM 69 O ASP A 8 11.008 17.874 -20.486 1.00 0.00 O ATOM 70 CB ASP A 8 10.530 15.190 -21.089 1.00 0.00 C ATOM 71 CG ASP A 8 11.082 15.826 -22.367 1.00 0.00 C ATOM 72 OD1 ASP A 8 10.344 15.807 -23.375 1.00 0.00 O ATOM 73 OD2 ASP A 8 12.230 16.318 -22.305 1.00 0.00 O ATOM 0 H ASP A 8 8.705 16.924 -22.077 1.00 0.00 H new ATOM 0 HA ASP A 8 9.051 15.432 -19.544 1.00 0.00 H new ATOM 0 HB2 ASP A 8 11.360 14.995 -20.411 1.00 0.00 H new ATOM 0 HB3 ASP A 8 10.091 14.225 -21.342 1.00 0.00 H new ATOM 78 N ASP A 9 9.799 17.639 -18.590 1.00 0.00 N ATOM 79 CA ASP A 9 10.372 18.810 -17.947 1.00 0.00 C ATOM 80 C ASP A 9 9.863 18.897 -16.507 1.00 0.00 C ATOM 81 O ASP A 9 8.664 18.772 -16.260 1.00 0.00 O ATOM 82 CB ASP A 9 9.961 20.093 -18.673 1.00 0.00 C ATOM 83 CG ASP A 9 11.035 21.182 -18.719 1.00 0.00 C ATOM 84 OD1 ASP A 9 11.671 21.397 -17.664 1.00 0.00 O ATOM 85 OD2 ASP A 9 11.196 21.774 -19.808 1.00 0.00 O ATOM 0 H ASP A 9 9.106 17.142 -18.031 1.00 0.00 H new ATOM 0 HA ASP A 9 11.457 18.712 -17.974 1.00 0.00 H new ATOM 0 HB2 ASP A 9 9.678 19.840 -19.695 1.00 0.00 H new ATOM 0 HB3 ASP A 9 9.074 20.499 -18.187 1.00 0.00 H new ATOM 90 N ASN A 10 10.799 19.111 -15.594 1.00 0.00 N ATOM 91 CA ASN A 10 10.459 19.216 -14.185 1.00 0.00 C ATOM 92 C ASN A 10 9.459 20.357 -13.990 1.00 0.00 C ATOM 93 O ASN A 10 8.568 20.269 -13.146 1.00 0.00 O ATOM 94 CB ASN A 10 11.698 19.523 -13.342 1.00 0.00 C ATOM 95 CG ASN A 10 12.541 18.264 -13.127 1.00 0.00 C ATOM 96 OD1 ASN A 10 12.047 17.209 -12.766 1.00 0.00 O ATOM 97 ND2 ASN A 10 13.838 18.434 -13.368 1.00 0.00 N ATOM 0 H ASN A 10 11.792 19.215 -15.802 1.00 0.00 H new ATOM 0 HA ASN A 10 10.034 18.264 -13.868 1.00 0.00 H new ATOM 0 HB2 ASN A 10 12.298 20.287 -13.836 1.00 0.00 H new ATOM 0 HB3 ASN A 10 11.394 19.931 -12.378 1.00 0.00 H new ATOM 0 HD21 ASN A 10 14.485 17.654 -13.253 1.00 0.00 H new ATOM 0 HD22 ASN A 10 14.186 19.345 -13.668 1.00 0.00 H new ATOM 104 N GLU A 11 9.641 21.403 -14.784 1.00 0.00 N ATOM 105 CA GLU A 11 8.766 22.560 -14.708 1.00 0.00 C ATOM 106 C GLU A 11 7.311 22.141 -14.930 1.00 0.00 C ATOM 107 O GLU A 11 6.437 22.474 -14.131 1.00 0.00 O ATOM 108 CB GLU A 11 9.187 23.632 -15.715 1.00 0.00 C ATOM 109 CG GLU A 11 9.884 24.799 -15.014 1.00 0.00 C ATOM 110 CD GLU A 11 10.511 25.755 -16.032 1.00 0.00 C ATOM 111 OE1 GLU A 11 9.742 26.279 -16.866 1.00 0.00 O ATOM 112 OE2 GLU A 11 11.744 25.940 -15.952 1.00 0.00 O ATOM 0 H GLU A 11 10.381 21.473 -15.482 1.00 0.00 H new ATOM 0 HA GLU A 11 8.851 22.991 -13.710 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.857 23.196 -16.457 1.00 0.00 H new ATOM 0 HB3 GLU A 11 8.311 23.996 -16.251 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.165 25.339 -14.397 1.00 0.00 H new ATOM 0 HG3 GLU A 11 10.655 24.418 -14.345 1.00 0.00 H new ATOM 119 N ARG A 12 7.096 21.417 -16.018 1.00 0.00 N ATOM 120 CA ARG A 12 5.763 20.948 -16.355 1.00 0.00 C ATOM 121 C ARG A 12 5.272 19.946 -15.308 1.00 0.00 C ATOM 122 O ARG A 12 4.117 19.998 -14.888 1.00 0.00 O ATOM 123 CB ARG A 12 5.743 20.286 -17.734 1.00 0.00 C ATOM 124 CG ARG A 12 6.042 21.304 -18.836 1.00 0.00 C ATOM 125 CD ARG A 12 5.936 20.661 -20.220 1.00 0.00 C ATOM 126 NE ARG A 12 7.144 20.971 -21.016 1.00 0.00 N ATOM 127 CZ ARG A 12 7.506 22.208 -21.383 1.00 0.00 C ATOM 128 NH1 ARG A 12 6.754 23.259 -21.028 1.00 0.00 N ATOM 129 NH2 ARG A 12 8.619 22.394 -22.105 1.00 0.00 N ATOM 0 H ARG A 12 7.824 21.143 -16.678 1.00 0.00 H new ATOM 0 HA ARG A 12 5.102 21.814 -16.372 1.00 0.00 H new ATOM 0 HB2 ARG A 12 6.479 19.483 -17.766 1.00 0.00 H new ATOM 0 HB3 ARG A 12 4.768 19.831 -17.909 1.00 0.00 H new ATOM 0 HG2 ARG A 12 5.344 22.138 -18.764 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.043 21.713 -18.697 1.00 0.00 H new ATOM 0 HD2 ARG A 12 5.823 19.581 -20.121 1.00 0.00 H new ATOM 0 HD3 ARG A 12 5.048 21.029 -20.734 1.00 0.00 H new ATOM 0 HE ARG A 12 7.739 20.194 -21.304 1.00 0.00 H new ATOM 0 HH11 ARG A 12 5.906 23.117 -20.479 1.00 0.00 H new ATOM 0 HH12 ARG A 12 7.029 24.201 -21.307 1.00 0.00 H new ATOM 0 HH21 ARG A 12 9.191 21.594 -22.376 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.894 23.336 -22.384 1.00 0.00 H new ATOM 143 N LEU A 13 6.174 19.057 -14.918 1.00 0.00 N ATOM 144 CA LEU A 13 5.847 18.045 -13.929 1.00 0.00 C ATOM 145 C LEU A 13 5.312 18.725 -12.667 1.00 0.00 C ATOM 146 O LEU A 13 4.155 19.140 -12.624 1.00 0.00 O ATOM 147 CB LEU A 13 7.051 17.136 -13.674 1.00 0.00 C ATOM 148 CG LEU A 13 7.369 16.120 -14.773 1.00 0.00 C ATOM 149 CD1 LEU A 13 8.810 15.619 -14.656 1.00 0.00 C ATOM 150 CD2 LEU A 13 6.360 14.971 -14.766 1.00 0.00 C ATOM 0 H LEU A 13 7.131 19.017 -15.269 1.00 0.00 H new ATOM 0 HA LEU A 13 5.057 17.392 -14.299 1.00 0.00 H new ATOM 0 HB2 LEU A 13 7.929 17.764 -13.522 1.00 0.00 H new ATOM 0 HB3 LEU A 13 6.881 16.594 -12.744 1.00 0.00 H new ATOM 0 HG LEU A 13 7.280 16.620 -15.737 1.00 0.00 H new ATOM 0 HD11 LEU A 13 9.010 14.898 -15.449 1.00 0.00 H new ATOM 0 HD12 LEU A 13 9.496 16.461 -14.749 1.00 0.00 H new ATOM 0 HD13 LEU A 13 8.951 15.141 -13.687 1.00 0.00 H new ATOM 0 HD21 LEU A 13 6.609 14.263 -15.557 1.00 0.00 H new ATOM 0 HD22 LEU A 13 6.393 14.464 -13.802 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.358 15.366 -14.935 1.00 0.00 H new ATOM 162 N SER A 14 6.180 18.818 -11.670 1.00 0.00 N ATOM 163 CA SER A 14 5.809 19.440 -10.410 1.00 0.00 C ATOM 164 C SER A 14 4.643 18.682 -9.775 1.00 0.00 C ATOM 165 O SER A 14 4.844 17.868 -8.874 1.00 0.00 O ATOM 166 CB SER A 14 5.439 20.911 -10.611 1.00 0.00 C ATOM 167 OG SER A 14 5.644 21.335 -11.956 1.00 0.00 O ATOM 0 H SER A 14 7.139 18.473 -11.709 1.00 0.00 H new ATOM 0 HA SER A 14 6.669 19.397 -9.741 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.395 21.062 -10.339 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.036 21.530 -9.941 1.00 0.00 H new ATOM 0 HG SER A 14 6.404 21.953 -11.992 1.00 0.00 H new ATOM 173 N LYS A 15 3.449 18.975 -10.269 1.00 0.00 N ATOM 174 CA LYS A 15 2.250 18.330 -9.761 1.00 0.00 C ATOM 175 C LYS A 15 2.252 16.858 -10.178 1.00 0.00 C ATOM 176 O LYS A 15 1.588 16.031 -9.553 1.00 0.00 O ATOM 177 CB LYS A 15 1.001 19.094 -10.206 1.00 0.00 C ATOM 178 CG LYS A 15 -0.268 18.432 -9.665 1.00 0.00 C ATOM 179 CD LYS A 15 -0.854 17.454 -10.686 1.00 0.00 C ATOM 180 CE LYS A 15 -2.352 17.248 -10.450 1.00 0.00 C ATOM 181 NZ LYS A 15 -3.031 16.893 -11.716 1.00 0.00 N ATOM 0 H LYS A 15 3.286 19.650 -11.016 1.00 0.00 H new ATOM 0 HA LYS A 15 2.238 18.353 -8.671 1.00 0.00 H new ATOM 0 HB2 LYS A 15 1.056 20.124 -9.855 1.00 0.00 H new ATOM 0 HB3 LYS A 15 0.961 19.130 -11.295 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.041 17.904 -8.739 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -1.006 19.196 -9.423 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -0.690 17.834 -11.694 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.336 16.497 -10.617 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -2.505 16.459 -9.714 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -2.790 18.157 -10.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.047 16.757 -11.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.900 17.659 -12.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.624 16.013 -12.093 1.00 0.00 H new ATOM 195 N VAL A 16 3.005 16.575 -11.230 1.00 0.00 N ATOM 196 CA VAL A 16 3.102 15.217 -11.738 1.00 0.00 C ATOM 197 C VAL A 16 4.227 14.483 -11.006 1.00 0.00 C ATOM 198 O VAL A 16 4.018 13.394 -10.472 1.00 0.00 O ATOM 199 CB VAL A 16 3.291 15.238 -13.256 1.00 0.00 C ATOM 200 CG1 VAL A 16 3.201 13.826 -13.839 1.00 0.00 C ATOM 201 CG2 VAL A 16 2.278 16.172 -13.921 1.00 0.00 C ATOM 0 H VAL A 16 3.554 17.263 -11.745 1.00 0.00 H new ATOM 0 HA VAL A 16 2.178 14.671 -11.547 1.00 0.00 H new ATOM 0 HB VAL A 16 4.289 15.623 -13.465 1.00 0.00 H new ATOM 0 HG11 VAL A 16 3.339 13.869 -14.919 1.00 0.00 H new ATOM 0 HG12 VAL A 16 3.978 13.200 -13.399 1.00 0.00 H new ATOM 0 HG13 VAL A 16 2.223 13.401 -13.615 1.00 0.00 H new ATOM 0 HG21 VAL A 16 2.434 16.169 -15.000 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.267 15.830 -13.699 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.410 17.184 -13.538 1.00 0.00 H new ATOM 211 N GLU A 17 5.395 15.107 -11.004 1.00 0.00 N ATOM 212 CA GLU A 17 6.553 14.526 -10.346 1.00 0.00 C ATOM 213 C GLU A 17 6.188 14.071 -8.932 1.00 0.00 C ATOM 214 O GLU A 17 6.602 12.998 -8.495 1.00 0.00 O ATOM 215 CB GLU A 17 7.721 15.514 -10.319 1.00 0.00 C ATOM 216 CG GLU A 17 8.801 15.114 -11.327 1.00 0.00 C ATOM 217 CD GLU A 17 9.813 14.157 -10.695 1.00 0.00 C ATOM 218 OE1 GLU A 17 10.404 14.553 -9.667 1.00 0.00 O ATOM 219 OE2 GLU A 17 9.974 13.051 -11.254 1.00 0.00 O ATOM 0 H GLU A 17 5.565 16.010 -11.448 1.00 0.00 H new ATOM 0 HA GLU A 17 6.871 13.653 -10.917 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.359 16.517 -10.547 1.00 0.00 H new ATOM 0 HB3 GLU A 17 8.149 15.550 -9.317 1.00 0.00 H new ATOM 0 HG2 GLU A 17 8.338 14.640 -12.192 1.00 0.00 H new ATOM 0 HG3 GLU A 17 9.314 16.005 -11.688 1.00 0.00 H new ATOM 226 N LYS A 18 5.416 14.909 -8.256 1.00 0.00 N ATOM 227 CA LYS A 18 4.990 14.606 -6.900 1.00 0.00 C ATOM 228 C LYS A 18 4.033 13.413 -6.926 1.00 0.00 C ATOM 229 O LYS A 18 4.158 12.494 -6.117 1.00 0.00 O ATOM 230 CB LYS A 18 4.403 15.851 -6.232 1.00 0.00 C ATOM 231 CG LYS A 18 5.371 16.424 -5.195 1.00 0.00 C ATOM 232 CD LYS A 18 4.997 15.966 -3.784 1.00 0.00 C ATOM 233 CE LYS A 18 5.080 14.443 -3.662 1.00 0.00 C ATOM 234 NZ LYS A 18 5.426 14.052 -2.277 1.00 0.00 N ATOM 0 H LYS A 18 5.074 15.798 -8.622 1.00 0.00 H new ATOM 0 HA LYS A 18 5.844 14.317 -6.288 1.00 0.00 H new ATOM 0 HB2 LYS A 18 4.186 16.606 -6.988 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.457 15.599 -5.752 1.00 0.00 H new ATOM 0 HG2 LYS A 18 6.388 16.106 -5.427 1.00 0.00 H new ATOM 0 HG3 LYS A 18 5.358 17.513 -5.243 1.00 0.00 H new ATOM 0 HD2 LYS A 18 5.665 16.430 -3.058 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.987 16.299 -3.545 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.126 13.997 -3.945 1.00 0.00 H new ATOM 0 HE3 LYS A 18 5.829 14.057 -4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.478 13.015 -2.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.347 14.462 -2.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.696 14.404 -1.624 1.00 0.00 H new ATOM 248 N ALA A 19 3.098 13.465 -7.864 1.00 0.00 N ATOM 249 CA ALA A 19 2.120 12.400 -8.005 1.00 0.00 C ATOM 250 C ALA A 19 2.844 11.081 -8.282 1.00 0.00 C ATOM 251 O ALA A 19 2.730 10.131 -7.509 1.00 0.00 O ATOM 252 CB ALA A 19 1.126 12.762 -9.111 1.00 0.00 C ATOM 0 H ALA A 19 2.997 14.228 -8.533 1.00 0.00 H new ATOM 0 HA ALA A 19 1.552 12.277 -7.083 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.392 11.963 -9.217 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.617 13.690 -8.853 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.660 12.891 -10.052 1.00 0.00 H new ATOM 258 N ARG A 20 3.574 11.065 -9.388 1.00 0.00 N ATOM 259 CA ARG A 20 4.317 9.879 -9.777 1.00 0.00 C ATOM 260 C ARG A 20 4.946 9.219 -8.548 1.00 0.00 C ATOM 261 O ARG A 20 4.558 8.117 -8.164 1.00 0.00 O ATOM 262 CB ARG A 20 5.419 10.223 -10.782 1.00 0.00 C ATOM 263 CG ARG A 20 5.442 9.219 -11.936 1.00 0.00 C ATOM 264 CD ARG A 20 6.861 8.704 -12.186 1.00 0.00 C ATOM 265 NE ARG A 20 6.812 7.329 -12.731 1.00 0.00 N ATOM 266 CZ ARG A 20 7.896 6.589 -13.000 1.00 0.00 C ATOM 267 NH1 ARG A 20 9.120 7.086 -12.776 1.00 0.00 N ATOM 268 NH2 ARG A 20 7.756 5.351 -13.494 1.00 0.00 N ATOM 0 H ARG A 20 3.666 11.855 -10.027 1.00 0.00 H new ATOM 0 HA ARG A 20 3.616 9.189 -10.246 1.00 0.00 H new ATOM 0 HB2 ARG A 20 5.259 11.228 -11.173 1.00 0.00 H new ATOM 0 HB3 ARG A 20 6.386 10.227 -10.279 1.00 0.00 H new ATOM 0 HG2 ARG A 20 4.782 8.382 -11.708 1.00 0.00 H new ATOM 0 HG3 ARG A 20 5.058 9.690 -12.841 1.00 0.00 H new ATOM 0 HD2 ARG A 20 7.378 9.362 -12.884 1.00 0.00 H new ATOM 0 HD3 ARG A 20 7.430 8.715 -11.256 1.00 0.00 H new ATOM 0 HE ARG A 20 5.896 6.919 -12.913 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.227 8.028 -12.400 1.00 0.00 H new ATOM 0 HH12 ARG A 20 9.945 6.522 -12.981 1.00 0.00 H new ATOM 0 HH21 ARG A 20 6.824 4.972 -13.665 1.00 0.00 H new ATOM 0 HH22 ARG A 20 8.581 4.787 -13.699 1.00 0.00 H new ATOM 282 N GLN A 21 5.906 9.922 -7.965 1.00 0.00 N ATOM 283 CA GLN A 21 6.593 9.419 -6.787 1.00 0.00 C ATOM 284 C GLN A 21 5.586 8.822 -5.802 1.00 0.00 C ATOM 285 O GLN A 21 5.651 7.634 -5.487 1.00 0.00 O ATOM 286 CB GLN A 21 7.422 10.520 -6.124 1.00 0.00 C ATOM 287 CG GLN A 21 8.621 10.902 -6.994 1.00 0.00 C ATOM 288 CD GLN A 21 9.640 11.718 -6.196 1.00 0.00 C ATOM 289 OE1 GLN A 21 9.459 12.013 -5.026 1.00 0.00 O ATOM 290 NE2 GLN A 21 10.719 12.066 -6.892 1.00 0.00 N ATOM 0 H GLN A 21 6.225 10.836 -8.286 1.00 0.00 H new ATOM 0 HA GLN A 21 7.279 8.631 -7.098 1.00 0.00 H new ATOM 0 HB2 GLN A 21 6.798 11.397 -5.953 1.00 0.00 H new ATOM 0 HB3 GLN A 21 7.769 10.181 -5.148 1.00 0.00 H new ATOM 0 HG2 GLN A 21 9.095 10.000 -7.382 1.00 0.00 H new ATOM 0 HG3 GLN A 21 8.281 11.479 -7.854 1.00 0.00 H new ATOM 0 HE21 GLN A 21 10.808 11.786 -7.869 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.457 12.613 -6.449 1.00 0.00 H new ATOM 299 N LEU A 22 4.680 9.672 -5.342 1.00 0.00 N ATOM 300 CA LEU A 22 3.662 9.243 -4.398 1.00 0.00 C ATOM 301 C LEU A 22 3.155 7.856 -4.797 1.00 0.00 C ATOM 302 O LEU A 22 3.307 6.895 -4.044 1.00 0.00 O ATOM 303 CB LEU A 22 2.556 10.294 -4.289 1.00 0.00 C ATOM 304 CG LEU A 22 2.908 11.560 -3.506 1.00 0.00 C ATOM 305 CD1 LEU A 22 1.768 12.579 -3.568 1.00 0.00 C ATOM 306 CD2 LEU A 22 3.297 11.223 -2.065 1.00 0.00 C ATOM 0 H LEU A 22 4.630 10.656 -5.605 1.00 0.00 H new ATOM 0 HA LEU A 22 4.084 9.153 -3.397 1.00 0.00 H new ATOM 0 HB2 LEU A 22 2.258 10.585 -5.296 1.00 0.00 H new ATOM 0 HB3 LEU A 22 1.687 9.831 -3.821 1.00 0.00 H new ATOM 0 HG LEU A 22 3.777 12.021 -3.975 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.045 13.469 -3.003 1.00 0.00 H new ATOM 0 HD12 LEU A 22 1.580 12.852 -4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.866 12.143 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.543 12.141 -1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.463 10.726 -1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.163 10.561 -2.067 1.00 0.00 H new ATOM 318 N ARG A 23 2.564 7.795 -5.982 1.00 0.00 N ATOM 319 CA ARG A 23 2.034 6.541 -6.490 1.00 0.00 C ATOM 320 C ARG A 23 2.990 5.391 -6.167 1.00 0.00 C ATOM 321 O ARG A 23 2.562 4.336 -5.700 1.00 0.00 O ATOM 322 CB ARG A 23 1.820 6.607 -8.003 1.00 0.00 C ATOM 323 CG ARG A 23 0.698 7.585 -8.356 1.00 0.00 C ATOM 324 CD ARG A 23 0.124 7.285 -9.742 1.00 0.00 C ATOM 325 NE ARG A 23 1.221 7.163 -10.728 1.00 0.00 N ATOM 326 CZ ARG A 23 1.039 6.852 -12.019 1.00 0.00 C ATOM 327 NH1 ARG A 23 -0.197 6.630 -12.487 1.00 0.00 N ATOM 328 NH2 ARG A 23 2.093 6.763 -12.842 1.00 0.00 N ATOM 0 H ARG A 23 2.441 8.594 -6.604 1.00 0.00 H new ATOM 0 HA ARG A 23 1.073 6.366 -6.006 1.00 0.00 H new ATOM 0 HB2 ARG A 23 2.744 6.917 -8.491 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.575 5.615 -8.383 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.093 7.521 -7.609 1.00 0.00 H new ATOM 0 HG3 ARG A 23 1.079 8.606 -8.330 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.455 6.362 -9.713 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.559 8.080 -10.042 1.00 0.00 H new ATOM 0 HE ARG A 23 2.175 7.326 -10.405 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -0.999 6.698 -11.861 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -0.335 6.393 -13.469 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.034 6.932 -12.486 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.954 6.526 -13.824 1.00 0.00 H new ATOM 342 N GLU A 24 4.266 5.633 -6.428 1.00 0.00 N ATOM 343 CA GLU A 24 5.286 4.631 -6.170 1.00 0.00 C ATOM 344 C GLU A 24 5.312 4.269 -4.684 1.00 0.00 C ATOM 345 O GLU A 24 5.260 3.093 -4.327 1.00 0.00 O ATOM 346 CB GLU A 24 6.660 5.113 -6.641 1.00 0.00 C ATOM 347 CG GLU A 24 6.597 5.627 -8.081 1.00 0.00 C ATOM 348 CD GLU A 24 7.823 5.177 -8.878 1.00 0.00 C ATOM 349 OE1 GLU A 24 8.246 4.021 -8.664 1.00 0.00 O ATOM 350 OE2 GLU A 24 8.310 6.001 -9.682 1.00 0.00 O ATOM 0 H GLU A 24 4.617 6.509 -6.816 1.00 0.00 H new ATOM 0 HA GLU A 24 5.038 3.734 -6.738 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.016 5.906 -5.983 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.379 4.296 -6.574 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.691 5.260 -8.563 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.539 6.715 -8.080 1.00 0.00 H new ATOM 357 N GLN A 25 5.392 5.301 -3.858 1.00 0.00 N ATOM 358 CA GLN A 25 5.425 5.107 -2.418 1.00 0.00 C ATOM 359 C GLN A 25 4.182 4.343 -1.957 1.00 0.00 C ATOM 360 O GLN A 25 4.292 3.317 -1.288 1.00 0.00 O ATOM 361 CB GLN A 25 5.549 6.445 -1.687 1.00 0.00 C ATOM 362 CG GLN A 25 6.973 6.657 -1.170 1.00 0.00 C ATOM 363 CD GLN A 25 6.962 7.216 0.254 1.00 0.00 C ATOM 364 OE1 GLN A 25 7.283 6.539 1.217 1.00 0.00 O ATOM 365 NE2 GLN A 25 6.576 8.486 0.334 1.00 0.00 N ATOM 0 H GLN A 25 5.435 6.275 -4.158 1.00 0.00 H new ATOM 0 HA GLN A 25 6.305 4.513 -2.171 1.00 0.00 H new ATOM 0 HB2 GLN A 25 5.278 7.258 -2.361 1.00 0.00 H new ATOM 0 HB3 GLN A 25 4.847 6.474 -0.853 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.515 5.712 -1.189 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.505 7.343 -1.830 1.00 0.00 H new ATOM 0 HE21 GLN A 25 6.321 8.996 -0.512 1.00 0.00 H new ATOM 0 HE22 GLN A 25 6.535 8.951 1.241 1.00 0.00 H new ATOM 374 N VAL A 26 3.027 4.874 -2.332 1.00 0.00 N ATOM 375 CA VAL A 26 1.765 4.256 -1.965 1.00 0.00 C ATOM 376 C VAL A 26 1.757 2.801 -2.440 1.00 0.00 C ATOM 377 O VAL A 26 1.510 1.889 -1.652 1.00 0.00 O ATOM 378 CB VAL A 26 0.599 5.073 -2.526 1.00 0.00 C ATOM 379 CG1 VAL A 26 -0.737 4.377 -2.258 1.00 0.00 C ATOM 380 CG2 VAL A 26 0.602 6.493 -1.958 1.00 0.00 C ATOM 0 H VAL A 26 2.939 5.726 -2.886 1.00 0.00 H new ATOM 0 HA VAL A 26 1.646 4.246 -0.882 1.00 0.00 H new ATOM 0 HB VAL A 26 0.728 5.144 -3.606 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -1.549 4.978 -2.667 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.738 3.396 -2.733 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.877 4.260 -1.183 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.237 7.053 -2.373 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.509 6.451 -0.873 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.536 6.989 -2.223 1.00 0.00 H new ATOM 390 N ASN A 27 2.033 2.630 -3.724 1.00 0.00 N ATOM 391 CA ASN A 27 2.061 1.301 -4.313 1.00 0.00 C ATOM 392 C ASN A 27 2.957 0.393 -3.468 1.00 0.00 C ATOM 393 O ASN A 27 2.475 -0.542 -2.831 1.00 0.00 O ATOM 394 CB ASN A 27 2.630 1.340 -5.732 1.00 0.00 C ATOM 395 CG ASN A 27 2.697 -0.065 -6.335 1.00 0.00 C ATOM 396 OD1 ASN A 27 3.735 -0.784 -5.917 1.00 0.00 O flip ATOM 397 ND2 ASN A 27 1.862 -0.469 -7.126 1.00 0.00 N flip ATOM 0 H ASN A 27 2.239 3.389 -4.373 1.00 0.00 H new ATOM 0 HA ASN A 27 1.039 0.924 -4.345 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.009 1.980 -6.359 1.00 0.00 H new ATOM 0 HB3 ASN A 27 3.627 1.781 -5.716 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.089 0.136 -7.405 1.00 0.00 H new ATOM 0 HD22 ASN A 27 1.936 -1.412 -7.509 1.00 0.00 H new ATOM 404 N ASP A 28 4.246 0.700 -3.491 1.00 0.00 N ATOM 405 CA ASP A 28 5.214 -0.076 -2.735 1.00 0.00 C ATOM 406 C ASP A 28 4.718 -0.242 -1.298 1.00 0.00 C ATOM 407 O ASP A 28 4.690 -1.353 -0.771 1.00 0.00 O ATOM 408 CB ASP A 28 6.571 0.629 -2.689 1.00 0.00 C ATOM 409 CG ASP A 28 7.782 -0.287 -2.873 1.00 0.00 C ATOM 410 OD1 ASP A 28 7.764 -1.063 -3.853 1.00 0.00 O ATOM 411 OD2 ASP A 28 8.699 -0.192 -2.029 1.00 0.00 O ATOM 0 H ASP A 28 4.642 1.476 -4.022 1.00 0.00 H new ATOM 0 HA ASP A 28 5.327 -1.043 -3.225 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.592 1.395 -3.465 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.665 1.142 -1.732 1.00 0.00 H new ATOM 416 N LEU A 29 4.339 0.880 -0.704 1.00 0.00 N ATOM 417 CA LEU A 29 3.845 0.874 0.663 1.00 0.00 C ATOM 418 C LEU A 29 2.936 -0.340 0.867 1.00 0.00 C ATOM 419 O LEU A 29 3.285 -1.266 1.597 1.00 0.00 O ATOM 420 CB LEU A 29 3.175 2.208 0.997 1.00 0.00 C ATOM 421 CG LEU A 29 2.097 2.164 2.082 1.00 0.00 C ATOM 422 CD1 LEU A 29 2.699 1.791 3.438 1.00 0.00 C ATOM 423 CD2 LEU A 29 1.324 3.483 2.141 1.00 0.00 C ATOM 0 H LEU A 29 4.364 1.800 -1.144 1.00 0.00 H new ATOM 0 HA LEU A 29 4.672 0.775 1.366 1.00 0.00 H new ATOM 0 HB2 LEU A 29 3.947 2.912 1.308 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.729 2.606 0.086 1.00 0.00 H new ATOM 0 HG LEU A 29 1.382 1.384 1.822 1.00 0.00 H new ATOM 0 HD11 LEU A 29 1.912 1.767 4.191 1.00 0.00 H new ATOM 0 HD12 LEU A 29 3.167 0.809 3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.448 2.531 3.720 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.564 3.425 2.920 1.00 0.00 H new ATOM 0 HD22 LEU A 29 2.012 4.298 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.844 3.667 1.180 1.00 0.00 H new ATOM 435 N PHE A 30 1.787 -0.295 0.208 1.00 0.00 N ATOM 436 CA PHE A 30 0.825 -1.380 0.307 1.00 0.00 C ATOM 437 C PHE A 30 1.496 -2.732 0.061 1.00 0.00 C ATOM 438 O PHE A 30 1.215 -3.705 0.758 1.00 0.00 O ATOM 439 CB PHE A 30 -0.230 -1.142 -0.775 1.00 0.00 C ATOM 440 CG PHE A 30 -1.147 0.052 -0.499 1.00 0.00 C ATOM 441 CD1 PHE A 30 -1.590 0.291 0.765 1.00 0.00 C ATOM 442 CD2 PHE A 30 -1.519 0.873 -1.517 1.00 0.00 C ATOM 443 CE1 PHE A 30 -2.440 1.399 1.021 1.00 0.00 C ATOM 444 CE2 PHE A 30 -2.369 1.981 -1.260 1.00 0.00 C ATOM 445 CZ PHE A 30 -2.812 2.220 0.003 1.00 0.00 C ATOM 0 H PHE A 30 1.501 0.475 -0.396 1.00 0.00 H new ATOM 0 HA PHE A 30 0.387 -1.399 1.305 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.272 -0.988 -1.730 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.840 -2.040 -0.877 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.295 -0.362 1.573 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.168 0.682 -2.521 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.791 1.590 2.024 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.664 2.634 -2.068 1.00 0.00 H new ATOM 0 HZ PHE A 30 -3.460 3.062 0.198 1.00 0.00 H new ATOM 455 N SER A 31 2.371 -2.750 -0.935 1.00 0.00 N ATOM 456 CA SER A 31 3.084 -3.967 -1.282 1.00 0.00 C ATOM 457 C SER A 31 3.902 -4.455 -0.084 1.00 0.00 C ATOM 458 O SER A 31 3.773 -5.605 0.333 1.00 0.00 O ATOM 459 CB SER A 31 3.994 -3.746 -2.492 1.00 0.00 C ATOM 460 OG SER A 31 3.584 -2.626 -3.271 1.00 0.00 O ATOM 0 H SER A 31 2.602 -1.941 -1.512 1.00 0.00 H new ATOM 0 HA SER A 31 2.351 -4.729 -1.547 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.019 -3.596 -2.152 1.00 0.00 H new ATOM 0 HB3 SER A 31 3.993 -4.641 -3.115 1.00 0.00 H new ATOM 0 HG SER A 31 3.827 -2.773 -4.209 1.00 0.00 H new ATOM 466 N ARG A 32 4.725 -3.556 0.435 1.00 0.00 N ATOM 467 CA ARG A 32 5.564 -3.880 1.576 1.00 0.00 C ATOM 468 C ARG A 32 4.714 -4.449 2.714 1.00 0.00 C ATOM 469 O ARG A 32 4.908 -5.592 3.127 1.00 0.00 O ATOM 470 CB ARG A 32 6.314 -2.645 2.077 1.00 0.00 C ATOM 471 CG ARG A 32 7.827 -2.867 2.033 1.00 0.00 C ATOM 472 CD ARG A 32 8.518 -2.165 3.204 1.00 0.00 C ATOM 473 NE ARG A 32 9.352 -3.131 3.953 1.00 0.00 N ATOM 474 CZ ARG A 32 10.063 -2.821 5.046 1.00 0.00 C ATOM 475 NH1 ARG A 32 10.046 -1.569 5.523 1.00 0.00 N ATOM 476 NH2 ARG A 32 10.790 -3.763 5.661 1.00 0.00 N ATOM 0 H ARG A 32 4.829 -2.603 0.086 1.00 0.00 H new ATOM 0 HA ARG A 32 6.291 -4.625 1.253 1.00 0.00 H new ATOM 0 HB2 ARG A 32 6.051 -1.782 1.465 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.006 -2.417 3.097 1.00 0.00 H new ATOM 0 HG2 ARG A 32 8.043 -3.935 2.066 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.226 -2.490 1.091 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.137 -1.348 2.834 1.00 0.00 H new ATOM 0 HD3 ARG A 32 7.772 -1.726 3.867 1.00 0.00 H new ATOM 0 HE ARG A 32 9.388 -4.093 3.616 1.00 0.00 H new ATOM 0 HH11 ARG A 32 9.492 -0.852 5.054 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.587 -1.333 6.355 1.00 0.00 H new ATOM 0 HH21 ARG A 32 10.802 -4.716 5.297 1.00 0.00 H new ATOM 0 HH22 ARG A 32 11.331 -3.527 6.493 1.00 0.00 H new ATOM 490 N LYS A 33 3.791 -3.626 3.189 1.00 0.00 N ATOM 491 CA LYS A 33 2.911 -4.033 4.272 1.00 0.00 C ATOM 492 C LYS A 33 2.304 -5.398 3.944 1.00 0.00 C ATOM 493 O LYS A 33 2.478 -6.356 4.696 1.00 0.00 O ATOM 494 CB LYS A 33 1.869 -2.948 4.552 1.00 0.00 C ATOM 495 CG LYS A 33 2.538 -1.651 5.011 1.00 0.00 C ATOM 496 CD LYS A 33 2.978 -1.749 6.473 1.00 0.00 C ATOM 497 CE LYS A 33 3.907 -0.592 6.845 1.00 0.00 C ATOM 498 NZ LYS A 33 4.278 -0.663 8.276 1.00 0.00 N ATOM 0 H LYS A 33 3.633 -2.679 2.844 1.00 0.00 H new ATOM 0 HA LYS A 33 3.474 -4.148 5.198 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.283 -2.761 3.652 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.175 -3.294 5.318 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.402 -1.440 4.381 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.845 -0.818 4.891 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.102 -1.739 7.121 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.488 -2.698 6.640 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.805 -0.627 6.228 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.415 0.358 6.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 4.909 0.130 8.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 3.420 -0.607 8.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.767 -1.562 8.464 1.00 0.00 H new ATOM 512 N PHE A 34 1.603 -5.445 2.820 1.00 0.00 N ATOM 513 CA PHE A 34 0.970 -6.677 2.384 1.00 0.00 C ATOM 514 C PHE A 34 1.919 -7.867 2.540 1.00 0.00 C ATOM 515 O PHE A 34 1.478 -8.989 2.783 1.00 0.00 O ATOM 516 CB PHE A 34 0.628 -6.504 0.903 1.00 0.00 C ATOM 517 CG PHE A 34 0.144 -7.786 0.222 1.00 0.00 C ATOM 518 CD1 PHE A 34 -1.071 -8.308 0.540 1.00 0.00 C ATOM 519 CD2 PHE A 34 0.929 -8.403 -0.702 1.00 0.00 C ATOM 520 CE1 PHE A 34 -1.519 -9.498 -0.092 1.00 0.00 C ATOM 521 CE2 PHE A 34 0.481 -9.593 -1.334 1.00 0.00 C ATOM 522 CZ PHE A 34 -0.734 -10.115 -1.016 1.00 0.00 C ATOM 0 H PHE A 34 1.460 -4.649 2.199 1.00 0.00 H new ATOM 0 HA PHE A 34 0.083 -6.873 2.987 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.143 -5.740 0.806 1.00 0.00 H new ATOM 0 HB3 PHE A 34 1.509 -6.136 0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -1.695 -7.818 1.273 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.893 -7.988 -0.955 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -2.483 -9.913 0.161 1.00 0.00 H new ATOM 0 HE2 PHE A 34 1.105 -10.083 -2.067 1.00 0.00 H new ATOM 0 HZ PHE A 34 -1.076 -11.020 -1.497 1.00 0.00 H new ATOM 532 N GLY A 35 3.204 -7.581 2.395 1.00 0.00 N ATOM 533 CA GLY A 35 4.219 -8.613 2.518 1.00 0.00 C ATOM 534 C GLY A 35 4.025 -9.423 3.801 1.00 0.00 C ATOM 535 O GLY A 35 3.661 -10.597 3.750 1.00 0.00 O ATOM 0 H GLY A 35 3.566 -6.649 2.193 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.174 -9.277 1.655 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.209 -8.156 2.518 1.00 0.00 H new ATOM 539 N GLU A 36 4.278 -8.764 4.922 1.00 0.00 N ATOM 540 CA GLU A 36 4.136 -9.408 6.217 1.00 0.00 C ATOM 541 C GLU A 36 2.802 -10.153 6.296 1.00 0.00 C ATOM 542 O GLU A 36 2.710 -11.204 6.929 1.00 0.00 O ATOM 543 CB GLU A 36 4.264 -8.391 7.353 1.00 0.00 C ATOM 544 CG GLU A 36 3.486 -7.113 7.034 1.00 0.00 C ATOM 545 CD GLU A 36 3.328 -6.242 8.282 1.00 0.00 C ATOM 546 OE1 GLU A 36 2.865 -6.793 9.304 1.00 0.00 O ATOM 547 OE2 GLU A 36 3.673 -5.044 8.186 1.00 0.00 O ATOM 0 H GLU A 36 4.580 -7.791 4.961 1.00 0.00 H new ATOM 0 HA GLU A 36 4.942 -10.133 6.330 1.00 0.00 H new ATOM 0 HB2 GLU A 36 3.891 -8.827 8.280 1.00 0.00 H new ATOM 0 HB3 GLU A 36 5.315 -8.151 7.514 1.00 0.00 H new ATOM 0 HG2 GLU A 36 4.005 -6.551 6.257 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.503 -7.370 6.639 1.00 0.00 H new ATOM 554 N ALA A 37 1.801 -9.580 5.644 1.00 0.00 N ATOM 555 CA ALA A 37 0.476 -10.176 5.633 1.00 0.00 C ATOM 556 C ALA A 37 0.575 -11.618 5.132 1.00 0.00 C ATOM 557 O ALA A 37 -0.297 -12.439 5.414 1.00 0.00 O ATOM 558 CB ALA A 37 -0.460 -9.324 4.774 1.00 0.00 C ATOM 0 H ALA A 37 1.881 -8.709 5.119 1.00 0.00 H new ATOM 0 HA ALA A 37 0.059 -10.204 6.640 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -1.454 -9.771 4.766 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -0.518 -8.317 5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.076 -9.276 3.755 1.00 0.00 H new ATOM 564 N ILE A 38 1.645 -11.884 4.397 1.00 0.00 N ATOM 565 CA ILE A 38 1.869 -13.213 3.854 1.00 0.00 C ATOM 566 C ILE A 38 3.188 -13.765 4.398 1.00 0.00 C ATOM 567 O ILE A 38 3.768 -14.682 3.817 1.00 0.00 O ATOM 568 CB ILE A 38 1.797 -13.187 2.326 1.00 0.00 C ATOM 569 CG1 ILE A 38 2.441 -11.916 1.768 1.00 0.00 C ATOM 570 CG2 ILE A 38 0.355 -13.358 1.843 1.00 0.00 C ATOM 571 CD1 ILE A 38 2.215 -11.804 0.259 1.00 0.00 C ATOM 0 H ILE A 38 2.366 -11.201 4.165 1.00 0.00 H new ATOM 0 HA ILE A 38 1.081 -13.894 4.175 1.00 0.00 H new ATOM 0 HB ILE A 38 2.368 -14.032 1.942 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.023 -11.042 2.268 1.00 0.00 H new ATOM 0 HG13 ILE A 38 3.510 -11.923 1.980 1.00 0.00 H new ATOM 0 HG21 ILE A 38 0.331 -13.336 0.753 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.036 -14.313 2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.259 -12.547 2.236 1.00 0.00 H new ATOM 0 HD11 ILE A 38 2.683 -10.892 -0.112 1.00 0.00 H new ATOM 0 HD12 ILE A 38 2.656 -12.667 -0.240 1.00 0.00 H new ATOM 0 HD13 ILE A 38 1.145 -11.773 0.053 1.00 0.00 H new ATOM 583 N GLY A 39 3.625 -13.183 5.505 1.00 0.00 N ATOM 584 CA GLY A 39 4.865 -13.606 6.134 1.00 0.00 C ATOM 585 C GLY A 39 6.018 -13.605 5.127 1.00 0.00 C ATOM 586 O GLY A 39 7.043 -14.246 5.352 1.00 0.00 O ATOM 0 H GLY A 39 3.143 -12.422 5.983 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.102 -12.940 6.964 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.743 -14.605 6.552 1.00 0.00 H new ATOM 590 N MET A 40 5.811 -12.877 4.040 1.00 0.00 N ATOM 591 CA MET A 40 6.820 -12.784 2.998 1.00 0.00 C ATOM 592 C MET A 40 7.924 -11.801 3.391 1.00 0.00 C ATOM 593 O MET A 40 7.655 -10.779 4.021 1.00 0.00 O ATOM 594 CB MET A 40 6.166 -12.324 1.694 1.00 0.00 C ATOM 595 CG MET A 40 5.209 -13.389 1.154 1.00 0.00 C ATOM 596 SD MET A 40 6.135 -14.718 0.405 1.00 0.00 S ATOM 597 CE MET A 40 5.457 -14.677 -1.246 1.00 0.00 C ATOM 0 H MET A 40 4.960 -12.346 3.858 1.00 0.00 H new ATOM 0 HA MET A 40 7.268 -13.768 2.862 1.00 0.00 H new ATOM 0 HB2 MET A 40 5.623 -11.394 1.864 1.00 0.00 H new ATOM 0 HB3 MET A 40 6.936 -12.112 0.952 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.590 -13.777 1.963 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.535 -12.946 0.421 1.00 0.00 H new ATOM 0 HE1 MET A 40 6.217 -14.995 -1.960 1.00 0.00 H new ATOM 0 HE2 MET A 40 4.601 -15.349 -1.305 1.00 0.00 H new ATOM 0 HE3 MET A 40 5.138 -13.662 -1.483 1.00 0.00 H new ATOM 607 N GLY A 41 9.143 -12.144 3.003 1.00 0.00 N ATOM 608 CA GLY A 41 10.290 -11.304 3.306 1.00 0.00 C ATOM 609 C GLY A 41 10.543 -10.295 2.184 1.00 0.00 C ATOM 610 O GLY A 41 11.691 -9.993 1.863 1.00 0.00 O ATOM 0 H GLY A 41 9.362 -12.993 2.481 1.00 0.00 H new ATOM 0 HA2 GLY A 41 10.120 -10.775 4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 41 11.174 -11.926 3.446 1.00 0.00 H new ATOM 614 N PHE A 42 9.451 -9.801 1.619 1.00 0.00 N ATOM 615 CA PHE A 42 9.540 -8.832 0.540 1.00 0.00 C ATOM 616 C PHE A 42 8.158 -8.284 0.179 1.00 0.00 C ATOM 617 O PHE A 42 7.139 -8.860 0.560 1.00 0.00 O ATOM 618 CB PHE A 42 10.117 -9.565 -0.672 1.00 0.00 C ATOM 619 CG PHE A 42 9.564 -10.978 -0.867 1.00 0.00 C ATOM 620 CD1 PHE A 42 8.232 -11.166 -1.065 1.00 0.00 C ATOM 621 CD2 PHE A 42 10.405 -12.047 -0.841 1.00 0.00 C ATOM 622 CE1 PHE A 42 7.719 -12.478 -1.245 1.00 0.00 C ATOM 623 CE2 PHE A 42 9.892 -13.359 -1.021 1.00 0.00 C ATOM 624 CZ PHE A 42 8.559 -13.546 -1.219 1.00 0.00 C ATOM 0 H PHE A 42 8.500 -10.054 1.888 1.00 0.00 H new ATOM 0 HA PHE A 42 10.165 -7.993 0.844 1.00 0.00 H new ATOM 0 HB2 PHE A 42 9.913 -8.979 -1.568 1.00 0.00 H new ATOM 0 HB3 PHE A 42 11.201 -9.621 -0.567 1.00 0.00 H new ATOM 0 HD1 PHE A 42 7.564 -10.318 -1.085 1.00 0.00 H new ATOM 0 HD2 PHE A 42 11.463 -11.898 -0.683 1.00 0.00 H new ATOM 0 HE1 PHE A 42 6.661 -12.627 -1.403 1.00 0.00 H new ATOM 0 HE2 PHE A 42 10.560 -14.208 -1.001 1.00 0.00 H new ATOM 0 HZ PHE A 42 8.168 -14.544 -1.356 1.00 0.00 H new ATOM 634 N PRO A 43 8.167 -7.149 -0.570 1.00 0.00 N ATOM 635 CA PRO A 43 6.926 -6.517 -0.986 1.00 0.00 C ATOM 636 C PRO A 43 6.265 -7.302 -2.121 1.00 0.00 C ATOM 637 O PRO A 43 6.861 -7.489 -3.181 1.00 0.00 O ATOM 638 CB PRO A 43 7.320 -5.106 -1.391 1.00 0.00 C ATOM 639 CG PRO A 43 8.821 -5.144 -1.628 1.00 0.00 C ATOM 640 CD PRO A 43 9.353 -6.440 -1.038 1.00 0.00 C ATOM 0 HA PRO A 43 6.178 -6.496 -0.193 1.00 0.00 H new ATOM 0 HB2 PRO A 43 6.790 -4.796 -2.292 1.00 0.00 H new ATOM 0 HB3 PRO A 43 7.066 -4.390 -0.609 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.041 -5.092 -2.694 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.303 -4.285 -1.161 1.00 0.00 H new ATOM 0 HD2 PRO A 43 9.893 -7.022 -1.784 1.00 0.00 H new ATOM 0 HD3 PRO A 43 10.047 -6.247 -0.220 1.00 0.00 H new ATOM 648 N VAL A 44 5.042 -7.741 -1.860 1.00 0.00 N ATOM 649 CA VAL A 44 4.294 -8.501 -2.847 1.00 0.00 C ATOM 650 C VAL A 44 3.167 -7.631 -3.407 1.00 0.00 C ATOM 651 O VAL A 44 2.716 -6.694 -2.750 1.00 0.00 O ATOM 652 CB VAL A 44 3.790 -9.807 -2.228 1.00 0.00 C ATOM 653 CG1 VAL A 44 3.192 -10.724 -3.297 1.00 0.00 C ATOM 654 CG2 VAL A 44 4.907 -10.516 -1.460 1.00 0.00 C ATOM 0 H VAL A 44 4.551 -7.585 -0.980 1.00 0.00 H new ATOM 0 HA VAL A 44 4.936 -8.779 -3.683 1.00 0.00 H new ATOM 0 HB VAL A 44 3.001 -9.560 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.841 -11.645 -2.831 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.355 -10.221 -3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.953 -10.960 -4.041 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.523 -11.441 -1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.727 -10.745 -2.140 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.268 -9.868 -0.662 1.00 0.00 H new ATOM 664 N LYS A 45 2.744 -7.972 -4.616 1.00 0.00 N ATOM 665 CA LYS A 45 1.679 -7.234 -5.272 1.00 0.00 C ATOM 666 C LYS A 45 0.477 -7.136 -4.330 1.00 0.00 C ATOM 667 O LYS A 45 0.381 -7.886 -3.360 1.00 0.00 O ATOM 668 CB LYS A 45 1.348 -7.861 -6.627 1.00 0.00 C ATOM 669 CG LYS A 45 1.889 -7.005 -7.775 1.00 0.00 C ATOM 670 CD LYS A 45 1.094 -5.705 -7.910 1.00 0.00 C ATOM 671 CE LYS A 45 1.111 -5.200 -9.354 1.00 0.00 C ATOM 672 NZ LYS A 45 0.298 -6.082 -10.221 1.00 0.00 N ATOM 0 H LYS A 45 3.120 -8.750 -5.158 1.00 0.00 H new ATOM 0 HA LYS A 45 1.999 -6.215 -5.488 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.776 -8.862 -6.683 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.268 -7.970 -6.727 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.940 -6.776 -7.599 1.00 0.00 H new ATOM 0 HG3 LYS A 45 1.837 -7.566 -8.708 1.00 0.00 H new ATOM 0 HD2 LYS A 45 0.065 -5.869 -7.590 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.516 -4.946 -7.251 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.723 -4.182 -9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.137 -5.164 -9.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -0.034 -5.546 -11.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.877 -6.885 -10.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.521 -6.436 -9.686 1.00 0.00 H new ATOM 686 N VAL A 46 -0.410 -6.204 -4.649 1.00 0.00 N ATOM 687 CA VAL A 46 -1.601 -5.998 -3.843 1.00 0.00 C ATOM 688 C VAL A 46 -2.834 -6.019 -4.749 1.00 0.00 C ATOM 689 O VAL A 46 -3.027 -5.115 -5.561 1.00 0.00 O ATOM 690 CB VAL A 46 -1.472 -4.703 -3.039 1.00 0.00 C ATOM 691 CG1 VAL A 46 -2.699 -4.483 -2.152 1.00 0.00 C ATOM 692 CG2 VAL A 46 -0.187 -4.700 -2.207 1.00 0.00 C ATOM 0 H VAL A 46 -0.327 -5.584 -5.454 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.716 -6.804 -3.118 1.00 0.00 H new ATOM 0 HB VAL A 46 -1.417 -3.875 -3.745 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.581 -3.556 -1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -3.591 -4.420 -2.775 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.800 -5.317 -1.457 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.120 -3.768 -1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -0.200 -5.542 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.675 -4.788 -2.868 1.00 0.00 H new ATOM 702 N PRO A 47 -3.657 -7.087 -4.574 1.00 0.00 N ATOM 703 CA PRO A 47 -4.866 -7.237 -5.367 1.00 0.00 C ATOM 704 C PRO A 47 -5.957 -6.275 -4.891 1.00 0.00 C ATOM 705 O PRO A 47 -6.996 -6.706 -4.393 1.00 0.00 O ATOM 706 CB PRO A 47 -5.256 -8.698 -5.216 1.00 0.00 C ATOM 707 CG PRO A 47 -4.525 -9.200 -3.982 1.00 0.00 C ATOM 708 CD PRO A 47 -3.460 -8.176 -3.622 1.00 0.00 C ATOM 0 HA PRO A 47 -4.715 -6.985 -6.417 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -6.335 -8.804 -5.101 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -4.972 -9.271 -6.098 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -5.221 -9.334 -3.154 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -4.070 -10.171 -4.176 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -3.575 -7.830 -2.595 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -2.459 -8.599 -3.706 1.00 0.00 H new ATOM 716 N TYR A 48 -5.682 -4.990 -5.060 1.00 0.00 N ATOM 717 CA TYR A 48 -6.627 -3.963 -4.654 1.00 0.00 C ATOM 718 C TYR A 48 -8.037 -4.288 -5.152 1.00 0.00 C ATOM 719 O TYR A 48 -9.022 -3.961 -4.492 1.00 0.00 O ATOM 720 CB TYR A 48 -6.151 -2.668 -5.315 1.00 0.00 C ATOM 721 CG TYR A 48 -4.718 -2.274 -4.953 1.00 0.00 C ATOM 722 CD1 TYR A 48 -4.422 -1.847 -3.674 1.00 0.00 C ATOM 723 CD2 TYR A 48 -3.721 -2.346 -5.904 1.00 0.00 C ATOM 724 CE1 TYR A 48 -3.073 -1.476 -3.333 1.00 0.00 C ATOM 725 CE2 TYR A 48 -2.372 -1.975 -5.563 1.00 0.00 C ATOM 726 CZ TYR A 48 -2.115 -1.559 -4.294 1.00 0.00 C ATOM 727 OH TYR A 48 -0.841 -1.208 -3.971 1.00 0.00 O ATOM 0 H TYR A 48 -4.819 -4.636 -5.472 1.00 0.00 H new ATOM 0 HA TYR A 48 -6.669 -3.887 -3.567 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -6.225 -2.776 -6.397 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -6.823 -1.858 -5.029 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -5.202 -1.791 -2.929 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -3.952 -2.681 -6.904 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -2.828 -1.139 -2.336 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -1.582 -2.026 -6.298 1.00 0.00 H new ATOM 0 HH TYR A 48 -0.263 -1.318 -4.755 1.00 0.00 H new ATOM 737 N ARG A 49 -8.088 -4.926 -6.312 1.00 0.00 N ATOM 738 CA ARG A 49 -9.361 -5.299 -6.905 1.00 0.00 C ATOM 739 C ARG A 49 -10.143 -6.209 -5.956 1.00 0.00 C ATOM 740 O ARG A 49 -11.173 -5.810 -5.416 1.00 0.00 O ATOM 741 CB ARG A 49 -9.157 -6.019 -8.240 1.00 0.00 C ATOM 742 CG ARG A 49 -10.499 -6.407 -8.864 1.00 0.00 C ATOM 743 CD ARG A 49 -11.051 -5.270 -9.726 1.00 0.00 C ATOM 744 NE ARG A 49 -12.198 -5.754 -10.528 1.00 0.00 N ATOM 745 CZ ARG A 49 -12.760 -5.063 -11.528 1.00 0.00 C ATOM 746 NH1 ARG A 49 -12.285 -3.854 -11.856 1.00 0.00 N ATOM 747 NH2 ARG A 49 -13.797 -5.581 -12.201 1.00 0.00 N ATOM 0 H ARG A 49 -7.269 -5.194 -6.857 1.00 0.00 H new ATOM 0 HA ARG A 49 -9.925 -4.383 -7.082 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -8.606 -5.374 -8.925 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -8.551 -6.912 -8.087 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -10.376 -7.303 -9.473 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -11.213 -6.652 -8.077 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -11.364 -4.441 -9.092 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -10.270 -4.890 -10.385 1.00 0.00 H new ATOM 0 HE ARG A 49 -12.584 -6.671 -10.305 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -11.496 -3.460 -11.344 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -12.713 -3.327 -12.618 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.158 -6.502 -11.951 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -14.225 -5.054 -12.963 1.00 0.00 H new ATOM 761 N LYS A 50 -9.624 -7.415 -5.783 1.00 0.00 N ATOM 762 CA LYS A 50 -10.260 -8.386 -4.909 1.00 0.00 C ATOM 763 C LYS A 50 -10.593 -7.720 -3.572 1.00 0.00 C ATOM 764 O LYS A 50 -11.696 -7.882 -3.051 1.00 0.00 O ATOM 765 CB LYS A 50 -9.390 -9.637 -4.773 1.00 0.00 C ATOM 766 CG LYS A 50 -8.950 -10.150 -6.145 1.00 0.00 C ATOM 767 CD LYS A 50 -9.023 -11.677 -6.208 1.00 0.00 C ATOM 768 CE LYS A 50 -8.081 -12.227 -7.282 1.00 0.00 C ATOM 769 NZ LYS A 50 -8.024 -13.704 -7.214 1.00 0.00 N ATOM 0 H LYS A 50 -8.769 -7.742 -6.234 1.00 0.00 H new ATOM 0 HA LYS A 50 -11.201 -8.727 -5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.513 -9.410 -4.167 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -9.946 -10.416 -4.251 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -9.585 -9.720 -6.919 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -7.931 -9.822 -6.350 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -8.759 -12.098 -5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -10.046 -11.987 -6.423 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -8.424 -11.915 -8.269 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -7.082 -11.812 -7.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -7.381 -14.061 -7.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.676 -13.995 -6.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -8.975 -14.096 -7.367 1.00 0.00 H new ATOM 783 N ILE A 51 -9.620 -6.985 -3.055 1.00 0.00 N ATOM 784 CA ILE A 51 -9.796 -6.294 -1.788 1.00 0.00 C ATOM 785 C ILE A 51 -10.970 -5.320 -1.903 1.00 0.00 C ATOM 786 O ILE A 51 -11.674 -5.073 -0.924 1.00 0.00 O ATOM 787 CB ILE A 51 -8.487 -5.631 -1.353 1.00 0.00 C ATOM 788 CG1 ILE A 51 -7.595 -6.621 -0.602 1.00 0.00 C ATOM 789 CG2 ILE A 51 -8.759 -4.368 -0.534 1.00 0.00 C ATOM 790 CD1 ILE A 51 -6.181 -6.637 -1.185 1.00 0.00 C ATOM 0 H ILE A 51 -8.707 -6.852 -3.490 1.00 0.00 H new ATOM 0 HA ILE A 51 -10.045 -7.003 -0.998 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.945 -5.324 -2.247 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -7.554 -6.351 0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -8.027 -7.620 -0.659 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.813 -3.916 -0.237 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.327 -3.659 -1.137 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.332 -4.628 0.356 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -5.568 -7.349 -0.633 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -6.223 -6.931 -2.234 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.743 -5.642 -1.105 1.00 0.00 H new ATOM 802 N THR A 52 -11.146 -4.793 -3.106 1.00 0.00 N ATOM 803 CA THR A 52 -12.223 -3.852 -3.361 1.00 0.00 C ATOM 804 C THR A 52 -13.572 -4.574 -3.366 1.00 0.00 C ATOM 805 O THR A 52 -14.407 -4.341 -2.493 1.00 0.00 O ATOM 806 CB THR A 52 -11.917 -3.127 -4.673 1.00 0.00 C ATOM 807 OG1 THR A 52 -11.690 -1.776 -4.278 1.00 0.00 O ATOM 808 CG2 THR A 52 -13.134 -3.047 -5.595 1.00 0.00 C ATOM 0 H THR A 52 -10.560 -5.000 -3.915 1.00 0.00 H new ATOM 0 HA THR A 52 -12.292 -3.106 -2.569 1.00 0.00 H new ATOM 0 HB THR A 52 -11.104 -3.638 -5.189 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.483 -1.235 -5.068 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.862 -2.523 -6.511 1.00 0.00 H new ATOM 0 HG22 THR A 52 -13.472 -4.054 -5.839 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.936 -2.507 -5.092 1.00 0.00 H new ATOM 816 N ILE A 53 -13.743 -5.434 -4.358 1.00 0.00 N ATOM 817 CA ILE A 53 -14.976 -6.191 -4.489 1.00 0.00 C ATOM 818 C ILE A 53 -15.364 -6.764 -3.124 1.00 0.00 C ATOM 819 O ILE A 53 -16.537 -6.752 -2.753 1.00 0.00 O ATOM 820 CB ILE A 53 -14.841 -7.251 -5.584 1.00 0.00 C ATOM 821 CG1 ILE A 53 -13.632 -8.153 -5.329 1.00 0.00 C ATOM 822 CG2 ILE A 53 -14.792 -6.604 -6.970 1.00 0.00 C ATOM 823 CD1 ILE A 53 -13.249 -8.927 -6.592 1.00 0.00 C ATOM 0 H ILE A 53 -13.048 -5.624 -5.080 1.00 0.00 H new ATOM 0 HA ILE A 53 -15.791 -5.540 -4.807 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.727 -7.886 -5.556 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -12.787 -7.549 -4.998 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.859 -8.852 -4.524 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -14.696 -7.379 -7.730 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -15.709 -6.040 -7.141 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -13.936 -5.931 -7.027 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -12.387 -9.560 -6.383 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -14.088 -9.548 -6.907 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -12.999 -8.225 -7.387 1.00 0.00 H new ATOM 835 N ASN A 54 -14.358 -7.251 -2.414 1.00 0.00 N ATOM 836 CA ASN A 54 -14.579 -7.827 -1.099 1.00 0.00 C ATOM 837 C ASN A 54 -13.230 -8.069 -0.419 1.00 0.00 C ATOM 838 O ASN A 54 -12.385 -8.790 -0.947 1.00 0.00 O ATOM 839 CB ASN A 54 -15.305 -9.170 -1.200 1.00 0.00 C ATOM 840 CG ASN A 54 -14.372 -10.258 -1.736 1.00 0.00 C ATOM 841 OD1 ASN A 54 -13.593 -10.856 -1.013 1.00 0.00 O ATOM 842 ND2 ASN A 54 -14.495 -10.481 -3.042 1.00 0.00 N ATOM 0 H ASN A 54 -13.387 -7.259 -2.725 1.00 0.00 H new ATOM 0 HA ASN A 54 -15.189 -7.130 -0.525 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -15.681 -9.459 -0.219 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -16.170 -9.072 -1.856 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -13.917 -11.189 -3.495 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -15.168 -9.944 -3.590 1.00 0.00 H new ATOM 849 N PRO A 55 -13.066 -7.437 0.774 1.00 0.00 N ATOM 850 CA PRO A 55 -11.834 -7.576 1.532 1.00 0.00 C ATOM 851 C PRO A 55 -11.758 -8.947 2.208 1.00 0.00 C ATOM 852 O PRO A 55 -10.671 -9.432 2.516 1.00 0.00 O ATOM 853 CB PRO A 55 -11.849 -6.424 2.523 1.00 0.00 C ATOM 854 CG PRO A 55 -13.294 -5.960 2.600 1.00 0.00 C ATOM 855 CD PRO A 55 -14.045 -6.576 1.431 1.00 0.00 C ATOM 0 HA PRO A 55 -10.945 -7.530 0.903 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -11.489 -6.745 3.501 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -11.196 -5.616 2.193 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -13.743 -6.265 3.545 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -13.348 -4.872 2.558 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -14.909 -7.147 1.772 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -14.417 -5.809 0.751 1.00 0.00 H new ATOM 863 N GLY A 56 -12.928 -9.532 2.420 1.00 0.00 N ATOM 864 CA GLY A 56 -13.009 -10.836 3.054 1.00 0.00 C ATOM 865 C GLY A 56 -11.643 -11.527 3.063 1.00 0.00 C ATOM 866 O GLY A 56 -11.059 -11.741 4.125 1.00 0.00 O ATOM 0 H GLY A 56 -13.828 -9.126 2.164 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.371 -10.726 4.076 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.731 -11.457 2.525 1.00 0.00 H new ATOM 870 N CYS A 57 -11.174 -11.855 1.869 1.00 0.00 N ATOM 871 CA CYS A 57 -9.888 -12.517 1.726 1.00 0.00 C ATOM 872 C CYS A 57 -8.831 -11.671 2.438 1.00 0.00 C ATOM 873 O CYS A 57 -8.543 -11.891 3.613 1.00 0.00 O ATOM 874 CB CYS A 57 -9.535 -12.754 0.256 1.00 0.00 C ATOM 875 SG CYS A 57 -10.537 -14.131 -0.414 1.00 0.00 S ATOM 0 H CYS A 57 -11.661 -11.675 0.991 1.00 0.00 H new ATOM 0 HA CYS A 57 -9.931 -13.505 2.185 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -9.716 -11.847 -0.321 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -8.474 -12.985 0.161 1.00 0.00 H new ATOM 0 HG CYS A 57 -10.738 -13.943 -1.684 1.00 0.00 H new ATOM 881 N VAL A 58 -8.282 -10.720 1.696 1.00 0.00 N ATOM 882 CA VAL A 58 -7.262 -9.840 2.241 1.00 0.00 C ATOM 883 C VAL A 58 -7.923 -8.559 2.755 1.00 0.00 C ATOM 884 O VAL A 58 -8.694 -7.924 2.038 1.00 0.00 O ATOM 885 CB VAL A 58 -6.182 -9.576 1.191 1.00 0.00 C ATOM 886 CG1 VAL A 58 -5.365 -8.332 1.545 1.00 0.00 C ATOM 887 CG2 VAL A 58 -5.276 -10.797 1.018 1.00 0.00 C ATOM 0 H VAL A 58 -8.524 -10.540 0.722 1.00 0.00 H new ATOM 0 HA VAL A 58 -6.763 -10.311 3.088 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.679 -9.390 0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.604 -8.167 0.782 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.024 -7.465 1.593 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -4.884 -8.476 2.512 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.517 -10.583 0.266 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -4.792 -11.028 1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.873 -11.651 0.698 1.00 0.00 H new ATOM 897 N VAL A 59 -7.596 -8.218 3.993 1.00 0.00 N ATOM 898 CA VAL A 59 -8.147 -7.025 4.611 1.00 0.00 C ATOM 899 C VAL A 59 -7.083 -5.926 4.627 1.00 0.00 C ATOM 900 O VAL A 59 -5.901 -6.198 4.423 1.00 0.00 O ATOM 901 CB VAL A 59 -8.685 -7.357 6.004 1.00 0.00 C ATOM 902 CG1 VAL A 59 -9.295 -6.120 6.666 1.00 0.00 C ATOM 903 CG2 VAL A 59 -9.697 -8.502 5.943 1.00 0.00 C ATOM 0 H VAL A 59 -6.956 -8.748 4.585 1.00 0.00 H new ATOM 0 HA VAL A 59 -8.992 -6.651 4.032 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.846 -7.685 6.617 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -9.670 -6.384 7.655 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -8.534 -5.346 6.761 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -10.117 -5.748 6.054 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -10.063 -8.718 6.947 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -10.533 -8.215 5.305 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.217 -9.391 5.534 1.00 0.00 H new ATOM 913 N VAL A 60 -7.541 -4.706 4.872 1.00 0.00 N ATOM 914 CA VAL A 60 -6.642 -3.565 4.918 1.00 0.00 C ATOM 915 C VAL A 60 -7.077 -2.624 6.043 1.00 0.00 C ATOM 916 O VAL A 60 -8.225 -2.184 6.080 1.00 0.00 O ATOM 917 CB VAL A 60 -6.596 -2.881 3.550 1.00 0.00 C ATOM 918 CG1 VAL A 60 -5.853 -1.546 3.630 1.00 0.00 C ATOM 919 CG2 VAL A 60 -5.966 -3.797 2.500 1.00 0.00 C ATOM 0 H VAL A 60 -8.522 -4.483 5.041 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.625 -3.888 5.140 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.622 -2.676 3.243 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.834 -1.080 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.363 -0.887 4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.832 -1.718 3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -5.946 -3.287 1.537 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.948 -4.048 2.799 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.554 -4.711 2.414 1.00 0.00 H new ATOM 929 N ASP A 61 -6.137 -2.343 6.933 1.00 0.00 N ATOM 930 CA ASP A 61 -6.409 -1.462 8.056 1.00 0.00 C ATOM 931 C ASP A 61 -5.364 -0.345 8.086 1.00 0.00 C ATOM 932 O ASP A 61 -4.435 -0.337 7.281 1.00 0.00 O ATOM 933 CB ASP A 61 -6.328 -2.220 9.383 1.00 0.00 C ATOM 934 CG ASP A 61 -7.640 -2.858 9.843 1.00 0.00 C ATOM 935 OD1 ASP A 61 -8.245 -3.574 9.016 1.00 0.00 O ATOM 936 OD2 ASP A 61 -8.009 -2.616 11.013 1.00 0.00 O ATOM 0 H ASP A 61 -5.186 -2.710 6.899 1.00 0.00 H new ATOM 0 HA ASP A 61 -7.414 -1.058 7.932 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -5.573 -3.001 9.293 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.984 -1.533 10.156 1.00 0.00 H new ATOM 941 N GLY A 62 -5.553 0.573 9.024 1.00 0.00 N ATOM 942 CA GLY A 62 -4.639 1.693 9.169 1.00 0.00 C ATOM 943 C GLY A 62 -5.088 2.881 8.317 1.00 0.00 C ATOM 944 O GLY A 62 -4.868 4.034 8.687 1.00 0.00 O ATOM 0 H GLY A 62 -6.325 0.563 9.690 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -4.587 1.991 10.216 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.635 1.388 8.874 1.00 0.00 H new ATOM 948 N MET A 63 -5.710 2.561 7.192 1.00 0.00 N ATOM 949 CA MET A 63 -6.192 3.588 6.284 1.00 0.00 C ATOM 950 C MET A 63 -6.848 4.736 7.054 1.00 0.00 C ATOM 951 O MET A 63 -7.407 4.527 8.129 1.00 0.00 O ATOM 952 CB MET A 63 -7.206 2.977 5.315 1.00 0.00 C ATOM 953 CG MET A 63 -6.551 1.912 4.434 1.00 0.00 C ATOM 954 SD MET A 63 -5.182 2.622 3.535 1.00 0.00 S ATOM 955 CE MET A 63 -6.064 3.409 2.198 1.00 0.00 C ATOM 0 H MET A 63 -5.891 1.604 6.888 1.00 0.00 H new ATOM 0 HA MET A 63 -5.342 3.986 5.730 1.00 0.00 H new ATOM 0 HB2 MET A 63 -8.029 2.534 5.876 1.00 0.00 H new ATOM 0 HB3 MET A 63 -7.633 3.760 4.688 1.00 0.00 H new ATOM 0 HG2 MET A 63 -6.202 1.083 5.050 1.00 0.00 H new ATOM 0 HG3 MET A 63 -7.283 1.505 3.736 1.00 0.00 H new ATOM 0 HE1 MET A 63 -5.530 3.243 1.262 1.00 0.00 H new ATOM 0 HE2 MET A 63 -7.066 2.985 2.124 1.00 0.00 H new ATOM 0 HE3 MET A 63 -6.136 4.480 2.390 1.00 0.00 H new ATOM 965 N PRO A 64 -6.754 5.955 6.458 1.00 0.00 N ATOM 966 CA PRO A 64 -7.332 7.136 7.076 1.00 0.00 C ATOM 967 C PRO A 64 -8.854 7.143 6.929 1.00 0.00 C ATOM 968 O PRO A 64 -9.413 6.343 6.180 1.00 0.00 O ATOM 969 CB PRO A 64 -6.663 8.311 6.380 1.00 0.00 C ATOM 970 CG PRO A 64 -6.086 7.756 5.088 1.00 0.00 C ATOM 971 CD PRO A 64 -6.099 6.239 5.185 1.00 0.00 C ATOM 0 HA PRO A 64 -7.159 7.175 8.151 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -7.381 9.106 6.177 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.880 8.741 7.005 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -6.675 8.089 4.233 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -5.070 8.120 4.936 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -6.643 5.794 4.352 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -5.088 5.832 5.160 1.00 0.00 H new ATOM 979 N PRO A 65 -9.500 8.079 7.676 1.00 0.00 N ATOM 980 CA PRO A 65 -10.947 8.200 7.636 1.00 0.00 C ATOM 981 C PRO A 65 -11.406 8.869 6.339 1.00 0.00 C ATOM 982 O PRO A 65 -10.723 9.746 5.813 1.00 0.00 O ATOM 983 CB PRO A 65 -11.309 9.001 8.877 1.00 0.00 C ATOM 984 CG PRO A 65 -10.028 9.693 9.315 1.00 0.00 C ATOM 985 CD PRO A 65 -8.871 9.043 8.574 1.00 0.00 C ATOM 0 HA PRO A 65 -11.450 7.233 7.641 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -12.091 9.728 8.658 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -11.690 8.351 9.664 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -10.074 10.759 9.091 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.892 9.599 10.392 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.292 9.781 8.019 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -8.185 8.552 9.264 1.00 0.00 H new ATOM 993 N GLY A 66 -12.560 8.428 5.860 1.00 0.00 N ATOM 994 CA GLY A 66 -13.118 8.973 4.634 1.00 0.00 C ATOM 995 C GLY A 66 -12.163 8.766 3.457 1.00 0.00 C ATOM 996 O GLY A 66 -12.227 9.492 2.466 1.00 0.00 O ATOM 0 H GLY A 66 -13.124 7.700 6.299 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -14.073 8.493 4.420 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -13.317 10.037 4.762 1.00 0.00 H new ATOM 1000 N VAL A 67 -11.298 7.774 3.606 1.00 0.00 N ATOM 1001 CA VAL A 67 -10.330 7.463 2.568 1.00 0.00 C ATOM 1002 C VAL A 67 -10.365 5.961 2.277 1.00 0.00 C ATOM 1003 O VAL A 67 -9.885 5.159 3.077 1.00 0.00 O ATOM 1004 CB VAL A 67 -8.943 7.960 2.979 1.00 0.00 C ATOM 1005 CG1 VAL A 67 -7.892 7.579 1.935 1.00 0.00 C ATOM 1006 CG2 VAL A 67 -8.952 9.470 3.223 1.00 0.00 C ATOM 0 H VAL A 67 -11.247 7.175 4.430 1.00 0.00 H new ATOM 0 HA VAL A 67 -10.584 7.980 1.642 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.676 7.471 3.916 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.915 7.944 2.252 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.858 6.494 1.832 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.153 8.026 0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.954 9.798 3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.251 9.984 2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.658 9.706 4.020 1.00 0.00 H new ATOM 1016 N SER A 68 -10.937 5.625 1.130 1.00 0.00 N ATOM 1017 CA SER A 68 -11.041 4.234 0.725 1.00 0.00 C ATOM 1018 C SER A 68 -9.686 3.734 0.218 1.00 0.00 C ATOM 1019 O SER A 68 -8.842 4.528 -0.193 1.00 0.00 O ATOM 1020 CB SER A 68 -12.110 4.053 -0.354 1.00 0.00 C ATOM 1021 OG SER A 68 -12.050 5.077 -1.343 1.00 0.00 O ATOM 0 H SER A 68 -11.333 6.293 0.468 1.00 0.00 H new ATOM 0 HA SER A 68 -11.337 3.646 1.594 1.00 0.00 H new ATOM 0 HB2 SER A 68 -11.983 3.081 -0.831 1.00 0.00 H new ATOM 0 HB3 SER A 68 -13.097 4.054 0.109 1.00 0.00 H new ATOM 0 HG SER A 68 -12.747 4.925 -2.014 1.00 0.00 H new ATOM 1027 N PHE A 69 -9.521 2.420 0.265 1.00 0.00 N ATOM 1028 CA PHE A 69 -8.283 1.805 -0.183 1.00 0.00 C ATOM 1029 C PHE A 69 -8.409 1.309 -1.625 1.00 0.00 C ATOM 1030 O PHE A 69 -9.431 0.738 -2.002 1.00 0.00 O ATOM 1031 CB PHE A 69 -8.020 0.609 0.734 1.00 0.00 C ATOM 1032 CG PHE A 69 -6.886 -0.302 0.258 1.00 0.00 C ATOM 1033 CD1 PHE A 69 -5.631 0.198 0.106 1.00 0.00 C ATOM 1034 CD2 PHE A 69 -7.135 -1.611 -0.012 1.00 0.00 C ATOM 1035 CE1 PHE A 69 -4.579 -0.647 -0.336 1.00 0.00 C ATOM 1036 CE2 PHE A 69 -6.083 -2.457 -0.454 1.00 0.00 C ATOM 1037 CZ PHE A 69 -4.827 -1.957 -0.606 1.00 0.00 C ATOM 0 H PHE A 69 -10.224 1.764 0.606 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.471 2.532 -0.146 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -7.783 0.975 1.733 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -8.934 0.021 0.818 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -5.434 1.238 0.321 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.132 -2.007 0.110 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -3.582 -0.250 -0.458 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -6.280 -3.497 -0.669 1.00 0.00 H new ATOM 0 HZ PHE A 69 -4.027 -2.600 -0.941 1.00 0.00 H new ATOM 1047 N LYS A 70 -7.355 1.545 -2.393 1.00 0.00 N ATOM 1048 CA LYS A 70 -7.335 1.130 -3.785 1.00 0.00 C ATOM 1049 C LYS A 70 -5.991 1.515 -4.408 1.00 0.00 C ATOM 1050 O LYS A 70 -5.198 2.225 -3.792 1.00 0.00 O ATOM 1051 CB LYS A 70 -8.544 1.697 -4.531 1.00 0.00 C ATOM 1052 CG LYS A 70 -8.610 3.219 -4.391 1.00 0.00 C ATOM 1053 CD LYS A 70 -9.897 3.771 -5.006 1.00 0.00 C ATOM 1054 CE LYS A 70 -10.776 4.429 -3.940 1.00 0.00 C ATOM 1055 NZ LYS A 70 -11.309 5.719 -4.432 1.00 0.00 N ATOM 0 H LYS A 70 -6.509 2.019 -2.077 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.423 0.046 -3.861 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.484 1.427 -5.585 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.459 1.252 -4.139 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.560 3.493 -3.337 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -7.747 3.670 -4.880 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -9.652 4.498 -5.780 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.448 2.965 -5.490 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -11.599 3.765 -3.678 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -10.196 4.591 -3.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.903 6.152 -3.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.520 6.357 -4.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.879 5.556 -5.286 1.00 0.00 H new ATOM 1069 N ALA A 71 -5.777 1.028 -5.621 1.00 0.00 N ATOM 1070 CA ALA A 71 -4.543 1.312 -6.334 1.00 0.00 C ATOM 1071 C ALA A 71 -4.230 2.806 -6.227 1.00 0.00 C ATOM 1072 O ALA A 71 -5.136 3.625 -6.087 1.00 0.00 O ATOM 1073 CB ALA A 71 -4.674 0.846 -7.786 1.00 0.00 C ATOM 0 H ALA A 71 -6.437 0.439 -6.128 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.709 0.768 -5.891 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -3.749 1.059 -8.321 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -4.867 -0.226 -7.808 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.499 1.373 -8.264 1.00 0.00 H new ATOM 1079 N PRO A 72 -2.909 3.122 -6.299 1.00 0.00 N ATOM 1080 CA PRO A 72 -2.464 4.503 -6.212 1.00 0.00 C ATOM 1081 C PRO A 72 -2.751 5.255 -7.513 1.00 0.00 C ATOM 1082 O PRO A 72 -2.589 6.472 -7.580 1.00 0.00 O ATOM 1083 CB PRO A 72 -0.982 4.419 -5.889 1.00 0.00 C ATOM 1084 CG PRO A 72 -0.552 3.010 -6.265 1.00 0.00 C ATOM 1085 CD PRO A 72 -1.808 2.178 -6.466 1.00 0.00 C ATOM 0 HA PRO A 72 -2.994 5.068 -5.445 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.417 5.163 -6.451 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.801 4.613 -4.832 1.00 0.00 H new ATOM 0 HG2 PRO A 72 0.047 3.024 -7.176 1.00 0.00 H new ATOM 0 HG3 PRO A 72 0.070 2.579 -5.481 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.826 1.720 -7.455 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.867 1.368 -5.739 1.00 0.00 H new ATOM 1093 N SER A 73 -3.173 4.498 -8.516 1.00 0.00 N ATOM 1094 CA SER A 73 -3.485 5.078 -9.811 1.00 0.00 C ATOM 1095 C SER A 73 -4.796 5.862 -9.732 1.00 0.00 C ATOM 1096 O SER A 73 -4.893 6.969 -10.260 1.00 0.00 O ATOM 1097 CB SER A 73 -3.577 3.997 -10.890 1.00 0.00 C ATOM 1098 OG SER A 73 -3.887 4.544 -12.169 1.00 0.00 O ATOM 0 H SER A 73 -3.306 3.488 -8.458 1.00 0.00 H new ATOM 0 HA SER A 73 -2.679 5.759 -10.084 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.631 3.459 -10.946 1.00 0.00 H new ATOM 0 HB3 SER A 73 -4.341 3.271 -10.611 1.00 0.00 H new ATOM 0 HG SER A 73 -3.253 4.202 -12.833 1.00 0.00 H new ATOM 1104 N TYR A 74 -5.771 5.258 -9.069 1.00 0.00 N ATOM 1105 CA TYR A 74 -7.072 5.887 -8.914 1.00 0.00 C ATOM 1106 C TYR A 74 -7.025 6.989 -7.854 1.00 0.00 C ATOM 1107 O TYR A 74 -7.651 8.036 -8.014 1.00 0.00 O ATOM 1108 CB TYR A 74 -8.020 4.782 -8.443 1.00 0.00 C ATOM 1109 CG TYR A 74 -8.130 3.602 -9.411 1.00 0.00 C ATOM 1110 CD1 TYR A 74 -8.260 3.831 -10.766 1.00 0.00 C ATOM 1111 CD2 TYR A 74 -8.099 2.310 -8.929 1.00 0.00 C ATOM 1112 CE1 TYR A 74 -8.364 2.720 -11.676 1.00 0.00 C ATOM 1113 CE2 TYR A 74 -8.202 1.199 -9.840 1.00 0.00 C ATOM 1114 CZ TYR A 74 -8.330 1.459 -11.168 1.00 0.00 C ATOM 1115 OH TYR A 74 -8.428 0.410 -12.029 1.00 0.00 O ATOM 0 H TYR A 74 -5.686 4.340 -8.633 1.00 0.00 H new ATOM 0 HA TYR A 74 -7.393 6.342 -9.851 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -7.680 4.414 -7.475 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -9.012 5.208 -8.292 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -8.284 4.843 -11.143 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -7.998 2.131 -7.869 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.467 2.884 -12.738 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.178 0.182 -9.476 1.00 0.00 H new ATOM 0 HH TYR A 74 -8.388 -0.430 -11.527 1.00 0.00 H new ATOM 1125 N LEU A 75 -6.279 6.715 -6.794 1.00 0.00 N ATOM 1126 CA LEU A 75 -6.143 7.671 -5.708 1.00 0.00 C ATOM 1127 C LEU A 75 -5.436 8.926 -6.224 1.00 0.00 C ATOM 1128 O LEU A 75 -4.685 8.864 -7.196 1.00 0.00 O ATOM 1129 CB LEU A 75 -5.449 7.023 -4.508 1.00 0.00 C ATOM 1130 CG LEU A 75 -6.123 5.774 -3.937 1.00 0.00 C ATOM 1131 CD1 LEU A 75 -5.225 5.090 -2.905 1.00 0.00 C ATOM 1132 CD2 LEU A 75 -7.502 6.110 -3.364 1.00 0.00 C ATOM 0 H LEU A 75 -5.763 5.845 -6.664 1.00 0.00 H new ATOM 0 HA LEU A 75 -7.124 7.983 -5.350 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.432 6.761 -4.800 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.372 7.765 -3.714 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.276 5.065 -4.751 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.728 4.205 -2.515 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.287 4.796 -3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.019 5.781 -2.087 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.960 5.205 -2.964 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.395 6.845 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -8.134 6.519 -4.152 1.00 0.00 H new ATOM 1144 N GLU A 76 -5.701 10.035 -5.549 1.00 0.00 N ATOM 1145 CA GLU A 76 -5.099 11.303 -5.927 1.00 0.00 C ATOM 1146 C GLU A 76 -3.889 11.601 -5.040 1.00 0.00 C ATOM 1147 O GLU A 76 -3.631 10.885 -4.074 1.00 0.00 O ATOM 1148 CB GLU A 76 -6.123 12.437 -5.858 1.00 0.00 C ATOM 1149 CG GLU A 76 -7.058 12.407 -7.069 1.00 0.00 C ATOM 1150 CD GLU A 76 -6.543 13.322 -8.182 1.00 0.00 C ATOM 1151 OE1 GLU A 76 -6.846 14.532 -8.107 1.00 0.00 O ATOM 1152 OE2 GLU A 76 -5.859 12.790 -9.083 1.00 0.00 O ATOM 0 H GLU A 76 -6.324 10.082 -4.743 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.758 11.228 -6.959 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.706 12.349 -4.941 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -5.607 13.396 -5.817 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -7.143 11.386 -7.442 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.058 12.721 -6.769 1.00 0.00 H new ATOM 1159 N ILE A 77 -3.178 12.660 -5.400 1.00 0.00 N ATOM 1160 CA ILE A 77 -2.002 13.062 -4.648 1.00 0.00 C ATOM 1161 C ILE A 77 -2.362 13.174 -3.166 1.00 0.00 C ATOM 1162 O ILE A 77 -1.826 12.441 -2.336 1.00 0.00 O ATOM 1163 CB ILE A 77 -1.404 14.343 -5.234 1.00 0.00 C ATOM 1164 CG1 ILE A 77 -1.045 14.156 -6.710 1.00 0.00 C ATOM 1165 CG2 ILE A 77 -0.206 14.816 -4.409 1.00 0.00 C ATOM 1166 CD1 ILE A 77 0.000 15.181 -7.155 1.00 0.00 C ATOM 0 H ILE A 77 -3.394 13.251 -6.202 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.221 12.306 -4.730 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.160 15.127 -5.183 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.662 13.148 -6.870 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.942 14.257 -7.321 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.200 15.728 -4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.525 15.016 -3.386 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.562 14.042 -4.405 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.237 15.026 -8.208 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.395 16.187 -7.017 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.904 15.061 -6.558 1.00 0.00 H new ATOM 1178 N SER A 78 -3.268 14.096 -2.878 1.00 0.00 N ATOM 1179 CA SER A 78 -3.707 14.313 -1.510 1.00 0.00 C ATOM 1180 C SER A 78 -4.051 12.975 -0.852 1.00 0.00 C ATOM 1181 O SER A 78 -3.709 12.743 0.307 1.00 0.00 O ATOM 1182 CB SER A 78 -4.912 15.254 -1.460 1.00 0.00 C ATOM 1183 OG SER A 78 -5.098 15.816 -0.164 1.00 0.00 O ATOM 0 H SER A 78 -3.711 14.702 -3.569 1.00 0.00 H new ATOM 0 HA SER A 78 -2.891 14.782 -0.960 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.776 16.055 -2.186 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.810 14.709 -1.751 1.00 0.00 H new ATOM 0 HG SER A 78 -5.876 16.412 -0.174 1.00 0.00 H new ATOM 1189 N SER A 79 -4.723 12.130 -1.620 1.00 0.00 N ATOM 1190 CA SER A 79 -5.117 10.822 -1.126 1.00 0.00 C ATOM 1191 C SER A 79 -3.877 10.018 -0.728 1.00 0.00 C ATOM 1192 O SER A 79 -3.798 9.504 0.387 1.00 0.00 O ATOM 1193 CB SER A 79 -5.929 10.059 -2.175 1.00 0.00 C ATOM 1194 OG SER A 79 -6.499 8.865 -1.644 1.00 0.00 O ATOM 0 H SER A 79 -5.004 12.326 -2.581 1.00 0.00 H new ATOM 0 HA SER A 79 -5.748 10.963 -0.249 1.00 0.00 H new ATOM 0 HB2 SER A 79 -6.723 10.701 -2.557 1.00 0.00 H new ATOM 0 HB3 SER A 79 -5.287 9.810 -3.020 1.00 0.00 H new ATOM 0 HG SER A 79 -7.475 8.907 -1.720 1.00 0.00 H new ATOM 1200 N MET A 80 -2.940 9.934 -1.661 1.00 0.00 N ATOM 1201 CA MET A 80 -1.709 9.201 -1.421 1.00 0.00 C ATOM 1202 C MET A 80 -0.995 9.723 -0.172 1.00 0.00 C ATOM 1203 O MET A 80 -0.725 8.963 0.757 1.00 0.00 O ATOM 1204 CB MET A 80 -0.786 9.342 -2.633 1.00 0.00 C ATOM 1205 CG MET A 80 -1.350 8.591 -3.841 1.00 0.00 C ATOM 1206 SD MET A 80 -0.143 8.555 -5.156 1.00 0.00 S ATOM 1207 CE MET A 80 -0.570 10.064 -6.009 1.00 0.00 C ATOM 0 H MET A 80 -3.009 10.362 -2.585 1.00 0.00 H new ATOM 0 HA MET A 80 -1.958 8.152 -1.263 1.00 0.00 H new ATOM 0 HB2 MET A 80 -0.663 10.396 -2.881 1.00 0.00 H new ATOM 0 HB3 MET A 80 0.203 8.955 -2.389 1.00 0.00 H new ATOM 0 HG2 MET A 80 -1.618 7.574 -3.555 1.00 0.00 H new ATOM 0 HG3 MET A 80 -2.263 9.076 -4.187 1.00 0.00 H new ATOM 0 HE1 MET A 80 -0.372 9.948 -7.075 1.00 0.00 H new ATOM 0 HE2 MET A 80 -1.628 10.281 -5.858 1.00 0.00 H new ATOM 0 HE3 MET A 80 0.028 10.886 -5.616 1.00 0.00 H new ATOM 1217 N ARG A 81 -0.708 11.017 -0.191 1.00 0.00 N ATOM 1218 CA ARG A 81 -0.031 11.649 0.928 1.00 0.00 C ATOM 1219 C ARG A 81 -0.600 11.136 2.252 1.00 0.00 C ATOM 1220 O ARG A 81 0.141 10.646 3.103 1.00 0.00 O ATOM 1221 CB ARG A 81 -0.179 13.171 0.873 1.00 0.00 C ATOM 1222 CG ARG A 81 1.159 13.841 0.553 1.00 0.00 C ATOM 1223 CD ARG A 81 1.102 14.564 -0.794 1.00 0.00 C ATOM 1224 NE ARG A 81 0.814 16.001 -0.585 1.00 0.00 N ATOM 1225 CZ ARG A 81 1.660 16.859 0.001 1.00 0.00 C ATOM 1226 NH1 ARG A 81 2.851 16.431 0.440 1.00 0.00 N ATOM 1227 NH2 ARG A 81 1.314 18.145 0.148 1.00 0.00 N ATOM 0 H ARG A 81 -0.932 11.644 -0.964 1.00 0.00 H new ATOM 0 HA ARG A 81 1.027 11.395 0.861 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -0.915 13.441 0.116 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -0.554 13.538 1.828 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.412 14.551 1.340 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.950 13.091 0.534 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.050 14.447 -1.319 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.332 14.118 -1.423 1.00 0.00 H new ATOM 0 HE ARG A 81 -0.085 16.360 -0.907 1.00 0.00 H new ATOM 0 HH11 ARG A 81 3.114 15.452 0.328 1.00 0.00 H new ATOM 0 HH12 ARG A 81 3.495 17.084 0.886 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.407 18.470 -0.186 1.00 0.00 H new ATOM 0 HH22 ARG A 81 1.958 18.799 0.594 1.00 0.00 H new ATOM 1241 N ARG A 82 -1.912 11.266 2.386 1.00 0.00 N ATOM 1242 CA ARG A 82 -2.589 10.822 3.592 1.00 0.00 C ATOM 1243 C ARG A 82 -2.165 9.394 3.944 1.00 0.00 C ATOM 1244 O ARG A 82 -1.549 9.165 4.983 1.00 0.00 O ATOM 1245 CB ARG A 82 -4.109 10.867 3.419 1.00 0.00 C ATOM 1246 CG ARG A 82 -4.600 12.307 3.259 1.00 0.00 C ATOM 1247 CD ARG A 82 -6.087 12.342 2.900 1.00 0.00 C ATOM 1248 NE ARG A 82 -6.906 12.174 4.121 1.00 0.00 N ATOM 1249 CZ ARG A 82 -8.245 12.122 4.127 1.00 0.00 C ATOM 1250 NH1 ARG A 82 -8.924 12.225 2.976 1.00 0.00 N ATOM 1251 NH2 ARG A 82 -8.905 11.967 5.282 1.00 0.00 N ATOM 0 H ARG A 82 -2.524 11.673 1.679 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.306 11.498 4.399 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.397 10.282 2.546 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.591 10.409 4.283 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.433 12.857 4.185 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.023 12.808 2.482 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.331 13.288 2.416 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.316 11.550 2.187 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.421 12.093 5.014 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.421 12.343 2.096 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.943 12.185 2.980 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -8.388 11.888 6.158 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.924 11.928 5.286 1.00 0.00 H new ATOM 1265 N ILE A 83 -2.511 8.473 3.057 1.00 0.00 N ATOM 1266 CA ILE A 83 -2.174 7.074 3.261 1.00 0.00 C ATOM 1267 C ILE A 83 -0.734 6.970 3.768 1.00 0.00 C ATOM 1268 O ILE A 83 -0.474 6.321 4.780 1.00 0.00 O ATOM 1269 CB ILE A 83 -2.438 6.268 1.988 1.00 0.00 C ATOM 1270 CG1 ILE A 83 -3.940 6.119 1.734 1.00 0.00 C ATOM 1271 CG2 ILE A 83 -1.728 4.914 2.039 1.00 0.00 C ATOM 1272 CD1 ILE A 83 -4.274 6.361 0.261 1.00 0.00 C ATOM 0 H ILE A 83 -3.021 8.668 2.195 1.00 0.00 H new ATOM 0 HA ILE A 83 -2.814 6.635 4.026 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.022 6.818 1.144 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -4.264 5.120 2.025 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.489 6.826 2.356 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -1.932 4.361 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -0.654 5.070 2.137 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -2.091 4.345 2.894 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -5.347 6.249 0.108 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.971 7.370 -0.020 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.742 5.637 -0.356 1.00 0.00 H new ATOM 1284 N LEU A 84 0.164 7.618 3.040 1.00 0.00 N ATOM 1285 CA LEU A 84 1.570 7.606 3.403 1.00 0.00 C ATOM 1286 C LEU A 84 1.724 8.091 4.846 1.00 0.00 C ATOM 1287 O LEU A 84 2.423 7.467 5.643 1.00 0.00 O ATOM 1288 CB LEU A 84 2.391 8.411 2.393 1.00 0.00 C ATOM 1289 CG LEU A 84 2.364 7.902 0.950 1.00 0.00 C ATOM 1290 CD1 LEU A 84 2.997 8.919 -0.002 1.00 0.00 C ATOM 1291 CD2 LEU A 84 3.025 6.527 0.841 1.00 0.00 C ATOM 0 H LEU A 84 -0.055 8.154 2.201 1.00 0.00 H new ATOM 0 HA LEU A 84 1.965 6.591 3.363 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.032 9.440 2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.427 8.432 2.731 1.00 0.00 H new ATOM 0 HG LEU A 84 1.323 7.784 0.649 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.965 8.533 -1.021 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.444 9.857 0.048 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.033 9.093 0.288 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.992 6.189 -0.195 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.063 6.595 1.168 1.00 0.00 H new ATOM 0 HD23 LEU A 84 2.492 5.816 1.472 1.00 0.00 H new ATOM 1303 N ASP A 85 1.061 9.201 5.138 1.00 0.00 N ATOM 1304 CA ASP A 85 1.116 9.776 6.471 1.00 0.00 C ATOM 1305 C ASP A 85 0.766 8.701 7.501 1.00 0.00 C ATOM 1306 O ASP A 85 1.159 8.798 8.663 1.00 0.00 O ATOM 1307 CB ASP A 85 0.108 10.918 6.619 1.00 0.00 C ATOM 1308 CG ASP A 85 0.650 12.173 7.306 1.00 0.00 C ATOM 1309 OD1 ASP A 85 1.862 12.176 7.610 1.00 0.00 O ATOM 1310 OD2 ASP A 85 -0.161 13.102 7.512 1.00 0.00 O ATOM 0 H ASP A 85 0.483 9.717 4.474 1.00 0.00 H new ATOM 0 HA ASP A 85 2.124 10.160 6.631 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.256 11.192 5.629 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -0.750 10.554 7.184 1.00 0.00 H new ATOM 1315 N SER A 86 0.032 7.699 7.038 1.00 0.00 N ATOM 1316 CA SER A 86 -0.374 6.607 7.905 1.00 0.00 C ATOM 1317 C SER A 86 0.321 5.313 7.477 1.00 0.00 C ATOM 1318 O SER A 86 -0.130 4.220 7.817 1.00 0.00 O ATOM 1319 CB SER A 86 -1.893 6.424 7.886 1.00 0.00 C ATOM 1320 OG SER A 86 -2.485 6.743 9.142 1.00 0.00 O ATOM 0 H SER A 86 -0.292 7.621 6.074 1.00 0.00 H new ATOM 0 HA SER A 86 -0.077 6.852 8.925 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.325 7.057 7.111 1.00 0.00 H new ATOM 0 HB3 SER A 86 -2.131 5.393 7.625 1.00 0.00 H new ATOM 0 HG SER A 86 -2.047 7.535 9.518 1.00 0.00 H new ATOM 1326 N ALA A 87 1.407 5.479 6.737 1.00 0.00 N ATOM 1327 CA ALA A 87 2.169 4.338 6.259 1.00 0.00 C ATOM 1328 C ALA A 87 2.402 3.365 7.417 1.00 0.00 C ATOM 1329 O ALA A 87 2.300 2.152 7.243 1.00 0.00 O ATOM 1330 CB ALA A 87 3.478 4.824 5.634 1.00 0.00 C ATOM 0 H ALA A 87 1.778 6.387 6.457 1.00 0.00 H new ATOM 0 HA ALA A 87 1.617 3.804 5.486 1.00 0.00 H new ATOM 0 HB1 ALA A 87 4.050 3.968 5.275 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.258 5.489 4.799 1.00 0.00 H new ATOM 0 HB3 ALA A 87 4.061 5.362 6.382 1.00 0.00 H new ATOM 1336 N GLU A 88 2.711 3.934 8.573 1.00 0.00 N ATOM 1337 CA GLU A 88 2.959 3.132 9.759 1.00 0.00 C ATOM 1338 C GLU A 88 1.656 2.503 10.257 1.00 0.00 C ATOM 1339 O GLU A 88 1.671 1.433 10.863 1.00 0.00 O ATOM 1340 CB GLU A 88 3.621 3.967 10.857 1.00 0.00 C ATOM 1341 CG GLU A 88 2.677 5.063 11.356 1.00 0.00 C ATOM 1342 CD GLU A 88 3.384 5.984 12.352 1.00 0.00 C ATOM 1343 OE1 GLU A 88 3.639 5.510 13.480 1.00 0.00 O ATOM 1344 OE2 GLU A 88 3.654 7.141 11.963 1.00 0.00 O ATOM 0 H GLU A 88 2.795 4.941 8.714 1.00 0.00 H new ATOM 0 HA GLU A 88 3.648 2.330 9.494 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.906 3.322 11.688 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.537 4.417 10.474 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.313 5.647 10.511 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.806 4.610 11.829 1.00 0.00 H new ATOM 1351 N PHE A 89 0.560 3.196 9.984 1.00 0.00 N ATOM 1352 CA PHE A 89 -0.749 2.720 10.397 1.00 0.00 C ATOM 1353 C PHE A 89 -1.251 1.617 9.462 1.00 0.00 C ATOM 1354 O PHE A 89 -1.849 0.641 9.912 1.00 0.00 O ATOM 1355 CB PHE A 89 -1.704 3.912 10.319 1.00 0.00 C ATOM 1356 CG PHE A 89 -1.891 4.647 11.648 1.00 0.00 C ATOM 1357 CD1 PHE A 89 -2.396 3.986 12.725 1.00 0.00 C ATOM 1358 CD2 PHE A 89 -1.553 5.960 11.753 1.00 0.00 C ATOM 1359 CE1 PHE A 89 -2.570 4.668 13.958 1.00 0.00 C ATOM 1360 CE2 PHE A 89 -1.727 6.641 12.987 1.00 0.00 C ATOM 1361 CZ PHE A 89 -2.231 5.981 14.063 1.00 0.00 C ATOM 0 H PHE A 89 0.552 4.084 9.482 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.694 2.308 11.405 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.330 4.616 9.576 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.676 3.564 9.968 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.664 2.943 12.642 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.152 6.485 10.898 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.972 4.144 14.813 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.459 7.684 13.071 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.362 6.499 15.001 1.00 0.00 H new ATOM 1371 N ILE A 90 -0.989 1.810 8.177 1.00 0.00 N ATOM 1372 CA ILE A 90 -1.408 0.845 7.175 1.00 0.00 C ATOM 1373 C ILE A 90 -1.204 -0.570 7.720 1.00 0.00 C ATOM 1374 O ILE A 90 -0.286 -0.811 8.503 1.00 0.00 O ATOM 1375 CB ILE A 90 -0.688 1.103 5.850 1.00 0.00 C ATOM 1376 CG1 ILE A 90 -0.907 2.542 5.378 1.00 0.00 C ATOM 1377 CG2 ILE A 90 -1.109 0.083 4.790 1.00 0.00 C ATOM 1378 CD1 ILE A 90 -2.345 2.994 5.643 1.00 0.00 C ATOM 0 H ILE A 90 -0.492 2.620 7.807 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.471 0.955 6.961 1.00 0.00 H new ATOM 0 HB ILE A 90 0.382 0.976 6.013 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.213 3.207 5.892 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -0.689 2.616 4.313 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.583 0.289 3.858 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.861 -0.921 5.133 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.184 0.154 4.623 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.473 4.020 5.298 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.036 2.342 5.108 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.552 2.942 6.712 1.00 0.00 H new ATOM 1390 N LYS A 91 -2.074 -1.469 7.285 1.00 0.00 N ATOM 1391 CA LYS A 91 -2.002 -2.853 7.719 1.00 0.00 C ATOM 1392 C LYS A 91 -2.816 -3.727 6.762 1.00 0.00 C ATOM 1393 O LYS A 91 -3.782 -3.261 6.161 1.00 0.00 O ATOM 1394 CB LYS A 91 -2.430 -2.979 9.182 1.00 0.00 C ATOM 1395 CG LYS A 91 -2.039 -4.344 9.753 1.00 0.00 C ATOM 1396 CD LYS A 91 -3.231 -5.303 9.746 1.00 0.00 C ATOM 1397 CE LYS A 91 -3.855 -5.412 11.139 1.00 0.00 C ATOM 1398 NZ LYS A 91 -5.081 -4.588 11.223 1.00 0.00 N ATOM 0 H LYS A 91 -2.834 -1.265 6.635 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.973 -3.211 7.680 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.964 -2.188 9.770 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -3.509 -2.843 9.262 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.224 -4.767 9.167 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.670 -4.224 10.772 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -3.979 -4.954 9.035 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -2.908 -6.288 9.410 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -4.094 -6.453 11.357 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -3.138 -5.085 11.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -5.583 -4.802 12.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -4.824 -3.580 11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -5.699 -4.802 10.414 1.00 0.00 H new ATOM 1412 N PHE A 92 -2.395 -4.978 6.652 1.00 0.00 N ATOM 1413 CA PHE A 92 -3.073 -5.921 5.778 1.00 0.00 C ATOM 1414 C PHE A 92 -3.190 -7.295 6.441 1.00 0.00 C ATOM 1415 O PHE A 92 -2.181 -7.928 6.749 1.00 0.00 O ATOM 1416 CB PHE A 92 -2.224 -6.049 4.512 1.00 0.00 C ATOM 1417 CG PHE A 92 -2.400 -4.893 3.525 1.00 0.00 C ATOM 1418 CD1 PHE A 92 -1.936 -3.654 3.840 1.00 0.00 C ATOM 1419 CD2 PHE A 92 -3.020 -5.105 2.334 1.00 0.00 C ATOM 1420 CE1 PHE A 92 -2.099 -2.581 2.924 1.00 0.00 C ATOM 1421 CE2 PHE A 92 -3.183 -4.032 1.418 1.00 0.00 C ATOM 1422 CZ PHE A 92 -2.720 -2.793 1.732 1.00 0.00 C ATOM 0 H PHE A 92 -1.593 -5.361 7.153 1.00 0.00 H new ATOM 0 HA PHE A 92 -4.080 -5.566 5.557 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -1.174 -6.114 4.796 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.477 -6.983 4.010 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.444 -3.486 4.786 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.388 -6.089 2.084 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -1.730 -1.597 3.173 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.675 -4.200 0.471 1.00 0.00 H new ATOM 0 HZ PHE A 92 -2.845 -1.977 1.035 1.00 0.00 H new ATOM 1432 N THR A 93 -4.430 -7.717 6.640 1.00 0.00 N ATOM 1433 CA THR A 93 -4.692 -9.005 7.261 1.00 0.00 C ATOM 1434 C THR A 93 -5.189 -10.008 6.218 1.00 0.00 C ATOM 1435 O THR A 93 -6.158 -9.741 5.508 1.00 0.00 O ATOM 1436 CB THR A 93 -5.677 -8.784 8.410 1.00 0.00 C ATOM 1437 OG1 THR A 93 -5.019 -7.845 9.256 1.00 0.00 O ATOM 1438 CG2 THR A 93 -5.841 -10.026 9.288 1.00 0.00 C ATOM 0 H THR A 93 -5.265 -7.190 6.382 1.00 0.00 H new ATOM 0 HA THR A 93 -3.781 -9.438 7.674 1.00 0.00 H new ATOM 0 HB THR A 93 -6.647 -8.495 8.005 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.589 -7.644 10.027 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.551 -9.815 10.088 1.00 0.00 H new ATOM 0 HG22 THR A 93 -6.212 -10.853 8.683 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.877 -10.296 9.720 1.00 0.00 H new ATOM 1446 N VAL A 94 -4.504 -11.140 6.158 1.00 0.00 N ATOM 1447 CA VAL A 94 -4.864 -12.184 5.214 1.00 0.00 C ATOM 1448 C VAL A 94 -5.728 -13.229 5.922 1.00 0.00 C ATOM 1449 O VAL A 94 -5.240 -14.297 6.290 1.00 0.00 O ATOM 1450 CB VAL A 94 -3.602 -12.778 4.585 1.00 0.00 C ATOM 1451 CG1 VAL A 94 -3.934 -14.025 3.763 1.00 0.00 C ATOM 1452 CG2 VAL A 94 -2.873 -11.738 3.732 1.00 0.00 C ATOM 0 H VAL A 94 -3.701 -11.357 6.748 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.456 -11.773 4.396 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.934 -13.077 5.393 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.020 -14.427 3.327 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -4.389 -14.776 4.409 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -4.630 -13.761 2.967 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.980 -12.186 3.297 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -3.532 -11.395 2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.587 -10.891 4.356 1.00 0.00 H new ATOM 1462 N ILE A 95 -6.996 -12.886 6.090 1.00 0.00 N ATOM 1463 CA ILE A 95 -7.933 -13.782 6.747 1.00 0.00 C ATOM 1464 C ILE A 95 -8.003 -15.098 5.971 1.00 0.00 C ATOM 1465 O ILE A 95 -7.798 -16.170 6.540 1.00 0.00 O ATOM 1466 CB ILE A 95 -9.291 -13.100 6.925 1.00 0.00 C ATOM 1467 CG1 ILE A 95 -9.237 -12.050 8.036 1.00 0.00 C ATOM 1468 CG2 ILE A 95 -10.395 -14.132 7.165 1.00 0.00 C ATOM 1469 CD1 ILE A 95 -8.309 -10.895 7.655 1.00 0.00 C ATOM 0 H ILE A 95 -7.397 -12.000 5.783 1.00 0.00 H new ATOM 0 HA ILE A 95 -7.589 -14.023 7.753 1.00 0.00 H new ATOM 0 HB ILE A 95 -9.534 -12.577 6.000 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -10.239 -11.667 8.229 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -8.889 -12.511 8.960 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.350 -13.621 7.288 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -10.453 -14.808 6.312 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.170 -14.703 8.066 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -8.289 -10.163 8.462 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -7.302 -11.277 7.487 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -8.674 -10.421 6.744 1.00 0.00 H new ATOM 1481 N ARG A 96 -8.291 -14.975 4.684 1.00 0.00 N ATOM 1482 CA ARG A 96 -8.390 -16.142 3.824 1.00 0.00 C ATOM 1483 C ARG A 96 -7.873 -15.814 2.422 1.00 0.00 C ATOM 1484 O ARG A 96 -8.230 -14.786 1.849 1.00 0.00 O ATOM 1485 CB ARG A 96 -9.836 -16.632 3.725 1.00 0.00 C ATOM 1486 CG ARG A 96 -10.784 -15.479 3.388 1.00 0.00 C ATOM 1487 CD ARG A 96 -12.202 -15.773 3.880 1.00 0.00 C ATOM 1488 NE ARG A 96 -13.088 -16.058 2.729 1.00 0.00 N ATOM 1489 CZ ARG A 96 -14.368 -16.438 2.842 1.00 0.00 C ATOM 1490 NH1 ARG A 96 -14.920 -16.582 4.055 1.00 0.00 N ATOM 1491 NH2 ARG A 96 -15.097 -16.675 1.742 1.00 0.00 N ATOM 0 H ARG A 96 -8.459 -14.085 4.216 1.00 0.00 H new ATOM 0 HA ARG A 96 -7.780 -16.931 4.264 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -9.910 -17.404 2.959 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.134 -17.089 4.669 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -10.420 -14.559 3.845 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -10.796 -15.316 2.310 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.191 -16.625 4.560 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -12.585 -14.921 4.442 1.00 0.00 H new ATOM 0 HE ARG A 96 -12.700 -15.959 1.791 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -14.366 -16.402 4.892 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -15.894 -16.871 4.141 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -14.677 -16.566 0.819 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -16.071 -16.964 1.828 1.00 0.00 H new ATOM 1505 N PRO A 97 -7.016 -16.731 1.896 1.00 0.00 N ATOM 1506 CA PRO A 97 -6.446 -16.549 0.573 1.00 0.00 C ATOM 1507 C PRO A 97 -7.481 -16.841 -0.515 1.00 0.00 C ATOM 1508 O PRO A 97 -8.551 -17.378 -0.231 1.00 0.00 O ATOM 1509 CB PRO A 97 -5.253 -17.490 0.526 1.00 0.00 C ATOM 1510 CG PRO A 97 -5.473 -18.498 1.642 1.00 0.00 C ATOM 1511 CD PRO A 97 -6.571 -17.960 2.546 1.00 0.00 C ATOM 0 HA PRO A 97 -6.134 -15.521 0.387 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -5.186 -17.987 -0.442 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -4.320 -16.945 0.670 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -5.757 -19.467 1.231 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -4.553 -18.649 2.207 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -7.388 -18.674 2.645 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -6.196 -17.764 3.551 1.00 0.00 H new ATOM 1519 N PHE A 98 -7.127 -16.475 -1.738 1.00 0.00 N ATOM 1520 CA PHE A 98 -8.012 -16.691 -2.870 1.00 0.00 C ATOM 1521 C PHE A 98 -7.857 -18.108 -3.425 1.00 0.00 C ATOM 1522 O PHE A 98 -6.901 -18.808 -3.093 1.00 0.00 O ATOM 1523 CB PHE A 98 -7.609 -15.686 -3.951 1.00 0.00 C ATOM 1524 CG PHE A 98 -7.066 -14.365 -3.402 1.00 0.00 C ATOM 1525 CD1 PHE A 98 -7.863 -13.564 -2.647 1.00 0.00 C ATOM 1526 CD2 PHE A 98 -5.785 -13.993 -3.669 1.00 0.00 C ATOM 1527 CE1 PHE A 98 -7.360 -12.338 -2.137 1.00 0.00 C ATOM 1528 CE2 PHE A 98 -5.281 -12.767 -3.159 1.00 0.00 C ATOM 1529 CZ PHE A 98 -6.079 -11.966 -2.404 1.00 0.00 C ATOM 0 H PHE A 98 -6.239 -16.030 -1.970 1.00 0.00 H new ATOM 0 HA PHE A 98 -9.049 -16.562 -2.561 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -6.852 -16.140 -4.591 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.475 -15.478 -4.580 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -8.880 -13.860 -2.435 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -5.151 -14.630 -4.269 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -7.994 -11.701 -1.538 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.264 -12.471 -3.371 1.00 0.00 H new ATOM 0 HZ PHE A 98 -5.696 -11.034 -2.016 1.00 0.00 H new ATOM 1539 N PRO A 99 -8.837 -18.500 -4.283 1.00 0.00 N ATOM 1540 CA PRO A 99 -8.818 -19.822 -4.887 1.00 0.00 C ATOM 1541 C PRO A 99 -7.767 -19.903 -5.996 1.00 0.00 C ATOM 1542 O PRO A 99 -8.066 -19.639 -7.159 1.00 0.00 O ATOM 1543 CB PRO A 99 -10.234 -20.042 -5.393 1.00 0.00 C ATOM 1544 CG PRO A 99 -10.869 -18.663 -5.471 1.00 0.00 C ATOM 1545 CD PRO A 99 -9.984 -17.699 -4.699 1.00 0.00 C ATOM 0 HA PRO A 99 -8.535 -20.603 -4.182 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -10.229 -20.525 -6.370 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -10.793 -20.692 -4.719 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -10.965 -18.345 -6.509 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -11.874 -18.681 -5.049 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -9.675 -16.859 -5.322 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -10.508 -17.282 -3.839 1.00 0.00 H new ATOM 1553 N GLY A 100 -6.559 -20.270 -5.595 1.00 0.00 N ATOM 1554 CA GLY A 100 -5.462 -20.390 -6.541 1.00 0.00 C ATOM 1555 C GLY A 100 -4.254 -19.567 -6.086 1.00 0.00 C ATOM 1556 O GLY A 100 -3.228 -19.539 -6.763 1.00 0.00 O ATOM 0 H GLY A 100 -6.315 -20.488 -4.629 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -5.176 -21.437 -6.641 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -5.787 -20.052 -7.525 1.00 0.00 H new ATOM 1560 N LEU A 101 -4.417 -18.918 -4.943 1.00 0.00 N ATOM 1561 CA LEU A 101 -3.353 -18.097 -4.390 1.00 0.00 C ATOM 1562 C LEU A 101 -2.293 -19.002 -3.759 1.00 0.00 C ATOM 1563 O LEU A 101 -2.564 -20.161 -3.450 1.00 0.00 O ATOM 1564 CB LEU A 101 -3.925 -17.056 -3.426 1.00 0.00 C ATOM 1565 CG LEU A 101 -2.949 -15.983 -2.940 1.00 0.00 C ATOM 1566 CD1 LEU A 101 -2.581 -15.023 -4.073 1.00 0.00 C ATOM 1567 CD2 LEU A 101 -3.506 -15.246 -1.721 1.00 0.00 C ATOM 0 H LEU A 101 -5.270 -18.944 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.860 -17.529 -5.179 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.765 -16.561 -3.914 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.324 -17.577 -2.556 1.00 0.00 H new ATOM 0 HG LEU A 101 -2.029 -16.476 -2.625 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -1.886 -14.270 -3.701 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.112 -15.580 -4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.482 -14.534 -4.443 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -2.792 -14.489 -1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -4.449 -14.767 -1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -3.675 -15.957 -0.912 1.00 0.00 H new ATOM 1579 N VAL A 102 -1.106 -18.438 -3.587 1.00 0.00 N ATOM 1580 CA VAL A 102 -0.004 -19.179 -2.998 1.00 0.00 C ATOM 1581 C VAL A 102 0.958 -18.201 -2.320 1.00 0.00 C ATOM 1582 O VAL A 102 1.113 -17.066 -2.767 1.00 0.00 O ATOM 1583 CB VAL A 102 0.675 -20.042 -4.064 1.00 0.00 C ATOM 1584 CG1 VAL A 102 1.866 -20.803 -3.477 1.00 0.00 C ATOM 1585 CG2 VAL A 102 -0.325 -21.003 -4.709 1.00 0.00 C ATOM 0 H VAL A 102 -0.884 -17.477 -3.845 1.00 0.00 H new ATOM 0 HA VAL A 102 -0.370 -19.861 -2.230 1.00 0.00 H new ATOM 0 HB VAL A 102 1.052 -19.378 -4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.330 -21.408 -4.255 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.595 -20.093 -3.086 1.00 0.00 H new ATOM 0 HG13 VAL A 102 1.522 -21.451 -2.670 1.00 0.00 H new ATOM 0 HG21 VAL A 102 0.183 -21.605 -5.463 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.745 -21.657 -3.945 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -1.126 -20.433 -5.179 1.00 0.00 H new ATOM 1595 N ILE A 103 1.579 -18.677 -1.251 1.00 0.00 N ATOM 1596 CA ILE A 103 2.521 -17.859 -0.506 1.00 0.00 C ATOM 1597 C ILE A 103 3.943 -18.358 -0.771 1.00 0.00 C ATOM 1598 O ILE A 103 4.618 -18.835 0.140 1.00 0.00 O ATOM 1599 CB ILE A 103 2.148 -17.827 0.977 1.00 0.00 C ATOM 1600 CG1 ILE A 103 0.713 -17.331 1.171 1.00 0.00 C ATOM 1601 CG2 ILE A 103 3.154 -16.999 1.778 1.00 0.00 C ATOM 1602 CD1 ILE A 103 0.217 -17.627 2.587 1.00 0.00 C ATOM 0 H ILE A 103 1.448 -19.619 -0.883 1.00 0.00 H new ATOM 0 HA ILE A 103 2.477 -16.824 -0.844 1.00 0.00 H new ATOM 0 HB ILE A 103 2.191 -18.846 1.362 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.667 -16.258 0.983 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.057 -17.811 0.444 1.00 0.00 H new ATOM 0 HG21 ILE A 103 2.865 -16.993 2.829 1.00 0.00 H new ATOM 0 HG22 ILE A 103 4.147 -17.436 1.677 1.00 0.00 H new ATOM 0 HG23 ILE A 103 3.167 -15.977 1.399 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.805 -17.264 2.698 1.00 0.00 H new ATOM 0 HD12 ILE A 103 0.242 -18.702 2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 103 0.860 -17.126 3.310 1.00 0.00 H new ATOM 1614 N ASN A 104 4.357 -18.230 -2.024 1.00 0.00 N ATOM 1615 CA ASN A 104 5.687 -18.661 -2.420 1.00 0.00 C ATOM 1616 C ASN A 104 6.159 -17.818 -3.606 1.00 0.00 C ATOM 1617 O ASN A 104 5.358 -17.432 -4.456 1.00 0.00 O ATOM 1618 CB ASN A 104 5.683 -20.128 -2.854 1.00 0.00 C ATOM 1619 CG ASN A 104 6.979 -20.827 -2.439 1.00 0.00 C ATOM 1620 OD1 ASN A 104 7.058 -21.489 -1.417 1.00 0.00 O ATOM 1621 ND2 ASN A 104 7.989 -20.642 -3.285 1.00 0.00 N ATOM 0 H ASN A 104 3.795 -17.834 -2.777 1.00 0.00 H new ATOM 0 HA ASN A 104 6.350 -18.540 -1.564 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.831 -20.640 -2.408 1.00 0.00 H new ATOM 0 HB3 ASN A 104 5.562 -20.191 -3.935 1.00 0.00 H new ATOM 0 HD21 ASN A 104 8.897 -21.066 -3.096 1.00 0.00 H new ATOM 0 HD22 ASN A 104 7.855 -20.076 -4.123 1.00 0.00 H new ATOM 1628 N ASN A 105 7.458 -17.558 -3.626 1.00 0.00 N ATOM 1629 CA ASN A 105 8.047 -16.768 -4.694 1.00 0.00 C ATOM 1630 C ASN A 105 7.625 -17.349 -6.045 1.00 0.00 C ATOM 1631 O ASN A 105 7.441 -18.559 -6.174 1.00 0.00 O ATOM 1632 CB ASN A 105 9.575 -16.797 -4.623 1.00 0.00 C ATOM 1633 CG ASN A 105 10.076 -18.169 -4.167 1.00 0.00 C ATOM 1634 OD1 ASN A 105 9.900 -19.135 -5.065 1.00 0.00 O flip ATOM 1635 ND2 ASN A 105 10.588 -18.340 -3.073 1.00 0.00 N flip ATOM 0 H ASN A 105 8.119 -17.880 -2.920 1.00 0.00 H new ATOM 0 HA ASN A 105 7.701 -15.740 -4.583 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.993 -16.560 -5.601 1.00 0.00 H new ATOM 0 HB3 ASN A 105 9.925 -16.030 -3.932 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.693 -17.555 -2.431 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.911 -19.268 -2.801 1.00 0.00 H new ATOM 1642 N GLN A 106 7.483 -16.461 -7.017 1.00 0.00 N ATOM 1643 CA GLN A 106 7.087 -16.870 -8.354 1.00 0.00 C ATOM 1644 C GLN A 106 7.453 -15.788 -9.372 1.00 0.00 C ATOM 1645 O GLN A 106 6.800 -15.658 -10.406 1.00 0.00 O ATOM 1646 CB GLN A 106 5.591 -17.191 -8.408 1.00 0.00 C ATOM 1647 CG GLN A 106 5.358 -18.694 -8.566 1.00 0.00 C ATOM 1648 CD GLN A 106 5.393 -19.102 -10.040 1.00 0.00 C ATOM 1649 OE1 GLN A 106 4.419 -18.987 -10.766 1.00 0.00 O ATOM 1650 NE2 GLN A 106 6.566 -19.585 -10.440 1.00 0.00 N ATOM 0 H GLN A 106 7.635 -15.459 -6.906 1.00 0.00 H new ATOM 0 HA GLN A 106 7.630 -17.779 -8.610 1.00 0.00 H new ATOM 0 HB2 GLN A 106 5.107 -16.838 -7.497 1.00 0.00 H new ATOM 0 HB3 GLN A 106 5.131 -16.659 -9.241 1.00 0.00 H new ATOM 0 HG2 GLN A 106 6.121 -19.244 -8.015 1.00 0.00 H new ATOM 0 HG3 GLN A 106 4.395 -18.964 -8.133 1.00 0.00 H new ATOM 0 HE21 GLN A 106 7.341 -19.654 -9.780 1.00 0.00 H new ATOM 0 HE22 GLN A 106 6.691 -19.886 -11.407 1.00 0.00 H new ATOM 1659 N LEU A 107 8.496 -15.040 -9.043 1.00 0.00 N ATOM 1660 CA LEU A 107 8.956 -13.973 -9.915 1.00 0.00 C ATOM 1661 C LEU A 107 9.320 -14.559 -11.281 1.00 0.00 C ATOM 1662 O LEU A 107 9.908 -15.637 -11.361 1.00 0.00 O ATOM 1663 CB LEU A 107 10.097 -13.197 -9.255 1.00 0.00 C ATOM 1664 CG LEU A 107 11.506 -13.744 -9.492 1.00 0.00 C ATOM 1665 CD1 LEU A 107 11.614 -15.198 -9.030 1.00 0.00 C ATOM 1666 CD2 LEU A 107 11.921 -13.575 -10.955 1.00 0.00 C ATOM 0 H LEU A 107 9.035 -15.152 -8.185 1.00 0.00 H new ATOM 0 HA LEU A 107 8.161 -13.246 -10.081 1.00 0.00 H new ATOM 0 HB2 LEU A 107 10.064 -12.168 -9.612 1.00 0.00 H new ATOM 0 HB3 LEU A 107 9.916 -13.168 -8.181 1.00 0.00 H new ATOM 0 HG LEU A 107 12.204 -13.162 -8.890 1.00 0.00 H new ATOM 0 HD11 LEU A 107 12.625 -15.563 -9.210 1.00 0.00 H new ATOM 0 HD12 LEU A 107 11.390 -15.259 -7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 107 10.904 -15.810 -9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 107 12.926 -13.972 -11.096 1.00 0.00 H new ATOM 0 HD22 LEU A 107 11.224 -14.116 -11.596 1.00 0.00 H new ATOM 0 HD23 LEU A 107 11.909 -12.517 -11.217 1.00 0.00 H new ATOM 1678 N VAL A 108 8.956 -13.823 -12.321 1.00 0.00 N ATOM 1679 CA VAL A 108 9.237 -14.256 -13.679 1.00 0.00 C ATOM 1680 C VAL A 108 8.895 -15.741 -13.817 1.00 0.00 C ATOM 1681 O VAL A 108 9.728 -16.602 -13.541 1.00 0.00 O ATOM 1682 CB VAL A 108 10.690 -13.942 -14.038 1.00 0.00 C ATOM 1683 CG1 VAL A 108 11.112 -14.679 -15.311 1.00 0.00 C ATOM 1684 CG2 VAL A 108 10.906 -12.434 -14.181 1.00 0.00 C ATOM 0 H VAL A 108 8.469 -12.930 -12.250 1.00 0.00 H new ATOM 0 HA VAL A 108 8.615 -13.711 -14.390 1.00 0.00 H new ATOM 0 HB VAL A 108 11.320 -14.295 -13.222 1.00 0.00 H new ATOM 0 HG11 VAL A 108 12.149 -14.438 -15.544 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.014 -15.754 -15.158 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.473 -14.371 -16.139 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.947 -12.238 -14.436 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.260 -12.047 -14.969 1.00 0.00 H new ATOM 0 HG23 VAL A 108 10.665 -11.941 -13.239 1.00 0.00 H new ATOM 1694 N SER A 109 7.667 -15.995 -14.245 1.00 0.00 N ATOM 1695 CA SER A 109 7.204 -17.361 -14.423 1.00 0.00 C ATOM 1696 C SER A 109 7.479 -17.824 -15.855 1.00 0.00 C ATOM 1697 O SER A 109 7.448 -17.022 -16.788 1.00 0.00 O ATOM 1698 CB SER A 109 5.713 -17.484 -14.103 1.00 0.00 C ATOM 1699 OG SER A 109 5.488 -18.048 -12.814 1.00 0.00 O ATOM 0 H SER A 109 6.978 -15.278 -14.474 1.00 0.00 H new ATOM 0 HA SER A 109 7.751 -18.000 -13.729 1.00 0.00 H new ATOM 0 HB2 SER A 109 5.249 -16.499 -14.154 1.00 0.00 H new ATOM 0 HB3 SER A 109 5.230 -18.103 -14.859 1.00 0.00 H new ATOM 0 HG SER A 109 4.536 -18.254 -12.709 1.00 0.00 H new ATOM 1705 N GLY A 110 7.743 -19.116 -15.985 1.00 0.00 N ATOM 1706 CA GLY A 110 8.024 -19.695 -17.288 1.00 0.00 C ATOM 1707 C GLY A 110 7.061 -19.155 -18.347 1.00 0.00 C ATOM 1708 O GLY A 110 5.912 -19.586 -18.424 1.00 0.00 O ATOM 0 H GLY A 110 7.768 -19.778 -15.210 1.00 0.00 H new ATOM 0 HA2 GLY A 110 9.051 -19.470 -17.576 1.00 0.00 H new ATOM 0 HA3 GLY A 110 7.939 -20.780 -17.234 1.00 0.00 H new ATOM 1712 N PRO A 111 7.579 -18.194 -19.158 1.00 0.00 N ATOM 1713 CA PRO A 111 6.779 -17.590 -20.210 1.00 0.00 C ATOM 1714 C PRO A 111 6.613 -18.548 -21.392 1.00 0.00 C ATOM 1715 O PRO A 111 7.141 -19.659 -21.373 1.00 0.00 O ATOM 1716 CB PRO A 111 7.513 -16.312 -20.579 1.00 0.00 C ATOM 1717 CG PRO A 111 8.930 -16.480 -20.055 1.00 0.00 C ATOM 1718 CD PRO A 111 8.936 -17.659 -19.096 1.00 0.00 C ATOM 0 HA PRO A 111 5.761 -17.369 -19.890 1.00 0.00 H new ATOM 0 HB2 PRO A 111 7.511 -16.158 -21.658 1.00 0.00 H new ATOM 0 HB3 PRO A 111 7.032 -15.442 -20.132 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.623 -16.654 -20.878 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.259 -15.573 -19.547 1.00 0.00 H new ATOM 0 HD2 PRO A 111 9.671 -18.407 -19.393 1.00 0.00 H new ATOM 0 HD3 PRO A 111 9.192 -17.345 -18.084 1.00 0.00 H new ATOM 1726 N SER A 112 5.879 -18.082 -22.391 1.00 0.00 N ATOM 1727 CA SER A 112 5.637 -18.884 -23.579 1.00 0.00 C ATOM 1728 C SER A 112 6.849 -18.816 -24.511 1.00 0.00 C ATOM 1729 O SER A 112 6.734 -18.374 -25.653 1.00 0.00 O ATOM 1730 CB SER A 112 4.378 -18.417 -24.311 1.00 0.00 C ATOM 1731 OG SER A 112 3.199 -19.018 -23.782 1.00 0.00 O ATOM 0 H SER A 112 5.444 -17.160 -22.403 1.00 0.00 H new ATOM 0 HA SER A 112 5.482 -19.917 -23.269 1.00 0.00 H new ATOM 0 HB2 SER A 112 4.297 -17.333 -24.237 1.00 0.00 H new ATOM 0 HB3 SER A 112 4.464 -18.658 -25.370 1.00 0.00 H new ATOM 0 HG SER A 112 2.417 -18.693 -24.275 1.00 0.00 H new ATOM 1737 N SER A 113 7.982 -19.261 -23.988 1.00 0.00 N ATOM 1738 CA SER A 113 9.214 -19.256 -24.759 1.00 0.00 C ATOM 1739 C SER A 113 10.385 -19.695 -23.878 1.00 0.00 C ATOM 1740 O SER A 113 11.059 -20.678 -24.179 1.00 0.00 O ATOM 1741 CB SER A 113 9.486 -17.873 -25.354 1.00 0.00 C ATOM 1742 OG SER A 113 9.397 -17.877 -26.776 1.00 0.00 O ATOM 0 H SER A 113 8.073 -19.627 -23.040 1.00 0.00 H new ATOM 0 HA SER A 113 9.104 -19.961 -25.583 1.00 0.00 H new ATOM 0 HB2 SER A 113 8.772 -17.157 -24.948 1.00 0.00 H new ATOM 0 HB3 SER A 113 10.479 -17.538 -25.054 1.00 0.00 H new ATOM 0 HG SER A 113 8.470 -18.046 -27.045 1.00 0.00 H new ATOM 1748 N GLY A 114 10.591 -18.944 -22.806 1.00 0.00 N ATOM 1749 CA GLY A 114 11.668 -19.243 -21.878 1.00 0.00 C ATOM 1750 C GLY A 114 12.918 -19.717 -22.624 1.00 0.00 C ATOM 1751 O GLY A 114 13.418 -20.811 -22.370 1.00 0.00 O ATOM 0 H GLY A 114 10.030 -18.129 -22.559 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.905 -18.355 -21.292 1.00 0.00 H new ATOM 0 HA3 GLY A 114 11.345 -20.012 -21.176 1.00 0.00 H new TER 1755 GLY A 114