USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 724 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 81 ASN : amide:sc= 0 X(o=-4.3,f=-4.5) USER MOD Set 1.2: A 88 HIS : no HD1:sc= -2.59 X(o=-4.3,f=-4.5) USER MOD Set 1.3: A 92 SER OG : rot -120:sc= -1.67 USER MOD Set 2.1: A 61 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Set 2.2: A 65 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 52 SER OG : rot -30:sc= 1.05 USER MOD Set 3.2: A 78 TYR OH : rot 13:sc= 2.11 USER MOD Set 4.1: A 15 GLN :FLIP amide:sc= -0.867 X(o=-1.3,f=-0.84) USER MOD Set 4.2: A 17 GLN :FLIP amide:sc= 0.0243 F(o=-1.8,f=-0.84) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 15:sc= 1.13 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 CYS SG : rot 147:sc= 0.0334 USER MOD Single : A 10 GLN : amide:sc= -1.02 K(o=-1,f=-2.2!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 22:sc= 0.0266 USER MOD Single : A 27 ASN :FLIP amide:sc= -0.208 F(o=-3.3!,f=-0.21) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -2.97 K(o=-3,f=-3.8!) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.0132 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.703 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.381 X(o=-0.38,f=-0.38) USER MOD Single : A 58 CYS SG : rot 180:sc= 0.016 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 171:sc= -1.5 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot -161:sc= 0.977 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.027 36.845 2.125 1.00 0.00 N ATOM 2 CA GLY A 1 4.416 37.266 2.136 1.00 0.00 C ATOM 3 C GLY A 1 5.248 36.492 3.139 1.00 0.00 C ATOM 4 O GLY A 1 5.929 37.082 3.978 1.00 0.00 O ATOM 0 H1 GLY A 1 2.500 37.404 1.423 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.972 35.837 1.877 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.612 36.993 3.067 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.840 37.136 1.140 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.468 38.330 2.369 1.00 0.00 H new ATOM 8 N SER A 2 5.193 35.167 3.054 1.00 0.00 N ATOM 9 CA SER A 2 5.944 34.310 3.965 1.00 0.00 C ATOM 10 C SER A 2 7.440 34.596 3.870 1.00 0.00 C ATOM 11 O SER A 2 8.089 34.244 2.886 1.00 0.00 O ATOM 12 CB SER A 2 5.674 32.837 3.652 1.00 0.00 C ATOM 13 OG SER A 2 6.249 32.466 2.412 1.00 0.00 O ATOM 0 H SER A 2 4.636 34.663 2.364 1.00 0.00 H new ATOM 0 HA SER A 2 5.614 34.524 4.982 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.082 32.212 4.447 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.599 32.659 3.626 1.00 0.00 H new ATOM 0 HG SER A 2 6.887 33.153 2.129 1.00 0.00 H new ATOM 19 N SER A 3 7.980 35.237 4.902 1.00 0.00 N ATOM 20 CA SER A 3 9.398 35.575 4.935 1.00 0.00 C ATOM 21 C SER A 3 10.227 34.391 5.424 1.00 0.00 C ATOM 22 O SER A 3 11.147 33.940 4.743 1.00 0.00 O ATOM 23 CB SER A 3 9.635 36.785 5.840 1.00 0.00 C ATOM 24 OG SER A 3 10.960 37.269 5.709 1.00 0.00 O ATOM 0 H SER A 3 7.457 35.533 5.726 1.00 0.00 H new ATOM 0 HA SER A 3 9.711 35.822 3.920 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.929 37.576 5.587 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.446 36.509 6.878 1.00 0.00 H new ATOM 0 HG SER A 3 11.085 38.043 6.296 1.00 0.00 H new ATOM 30 N GLY A 4 9.892 33.891 6.609 1.00 0.00 N ATOM 31 CA GLY A 4 10.614 32.764 7.170 1.00 0.00 C ATOM 32 C GLY A 4 10.007 31.432 6.775 1.00 0.00 C ATOM 33 O GLY A 4 9.581 31.250 5.634 1.00 0.00 O ATOM 0 H GLY A 4 9.133 34.246 7.191 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.652 32.800 6.838 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.624 32.847 8.257 1.00 0.00 H new ATOM 37 N SER A 5 9.969 30.497 7.719 1.00 0.00 N ATOM 38 CA SER A 5 9.415 29.173 7.462 1.00 0.00 C ATOM 39 C SER A 5 7.901 29.172 7.648 1.00 0.00 C ATOM 40 O SER A 5 7.386 29.690 8.638 1.00 0.00 O ATOM 41 CB SER A 5 10.055 28.140 8.392 1.00 0.00 C ATOM 42 OG SER A 5 11.468 28.169 8.291 1.00 0.00 O ATOM 0 H SER A 5 10.315 30.632 8.669 1.00 0.00 H new ATOM 0 HA SER A 5 9.637 28.908 6.428 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.757 28.339 9.421 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.690 27.144 8.141 1.00 0.00 H new ATOM 0 HG SER A 5 11.853 27.501 8.896 1.00 0.00 H new ATOM 48 N SER A 6 7.194 28.586 6.687 1.00 0.00 N ATOM 49 CA SER A 6 5.738 28.520 6.741 1.00 0.00 C ATOM 50 C SER A 6 5.198 27.558 5.688 1.00 0.00 C ATOM 51 O SER A 6 5.457 27.715 4.495 1.00 0.00 O ATOM 52 CB SER A 6 5.136 29.911 6.533 1.00 0.00 C ATOM 53 OG SER A 6 3.855 30.007 7.131 1.00 0.00 O ATOM 0 H SER A 6 7.606 28.150 5.862 1.00 0.00 H new ATOM 0 HA SER A 6 5.452 28.151 7.726 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.798 30.665 6.960 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.060 30.122 5.466 1.00 0.00 H new ATOM 0 HG SER A 6 3.493 30.906 6.986 1.00 0.00 H new ATOM 59 N GLY A 7 4.446 26.558 6.138 1.00 0.00 N ATOM 60 CA GLY A 7 3.881 25.584 5.223 1.00 0.00 C ATOM 61 C GLY A 7 4.299 24.165 5.557 1.00 0.00 C ATOM 62 O GLY A 7 4.989 23.931 6.548 1.00 0.00 O ATOM 0 H GLY A 7 4.218 26.405 7.120 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.794 25.655 5.248 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.193 25.822 4.206 1.00 0.00 H new ATOM 66 N GLY A 8 3.878 23.215 4.727 1.00 0.00 N ATOM 67 CA GLY A 8 4.221 21.824 4.957 1.00 0.00 C ATOM 68 C GLY A 8 3.862 20.937 3.782 1.00 0.00 C ATOM 69 O GLY A 8 3.411 21.422 2.743 1.00 0.00 O ATOM 0 H GLY A 8 3.306 23.384 3.900 1.00 0.00 H new ATOM 0 HA2 GLY A 8 5.290 21.744 5.155 1.00 0.00 H new ATOM 0 HA3 GLY A 8 3.704 21.468 5.848 1.00 0.00 H new ATOM 73 N CYS A 9 4.062 19.633 3.944 1.00 0.00 N ATOM 74 CA CYS A 9 3.757 18.676 2.887 1.00 0.00 C ATOM 75 C CYS A 9 2.251 18.542 2.691 1.00 0.00 C ATOM 76 O CYS A 9 1.466 18.965 3.539 1.00 0.00 O ATOM 77 CB CYS A 9 4.364 17.311 3.216 1.00 0.00 C ATOM 78 SG CYS A 9 3.837 16.633 4.807 1.00 0.00 S ATOM 0 H CYS A 9 4.434 19.215 4.797 1.00 0.00 H new ATOM 0 HA CYS A 9 4.193 19.046 1.959 1.00 0.00 H new ATOM 0 HB2 CYS A 9 4.098 16.607 2.427 1.00 0.00 H new ATOM 0 HB3 CYS A 9 5.451 17.398 3.212 1.00 0.00 H new ATOM 0 HG CYS A 9 3.776 15.337 4.728 1.00 0.00 H new ATOM 84 N GLN A 10 1.855 17.953 1.567 1.00 0.00 N ATOM 85 CA GLN A 10 0.442 17.766 1.260 1.00 0.00 C ATOM 86 C GLN A 10 0.119 16.289 1.059 1.00 0.00 C ATOM 87 O GLN A 10 0.230 15.748 -0.041 1.00 0.00 O ATOM 88 CB GLN A 10 0.062 18.558 0.007 1.00 0.00 C ATOM 89 CG GLN A 10 -0.088 20.050 0.253 1.00 0.00 C ATOM 90 CD GLN A 10 -0.929 20.358 1.477 1.00 0.00 C ATOM 91 OE1 GLN A 10 -1.808 19.582 1.852 1.00 0.00 O ATOM 92 NE2 GLN A 10 -0.664 21.497 2.106 1.00 0.00 N ATOM 0 H GLN A 10 2.492 17.597 0.854 1.00 0.00 H new ATOM 0 HA GLN A 10 -0.139 18.134 2.105 1.00 0.00 H new ATOM 0 HB2 GLN A 10 0.822 18.399 -0.758 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -0.875 18.167 -0.389 1.00 0.00 H new ATOM 0 HG2 GLN A 10 0.899 20.496 0.374 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -0.543 20.515 -0.622 1.00 0.00 H new ATOM 0 HE21 GLN A 10 0.074 22.111 1.760 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -1.198 21.758 2.935 1.00 0.00 H new ATOM 101 N PRO A 11 -0.289 15.619 2.148 1.00 0.00 N ATOM 102 CA PRO A 11 -0.636 14.195 2.116 1.00 0.00 C ATOM 103 C PRO A 11 -1.927 13.930 1.349 1.00 0.00 C ATOM 104 O PRO A 11 -2.337 12.781 1.184 1.00 0.00 O ATOM 105 CB PRO A 11 -0.811 13.841 3.595 1.00 0.00 C ATOM 106 CG PRO A 11 -1.171 15.128 4.253 1.00 0.00 C ATOM 107 CD PRO A 11 -0.443 16.200 3.492 1.00 0.00 C ATOM 0 HA PRO A 11 0.123 13.601 1.607 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.592 13.094 3.733 1.00 0.00 H new ATOM 0 HB3 PRO A 11 0.106 13.425 4.014 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.248 15.293 4.225 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -0.876 15.126 5.302 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -1.011 17.130 3.465 1.00 0.00 H new ATOM 0 HD3 PRO A 11 0.522 16.429 3.944 1.00 0.00 H new ATOM 115 N SER A 12 -2.562 15.000 0.881 1.00 0.00 N ATOM 116 CA SER A 12 -3.808 14.882 0.133 1.00 0.00 C ATOM 117 C SER A 12 -3.534 14.749 -1.362 1.00 0.00 C ATOM 118 O SER A 12 -4.333 14.174 -2.102 1.00 0.00 O ATOM 119 CB SER A 12 -4.700 16.098 0.393 1.00 0.00 C ATOM 120 OG SER A 12 -4.278 17.213 -0.372 1.00 0.00 O ATOM 0 H SER A 12 -2.234 15.958 1.007 1.00 0.00 H new ATOM 0 HA SER A 12 -4.323 13.983 0.472 1.00 0.00 H new ATOM 0 HB2 SER A 12 -5.733 15.854 0.147 1.00 0.00 H new ATOM 0 HB3 SER A 12 -4.676 16.350 1.453 1.00 0.00 H new ATOM 0 HG SER A 12 -4.865 17.976 -0.189 1.00 0.00 H new ATOM 126 N ARG A 13 -2.399 15.284 -1.799 1.00 0.00 N ATOM 127 CA ARG A 13 -2.019 15.226 -3.205 1.00 0.00 C ATOM 128 C ARG A 13 -1.532 13.830 -3.580 1.00 0.00 C ATOM 129 O ARG A 13 -1.343 13.522 -4.757 1.00 0.00 O ATOM 130 CB ARG A 13 -0.927 16.256 -3.503 1.00 0.00 C ATOM 131 CG ARG A 13 -1.224 17.637 -2.944 1.00 0.00 C ATOM 132 CD ARG A 13 -2.008 18.483 -3.935 1.00 0.00 C ATOM 133 NE ARG A 13 -1.162 18.995 -5.009 1.00 0.00 N ATOM 134 CZ ARG A 13 -1.630 19.405 -6.182 1.00 0.00 C ATOM 135 NH1 ARG A 13 -2.932 19.364 -6.431 1.00 0.00 N ATOM 136 NH2 ARG A 13 -0.796 19.858 -7.109 1.00 0.00 N ATOM 0 H ARG A 13 -1.727 15.763 -1.200 1.00 0.00 H new ATOM 0 HA ARG A 13 -2.900 15.457 -3.803 1.00 0.00 H new ATOM 0 HB2 ARG A 13 0.017 15.902 -3.090 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -0.795 16.331 -4.582 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -1.790 17.542 -2.018 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -0.289 18.139 -2.696 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.814 17.887 -4.362 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.473 19.318 -3.410 1.00 0.00 H new ATOM 0 HE ARG A 13 -0.156 19.040 -4.849 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.576 19.017 -5.721 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -3.289 19.680 -7.333 1.00 0.00 H new ATOM 0 HH21 ARG A 13 0.206 19.892 -6.921 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -1.157 20.173 -8.010 1.00 0.00 H new ATOM 150 N VAL A 14 -1.331 12.988 -2.571 1.00 0.00 N ATOM 151 CA VAL A 14 -0.867 11.624 -2.795 1.00 0.00 C ATOM 152 C VAL A 14 -2.010 10.722 -3.246 1.00 0.00 C ATOM 153 O VAL A 14 -3.178 11.002 -2.977 1.00 0.00 O ATOM 154 CB VAL A 14 -0.232 11.032 -1.522 1.00 0.00 C ATOM 155 CG1 VAL A 14 0.502 9.739 -1.844 1.00 0.00 C ATOM 156 CG2 VAL A 14 0.705 12.040 -0.876 1.00 0.00 C ATOM 0 H VAL A 14 -1.482 13.227 -1.591 1.00 0.00 H new ATOM 0 HA VAL A 14 -0.113 11.671 -3.581 1.00 0.00 H new ATOM 0 HB VAL A 14 -1.027 10.804 -0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.944 9.335 -0.933 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.200 9.015 -2.258 1.00 0.00 H new ATOM 0 HG13 VAL A 14 1.289 9.939 -2.572 1.00 0.00 H new ATOM 0 HG21 VAL A 14 1.144 11.605 0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.497 12.302 -1.577 1.00 0.00 H new ATOM 0 HG23 VAL A 14 0.146 12.937 -0.608 1.00 0.00 H new ATOM 166 N GLN A 15 -1.665 9.638 -3.934 1.00 0.00 N ATOM 167 CA GLN A 15 -2.663 8.694 -4.423 1.00 0.00 C ATOM 168 C GLN A 15 -2.131 7.266 -4.375 1.00 0.00 C ATOM 169 O GLN A 15 -0.921 7.043 -4.384 1.00 0.00 O ATOM 170 CB GLN A 15 -3.074 9.050 -5.853 1.00 0.00 C ATOM 171 CG GLN A 15 -2.252 8.339 -6.917 1.00 0.00 C ATOM 172 CD GLN A 15 -2.603 8.788 -8.322 1.00 0.00 C ATOM 173 OE1 GLN A 15 -2.503 10.088 -8.571 1.00 0.00 O flip ATOM 174 NE2 GLN A 15 -2.962 7.974 -9.174 1.00 0.00 N flip ATOM 0 H GLN A 15 -0.702 9.392 -4.165 1.00 0.00 H new ATOM 0 HA GLN A 15 -3.537 8.759 -3.774 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.126 8.802 -5.992 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -2.979 10.127 -5.992 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.193 8.522 -6.735 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.409 7.264 -6.833 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.025 6.984 -8.939 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -3.196 8.290 -10.115 1.00 0.00 H new ATOM 183 N ALA A 16 -3.044 6.301 -4.323 1.00 0.00 N ATOM 184 CA ALA A 16 -2.667 4.894 -4.274 1.00 0.00 C ATOM 185 C ALA A 16 -3.684 4.027 -5.009 1.00 0.00 C ATOM 186 O ALA A 16 -4.864 4.009 -4.659 1.00 0.00 O ATOM 187 CB ALA A 16 -2.524 4.435 -2.831 1.00 0.00 C ATOM 0 H ALA A 16 -4.050 6.468 -4.314 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.705 4.784 -4.775 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.242 3.382 -2.810 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -1.754 5.027 -2.336 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.473 4.567 -2.312 1.00 0.00 H new ATOM 193 N GLN A 17 -3.219 3.312 -6.027 1.00 0.00 N ATOM 194 CA GLN A 17 -4.090 2.444 -6.812 1.00 0.00 C ATOM 195 C GLN A 17 -3.321 1.241 -7.347 1.00 0.00 C ATOM 196 O GLN A 17 -2.134 1.337 -7.653 1.00 0.00 O ATOM 197 CB GLN A 17 -4.712 3.224 -7.971 1.00 0.00 C ATOM 198 CG GLN A 17 -3.688 3.804 -8.933 1.00 0.00 C ATOM 199 CD GLN A 17 -4.306 4.750 -9.943 1.00 0.00 C ATOM 200 OE1 GLN A 17 -4.798 5.887 -9.466 1.00 0.00 O flip ATOM 201 NE2 GLN A 17 -4.340 4.463 -11.140 1.00 0.00 N flip ATOM 0 H GLN A 17 -2.245 3.316 -6.328 1.00 0.00 H new ATOM 0 HA GLN A 17 -4.885 2.082 -6.159 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.384 2.566 -8.522 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -5.319 4.034 -7.568 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.922 4.333 -8.366 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.189 2.991 -9.460 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -3.950 3.578 -11.463 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -4.758 5.110 -11.808 1.00 0.00 H new ATOM 210 N GLY A 18 -4.007 0.107 -7.457 1.00 0.00 N ATOM 211 CA GLY A 18 -3.372 -1.099 -7.955 1.00 0.00 C ATOM 212 C GLY A 18 -3.983 -2.358 -7.373 1.00 0.00 C ATOM 213 O GLY A 18 -5.000 -2.318 -6.680 1.00 0.00 O ATOM 0 H GLY A 18 -4.991 0.002 -7.210 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.455 -1.127 -9.041 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -2.309 -1.071 -7.717 1.00 0.00 H new ATOM 217 N PRO A 19 -3.357 -3.510 -7.658 1.00 0.00 N ATOM 218 CA PRO A 19 -3.829 -4.809 -7.169 1.00 0.00 C ATOM 219 C PRO A 19 -3.641 -4.965 -5.664 1.00 0.00 C ATOM 220 O PRO A 19 -4.516 -5.481 -4.969 1.00 0.00 O ATOM 221 CB PRO A 19 -2.953 -5.812 -7.924 1.00 0.00 C ATOM 222 CG PRO A 19 -1.712 -5.057 -8.255 1.00 0.00 C ATOM 223 CD PRO A 19 -2.141 -3.633 -8.478 1.00 0.00 C ATOM 0 HA PRO A 19 -4.897 -4.944 -7.337 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.733 -6.686 -7.311 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.450 -6.172 -8.825 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -0.987 -5.124 -7.444 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -1.233 -5.464 -9.145 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -1.372 -2.928 -8.164 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -2.344 -3.435 -9.530 1.00 0.00 H new ATOM 231 N GLY A 20 -2.493 -4.515 -5.166 1.00 0.00 N ATOM 232 CA GLY A 20 -2.212 -4.614 -3.745 1.00 0.00 C ATOM 233 C GLY A 20 -3.231 -3.876 -2.900 1.00 0.00 C ATOM 234 O GLY A 20 -3.281 -4.051 -1.681 1.00 0.00 O ATOM 0 H GLY A 20 -1.753 -4.084 -5.720 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.195 -5.664 -3.453 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.219 -4.212 -3.545 1.00 0.00 H new ATOM 238 N LEU A 21 -4.044 -3.048 -3.545 1.00 0.00 N ATOM 239 CA LEU A 21 -5.067 -2.279 -2.844 1.00 0.00 C ATOM 240 C LEU A 21 -6.459 -2.826 -3.142 1.00 0.00 C ATOM 241 O LEU A 21 -7.338 -2.821 -2.279 1.00 0.00 O ATOM 242 CB LEU A 21 -4.989 -0.805 -3.246 1.00 0.00 C ATOM 243 CG LEU A 21 -3.693 -0.078 -2.883 1.00 0.00 C ATOM 244 CD1 LEU A 21 -3.747 1.370 -3.343 1.00 0.00 C ATOM 245 CD2 LEU A 21 -3.440 -0.155 -1.385 1.00 0.00 C ATOM 0 H LEU A 21 -4.015 -2.891 -4.552 1.00 0.00 H new ATOM 0 HA LEU A 21 -4.884 -2.368 -1.773 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.131 -0.735 -4.324 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -5.821 -0.277 -2.780 1.00 0.00 H new ATOM 0 HG LEU A 21 -2.867 -0.570 -3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.817 1.871 -3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.880 1.404 -4.424 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.583 1.875 -2.859 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -2.514 0.367 -1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.268 0.311 -0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -3.356 -1.199 -1.083 1.00 0.00 H new ATOM 257 N LYS A 22 -6.654 -3.299 -4.368 1.00 0.00 N ATOM 258 CA LYS A 22 -7.938 -3.853 -4.780 1.00 0.00 C ATOM 259 C LYS A 22 -8.147 -5.242 -4.185 1.00 0.00 C ATOM 260 O LYS A 22 -9.142 -5.492 -3.506 1.00 0.00 O ATOM 261 CB LYS A 22 -8.020 -3.923 -6.307 1.00 0.00 C ATOM 262 CG LYS A 22 -8.415 -2.608 -6.956 1.00 0.00 C ATOM 263 CD LYS A 22 -8.815 -2.801 -8.409 1.00 0.00 C ATOM 264 CE LYS A 22 -7.601 -2.809 -9.325 1.00 0.00 C ATOM 265 NZ LYS A 22 -7.136 -1.430 -9.641 1.00 0.00 N ATOM 0 H LYS A 22 -5.938 -3.310 -5.095 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.725 -3.196 -4.410 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -7.053 -4.237 -6.700 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -8.742 -4.689 -6.589 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -9.244 -2.164 -6.405 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.582 -1.907 -6.897 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.359 -3.739 -8.516 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.494 -2.003 -8.710 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -6.792 -3.365 -8.851 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -7.847 -3.330 -10.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -6.307 -1.478 -10.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.899 -0.907 -10.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -6.877 -0.941 -8.761 1.00 0.00 H new ATOM 279 N GLU A 23 -7.202 -6.140 -4.444 1.00 0.00 N ATOM 280 CA GLU A 23 -7.285 -7.503 -3.933 1.00 0.00 C ATOM 281 C GLU A 23 -5.906 -8.157 -3.901 1.00 0.00 C ATOM 282 O GLU A 23 -5.074 -7.919 -4.776 1.00 0.00 O ATOM 283 CB GLU A 23 -8.237 -8.338 -4.792 1.00 0.00 C ATOM 284 CG GLU A 23 -7.692 -8.650 -6.176 1.00 0.00 C ATOM 285 CD GLU A 23 -8.014 -7.568 -7.188 1.00 0.00 C ATOM 286 OE1 GLU A 23 -9.164 -7.535 -7.675 1.00 0.00 O ATOM 287 OE2 GLU A 23 -7.117 -6.754 -7.493 1.00 0.00 O ATOM 0 H GLU A 23 -6.371 -5.949 -5.004 1.00 0.00 H new ATOM 0 HA GLU A 23 -7.671 -7.458 -2.915 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -8.453 -9.274 -4.276 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.182 -7.805 -4.894 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.611 -8.776 -6.117 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.105 -9.598 -6.520 1.00 0.00 H new ATOM 294 N ALA A 24 -5.672 -8.981 -2.885 1.00 0.00 N ATOM 295 CA ALA A 24 -4.395 -9.670 -2.738 1.00 0.00 C ATOM 296 C ALA A 24 -4.602 -11.150 -2.438 1.00 0.00 C ATOM 297 O ALA A 24 -5.731 -11.642 -2.436 1.00 0.00 O ATOM 298 CB ALA A 24 -3.566 -9.017 -1.643 1.00 0.00 C ATOM 0 H ALA A 24 -6.350 -9.188 -2.151 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.856 -9.590 -3.682 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.616 -9.542 -1.544 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.380 -7.974 -1.900 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.107 -9.066 -0.698 1.00 0.00 H new ATOM 304 N PHE A 25 -3.505 -11.856 -2.184 1.00 0.00 N ATOM 305 CA PHE A 25 -3.566 -13.282 -1.883 1.00 0.00 C ATOM 306 C PHE A 25 -2.481 -13.674 -0.884 1.00 0.00 C ATOM 307 O PHE A 25 -1.563 -12.900 -0.611 1.00 0.00 O ATOM 308 CB PHE A 25 -3.416 -14.102 -3.166 1.00 0.00 C ATOM 309 CG PHE A 25 -4.722 -14.394 -3.847 1.00 0.00 C ATOM 310 CD1 PHE A 25 -5.416 -13.390 -4.503 1.00 0.00 C ATOM 311 CD2 PHE A 25 -5.255 -15.672 -3.833 1.00 0.00 C ATOM 312 CE1 PHE A 25 -6.618 -13.655 -5.130 1.00 0.00 C ATOM 313 CE2 PHE A 25 -6.457 -15.944 -4.459 1.00 0.00 C ATOM 314 CZ PHE A 25 -7.139 -14.935 -5.109 1.00 0.00 C ATOM 0 H PHE A 25 -2.563 -11.464 -2.181 1.00 0.00 H new ATOM 0 HA PHE A 25 -4.538 -13.493 -1.437 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -2.767 -13.564 -3.857 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -2.920 -15.043 -2.930 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.012 -12.388 -4.524 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.725 -16.466 -3.327 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -7.150 -12.863 -5.636 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -6.862 -16.945 -4.440 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.078 -15.145 -5.600 1.00 0.00 H new ATOM 324 N THR A 26 -2.593 -14.883 -0.342 1.00 0.00 N ATOM 325 CA THR A 26 -1.624 -15.378 0.627 1.00 0.00 C ATOM 326 C THR A 26 -0.363 -15.883 -0.065 1.00 0.00 C ATOM 327 O THR A 26 -0.433 -16.682 -0.997 1.00 0.00 O ATOM 328 CB THR A 26 -2.216 -16.514 1.483 1.00 0.00 C ATOM 329 OG1 THR A 26 -2.613 -17.604 0.643 1.00 0.00 O ATOM 330 CG2 THR A 26 -3.411 -16.022 2.284 1.00 0.00 C ATOM 0 H THR A 26 -3.345 -15.537 -0.558 1.00 0.00 H new ATOM 0 HA THR A 26 -1.369 -14.540 1.275 1.00 0.00 H new ATOM 0 HB THR A 26 -1.448 -16.853 2.179 1.00 0.00 H new ATOM 0 HG1 THR A 26 -2.130 -17.554 -0.208 1.00 0.00 H new ATOM 0 HG21 THR A 26 -3.812 -16.842 2.880 1.00 0.00 H new ATOM 0 HG22 THR A 26 -3.099 -15.212 2.944 1.00 0.00 H new ATOM 0 HG23 THR A 26 -4.181 -15.659 1.603 1.00 0.00 H new ATOM 338 N ASN A 27 0.790 -15.411 0.398 1.00 0.00 N ATOM 339 CA ASN A 27 2.068 -15.815 -0.178 1.00 0.00 C ATOM 340 C ASN A 27 2.172 -15.374 -1.635 1.00 0.00 C ATOM 341 O ASN A 27 2.883 -15.987 -2.431 1.00 0.00 O ATOM 342 CB ASN A 27 2.238 -17.332 -0.078 1.00 0.00 C ATOM 343 CG ASN A 27 2.259 -17.818 1.358 1.00 0.00 C ATOM 344 OD1 ASN A 27 1.157 -17.610 2.069 1.00 0.00 O flip ATOM 345 ND2 ASN A 27 3.254 -18.375 1.822 1.00 0.00 N flip ATOM 0 H ASN A 27 0.866 -14.749 1.170 1.00 0.00 H new ATOM 0 HA ASN A 27 2.864 -15.329 0.387 1.00 0.00 H new ATOM 0 HB2 ASN A 27 1.424 -17.822 -0.613 1.00 0.00 H new ATOM 0 HB3 ASN A 27 3.165 -17.624 -0.571 1.00 0.00 H new ATOM 0 HD21 ASN A 27 4.079 -18.514 1.239 1.00 0.00 H new ATOM 0 HD22 ASN A 27 3.253 -18.698 2.790 1.00 0.00 H new ATOM 352 N LYS A 28 1.458 -14.307 -1.977 1.00 0.00 N ATOM 353 CA LYS A 28 1.470 -13.782 -3.337 1.00 0.00 C ATOM 354 C LYS A 28 1.956 -12.337 -3.358 1.00 0.00 C ATOM 355 O LYS A 28 1.676 -11.549 -2.453 1.00 0.00 O ATOM 356 CB LYS A 28 0.071 -13.870 -3.952 1.00 0.00 C ATOM 357 CG LYS A 28 -0.279 -15.254 -4.472 1.00 0.00 C ATOM 358 CD LYS A 28 -1.240 -15.181 -5.647 1.00 0.00 C ATOM 359 CE LYS A 28 -2.013 -16.480 -5.815 1.00 0.00 C ATOM 360 NZ LYS A 28 -2.739 -16.529 -7.114 1.00 0.00 N ATOM 0 H LYS A 28 0.863 -13.789 -1.330 1.00 0.00 H new ATOM 0 HA LYS A 28 2.158 -14.387 -3.927 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.665 -13.575 -3.204 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.003 -13.154 -4.771 1.00 0.00 H new ATOM 0 HG2 LYS A 28 0.631 -15.770 -4.777 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.726 -15.842 -3.671 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.938 -14.357 -5.497 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -0.685 -14.966 -6.560 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.325 -17.323 -5.752 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.725 -16.587 -4.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.253 -17.430 -7.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -3.414 -15.739 -7.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.057 -16.452 -7.896 1.00 0.00 H new ATOM 374 N PRO A 29 2.700 -11.977 -4.414 1.00 0.00 N ATOM 375 CA PRO A 29 3.238 -10.623 -4.579 1.00 0.00 C ATOM 376 C PRO A 29 2.149 -9.598 -4.873 1.00 0.00 C ATOM 377 O PRO A 29 1.515 -9.636 -5.926 1.00 0.00 O ATOM 378 CB PRO A 29 4.181 -10.760 -5.777 1.00 0.00 C ATOM 379 CG PRO A 29 3.649 -11.919 -6.548 1.00 0.00 C ATOM 380 CD PRO A 29 3.072 -12.863 -5.530 1.00 0.00 C ATOM 0 HA PRO A 29 3.727 -10.265 -3.673 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.188 -9.853 -6.381 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.207 -10.936 -5.455 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.887 -11.598 -7.259 1.00 0.00 H new ATOM 0 HG3 PRO A 29 4.439 -12.401 -7.123 1.00 0.00 H new ATOM 0 HD2 PRO A 29 2.208 -13.398 -5.923 1.00 0.00 H new ATOM 0 HD3 PRO A 29 3.799 -13.614 -5.221 1.00 0.00 H new ATOM 388 N ASN A 30 1.937 -8.681 -3.934 1.00 0.00 N ATOM 389 CA ASN A 30 0.923 -7.644 -4.093 1.00 0.00 C ATOM 390 C ASN A 30 1.554 -6.256 -4.050 1.00 0.00 C ATOM 391 O ASN A 30 2.070 -5.828 -3.017 1.00 0.00 O ATOM 392 CB ASN A 30 -0.139 -7.768 -2.999 1.00 0.00 C ATOM 393 CG ASN A 30 -0.351 -9.204 -2.559 1.00 0.00 C ATOM 394 OD1 ASN A 30 -1.088 -9.957 -3.195 1.00 0.00 O ATOM 395 ND2 ASN A 30 0.297 -9.590 -1.465 1.00 0.00 N ATOM 0 H ASN A 30 2.453 -8.635 -3.056 1.00 0.00 H new ATOM 0 HA ASN A 30 0.450 -7.779 -5.066 1.00 0.00 H new ATOM 0 HB2 ASN A 30 0.157 -7.167 -2.139 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.082 -7.360 -3.363 1.00 0.00 H new ATOM 0 HD21 ASN A 30 0.194 -10.545 -1.121 1.00 0.00 H new ATOM 0 HD22 ASN A 30 0.898 -8.932 -0.969 1.00 0.00 H new ATOM 402 N VAL A 31 1.508 -5.556 -5.179 1.00 0.00 N ATOM 403 CA VAL A 31 2.073 -4.215 -5.270 1.00 0.00 C ATOM 404 C VAL A 31 1.015 -3.200 -5.690 1.00 0.00 C ATOM 405 O VAL A 31 -0.071 -3.569 -6.137 1.00 0.00 O ATOM 406 CB VAL A 31 3.242 -4.165 -6.272 1.00 0.00 C ATOM 407 CG1 VAL A 31 4.111 -5.407 -6.140 1.00 0.00 C ATOM 408 CG2 VAL A 31 2.720 -4.018 -7.693 1.00 0.00 C ATOM 0 H VAL A 31 1.085 -5.895 -6.043 1.00 0.00 H new ATOM 0 HA VAL A 31 2.444 -3.960 -4.277 1.00 0.00 H new ATOM 0 HB VAL A 31 3.857 -3.294 -6.044 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.932 -5.355 -6.855 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.514 -5.463 -5.129 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.511 -6.294 -6.341 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.560 -3.984 -8.387 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.082 -4.868 -7.936 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.144 -3.096 -7.775 1.00 0.00 H new ATOM 418 N PHE A 32 1.341 -1.920 -5.545 1.00 0.00 N ATOM 419 CA PHE A 32 0.418 -0.851 -5.909 1.00 0.00 C ATOM 420 C PHE A 32 1.178 0.387 -6.378 1.00 0.00 C ATOM 421 O PHE A 32 2.287 0.661 -5.918 1.00 0.00 O ATOM 422 CB PHE A 32 -0.477 -0.494 -4.721 1.00 0.00 C ATOM 423 CG PHE A 32 0.270 -0.374 -3.423 1.00 0.00 C ATOM 424 CD1 PHE A 32 0.529 -1.496 -2.652 1.00 0.00 C ATOM 425 CD2 PHE A 32 0.712 0.860 -2.974 1.00 0.00 C ATOM 426 CE1 PHE A 32 1.215 -1.388 -1.457 1.00 0.00 C ATOM 427 CE2 PHE A 32 1.399 0.974 -1.780 1.00 0.00 C ATOM 428 CZ PHE A 32 1.651 -0.152 -1.021 1.00 0.00 C ATOM 0 H PHE A 32 2.237 -1.598 -5.178 1.00 0.00 H new ATOM 0 HA PHE A 32 -0.205 -1.207 -6.730 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.983 0.449 -4.928 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.250 -1.255 -4.617 1.00 0.00 H new ATOM 0 HD1 PHE A 32 0.191 -2.465 -2.988 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.517 1.743 -3.564 1.00 0.00 H new ATOM 0 HE1 PHE A 32 1.410 -2.270 -0.864 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.738 1.942 -1.441 1.00 0.00 H new ATOM 0 HZ PHE A 32 2.188 -0.066 -0.088 1.00 0.00 H new ATOM 438 N THR A 33 0.573 1.132 -7.298 1.00 0.00 N ATOM 439 CA THR A 33 1.191 2.339 -7.831 1.00 0.00 C ATOM 440 C THR A 33 0.891 3.546 -6.950 1.00 0.00 C ATOM 441 O THR A 33 -0.261 3.798 -6.596 1.00 0.00 O ATOM 442 CB THR A 33 0.709 2.632 -9.264 1.00 0.00 C ATOM 443 OG1 THR A 33 0.960 1.501 -10.106 1.00 0.00 O ATOM 444 CG2 THR A 33 1.409 3.858 -9.831 1.00 0.00 C ATOM 0 H THR A 33 -0.345 0.920 -7.689 1.00 0.00 H new ATOM 0 HA THR A 33 2.266 2.162 -7.846 1.00 0.00 H new ATOM 0 HB THR A 33 -0.363 2.829 -9.230 1.00 0.00 H new ATOM 0 HG1 THR A 33 0.649 1.695 -11.015 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.052 4.045 -10.844 1.00 0.00 H new ATOM 0 HG22 THR A 33 1.192 4.723 -9.204 1.00 0.00 H new ATOM 0 HG23 THR A 33 2.485 3.686 -9.852 1.00 0.00 H new ATOM 452 N VAL A 34 1.935 4.291 -6.598 1.00 0.00 N ATOM 453 CA VAL A 34 1.782 5.473 -5.759 1.00 0.00 C ATOM 454 C VAL A 34 2.336 6.713 -6.451 1.00 0.00 C ATOM 455 O VAL A 34 3.549 6.861 -6.607 1.00 0.00 O ATOM 456 CB VAL A 34 2.492 5.295 -4.403 1.00 0.00 C ATOM 457 CG1 VAL A 34 2.247 6.501 -3.509 1.00 0.00 C ATOM 458 CG2 VAL A 34 2.029 4.015 -3.724 1.00 0.00 C ATOM 0 H VAL A 34 2.895 4.096 -6.881 1.00 0.00 H new ATOM 0 HA VAL A 34 0.714 5.603 -5.587 1.00 0.00 H new ATOM 0 HB VAL A 34 3.564 5.218 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.756 6.357 -2.556 1.00 0.00 H new ATOM 0 HG12 VAL A 34 2.632 7.398 -3.994 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.177 6.614 -3.335 1.00 0.00 H new ATOM 0 HG21 VAL A 34 2.540 3.905 -2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 34 0.953 4.061 -3.557 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.262 3.161 -4.360 1.00 0.00 H new ATOM 468 N VAL A 35 1.440 7.604 -6.864 1.00 0.00 N ATOM 469 CA VAL A 35 1.839 8.833 -7.539 1.00 0.00 C ATOM 470 C VAL A 35 1.961 9.988 -6.550 1.00 0.00 C ATOM 471 O VAL A 35 0.959 10.514 -6.065 1.00 0.00 O ATOM 472 CB VAL A 35 0.835 9.220 -8.641 1.00 0.00 C ATOM 473 CG1 VAL A 35 1.289 10.482 -9.358 1.00 0.00 C ATOM 474 CG2 VAL A 35 0.658 8.073 -9.625 1.00 0.00 C ATOM 0 H VAL A 35 0.433 7.497 -6.743 1.00 0.00 H new ATOM 0 HA VAL A 35 2.811 8.643 -7.994 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.129 9.423 -8.175 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.567 10.740 -10.133 1.00 0.00 H new ATOM 0 HG12 VAL A 35 1.361 11.301 -8.642 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.265 10.311 -9.813 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.055 8.363 -10.397 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.617 7.838 -10.086 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.284 7.195 -9.097 1.00 0.00 H new ATOM 484 N THR A 36 3.197 10.379 -6.255 1.00 0.00 N ATOM 485 CA THR A 36 3.451 11.470 -5.324 1.00 0.00 C ATOM 486 C THR A 36 3.741 12.770 -6.066 1.00 0.00 C ATOM 487 O THR A 36 4.696 13.478 -5.748 1.00 0.00 O ATOM 488 CB THR A 36 4.635 11.150 -4.392 1.00 0.00 C ATOM 489 OG1 THR A 36 5.846 11.062 -5.152 1.00 0.00 O ATOM 490 CG2 THR A 36 4.401 9.844 -3.648 1.00 0.00 C ATOM 0 H THR A 36 4.038 9.956 -6.648 1.00 0.00 H new ATOM 0 HA THR A 36 2.548 11.590 -4.725 1.00 0.00 H new ATOM 0 HB THR A 36 4.722 11.955 -3.662 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.594 10.860 -4.553 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.250 9.639 -2.996 1.00 0.00 H new ATOM 0 HG22 THR A 36 3.494 9.924 -3.048 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.290 9.031 -4.366 1.00 0.00 H new ATOM 498 N ARG A 37 2.909 13.078 -7.056 1.00 0.00 N ATOM 499 CA ARG A 37 3.077 14.293 -7.844 1.00 0.00 C ATOM 500 C ARG A 37 2.246 15.435 -7.266 1.00 0.00 C ATOM 501 O ARG A 37 1.070 15.589 -7.592 1.00 0.00 O ATOM 502 CB ARG A 37 2.675 14.043 -9.299 1.00 0.00 C ATOM 503 CG ARG A 37 3.697 13.236 -10.083 1.00 0.00 C ATOM 504 CD ARG A 37 4.814 14.120 -10.616 1.00 0.00 C ATOM 505 NE ARG A 37 5.860 14.340 -9.621 1.00 0.00 N ATOM 506 CZ ARG A 37 6.893 15.155 -9.809 1.00 0.00 C ATOM 507 NH1 ARG A 37 7.016 15.824 -10.947 1.00 0.00 N ATOM 508 NH2 ARG A 37 7.804 15.302 -8.856 1.00 0.00 N ATOM 0 H ARG A 37 2.113 12.503 -7.331 1.00 0.00 H new ATOM 0 HA ARG A 37 4.129 14.576 -7.808 1.00 0.00 H new ATOM 0 HB2 ARG A 37 1.719 13.520 -9.318 1.00 0.00 H new ATOM 0 HB3 ARG A 37 2.523 15.002 -9.795 1.00 0.00 H new ATOM 0 HG2 ARG A 37 4.119 12.461 -9.443 1.00 0.00 H new ATOM 0 HG3 ARG A 37 3.204 12.730 -10.913 1.00 0.00 H new ATOM 0 HD2 ARG A 37 5.249 13.659 -11.503 1.00 0.00 H new ATOM 0 HD3 ARG A 37 4.400 15.080 -10.925 1.00 0.00 H new ATOM 0 HE ARG A 37 5.794 13.841 -8.734 1.00 0.00 H new ATOM 0 HH11 ARG A 37 6.317 15.714 -11.681 1.00 0.00 H new ATOM 0 HH12 ARG A 37 7.810 16.449 -11.088 1.00 0.00 H new ATOM 0 HH21 ARG A 37 7.712 14.790 -7.979 1.00 0.00 H new ATOM 0 HH22 ARG A 37 8.597 15.927 -9.000 1.00 0.00 H new ATOM 522 N GLY A 38 2.868 16.234 -6.403 1.00 0.00 N ATOM 523 CA GLY A 38 2.171 17.351 -5.792 1.00 0.00 C ATOM 524 C GLY A 38 2.313 17.367 -4.283 1.00 0.00 C ATOM 525 O GLY A 38 2.402 18.432 -3.673 1.00 0.00 O ATOM 0 H GLY A 38 3.841 16.127 -6.117 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.559 18.284 -6.200 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.114 17.303 -6.054 1.00 0.00 H new ATOM 529 N ALA A 39 2.332 16.183 -3.679 1.00 0.00 N ATOM 530 CA ALA A 39 2.464 16.066 -2.233 1.00 0.00 C ATOM 531 C ALA A 39 3.580 16.963 -1.708 1.00 0.00 C ATOM 532 O ALA A 39 3.340 17.864 -0.905 1.00 0.00 O ATOM 533 CB ALA A 39 2.721 14.618 -1.842 1.00 0.00 C ATOM 0 H ALA A 39 2.258 15.292 -4.169 1.00 0.00 H new ATOM 0 HA ALA A 39 1.528 16.393 -1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.818 14.545 -0.759 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.888 13.998 -2.175 1.00 0.00 H new ATOM 0 HB3 ALA A 39 3.641 14.272 -2.312 1.00 0.00 H new ATOM 539 N GLY A 40 4.802 16.711 -2.168 1.00 0.00 N ATOM 540 CA GLY A 40 5.937 17.504 -1.734 1.00 0.00 C ATOM 541 C GLY A 40 7.181 16.666 -1.517 1.00 0.00 C ATOM 542 O GLY A 40 7.428 15.709 -2.251 1.00 0.00 O ATOM 0 H GLY A 40 5.026 15.971 -2.834 1.00 0.00 H new ATOM 0 HA2 GLY A 40 6.146 18.272 -2.479 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.683 18.019 -0.807 1.00 0.00 H new ATOM 546 N ILE A 41 7.967 17.027 -0.508 1.00 0.00 N ATOM 547 CA ILE A 41 9.192 16.301 -0.197 1.00 0.00 C ATOM 548 C ILE A 41 9.160 15.751 1.224 1.00 0.00 C ATOM 549 O ILE A 41 8.872 16.476 2.176 1.00 0.00 O ATOM 550 CB ILE A 41 10.434 17.197 -0.361 1.00 0.00 C ATOM 551 CG1 ILE A 41 10.495 17.768 -1.779 1.00 0.00 C ATOM 552 CG2 ILE A 41 11.698 16.413 -0.045 1.00 0.00 C ATOM 553 CD1 ILE A 41 11.289 19.051 -1.881 1.00 0.00 C ATOM 0 H ILE A 41 7.777 17.818 0.108 1.00 0.00 H new ATOM 0 HA ILE A 41 9.255 15.473 -0.903 1.00 0.00 H new ATOM 0 HB ILE A 41 10.360 18.027 0.341 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.936 17.024 -2.443 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.480 17.949 -2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 41 12.567 17.060 -0.165 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.654 16.051 0.982 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.780 15.565 -0.725 1.00 0.00 H new ATOM 0 HD11 ILE A 41 11.289 19.398 -2.914 1.00 0.00 H new ATOM 0 HD12 ILE A 41 10.836 19.811 -1.244 1.00 0.00 H new ATOM 0 HD13 ILE A 41 12.315 18.871 -1.559 1.00 0.00 H new ATOM 565 N GLY A 42 9.460 14.463 1.362 1.00 0.00 N ATOM 566 CA GLY A 42 9.462 13.837 2.671 1.00 0.00 C ATOM 567 C GLY A 42 9.669 12.337 2.596 1.00 0.00 C ATOM 568 O GLY A 42 10.098 11.813 1.569 1.00 0.00 O ATOM 0 H GLY A 42 9.702 13.842 0.590 1.00 0.00 H new ATOM 0 HA2 GLY A 42 10.250 14.279 3.281 1.00 0.00 H new ATOM 0 HA3 GLY A 42 8.516 14.046 3.172 1.00 0.00 H new ATOM 572 N GLY A 43 9.365 11.644 3.689 1.00 0.00 N ATOM 573 CA GLY A 43 9.530 10.202 3.723 1.00 0.00 C ATOM 574 C GLY A 43 8.206 9.470 3.820 1.00 0.00 C ATOM 575 O GLY A 43 7.449 9.664 4.772 1.00 0.00 O ATOM 0 H GLY A 43 9.008 12.055 4.551 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.056 9.878 2.825 1.00 0.00 H new ATOM 0 HA3 GLY A 43 10.155 9.931 4.574 1.00 0.00 H new ATOM 579 N LEU A 44 7.924 8.628 2.832 1.00 0.00 N ATOM 580 CA LEU A 44 6.681 7.864 2.809 1.00 0.00 C ATOM 581 C LEU A 44 6.820 6.573 3.608 1.00 0.00 C ATOM 582 O LEU A 44 7.717 5.770 3.358 1.00 0.00 O ATOM 583 CB LEU A 44 6.283 7.545 1.367 1.00 0.00 C ATOM 584 CG LEU A 44 4.937 6.843 1.182 1.00 0.00 C ATOM 585 CD1 LEU A 44 3.820 7.864 1.023 1.00 0.00 C ATOM 586 CD2 LEU A 44 4.982 5.909 -0.018 1.00 0.00 C ATOM 0 H LEU A 44 8.539 8.457 2.036 1.00 0.00 H new ATOM 0 HA LEU A 44 5.901 8.471 3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.265 8.477 0.802 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.060 6.920 0.927 1.00 0.00 H new ATOM 0 HG LEU A 44 4.734 6.248 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.870 7.346 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.772 8.492 1.913 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.017 8.486 0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.016 5.418 -0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.208 6.482 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.755 5.156 0.136 1.00 0.00 H new ATOM 598 N GLY A 45 5.923 6.379 4.571 1.00 0.00 N ATOM 599 CA GLY A 45 5.962 5.182 5.390 1.00 0.00 C ATOM 600 C GLY A 45 4.808 4.243 5.100 1.00 0.00 C ATOM 601 O GLY A 45 3.673 4.501 5.502 1.00 0.00 O ATOM 0 H GLY A 45 5.171 7.029 4.798 1.00 0.00 H new ATOM 0 HA2 GLY A 45 6.903 4.659 5.219 1.00 0.00 H new ATOM 0 HA3 GLY A 45 5.941 5.465 6.442 1.00 0.00 H new ATOM 605 N ILE A 46 5.097 3.152 4.400 1.00 0.00 N ATOM 606 CA ILE A 46 4.074 2.172 4.056 1.00 0.00 C ATOM 607 C ILE A 46 4.188 0.928 4.931 1.00 0.00 C ATOM 608 O ILE A 46 5.239 0.290 4.990 1.00 0.00 O ATOM 609 CB ILE A 46 4.169 1.755 2.576 1.00 0.00 C ATOM 610 CG1 ILE A 46 4.059 2.982 1.670 1.00 0.00 C ATOM 611 CG2 ILE A 46 3.083 0.743 2.241 1.00 0.00 C ATOM 612 CD1 ILE A 46 4.212 2.663 0.199 1.00 0.00 C ATOM 0 H ILE A 46 6.031 2.924 4.060 1.00 0.00 H new ATOM 0 HA ILE A 46 3.109 2.649 4.230 1.00 0.00 H new ATOM 0 HB ILE A 46 5.139 1.288 2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.092 3.457 1.832 1.00 0.00 H new ATOM 0 HG13 ILE A 46 4.822 3.706 1.958 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.163 0.458 1.192 1.00 0.00 H new ATOM 0 HG22 ILE A 46 3.203 -0.141 2.868 1.00 0.00 H new ATOM 0 HG23 ILE A 46 2.104 1.186 2.423 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.123 3.580 -0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 46 5.190 2.215 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.433 1.963 -0.104 1.00 0.00 H new ATOM 624 N THR A 47 3.097 0.588 5.611 1.00 0.00 N ATOM 625 CA THR A 47 3.073 -0.580 6.483 1.00 0.00 C ATOM 626 C THR A 47 1.793 -1.385 6.289 1.00 0.00 C ATOM 627 O THR A 47 0.757 -0.841 5.907 1.00 0.00 O ATOM 628 CB THR A 47 3.193 -0.177 7.965 1.00 0.00 C ATOM 629 OG1 THR A 47 2.319 0.922 8.245 1.00 0.00 O ATOM 630 CG2 THR A 47 4.624 0.207 8.307 1.00 0.00 C ATOM 0 H THR A 47 2.219 1.105 5.574 1.00 0.00 H new ATOM 0 HA THR A 47 3.931 -1.195 6.211 1.00 0.00 H new ATOM 0 HB THR A 47 2.908 -1.033 8.576 1.00 0.00 H new ATOM 0 HG1 THR A 47 2.399 1.172 9.189 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.684 0.488 9.359 1.00 0.00 H new ATOM 0 HG22 THR A 47 5.283 -0.641 8.120 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.932 1.050 7.688 1.00 0.00 H new ATOM 638 N VAL A 48 1.872 -2.685 6.555 1.00 0.00 N ATOM 639 CA VAL A 48 0.718 -3.566 6.411 1.00 0.00 C ATOM 640 C VAL A 48 0.401 -4.275 7.723 1.00 0.00 C ATOM 641 O VAL A 48 1.298 -4.776 8.400 1.00 0.00 O ATOM 642 CB VAL A 48 0.951 -4.621 5.313 1.00 0.00 C ATOM 643 CG1 VAL A 48 -0.205 -5.609 5.268 1.00 0.00 C ATOM 644 CG2 VAL A 48 1.142 -3.949 3.961 1.00 0.00 C ATOM 0 H VAL A 48 2.722 -3.152 6.871 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.127 -2.938 6.128 1.00 0.00 H new ATOM 0 HB VAL A 48 1.860 -5.173 5.551 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -0.023 -6.347 4.486 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.290 -6.113 6.230 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.131 -5.076 5.055 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.305 -4.709 3.197 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.252 -3.371 3.713 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.006 -3.285 4.003 1.00 0.00 H new ATOM 654 N GLU A 49 -0.880 -4.313 8.074 1.00 0.00 N ATOM 655 CA GLU A 49 -1.315 -4.960 9.306 1.00 0.00 C ATOM 656 C GLU A 49 -2.317 -6.073 9.011 1.00 0.00 C ATOM 657 O GLU A 49 -3.187 -5.929 8.153 1.00 0.00 O ATOM 658 CB GLU A 49 -1.939 -3.935 10.255 1.00 0.00 C ATOM 659 CG GLU A 49 -0.919 -3.170 11.080 1.00 0.00 C ATOM 660 CD GLU A 49 -1.561 -2.319 12.159 1.00 0.00 C ATOM 661 OE1 GLU A 49 -2.373 -2.862 12.937 1.00 0.00 O ATOM 662 OE2 GLU A 49 -1.253 -1.111 12.224 1.00 0.00 O ATOM 0 H GLU A 49 -1.635 -3.904 7.523 1.00 0.00 H new ATOM 0 HA GLU A 49 -0.439 -5.400 9.784 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.529 -3.226 9.674 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.627 -4.447 10.927 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.228 -3.875 11.542 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.330 -2.532 10.422 1.00 0.00 H new ATOM 669 N GLY A 50 -2.187 -7.184 9.729 1.00 0.00 N ATOM 670 CA GLY A 50 -3.086 -8.306 9.530 1.00 0.00 C ATOM 671 C GLY A 50 -2.851 -9.422 10.528 1.00 0.00 C ATOM 672 O GLY A 50 -2.107 -9.271 11.497 1.00 0.00 O ATOM 0 H GLY A 50 -1.475 -7.327 10.445 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.117 -7.961 9.612 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.959 -8.694 8.519 1.00 0.00 H new ATOM 676 N PRO A 51 -3.498 -10.574 10.297 1.00 0.00 N ATOM 677 CA PRO A 51 -3.372 -11.743 11.173 1.00 0.00 C ATOM 678 C PRO A 51 -1.992 -12.386 11.087 1.00 0.00 C ATOM 679 O PRO A 51 -1.719 -13.384 11.753 1.00 0.00 O ATOM 680 CB PRO A 51 -4.442 -12.700 10.643 1.00 0.00 C ATOM 681 CG PRO A 51 -4.626 -12.311 9.217 1.00 0.00 C ATOM 682 CD PRO A 51 -4.401 -10.825 9.161 1.00 0.00 C ATOM 0 HA PRO A 51 -3.498 -11.481 12.223 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.123 -13.739 10.732 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -5.372 -12.603 11.203 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.920 -12.837 8.575 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -5.626 -12.568 8.868 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -3.951 -10.522 8.215 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -5.336 -10.273 9.261 1.00 0.00 H new ATOM 690 N SER A 52 -1.125 -11.807 10.262 1.00 0.00 N ATOM 691 CA SER A 52 0.227 -12.327 10.086 1.00 0.00 C ATOM 692 C SER A 52 1.136 -11.274 9.459 1.00 0.00 C ATOM 693 O SER A 52 0.717 -10.523 8.579 1.00 0.00 O ATOM 694 CB SER A 52 0.203 -13.583 9.214 1.00 0.00 C ATOM 695 OG SER A 52 -0.235 -13.284 7.900 1.00 0.00 O ATOM 0 H SER A 52 -1.334 -10.978 9.705 1.00 0.00 H new ATOM 0 HA SER A 52 0.623 -12.584 11.069 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.200 -14.023 9.177 1.00 0.00 H new ATOM 0 HB3 SER A 52 -0.457 -14.327 9.660 1.00 0.00 H new ATOM 0 HG SER A 52 -0.852 -12.523 7.926 1.00 0.00 H new ATOM 701 N GLU A 53 2.382 -11.228 9.918 1.00 0.00 N ATOM 702 CA GLU A 53 3.351 -10.267 9.403 1.00 0.00 C ATOM 703 C GLU A 53 3.560 -10.458 7.903 1.00 0.00 C ATOM 704 O GLU A 53 3.719 -11.581 7.425 1.00 0.00 O ATOM 705 CB GLU A 53 4.685 -10.411 10.137 1.00 0.00 C ATOM 706 CG GLU A 53 5.723 -9.383 9.719 1.00 0.00 C ATOM 707 CD GLU A 53 7.032 -9.538 10.469 1.00 0.00 C ATOM 708 OE1 GLU A 53 7.000 -9.569 11.717 1.00 0.00 O ATOM 709 OE2 GLU A 53 8.088 -9.628 9.808 1.00 0.00 O ATOM 0 H GLU A 53 2.745 -11.844 10.645 1.00 0.00 H new ATOM 0 HA GLU A 53 2.957 -9.265 9.574 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.511 -10.324 11.210 1.00 0.00 H new ATOM 0 HB3 GLU A 53 5.083 -11.410 9.958 1.00 0.00 H new ATOM 0 HG2 GLU A 53 5.909 -9.474 8.649 1.00 0.00 H new ATOM 0 HG3 GLU A 53 5.327 -8.382 9.890 1.00 0.00 H new ATOM 716 N SER A 54 3.557 -9.351 7.166 1.00 0.00 N ATOM 717 CA SER A 54 3.742 -9.396 5.720 1.00 0.00 C ATOM 718 C SER A 54 5.109 -8.842 5.331 1.00 0.00 C ATOM 719 O SER A 54 5.586 -7.866 5.911 1.00 0.00 O ATOM 720 CB SER A 54 2.639 -8.601 5.019 1.00 0.00 C ATOM 721 OG SER A 54 1.356 -9.004 5.468 1.00 0.00 O ATOM 0 H SER A 54 3.429 -8.413 7.546 1.00 0.00 H new ATOM 0 HA SER A 54 3.687 -10.437 5.403 1.00 0.00 H new ATOM 0 HB2 SER A 54 2.777 -7.537 5.209 1.00 0.00 H new ATOM 0 HB3 SER A 54 2.712 -8.744 3.941 1.00 0.00 H new ATOM 0 HG SER A 54 0.668 -8.480 5.006 1.00 0.00 H new ATOM 727 N LYS A 55 5.736 -9.471 4.342 1.00 0.00 N ATOM 728 CA LYS A 55 7.047 -9.043 3.871 1.00 0.00 C ATOM 729 C LYS A 55 6.925 -7.844 2.936 1.00 0.00 C ATOM 730 O LYS A 55 6.693 -8.002 1.737 1.00 0.00 O ATOM 731 CB LYS A 55 7.755 -10.194 3.153 1.00 0.00 C ATOM 732 CG LYS A 55 8.555 -11.091 4.082 1.00 0.00 C ATOM 733 CD LYS A 55 9.480 -12.013 3.306 1.00 0.00 C ATOM 734 CE LYS A 55 8.702 -13.098 2.577 1.00 0.00 C ATOM 735 NZ LYS A 55 9.583 -13.919 1.700 1.00 0.00 N ATOM 0 H LYS A 55 5.356 -10.280 3.851 1.00 0.00 H new ATOM 0 HA LYS A 55 7.637 -8.746 4.738 1.00 0.00 H new ATOM 0 HB2 LYS A 55 7.012 -10.797 2.630 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.422 -9.783 2.395 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.141 -10.477 4.766 1.00 0.00 H new ATOM 0 HG3 LYS A 55 7.874 -11.686 4.691 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.056 -11.431 2.587 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.194 -12.473 3.989 1.00 0.00 H new ATOM 0 HE2 LYS A 55 8.211 -13.744 3.305 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.917 -12.640 1.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 9.015 -14.647 1.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.032 -13.307 0.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.317 -14.377 2.277 1.00 0.00 H new ATOM 749 N ILE A 56 7.084 -6.647 3.491 1.00 0.00 N ATOM 750 CA ILE A 56 6.994 -5.423 2.705 1.00 0.00 C ATOM 751 C ILE A 56 8.357 -5.024 2.151 1.00 0.00 C ATOM 752 O ILE A 56 9.386 -5.242 2.789 1.00 0.00 O ATOM 753 CB ILE A 56 6.431 -4.258 3.541 1.00 0.00 C ATOM 754 CG1 ILE A 56 4.926 -4.435 3.755 1.00 0.00 C ATOM 755 CG2 ILE A 56 6.721 -2.929 2.860 1.00 0.00 C ATOM 756 CD1 ILE A 56 4.373 -3.592 4.882 1.00 0.00 C ATOM 0 H ILE A 56 7.276 -6.499 4.482 1.00 0.00 H new ATOM 0 HA ILE A 56 6.314 -5.628 1.878 1.00 0.00 H new ATOM 0 HB ILE A 56 6.920 -4.260 4.515 1.00 0.00 H new ATOM 0 HG12 ILE A 56 4.404 -4.182 2.832 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.717 -5.485 3.961 1.00 0.00 H new ATOM 0 HG21 ILE A 56 6.317 -2.116 3.463 1.00 0.00 H new ATOM 0 HG22 ILE A 56 7.798 -2.802 2.754 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.256 -2.916 1.874 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.301 -3.768 4.976 1.00 0.00 H new ATOM 0 HD12 ILE A 56 4.869 -3.861 5.815 1.00 0.00 H new ATOM 0 HD13 ILE A 56 4.550 -2.538 4.668 1.00 0.00 H new ATOM 768 N ASN A 57 8.356 -4.437 0.959 1.00 0.00 N ATOM 769 CA ASN A 57 9.593 -4.005 0.318 1.00 0.00 C ATOM 770 C ASN A 57 9.350 -2.790 -0.572 1.00 0.00 C ATOM 771 O ASN A 57 8.702 -2.892 -1.615 1.00 0.00 O ATOM 772 CB ASN A 57 10.188 -5.147 -0.509 1.00 0.00 C ATOM 773 CG ASN A 57 10.778 -6.242 0.357 1.00 0.00 C ATOM 774 OD1 ASN A 57 11.775 -6.033 1.049 1.00 0.00 O ATOM 775 ND2 ASN A 57 10.163 -7.419 0.323 1.00 0.00 N ATOM 0 H ASN A 57 7.512 -4.249 0.417 1.00 0.00 H new ATOM 0 HA ASN A 57 10.299 -3.724 1.099 1.00 0.00 H new ATOM 0 HB2 ASN A 57 9.413 -5.571 -1.148 1.00 0.00 H new ATOM 0 HB3 ASN A 57 10.962 -4.751 -1.166 1.00 0.00 H new ATOM 0 HD21 ASN A 57 10.514 -8.194 0.885 1.00 0.00 H new ATOM 0 HD22 ASN A 57 9.340 -7.547 -0.265 1.00 0.00 H new ATOM 782 N CYS A 58 9.873 -1.644 -0.154 1.00 0.00 N ATOM 783 CA CYS A 58 9.713 -0.408 -0.913 1.00 0.00 C ATOM 784 C CYS A 58 10.702 -0.351 -2.073 1.00 0.00 C ATOM 785 O CYS A 58 11.790 -0.921 -2.002 1.00 0.00 O ATOM 786 CB CYS A 58 9.907 0.804 -0.001 1.00 0.00 C ATOM 787 SG CYS A 58 11.557 0.921 0.730 1.00 0.00 S ATOM 0 H CYS A 58 10.412 -1.544 0.706 1.00 0.00 H new ATOM 0 HA CYS A 58 8.702 -0.389 -1.320 1.00 0.00 H new ATOM 0 HB2 CYS A 58 9.709 1.711 -0.573 1.00 0.00 H new ATOM 0 HB3 CYS A 58 9.168 0.765 0.800 1.00 0.00 H new ATOM 0 HG CYS A 58 11.624 1.979 1.483 1.00 0.00 H new ATOM 793 N ARG A 59 10.315 0.341 -3.140 1.00 0.00 N ATOM 794 CA ARG A 59 11.166 0.470 -4.316 1.00 0.00 C ATOM 795 C ARG A 59 11.144 1.900 -4.848 1.00 0.00 C ATOM 796 O ARG A 59 10.107 2.390 -5.297 1.00 0.00 O ATOM 797 CB ARG A 59 10.712 -0.499 -5.409 1.00 0.00 C ATOM 798 CG ARG A 59 11.826 -0.914 -6.357 1.00 0.00 C ATOM 799 CD ARG A 59 11.534 -2.258 -7.006 1.00 0.00 C ATOM 800 NE ARG A 59 10.760 -2.115 -8.236 1.00 0.00 N ATOM 801 CZ ARG A 59 10.386 -3.141 -8.992 1.00 0.00 C ATOM 802 NH1 ARG A 59 10.712 -4.378 -8.645 1.00 0.00 N ATOM 803 NH2 ARG A 59 9.683 -2.930 -10.098 1.00 0.00 N ATOM 0 H ARG A 59 9.418 0.821 -3.214 1.00 0.00 H new ATOM 0 HA ARG A 59 12.187 0.225 -4.024 1.00 0.00 H new ATOM 0 HB2 ARG A 59 10.294 -1.390 -4.942 1.00 0.00 H new ATOM 0 HB3 ARG A 59 9.911 -0.035 -5.984 1.00 0.00 H new ATOM 0 HG2 ARG A 59 11.949 -0.155 -7.129 1.00 0.00 H new ATOM 0 HG3 ARG A 59 12.768 -0.969 -5.811 1.00 0.00 H new ATOM 0 HD2 ARG A 59 12.473 -2.766 -7.226 1.00 0.00 H new ATOM 0 HD3 ARG A 59 10.987 -2.888 -6.305 1.00 0.00 H new ATOM 0 HE ARG A 59 10.492 -1.176 -8.531 1.00 0.00 H new ATOM 0 HH11 ARG A 59 11.251 -4.544 -7.795 1.00 0.00 H new ATOM 0 HH12 ARG A 59 10.423 -5.164 -9.228 1.00 0.00 H new ATOM 0 HH21 ARG A 59 9.430 -1.979 -10.368 1.00 0.00 H new ATOM 0 HH22 ARG A 59 9.396 -3.718 -10.678 1.00 0.00 H new ATOM 817 N ASP A 60 12.293 2.563 -4.794 1.00 0.00 N ATOM 818 CA ASP A 60 12.407 3.937 -5.271 1.00 0.00 C ATOM 819 C ASP A 60 12.513 3.977 -6.792 1.00 0.00 C ATOM 820 O ASP A 60 13.322 3.266 -7.387 1.00 0.00 O ATOM 821 CB ASP A 60 13.624 4.618 -4.645 1.00 0.00 C ATOM 822 CG ASP A 60 13.791 4.271 -3.178 1.00 0.00 C ATOM 823 OD1 ASP A 60 14.112 3.102 -2.877 1.00 0.00 O ATOM 824 OD2 ASP A 60 13.601 5.168 -2.331 1.00 0.00 O ATOM 0 H ASP A 60 13.160 2.172 -4.425 1.00 0.00 H new ATOM 0 HA ASP A 60 11.507 4.474 -4.973 1.00 0.00 H new ATOM 0 HB2 ASP A 60 14.521 4.324 -5.189 1.00 0.00 H new ATOM 0 HB3 ASP A 60 13.527 5.698 -4.751 1.00 0.00 H new ATOM 829 N ASN A 61 11.689 4.813 -7.416 1.00 0.00 N ATOM 830 CA ASN A 61 11.689 4.944 -8.869 1.00 0.00 C ATOM 831 C ASN A 61 12.383 6.233 -9.298 1.00 0.00 C ATOM 832 O ASN A 61 12.143 7.299 -8.731 1.00 0.00 O ATOM 833 CB ASN A 61 10.256 4.920 -9.404 1.00 0.00 C ATOM 834 CG ASN A 61 9.635 3.538 -9.334 1.00 0.00 C ATOM 835 OD1 ASN A 61 10.239 2.553 -9.757 1.00 0.00 O ATOM 836 ND2 ASN A 61 8.423 3.461 -8.797 1.00 0.00 N ATOM 0 H ASN A 61 11.013 5.409 -6.939 1.00 0.00 H new ATOM 0 HA ASN A 61 12.239 4.100 -9.286 1.00 0.00 H new ATOM 0 HB2 ASN A 61 9.646 5.619 -8.832 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.251 5.265 -10.438 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.955 2.558 -8.722 1.00 0.00 H new ATOM 0 HD22 ASN A 61 7.960 4.305 -8.459 1.00 0.00 H new ATOM 843 N LYS A 62 13.244 6.128 -10.305 1.00 0.00 N ATOM 844 CA LYS A 62 13.972 7.285 -10.813 1.00 0.00 C ATOM 845 C LYS A 62 13.154 8.022 -11.868 1.00 0.00 C ATOM 846 O LYS A 62 13.707 8.612 -12.797 1.00 0.00 O ATOM 847 CB LYS A 62 15.313 6.848 -11.406 1.00 0.00 C ATOM 848 CG LYS A 62 16.426 6.740 -10.379 1.00 0.00 C ATOM 849 CD LYS A 62 16.231 5.539 -9.469 1.00 0.00 C ATOM 850 CE LYS A 62 16.604 4.242 -10.170 1.00 0.00 C ATOM 851 NZ LYS A 62 17.028 3.191 -9.203 1.00 0.00 N ATOM 0 H LYS A 62 13.455 5.253 -10.785 1.00 0.00 H new ATOM 0 HA LYS A 62 14.153 7.964 -9.980 1.00 0.00 H new ATOM 0 HB2 LYS A 62 15.187 5.882 -11.895 1.00 0.00 H new ATOM 0 HB3 LYS A 62 15.609 7.560 -12.177 1.00 0.00 H new ATOM 0 HG2 LYS A 62 17.386 6.659 -10.889 1.00 0.00 H new ATOM 0 HG3 LYS A 62 16.459 7.650 -9.780 1.00 0.00 H new ATOM 0 HD2 LYS A 62 16.840 5.658 -8.573 1.00 0.00 H new ATOM 0 HD3 LYS A 62 15.192 5.492 -9.144 1.00 0.00 H new ATOM 0 HE2 LYS A 62 15.752 3.883 -10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 62 17.411 4.431 -10.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 17.274 2.323 -9.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 17.857 3.523 -8.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 16.249 2.992 -8.543 1.00 0.00 H new ATOM 865 N ASP A 63 11.834 7.986 -11.719 1.00 0.00 N ATOM 866 CA ASP A 63 10.940 8.653 -12.658 1.00 0.00 C ATOM 867 C ASP A 63 10.101 9.713 -11.950 1.00 0.00 C ATOM 868 O ASP A 63 10.214 10.903 -12.239 1.00 0.00 O ATOM 869 CB ASP A 63 10.025 7.632 -13.337 1.00 0.00 C ATOM 870 CG ASP A 63 9.344 8.196 -14.569 1.00 0.00 C ATOM 871 OD1 ASP A 63 10.041 8.808 -15.406 1.00 0.00 O ATOM 872 OD2 ASP A 63 8.114 8.023 -14.697 1.00 0.00 O ATOM 0 H ASP A 63 11.360 7.502 -10.957 1.00 0.00 H new ATOM 0 HA ASP A 63 11.550 9.144 -13.416 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.608 6.755 -13.617 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.268 7.298 -12.627 1.00 0.00 H new ATOM 877 N GLY A 64 9.259 9.271 -11.021 1.00 0.00 N ATOM 878 CA GLY A 64 8.413 10.194 -10.287 1.00 0.00 C ATOM 879 C GLY A 64 7.267 9.496 -9.582 1.00 0.00 C ATOM 880 O GLY A 64 6.122 9.941 -9.653 1.00 0.00 O ATOM 0 H GLY A 64 9.148 8.290 -10.764 1.00 0.00 H new ATOM 0 HA2 GLY A 64 9.016 10.728 -9.553 1.00 0.00 H new ATOM 0 HA3 GLY A 64 8.013 10.940 -10.974 1.00 0.00 H new ATOM 884 N SER A 65 7.576 8.397 -8.901 1.00 0.00 N ATOM 885 CA SER A 65 6.562 7.632 -8.185 1.00 0.00 C ATOM 886 C SER A 65 7.205 6.709 -7.154 1.00 0.00 C ATOM 887 O SER A 65 8.425 6.703 -6.986 1.00 0.00 O ATOM 888 CB SER A 65 5.723 6.812 -9.167 1.00 0.00 C ATOM 889 OG SER A 65 6.546 6.006 -9.992 1.00 0.00 O ATOM 0 H SER A 65 8.520 8.017 -8.830 1.00 0.00 H new ATOM 0 HA SER A 65 5.913 8.335 -7.663 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.026 6.181 -8.616 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.126 7.481 -9.787 1.00 0.00 H new ATOM 0 HG SER A 65 5.986 5.491 -10.609 1.00 0.00 H new ATOM 895 N CYS A 66 6.376 5.930 -6.468 1.00 0.00 N ATOM 896 CA CYS A 66 6.862 5.003 -5.453 1.00 0.00 C ATOM 897 C CYS A 66 6.119 3.673 -5.529 1.00 0.00 C ATOM 898 O CYS A 66 4.905 3.640 -5.732 1.00 0.00 O ATOM 899 CB CYS A 66 6.702 5.611 -4.058 1.00 0.00 C ATOM 900 SG CYS A 66 7.521 4.674 -2.746 1.00 0.00 S ATOM 0 H CYS A 66 5.364 5.922 -6.596 1.00 0.00 H new ATOM 0 HA CYS A 66 7.919 4.819 -5.642 1.00 0.00 H new ATOM 0 HB2 CYS A 66 7.100 6.626 -4.068 1.00 0.00 H new ATOM 0 HB3 CYS A 66 5.640 5.687 -3.826 1.00 0.00 H new ATOM 0 HG CYS A 66 7.331 5.268 -1.605 1.00 0.00 H new ATOM 906 N SER A 67 6.855 2.579 -5.368 1.00 0.00 N ATOM 907 CA SER A 67 6.267 1.246 -5.424 1.00 0.00 C ATOM 908 C SER A 67 6.381 0.544 -4.074 1.00 0.00 C ATOM 909 O SER A 67 7.367 0.710 -3.358 1.00 0.00 O ATOM 910 CB SER A 67 6.951 0.409 -6.507 1.00 0.00 C ATOM 911 OG SER A 67 6.087 -0.606 -6.989 1.00 0.00 O ATOM 0 H SER A 67 7.861 2.589 -5.198 1.00 0.00 H new ATOM 0 HA SER A 67 5.210 1.352 -5.670 1.00 0.00 H new ATOM 0 HB2 SER A 67 7.255 1.054 -7.331 1.00 0.00 H new ATOM 0 HB3 SER A 67 7.858 -0.042 -6.104 1.00 0.00 H new ATOM 0 HG SER A 67 6.547 -1.126 -7.681 1.00 0.00 H new ATOM 917 N ALA A 68 5.363 -0.241 -3.735 1.00 0.00 N ATOM 918 CA ALA A 68 5.349 -0.970 -2.473 1.00 0.00 C ATOM 919 C ALA A 68 4.804 -2.382 -2.661 1.00 0.00 C ATOM 920 O ALA A 68 3.634 -2.566 -2.993 1.00 0.00 O ATOM 921 CB ALA A 68 4.525 -0.218 -1.438 1.00 0.00 C ATOM 0 H ALA A 68 4.538 -0.388 -4.317 1.00 0.00 H new ATOM 0 HA ALA A 68 6.376 -1.049 -2.116 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.523 -0.774 -0.500 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.959 0.768 -1.274 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.502 -0.109 -1.797 1.00 0.00 H new ATOM 927 N GLU A 69 5.662 -3.375 -2.446 1.00 0.00 N ATOM 928 CA GLU A 69 5.265 -4.770 -2.594 1.00 0.00 C ATOM 929 C GLU A 69 5.240 -5.475 -1.241 1.00 0.00 C ATOM 930 O GLU A 69 6.174 -5.354 -0.448 1.00 0.00 O ATOM 931 CB GLU A 69 6.222 -5.497 -3.542 1.00 0.00 C ATOM 932 CG GLU A 69 7.589 -5.769 -2.937 1.00 0.00 C ATOM 933 CD GLU A 69 8.514 -6.499 -3.891 1.00 0.00 C ATOM 934 OE1 GLU A 69 8.593 -6.091 -5.069 1.00 0.00 O ATOM 935 OE2 GLU A 69 9.159 -7.478 -3.461 1.00 0.00 O ATOM 0 H GLU A 69 6.634 -3.239 -2.169 1.00 0.00 H new ATOM 0 HA GLU A 69 4.260 -4.793 -3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 69 5.773 -6.443 -3.843 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.346 -4.901 -4.446 1.00 0.00 H new ATOM 0 HG2 GLU A 69 8.047 -4.824 -2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.469 -6.360 -2.029 1.00 0.00 H new ATOM 942 N TYR A 70 4.164 -6.210 -0.983 1.00 0.00 N ATOM 943 CA TYR A 70 4.014 -6.931 0.275 1.00 0.00 C ATOM 944 C TYR A 70 3.529 -8.357 0.030 1.00 0.00 C ATOM 945 O TYR A 70 2.839 -8.630 -0.952 1.00 0.00 O ATOM 946 CB TYR A 70 3.035 -6.199 1.194 1.00 0.00 C ATOM 947 CG TYR A 70 1.594 -6.299 0.747 1.00 0.00 C ATOM 948 CD1 TYR A 70 0.796 -7.364 1.145 1.00 0.00 C ATOM 949 CD2 TYR A 70 1.031 -5.327 -0.071 1.00 0.00 C ATOM 950 CE1 TYR A 70 -0.521 -7.460 0.738 1.00 0.00 C ATOM 951 CE2 TYR A 70 -0.285 -5.414 -0.481 1.00 0.00 C ATOM 952 CZ TYR A 70 -1.057 -6.482 -0.074 1.00 0.00 C ATOM 953 OH TYR A 70 -2.369 -6.573 -0.480 1.00 0.00 O ATOM 0 H TYR A 70 3.383 -6.322 -1.629 1.00 0.00 H new ATOM 0 HA TYR A 70 4.990 -6.975 0.758 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.123 -6.605 2.202 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.318 -5.148 1.248 1.00 0.00 H new ATOM 0 HD1 TYR A 70 1.212 -8.130 1.783 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.633 -4.489 -0.392 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -1.127 -8.296 1.054 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -0.707 -4.650 -1.117 1.00 0.00 H new ATOM 0 HH TYR A 70 -2.635 -5.738 -0.918 1.00 0.00 H new ATOM 963 N ILE A 71 3.894 -9.262 0.932 1.00 0.00 N ATOM 964 CA ILE A 71 3.496 -10.659 0.817 1.00 0.00 C ATOM 965 C ILE A 71 3.057 -11.219 2.166 1.00 0.00 C ATOM 966 O ILE A 71 3.873 -11.504 3.042 1.00 0.00 O ATOM 967 CB ILE A 71 4.641 -11.527 0.261 1.00 0.00 C ATOM 968 CG1 ILE A 71 4.895 -11.193 -1.210 1.00 0.00 C ATOM 969 CG2 ILE A 71 4.314 -13.004 0.426 1.00 0.00 C ATOM 970 CD1 ILE A 71 6.254 -11.636 -1.704 1.00 0.00 C ATOM 0 H ILE A 71 4.465 -9.052 1.751 1.00 0.00 H new ATOM 0 HA ILE A 71 2.656 -10.691 0.123 1.00 0.00 H new ATOM 0 HB ILE A 71 5.548 -11.311 0.825 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.124 -11.665 -1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.799 -10.117 -1.352 1.00 0.00 H new ATOM 0 HG21 ILE A 71 5.132 -13.604 0.029 1.00 0.00 H new ATOM 0 HG22 ILE A 71 4.178 -13.231 1.483 1.00 0.00 H new ATOM 0 HG23 ILE A 71 3.397 -13.236 -0.116 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.365 -11.367 -2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 71 7.032 -11.144 -1.119 1.00 0.00 H new ATOM 0 HD13 ILE A 71 6.346 -12.717 -1.595 1.00 0.00 H new ATOM 982 N PRO A 72 1.737 -11.383 2.337 1.00 0.00 N ATOM 983 CA PRO A 72 1.160 -11.912 3.576 1.00 0.00 C ATOM 984 C PRO A 72 1.468 -13.393 3.773 1.00 0.00 C ATOM 985 O PRO A 72 1.993 -14.052 2.876 1.00 0.00 O ATOM 986 CB PRO A 72 -0.344 -11.700 3.386 1.00 0.00 C ATOM 987 CG PRO A 72 -0.540 -11.678 1.909 1.00 0.00 C ATOM 988 CD PRO A 72 0.707 -11.063 1.335 1.00 0.00 C ATOM 0 HA PRO A 72 1.566 -11.417 4.458 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -0.918 -12.502 3.850 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.673 -10.767 3.843 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -0.693 -12.685 1.521 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.421 -11.096 1.641 1.00 0.00 H new ATOM 0 HD2 PRO A 72 0.951 -11.484 0.360 1.00 0.00 H new ATOM 0 HD3 PRO A 72 0.599 -9.987 1.199 1.00 0.00 H new ATOM 996 N PHE A 73 1.137 -13.910 4.952 1.00 0.00 N ATOM 997 CA PHE A 73 1.379 -15.313 5.266 1.00 0.00 C ATOM 998 C PHE A 73 0.079 -16.018 5.641 1.00 0.00 C ATOM 999 O PHE A 73 0.010 -17.247 5.658 1.00 0.00 O ATOM 1000 CB PHE A 73 2.387 -15.434 6.411 1.00 0.00 C ATOM 1001 CG PHE A 73 3.764 -14.952 6.051 1.00 0.00 C ATOM 1002 CD1 PHE A 73 3.986 -13.621 5.739 1.00 0.00 C ATOM 1003 CD2 PHE A 73 4.835 -15.830 6.025 1.00 0.00 C ATOM 1004 CE1 PHE A 73 5.251 -13.174 5.408 1.00 0.00 C ATOM 1005 CE2 PHE A 73 6.102 -15.389 5.695 1.00 0.00 C ATOM 1006 CZ PHE A 73 6.311 -14.059 5.385 1.00 0.00 C ATOM 0 H PHE A 73 0.701 -13.378 5.705 1.00 0.00 H new ATOM 0 HA PHE A 73 1.789 -15.793 4.378 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.023 -14.864 7.266 1.00 0.00 H new ATOM 0 HB3 PHE A 73 2.446 -16.476 6.724 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.161 -12.924 5.755 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.678 -16.871 6.265 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.411 -12.133 5.167 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.929 -16.084 5.679 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.300 -13.712 5.125 1.00 0.00 H new ATOM 1016 N ALA A 74 -0.949 -15.231 5.942 1.00 0.00 N ATOM 1017 CA ALA A 74 -2.247 -15.779 6.315 1.00 0.00 C ATOM 1018 C ALA A 74 -3.383 -14.934 5.749 1.00 0.00 C ATOM 1019 O ALA A 74 -3.302 -13.707 5.681 1.00 0.00 O ATOM 1020 CB ALA A 74 -2.362 -15.876 7.829 1.00 0.00 C ATOM 0 H ALA A 74 -0.908 -14.212 5.935 1.00 0.00 H new ATOM 0 HA ALA A 74 -2.328 -16.780 5.890 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.336 -16.287 8.094 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -1.577 -16.527 8.213 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.256 -14.883 8.266 1.00 0.00 H new ATOM 1026 N PRO A 75 -4.468 -15.603 5.332 1.00 0.00 N ATOM 1027 CA PRO A 75 -5.641 -14.933 4.764 1.00 0.00 C ATOM 1028 C PRO A 75 -6.414 -14.134 5.808 1.00 0.00 C ATOM 1029 O PRO A 75 -6.468 -14.510 6.978 1.00 0.00 O ATOM 1030 CB PRO A 75 -6.492 -16.092 4.239 1.00 0.00 C ATOM 1031 CG PRO A 75 -6.090 -17.263 5.068 1.00 0.00 C ATOM 1032 CD PRO A 75 -4.633 -17.065 5.384 1.00 0.00 C ATOM 0 HA PRO A 75 -5.365 -14.208 3.998 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.556 -15.880 4.343 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.305 -16.273 3.181 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.684 -17.317 5.981 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.249 -18.197 4.528 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.377 -17.464 6.366 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.993 -17.568 4.659 1.00 0.00 H new ATOM 1040 N GLY A 76 -7.013 -13.028 5.376 1.00 0.00 N ATOM 1041 CA GLY A 76 -7.776 -12.193 6.286 1.00 0.00 C ATOM 1042 C GLY A 76 -7.916 -10.769 5.787 1.00 0.00 C ATOM 1043 O GLY A 76 -7.664 -10.487 4.616 1.00 0.00 O ATOM 0 H GLY A 76 -6.983 -12.695 4.412 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -8.767 -12.625 6.426 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.290 -12.187 7.262 1.00 0.00 H new ATOM 1047 N ASP A 77 -8.320 -9.869 6.677 1.00 0.00 N ATOM 1048 CA ASP A 77 -8.494 -8.466 6.321 1.00 0.00 C ATOM 1049 C ASP A 77 -7.294 -7.638 6.771 1.00 0.00 C ATOM 1050 O ASP A 77 -7.096 -7.413 7.965 1.00 0.00 O ATOM 1051 CB ASP A 77 -9.775 -7.913 6.949 1.00 0.00 C ATOM 1052 CG ASP A 77 -9.943 -8.341 8.393 1.00 0.00 C ATOM 1053 OD1 ASP A 77 -10.526 -9.421 8.629 1.00 0.00 O ATOM 1054 OD2 ASP A 77 -9.491 -7.597 9.288 1.00 0.00 O ATOM 0 H ASP A 77 -8.533 -10.086 7.651 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.572 -8.399 5.236 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.762 -6.824 6.895 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -10.635 -8.251 6.371 1.00 0.00 H new ATOM 1059 N TYR A 78 -6.498 -7.190 5.808 1.00 0.00 N ATOM 1060 CA TYR A 78 -5.315 -6.390 6.105 1.00 0.00 C ATOM 1061 C TYR A 78 -5.600 -4.904 5.912 1.00 0.00 C ATOM 1062 O TYR A 78 -6.597 -4.526 5.296 1.00 0.00 O ATOM 1063 CB TYR A 78 -4.148 -6.816 5.213 1.00 0.00 C ATOM 1064 CG TYR A 78 -3.536 -8.141 5.608 1.00 0.00 C ATOM 1065 CD1 TYR A 78 -4.245 -9.327 5.464 1.00 0.00 C ATOM 1066 CD2 TYR A 78 -2.249 -8.207 6.127 1.00 0.00 C ATOM 1067 CE1 TYR A 78 -3.691 -10.540 5.825 1.00 0.00 C ATOM 1068 CE2 TYR A 78 -1.686 -9.415 6.490 1.00 0.00 C ATOM 1069 CZ TYR A 78 -2.410 -10.579 6.337 1.00 0.00 C ATOM 1070 OH TYR A 78 -1.853 -11.784 6.698 1.00 0.00 O ATOM 0 H TYR A 78 -6.650 -7.367 4.815 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.047 -6.558 7.148 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -4.494 -6.878 4.181 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.377 -6.046 5.245 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -5.247 -9.300 5.063 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -1.679 -7.298 6.249 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -4.257 -11.452 5.707 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.684 -9.448 6.892 1.00 0.00 H new ATOM 0 HH TYR A 78 -2.399 -12.516 6.343 1.00 0.00 H new ATOM 1080 N ASP A 79 -4.717 -4.065 6.443 1.00 0.00 N ATOM 1081 CA ASP A 79 -4.871 -2.620 6.329 1.00 0.00 C ATOM 1082 C ASP A 79 -3.569 -1.969 5.873 1.00 0.00 C ATOM 1083 O ASP A 79 -2.592 -1.920 6.620 1.00 0.00 O ATOM 1084 CB ASP A 79 -5.311 -2.025 7.668 1.00 0.00 C ATOM 1085 CG ASP A 79 -6.818 -2.014 7.830 1.00 0.00 C ATOM 1086 OD1 ASP A 79 -7.393 -3.089 8.098 1.00 0.00 O ATOM 1087 OD2 ASP A 79 -7.422 -0.930 7.687 1.00 0.00 O ATOM 0 H ASP A 79 -3.887 -4.361 6.957 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.638 -2.419 5.581 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.865 -2.598 8.481 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.932 -1.006 7.752 1.00 0.00 H new ATOM 1092 N VAL A 80 -3.563 -1.471 4.640 1.00 0.00 N ATOM 1093 CA VAL A 80 -2.381 -0.823 4.083 1.00 0.00 C ATOM 1094 C VAL A 80 -2.266 0.619 4.566 1.00 0.00 C ATOM 1095 O VAL A 80 -3.015 1.492 4.130 1.00 0.00 O ATOM 1096 CB VAL A 80 -2.407 -0.837 2.544 1.00 0.00 C ATOM 1097 CG1 VAL A 80 -1.137 -0.215 1.983 1.00 0.00 C ATOM 1098 CG2 VAL A 80 -2.589 -2.256 2.027 1.00 0.00 C ATOM 0 H VAL A 80 -4.363 -1.504 4.008 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.516 -1.389 4.429 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.255 -0.241 2.207 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.173 -0.234 0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.055 0.816 2.326 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.272 -0.782 2.327 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.605 -2.247 0.937 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.763 -2.878 2.373 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -3.529 -2.661 2.400 1.00 0.00 H new ATOM 1108 N ASN A 81 -1.322 0.861 5.469 1.00 0.00 N ATOM 1109 CA ASN A 81 -1.108 2.198 6.012 1.00 0.00 C ATOM 1110 C ASN A 81 -0.077 2.962 5.187 1.00 0.00 C ATOM 1111 O ASN A 81 1.025 2.469 4.942 1.00 0.00 O ATOM 1112 CB ASN A 81 -0.649 2.112 7.469 1.00 0.00 C ATOM 1113 CG ASN A 81 -1.749 1.627 8.394 1.00 0.00 C ATOM 1114 OD1 ASN A 81 -2.443 2.426 9.024 1.00 0.00 O ATOM 1115 ND2 ASN A 81 -1.913 0.312 8.480 1.00 0.00 N ATOM 0 H ASN A 81 -0.693 0.149 5.840 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.055 2.737 5.967 1.00 0.00 H new ATOM 0 HB2 ASN A 81 0.204 1.438 7.539 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -0.308 3.093 7.798 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -2.637 -0.073 9.086 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -1.315 -0.313 7.940 1.00 0.00 H new ATOM 1122 N ILE A 82 -0.442 4.166 4.762 1.00 0.00 N ATOM 1123 CA ILE A 82 0.451 4.998 3.966 1.00 0.00 C ATOM 1124 C ILE A 82 0.474 6.432 4.484 1.00 0.00 C ATOM 1125 O ILE A 82 -0.545 7.124 4.475 1.00 0.00 O ATOM 1126 CB ILE A 82 0.040 5.007 2.482 1.00 0.00 C ATOM 1127 CG1 ILE A 82 -0.097 3.575 1.959 1.00 0.00 C ATOM 1128 CG2 ILE A 82 1.054 5.784 1.655 1.00 0.00 C ATOM 1129 CD1 ILE A 82 -0.977 3.460 0.735 1.00 0.00 C ATOM 0 H ILE A 82 -1.350 4.588 4.956 1.00 0.00 H new ATOM 0 HA ILE A 82 1.448 4.565 4.056 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.927 5.501 2.392 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.894 3.187 1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -0.505 2.946 2.750 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.749 5.781 0.609 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.106 6.812 2.015 1.00 0.00 H new ATOM 0 HG23 ILE A 82 2.034 5.317 1.749 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -1.028 2.418 0.420 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -1.979 3.817 0.973 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.559 4.062 -0.072 1.00 0.00 H new ATOM 1141 N THR A 83 1.644 6.875 4.934 1.00 0.00 N ATOM 1142 CA THR A 83 1.801 8.227 5.455 1.00 0.00 C ATOM 1143 C THR A 83 2.930 8.963 4.744 1.00 0.00 C ATOM 1144 O THR A 83 4.007 8.407 4.527 1.00 0.00 O ATOM 1145 CB THR A 83 2.084 8.216 6.969 1.00 0.00 C ATOM 1146 OG1 THR A 83 3.222 7.394 7.249 1.00 0.00 O ATOM 1147 CG2 THR A 83 0.878 7.701 7.741 1.00 0.00 C ATOM 0 H THR A 83 2.497 6.316 4.948 1.00 0.00 H new ATOM 0 HA THR A 83 0.861 8.747 5.272 1.00 0.00 H new ATOM 0 HB THR A 83 2.289 9.239 7.285 1.00 0.00 H new ATOM 0 HG1 THR A 83 3.396 7.394 8.213 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.101 7.702 8.808 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.021 8.346 7.549 1.00 0.00 H new ATOM 0 HG23 THR A 83 0.647 6.685 7.420 1.00 0.00 H new ATOM 1155 N TYR A 84 2.678 10.216 4.383 1.00 0.00 N ATOM 1156 CA TYR A 84 3.674 11.029 3.694 1.00 0.00 C ATOM 1157 C TYR A 84 4.298 12.047 4.644 1.00 0.00 C ATOM 1158 O TYR A 84 3.643 12.996 5.072 1.00 0.00 O ATOM 1159 CB TYR A 84 3.041 11.748 2.502 1.00 0.00 C ATOM 1160 CG TYR A 84 4.030 12.106 1.416 1.00 0.00 C ATOM 1161 CD1 TYR A 84 4.944 11.172 0.946 1.00 0.00 C ATOM 1162 CD2 TYR A 84 4.050 13.380 0.861 1.00 0.00 C ATOM 1163 CE1 TYR A 84 5.850 11.495 -0.045 1.00 0.00 C ATOM 1164 CE2 TYR A 84 4.951 13.711 -0.132 1.00 0.00 C ATOM 1165 CZ TYR A 84 5.850 12.766 -0.582 1.00 0.00 C ATOM 1166 OH TYR A 84 6.750 13.093 -1.570 1.00 0.00 O ATOM 0 H TYR A 84 1.792 10.691 4.556 1.00 0.00 H new ATOM 0 HA TYR A 84 4.460 10.366 3.333 1.00 0.00 H new ATOM 0 HB2 TYR A 84 2.262 11.114 2.078 1.00 0.00 H new ATOM 0 HB3 TYR A 84 2.555 12.658 2.854 1.00 0.00 H new ATOM 0 HD1 TYR A 84 4.946 10.176 1.363 1.00 0.00 H new ATOM 0 HD2 TYR A 84 3.350 14.123 1.212 1.00 0.00 H new ATOM 0 HE1 TYR A 84 6.555 10.757 -0.398 1.00 0.00 H new ATOM 0 HE2 TYR A 84 4.952 14.705 -0.554 1.00 0.00 H new ATOM 0 HH TYR A 84 6.828 14.068 -1.632 1.00 0.00 H new ATOM 1176 N GLY A 85 5.571 11.841 4.969 1.00 0.00 N ATOM 1177 CA GLY A 85 6.264 12.749 5.865 1.00 0.00 C ATOM 1178 C GLY A 85 5.863 12.551 7.313 1.00 0.00 C ATOM 1179 O GLY A 85 6.671 12.122 8.135 1.00 0.00 O ATOM 0 H GLY A 85 6.134 11.062 4.628 1.00 0.00 H new ATOM 0 HA2 GLY A 85 7.340 12.603 5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.054 13.777 5.570 1.00 0.00 H new ATOM 1183 N GLY A 86 4.611 12.868 7.628 1.00 0.00 N ATOM 1184 CA GLY A 86 4.127 12.718 8.988 1.00 0.00 C ATOM 1185 C GLY A 86 2.615 12.776 9.075 1.00 0.00 C ATOM 1186 O GLY A 86 2.058 13.062 10.135 1.00 0.00 O ATOM 0 H GLY A 86 3.923 13.226 6.966 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.475 11.767 9.391 1.00 0.00 H new ATOM 0 HA3 GLY A 86 4.554 13.504 9.611 1.00 0.00 H new ATOM 1190 N ALA A 87 1.949 12.506 7.957 1.00 0.00 N ATOM 1191 CA ALA A 87 0.492 12.528 7.912 1.00 0.00 C ATOM 1192 C ALA A 87 -0.052 11.322 7.154 1.00 0.00 C ATOM 1193 O ALA A 87 0.693 10.617 6.472 1.00 0.00 O ATOM 1194 CB ALA A 87 0.003 13.819 7.274 1.00 0.00 C ATOM 0 H ALA A 87 2.395 12.270 7.071 1.00 0.00 H new ATOM 0 HA ALA A 87 0.121 12.478 8.936 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -1.087 13.822 7.247 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.354 14.669 7.859 1.00 0.00 H new ATOM 0 HB3 ALA A 87 0.391 13.893 6.258 1.00 0.00 H new ATOM 1200 N HIS A 88 -1.355 11.089 7.277 1.00 0.00 N ATOM 1201 CA HIS A 88 -1.999 9.967 6.603 1.00 0.00 C ATOM 1202 C HIS A 88 -2.739 10.436 5.354 1.00 0.00 C ATOM 1203 O HIS A 88 -3.467 11.429 5.389 1.00 0.00 O ATOM 1204 CB HIS A 88 -2.970 9.264 7.552 1.00 0.00 C ATOM 1205 CG HIS A 88 -2.337 8.166 8.351 1.00 0.00 C ATOM 1206 ND1 HIS A 88 -2.357 6.844 7.961 1.00 0.00 N ATOM 1207 CD2 HIS A 88 -1.662 8.201 9.524 1.00 0.00 C ATOM 1208 CE1 HIS A 88 -1.723 6.112 8.860 1.00 0.00 C ATOM 1209 NE2 HIS A 88 -1.292 6.912 9.819 1.00 0.00 N ATOM 0 H HIS A 88 -1.986 11.662 7.837 1.00 0.00 H new ATOM 0 HA HIS A 88 -1.224 9.263 6.301 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -3.395 10.000 8.234 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -3.796 8.851 6.973 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -1.453 9.079 10.117 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -1.581 5.042 8.818 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -0.769 6.620 10.645 1.00 0.00 H new ATOM 1218 N ILE A 89 -2.548 9.717 4.254 1.00 0.00 N ATOM 1219 CA ILE A 89 -3.198 10.060 2.995 1.00 0.00 C ATOM 1220 C ILE A 89 -4.676 9.687 3.020 1.00 0.00 C ATOM 1221 O ILE A 89 -5.095 8.753 3.705 1.00 0.00 O ATOM 1222 CB ILE A 89 -2.523 9.356 1.803 1.00 0.00 C ATOM 1223 CG1 ILE A 89 -2.758 7.846 1.874 1.00 0.00 C ATOM 1224 CG2 ILE A 89 -1.033 9.665 1.780 1.00 0.00 C ATOM 1225 CD1 ILE A 89 -2.503 7.132 0.565 1.00 0.00 C ATOM 0 H ILE A 89 -1.948 8.893 4.209 1.00 0.00 H new ATOM 0 HA ILE A 89 -3.100 11.139 2.873 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.967 9.731 0.880 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.111 7.422 2.642 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.786 7.661 2.185 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.570 9.160 0.932 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.886 10.741 1.687 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.575 9.315 2.705 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -2.689 6.065 0.690 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -3.168 7.529 -0.202 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.467 7.286 0.262 1.00 0.00 H new ATOM 1237 N PRO A 90 -5.488 10.432 2.255 1.00 0.00 N ATOM 1238 CA PRO A 90 -6.932 10.197 2.170 1.00 0.00 C ATOM 1239 C PRO A 90 -7.267 8.903 1.436 1.00 0.00 C ATOM 1240 O PRO A 90 -7.423 8.893 0.216 1.00 0.00 O ATOM 1241 CB PRO A 90 -7.442 11.406 1.383 1.00 0.00 C ATOM 1242 CG PRO A 90 -6.272 11.855 0.578 1.00 0.00 C ATOM 1243 CD PRO A 90 -5.057 11.561 1.413 1.00 0.00 C ATOM 0 HA PRO A 90 -7.386 10.090 3.155 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -8.282 11.136 0.743 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -7.790 12.195 2.050 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.228 11.327 -0.374 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -6.341 12.919 0.350 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -4.199 11.297 0.795 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.764 12.422 2.014 1.00 0.00 H new ATOM 1251 N GLY A 91 -7.376 7.812 2.189 1.00 0.00 N ATOM 1252 CA GLY A 91 -7.692 6.528 1.592 1.00 0.00 C ATOM 1253 C GLY A 91 -7.170 5.364 2.410 1.00 0.00 C ATOM 1254 O GLY A 91 -7.608 4.227 2.234 1.00 0.00 O ATOM 0 H GLY A 91 -7.251 7.795 3.201 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.773 6.437 1.485 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.267 6.483 0.589 1.00 0.00 H new ATOM 1258 N SER A 92 -6.230 5.647 3.307 1.00 0.00 N ATOM 1259 CA SER A 92 -5.644 4.613 4.152 1.00 0.00 C ATOM 1260 C SER A 92 -6.193 4.697 5.572 1.00 0.00 C ATOM 1261 O SER A 92 -6.605 5.757 6.045 1.00 0.00 O ATOM 1262 CB SER A 92 -4.120 4.747 4.173 1.00 0.00 C ATOM 1263 OG SER A 92 -3.588 4.316 5.414 1.00 0.00 O ATOM 0 H SER A 92 -5.858 6.583 3.467 1.00 0.00 H new ATOM 0 HA SER A 92 -5.911 3.642 3.735 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.689 4.157 3.364 1.00 0.00 H new ATOM 0 HB3 SER A 92 -3.840 5.785 3.995 1.00 0.00 H new ATOM 0 HG SER A 92 -3.107 5.057 5.839 1.00 0.00 H new ATOM 1269 N PRO A 93 -6.201 3.552 6.271 1.00 0.00 N ATOM 1270 CA PRO A 93 -5.714 2.284 5.719 1.00 0.00 C ATOM 1271 C PRO A 93 -6.628 1.738 4.627 1.00 0.00 C ATOM 1272 O PRO A 93 -7.847 1.900 4.687 1.00 0.00 O ATOM 1273 CB PRO A 93 -5.709 1.348 6.930 1.00 0.00 C ATOM 1274 CG PRO A 93 -6.732 1.917 7.852 1.00 0.00 C ATOM 1275 CD PRO A 93 -6.685 3.407 7.654 1.00 0.00 C ATOM 0 HA PRO A 93 -4.739 2.394 5.244 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -5.959 0.327 6.642 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -4.726 1.315 7.401 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -7.723 1.524 7.625 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -6.514 1.654 8.887 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -7.667 3.861 7.786 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -6.014 3.886 8.367 1.00 0.00 H new ATOM 1283 N PHE A 94 -6.032 1.092 3.631 1.00 0.00 N ATOM 1284 CA PHE A 94 -6.794 0.522 2.526 1.00 0.00 C ATOM 1285 C PHE A 94 -7.087 -0.955 2.771 1.00 0.00 C ATOM 1286 O PHE A 94 -6.180 -1.787 2.772 1.00 0.00 O ATOM 1287 CB PHE A 94 -6.028 0.690 1.211 1.00 0.00 C ATOM 1288 CG PHE A 94 -5.918 2.118 0.760 1.00 0.00 C ATOM 1289 CD1 PHE A 94 -5.140 3.023 1.464 1.00 0.00 C ATOM 1290 CD2 PHE A 94 -6.593 2.556 -0.368 1.00 0.00 C ATOM 1291 CE1 PHE A 94 -5.037 4.338 1.051 1.00 0.00 C ATOM 1292 CE2 PHE A 94 -6.494 3.870 -0.786 1.00 0.00 C ATOM 1293 CZ PHE A 94 -5.714 4.762 -0.076 1.00 0.00 C ATOM 0 H PHE A 94 -5.024 0.950 3.566 1.00 0.00 H new ATOM 0 HA PHE A 94 -7.742 1.056 2.458 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.026 0.276 1.328 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.524 0.109 0.434 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -4.608 2.697 2.346 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -7.204 1.863 -0.927 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.428 5.034 1.609 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -7.026 4.199 -1.667 1.00 0.00 H new ATOM 0 HZ PHE A 94 -5.634 5.789 -0.401 1.00 0.00 H new ATOM 1303 N ARG A 95 -8.361 -1.272 2.980 1.00 0.00 N ATOM 1304 CA ARG A 95 -8.775 -2.648 3.229 1.00 0.00 C ATOM 1305 C ARG A 95 -8.490 -3.529 2.016 1.00 0.00 C ATOM 1306 O ARG A 95 -8.905 -3.220 0.900 1.00 0.00 O ATOM 1307 CB ARG A 95 -10.265 -2.701 3.572 1.00 0.00 C ATOM 1308 CG ARG A 95 -10.801 -4.113 3.741 1.00 0.00 C ATOM 1309 CD ARG A 95 -10.184 -4.802 4.948 1.00 0.00 C ATOM 1310 NE ARG A 95 -10.692 -4.262 6.206 1.00 0.00 N ATOM 1311 CZ ARG A 95 -11.918 -4.492 6.663 1.00 0.00 C ATOM 1312 NH1 ARG A 95 -12.757 -5.249 5.969 1.00 0.00 N ATOM 1313 NH2 ARG A 95 -12.306 -3.965 7.817 1.00 0.00 N ATOM 0 H ARG A 95 -9.124 -0.595 2.982 1.00 0.00 H new ATOM 0 HA ARG A 95 -8.201 -3.026 4.075 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -10.437 -2.143 4.493 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -10.828 -2.199 2.785 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -11.885 -4.081 3.853 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -10.591 -4.693 2.843 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -10.393 -5.871 4.902 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.100 -4.688 4.916 1.00 0.00 H new ATOM 0 HE ARG A 95 -10.071 -3.676 6.765 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -12.462 -5.656 5.082 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -13.698 -5.424 6.322 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -11.663 -3.383 8.354 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -13.247 -4.142 8.168 1.00 0.00 H new ATOM 1327 N VAL A 96 -7.778 -4.628 2.244 1.00 0.00 N ATOM 1328 CA VAL A 96 -7.438 -5.555 1.171 1.00 0.00 C ATOM 1329 C VAL A 96 -7.789 -6.989 1.551 1.00 0.00 C ATOM 1330 O VAL A 96 -7.178 -7.591 2.435 1.00 0.00 O ATOM 1331 CB VAL A 96 -5.940 -5.481 0.820 1.00 0.00 C ATOM 1332 CG1 VAL A 96 -5.626 -6.373 -0.371 1.00 0.00 C ATOM 1333 CG2 VAL A 96 -5.528 -4.043 0.542 1.00 0.00 C ATOM 0 H VAL A 96 -7.425 -4.898 3.162 1.00 0.00 H new ATOM 0 HA VAL A 96 -8.023 -5.260 0.300 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.367 -5.841 1.674 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.563 -6.308 -0.604 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.882 -7.405 -0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.207 -6.047 -1.233 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.467 -4.010 0.296 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.107 -3.654 -0.295 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.715 -3.434 1.426 1.00 0.00 H new ATOM 1343 N PRO A 97 -8.797 -7.552 0.869 1.00 0.00 N ATOM 1344 CA PRO A 97 -9.253 -8.923 1.117 1.00 0.00 C ATOM 1345 C PRO A 97 -8.235 -9.963 0.662 1.00 0.00 C ATOM 1346 O PRO A 97 -8.135 -10.270 -0.526 1.00 0.00 O ATOM 1347 CB PRO A 97 -10.533 -9.027 0.285 1.00 0.00 C ATOM 1348 CG PRO A 97 -10.363 -8.019 -0.799 1.00 0.00 C ATOM 1349 CD PRO A 97 -9.571 -6.893 -0.197 1.00 0.00 C ATOM 0 HA PRO A 97 -9.402 -9.117 2.179 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -10.660 -10.030 -0.123 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -11.416 -8.815 0.888 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -9.841 -8.450 -1.654 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -11.330 -7.667 -1.160 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -8.920 -6.421 -0.933 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -10.220 -6.113 0.201 1.00 0.00 H new ATOM 1357 N VAL A 98 -7.481 -10.503 1.614 1.00 0.00 N ATOM 1358 CA VAL A 98 -6.472 -11.510 1.311 1.00 0.00 C ATOM 1359 C VAL A 98 -7.068 -12.913 1.344 1.00 0.00 C ATOM 1360 O VAL A 98 -7.391 -13.438 2.410 1.00 0.00 O ATOM 1361 CB VAL A 98 -5.294 -11.441 2.302 1.00 0.00 C ATOM 1362 CG1 VAL A 98 -4.295 -12.554 2.023 1.00 0.00 C ATOM 1363 CG2 VAL A 98 -4.621 -10.079 2.234 1.00 0.00 C ATOM 0 H VAL A 98 -7.550 -10.260 2.602 1.00 0.00 H new ATOM 0 HA VAL A 98 -6.105 -11.298 0.307 1.00 0.00 H new ATOM 0 HB VAL A 98 -5.682 -11.579 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -3.470 -12.489 2.733 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -4.788 -13.520 2.127 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -3.910 -12.451 1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -3.791 -10.047 2.940 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -4.245 -9.909 1.225 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -5.343 -9.303 2.488 1.00 0.00 H new ATOM 1373 N LYS A 99 -7.210 -13.517 0.169 1.00 0.00 N ATOM 1374 CA LYS A 99 -7.766 -14.861 0.062 1.00 0.00 C ATOM 1375 C LYS A 99 -6.659 -15.910 0.076 1.00 0.00 C ATOM 1376 O LYS A 99 -5.494 -15.600 -0.173 1.00 0.00 O ATOM 1377 CB LYS A 99 -8.592 -14.992 -1.220 1.00 0.00 C ATOM 1378 CG LYS A 99 -9.614 -13.884 -1.401 1.00 0.00 C ATOM 1379 CD LYS A 99 -10.003 -13.717 -2.860 1.00 0.00 C ATOM 1380 CE LYS A 99 -11.406 -13.147 -3.002 1.00 0.00 C ATOM 1381 NZ LYS A 99 -11.973 -13.398 -4.356 1.00 0.00 N ATOM 0 H LYS A 99 -6.948 -13.097 -0.723 1.00 0.00 H new ATOM 0 HA LYS A 99 -8.413 -15.030 0.923 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.919 -14.997 -2.077 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -9.107 -15.953 -1.214 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -10.502 -14.107 -0.810 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -9.206 -12.947 -1.023 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -9.290 -13.058 -3.354 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -9.948 -14.682 -3.365 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -12.056 -13.591 -2.248 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.383 -12.074 -2.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -12.930 -12.994 -4.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -11.367 -12.953 -5.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -12.019 -14.423 -4.529 1.00 0.00 H new ATOM 1395 N ASP A 100 -7.031 -17.152 0.367 1.00 0.00 N ATOM 1396 CA ASP A 100 -6.069 -18.247 0.410 1.00 0.00 C ATOM 1397 C ASP A 100 -6.077 -19.030 -0.899 1.00 0.00 C ATOM 1398 O ASP A 100 -7.124 -19.496 -1.349 1.00 0.00 O ATOM 1399 CB ASP A 100 -6.382 -19.182 1.580 1.00 0.00 C ATOM 1400 CG ASP A 100 -7.869 -19.293 1.850 1.00 0.00 C ATOM 1401 OD1 ASP A 100 -8.419 -18.396 2.524 1.00 0.00 O ATOM 1402 OD2 ASP A 100 -8.484 -20.277 1.388 1.00 0.00 O ATOM 0 H ASP A 100 -7.991 -17.425 0.576 1.00 0.00 H new ATOM 0 HA ASP A 100 -5.076 -17.820 0.550 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.979 -20.172 1.368 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -5.879 -18.819 2.476 1.00 0.00 H new ATOM 1407 N VAL A 101 -4.903 -19.169 -1.507 1.00 0.00 N ATOM 1408 CA VAL A 101 -4.775 -19.895 -2.765 1.00 0.00 C ATOM 1409 C VAL A 101 -5.592 -21.182 -2.743 1.00 0.00 C ATOM 1410 O VAL A 101 -6.258 -21.524 -3.720 1.00 0.00 O ATOM 1411 CB VAL A 101 -3.305 -20.238 -3.068 1.00 0.00 C ATOM 1412 CG1 VAL A 101 -3.199 -21.058 -4.345 1.00 0.00 C ATOM 1413 CG2 VAL A 101 -2.471 -18.970 -3.168 1.00 0.00 C ATOM 0 H VAL A 101 -4.027 -18.788 -1.149 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.156 -19.240 -3.548 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.914 -20.838 -2.246 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.153 -21.290 -4.542 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.761 -21.985 -4.230 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -3.607 -20.487 -5.179 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.435 -19.232 -3.383 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.860 -18.341 -3.969 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.520 -18.427 -2.224 1.00 0.00 H new ATOM 1423 N VAL A 102 -5.537 -21.892 -1.620 1.00 0.00 N ATOM 1424 CA VAL A 102 -6.273 -23.141 -1.469 1.00 0.00 C ATOM 1425 C VAL A 102 -7.073 -23.154 -0.171 1.00 0.00 C ATOM 1426 O VAL A 102 -6.576 -22.750 0.880 1.00 0.00 O ATOM 1427 CB VAL A 102 -5.327 -24.356 -1.488 1.00 0.00 C ATOM 1428 CG1 VAL A 102 -4.378 -24.313 -0.300 1.00 0.00 C ATOM 1429 CG2 VAL A 102 -6.124 -25.652 -1.498 1.00 0.00 C ATOM 0 H VAL A 102 -4.990 -21.623 -0.802 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.957 -23.209 -2.315 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.731 -24.316 -2.400 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -3.717 -25.179 -0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.783 -23.401 -0.343 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -4.953 -24.328 0.626 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -5.439 -26.500 -1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -6.747 -25.703 -0.605 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.757 -25.683 -2.385 1.00 0.00 H new ATOM 1439 N ASP A 103 -8.314 -23.621 -0.253 1.00 0.00 N ATOM 1440 CA ASP A 103 -9.184 -23.689 0.916 1.00 0.00 C ATOM 1441 C ASP A 103 -9.629 -25.124 1.180 1.00 0.00 C ATOM 1442 O ASP A 103 -9.831 -25.916 0.259 1.00 0.00 O ATOM 1443 CB ASP A 103 -10.406 -22.790 0.722 1.00 0.00 C ATOM 1444 CG ASP A 103 -11.158 -23.103 -0.557 1.00 0.00 C ATOM 1445 OD1 ASP A 103 -10.511 -23.178 -1.622 1.00 0.00 O ATOM 1446 OD2 ASP A 103 -12.393 -23.274 -0.492 1.00 0.00 O ATOM 0 H ASP A 103 -8.740 -23.958 -1.116 1.00 0.00 H new ATOM 0 HA ASP A 103 -8.619 -23.339 1.780 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -11.078 -22.906 1.573 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -10.088 -21.748 0.707 1.00 0.00 H new ATOM 1451 N PRO A 104 -9.785 -25.468 2.467 1.00 0.00 N ATOM 1452 CA PRO A 104 -10.208 -26.809 2.881 1.00 0.00 C ATOM 1453 C PRO A 104 -11.663 -27.094 2.527 1.00 0.00 C ATOM 1454 O PRO A 104 -12.456 -26.173 2.331 1.00 0.00 O ATOM 1455 CB PRO A 104 -10.022 -26.785 4.401 1.00 0.00 C ATOM 1456 CG PRO A 104 -10.132 -25.347 4.773 1.00 0.00 C ATOM 1457 CD PRO A 104 -9.562 -24.575 3.616 1.00 0.00 C ATOM 0 HA PRO A 104 -9.636 -27.590 2.379 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -10.783 -27.383 4.902 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -9.054 -27.195 4.688 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -11.170 -25.069 4.954 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -9.582 -25.138 5.690 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.066 -23.618 3.485 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -8.503 -24.361 3.759 1.00 0.00 H new ATOM 1465 N SER A 105 -12.008 -28.375 2.446 1.00 0.00 N ATOM 1466 CA SER A 105 -13.368 -28.781 2.112 1.00 0.00 C ATOM 1467 C SER A 105 -14.283 -28.671 3.328 1.00 0.00 C ATOM 1468 O SER A 105 -15.367 -28.094 3.252 1.00 0.00 O ATOM 1469 CB SER A 105 -13.379 -30.215 1.580 1.00 0.00 C ATOM 1470 OG SER A 105 -12.954 -31.131 2.574 1.00 0.00 O ATOM 0 H SER A 105 -11.364 -29.150 2.607 1.00 0.00 H new ATOM 0 HA SER A 105 -13.740 -28.111 1.337 1.00 0.00 H new ATOM 0 HB2 SER A 105 -14.384 -30.475 1.247 1.00 0.00 H new ATOM 0 HB3 SER A 105 -12.726 -30.289 0.710 1.00 0.00 H new ATOM 0 HG SER A 105 -12.972 -32.041 2.210 1.00 0.00 H new TER 1476 SER A 105