USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 890 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 102 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 106 HIS : no HD1:sc= 0 K(o=0,f=0.57) USER MOD Set 2.1: A 43 ASN : amide:sc= -0.992 K(o=-0.99,f=-3.4!) USER MOD Set 2.2: A 46 SER OG : rot 87:sc= 0.00466 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0.0608 USER MOD Single : A 5 SER OG : rot -87:sc= 0.157 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00276 USER MOD Single : A 9 ASN : amide:sc= -0.135 K(o=-0.13,f=-1.8!) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 165:sc= -0.0295 USER MOD Single : A 15 MET CE :methyl -159:sc= 0 (180deg=-0.612) USER MOD Single : A 16 LYS NZ :NH3+ -124:sc= 0.306 (180deg=-2.03!) USER MOD Single : A 17 TYR OH : rot 180:sc= -0.236 USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.662 USER MOD Single : A 19 ASN : amide:sc= -1.48 X(o=-1.5,f=-1.6) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.251 K(o=-0.25,f=-2.2!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 33 ASN : amide:sc= -0.773 K(o=-0.77,f=-1.4) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.187 K(o=-0.19,f=-1.2) USER MOD Single : A 48 ASN : amide:sc= 0.0656 K(o=0.066,f=-1.5!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= -0.655 USER MOD Single : A 69 SER OG : rot 180:sc= 0.00162 USER MOD Single : A 70 HIS : no HD1:sc= -4.92! K(o=-4.9!,f=-3.6) USER MOD Single : A 71 THR OG1 : rot -53:sc= -1.45 USER MOD Single : A 73 THR OG1 : rot -62:sc= 0.0651 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0101 X(o=-0.01,f=-0.01) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -152:sc= -0.0267 (180deg=-1.01) USER MOD Single : A 93 GLN : amide:sc= -0.0685 X(o=-0.069,f=-0.54) USER MOD Single : A 94 HIS : no HE2:sc= -0.888 K(o=-0.89,f=-3.5!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.309 K(o=-0.31,f=-1.3) USER MOD Single : A 103 THR OG1 : rot 20:sc= -0.697 USER MOD Single : A 104 GLN : amide:sc=-0.00112 K(o=-0.0011,f=-0.9) USER MOD Single : A 105 HIS : no HD1:sc= -0.0312 X(o=-0.031,f=-0.15) USER MOD Single : A 107 THR OG1 : rot -37:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 ASN : amide:sc= 0.0269 K(o=0.027,f=-0.65) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 41:sc= 0.649 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.741 -4.940 8.812 1.00 0.00 N ATOM 2 CA GLY A 1 -17.186 -6.127 9.434 1.00 0.00 C ATOM 3 C GLY A 1 -16.863 -5.917 10.900 1.00 0.00 C ATOM 4 O GLY A 1 -17.763 -5.768 11.726 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.944 -5.135 7.811 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.620 -4.672 9.298 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.056 -4.160 8.880 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.894 -6.950 9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.280 -6.421 8.904 1.00 0.00 H new ATOM 8 N SER A 2 -15.574 -5.905 11.225 1.00 0.00 N ATOM 9 CA SER A 2 -15.134 -5.717 12.602 1.00 0.00 C ATOM 10 C SER A 2 -14.637 -4.292 12.823 1.00 0.00 C ATOM 11 O SER A 2 -13.688 -3.847 12.178 1.00 0.00 O ATOM 12 CB SER A 2 -14.028 -6.715 12.947 1.00 0.00 C ATOM 13 OG SER A 2 -14.540 -8.034 13.037 1.00 0.00 O ATOM 0 H SER A 2 -14.816 -6.023 10.553 1.00 0.00 H new ATOM 0 HA SER A 2 -15.987 -5.891 13.257 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.248 -6.676 12.186 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.565 -6.436 13.893 1.00 0.00 H new ATOM 0 HG SER A 2 -13.813 -8.653 13.257 1.00 0.00 H new ATOM 19 N SER A 3 -15.284 -3.582 13.741 1.00 0.00 N ATOM 20 CA SER A 3 -14.911 -2.205 14.047 1.00 0.00 C ATOM 21 C SER A 3 -13.934 -2.154 15.217 1.00 0.00 C ATOM 22 O SER A 3 -13.880 -3.071 16.036 1.00 0.00 O ATOM 23 CB SER A 3 -16.156 -1.377 14.370 1.00 0.00 C ATOM 24 OG SER A 3 -17.116 -2.150 15.069 1.00 0.00 O ATOM 0 H SER A 3 -16.069 -3.937 14.286 1.00 0.00 H new ATOM 0 HA SER A 3 -14.421 -1.784 13.169 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.875 -0.511 14.970 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.593 -0.997 13.447 1.00 0.00 H new ATOM 0 HG SER A 3 -17.901 -1.597 15.265 1.00 0.00 H new ATOM 30 N GLY A 4 -13.162 -1.074 15.289 1.00 0.00 N ATOM 31 CA GLY A 4 -12.196 -0.922 16.362 1.00 0.00 C ATOM 32 C GLY A 4 -10.769 -1.110 15.888 1.00 0.00 C ATOM 33 O GLY A 4 -10.457 -2.085 15.205 1.00 0.00 O ATOM 0 H GLY A 4 -13.188 -0.301 14.624 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.301 0.069 16.804 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.413 -1.646 17.147 1.00 0.00 H new ATOM 37 N SER A 5 -9.899 -0.172 16.249 1.00 0.00 N ATOM 38 CA SER A 5 -8.497 -0.235 15.852 1.00 0.00 C ATOM 39 C SER A 5 -7.607 0.439 16.891 1.00 0.00 C ATOM 40 O SER A 5 -7.648 1.658 17.063 1.00 0.00 O ATOM 41 CB SER A 5 -8.302 0.429 14.488 1.00 0.00 C ATOM 42 OG SER A 5 -7.214 -0.151 13.789 1.00 0.00 O ATOM 0 H SER A 5 -10.140 0.641 16.816 1.00 0.00 H new ATOM 0 HA SER A 5 -8.211 -1.285 15.782 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.213 0.328 13.898 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.125 1.496 14.622 1.00 0.00 H new ATOM 0 HG SER A 5 -6.383 0.302 14.043 1.00 0.00 H new ATOM 48 N SER A 6 -6.803 -0.362 17.582 1.00 0.00 N ATOM 49 CA SER A 6 -5.904 0.155 18.607 1.00 0.00 C ATOM 50 C SER A 6 -4.942 1.182 18.018 1.00 0.00 C ATOM 51 O SER A 6 -4.750 2.261 18.576 1.00 0.00 O ATOM 52 CB SER A 6 -5.118 -0.989 19.250 1.00 0.00 C ATOM 53 OG SER A 6 -4.421 -1.742 18.272 1.00 0.00 O ATOM 0 H SER A 6 -6.756 -1.372 17.451 1.00 0.00 H new ATOM 0 HA SER A 6 -6.507 0.645 19.371 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.411 -0.586 19.975 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.800 -1.640 19.797 1.00 0.00 H new ATOM 0 HG SER A 6 -3.925 -2.466 18.709 1.00 0.00 H new ATOM 59 N GLY A 7 -4.337 0.835 16.886 1.00 0.00 N ATOM 60 CA GLY A 7 -3.401 1.736 16.239 1.00 0.00 C ATOM 61 C GLY A 7 -3.461 1.647 14.727 1.00 0.00 C ATOM 62 O GLY A 7 -4.294 0.930 14.174 1.00 0.00 O ATOM 0 H GLY A 7 -4.478 -0.054 16.406 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.614 2.759 16.548 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.389 1.506 16.574 1.00 0.00 H new ATOM 66 N GLU A 8 -2.577 2.380 14.057 1.00 0.00 N ATOM 67 CA GLU A 8 -2.536 2.382 12.599 1.00 0.00 C ATOM 68 C GLU A 8 -1.316 1.622 12.088 1.00 0.00 C ATOM 69 O GLU A 8 -0.308 2.222 11.718 1.00 0.00 O ATOM 70 CB GLU A 8 -2.516 3.817 12.070 1.00 0.00 C ATOM 71 CG GLU A 8 -3.848 4.535 12.205 1.00 0.00 C ATOM 72 CD GLU A 8 -3.721 6.037 12.034 1.00 0.00 C ATOM 73 OE1 GLU A 8 -2.656 6.587 12.383 1.00 0.00 O ATOM 74 OE2 GLU A 8 -4.689 6.662 11.550 1.00 0.00 O ATOM 0 H GLU A 8 -1.880 2.979 14.500 1.00 0.00 H new ATOM 0 HA GLU A 8 -3.433 1.881 12.235 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -1.753 4.382 12.605 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -2.225 3.804 11.020 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -4.543 4.146 11.461 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -4.275 4.319 13.184 1.00 0.00 H new ATOM 81 N ASN A 9 -1.416 0.297 12.071 1.00 0.00 N ATOM 82 CA ASN A 9 -0.320 -0.546 11.607 1.00 0.00 C ATOM 83 C ASN A 9 -0.776 -1.994 11.453 1.00 0.00 C ATOM 84 O ASN A 9 -1.029 -2.686 12.439 1.00 0.00 O ATOM 85 CB ASN A 9 0.857 -0.472 12.582 1.00 0.00 C ATOM 86 CG ASN A 9 2.184 -0.765 11.909 1.00 0.00 C ATOM 87 OD1 ASN A 9 2.621 -1.914 11.849 1.00 0.00 O ATOM 88 ND2 ASN A 9 2.832 0.276 11.400 1.00 0.00 N ATOM 0 H ASN A 9 -2.244 -0.216 12.373 1.00 0.00 H new ATOM 0 HA ASN A 9 0.001 -0.178 10.632 1.00 0.00 H new ATOM 0 HB2 ASN A 9 0.892 0.521 13.031 1.00 0.00 H new ATOM 0 HB3 ASN A 9 0.699 -1.183 13.393 1.00 0.00 H new ATOM 0 HD21 ASN A 9 3.730 0.140 10.936 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.432 1.211 11.473 1.00 0.00 H new ATOM 95 N VAL A 10 -0.877 -2.447 10.207 1.00 0.00 N ATOM 96 CA VAL A 10 -1.301 -3.813 9.922 1.00 0.00 C ATOM 97 C VAL A 10 -0.101 -4.745 9.793 1.00 0.00 C ATOM 98 O VAL A 10 0.786 -4.521 8.969 1.00 0.00 O ATOM 99 CB VAL A 10 -2.134 -3.884 8.629 1.00 0.00 C ATOM 100 CG1 VAL A 10 -2.722 -5.275 8.448 1.00 0.00 C ATOM 101 CG2 VAL A 10 -3.231 -2.830 8.643 1.00 0.00 C ATOM 0 H VAL A 10 -0.671 -1.888 9.379 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.919 -4.134 10.761 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.477 -3.680 7.783 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.307 -5.306 7.529 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.916 -6.006 8.389 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.365 -5.511 9.296 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.810 -2.895 7.722 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.888 -2.999 9.496 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.783 -1.839 8.721 1.00 0.00 H new ATOM 111 N TYR A 11 -0.080 -5.790 10.612 1.00 0.00 N ATOM 112 CA TYR A 11 1.012 -6.756 10.591 1.00 0.00 C ATOM 113 C TYR A 11 0.484 -8.180 10.736 1.00 0.00 C ATOM 114 O TYR A 11 -0.690 -8.390 11.038 1.00 0.00 O ATOM 115 CB TYR A 11 2.009 -6.454 11.711 1.00 0.00 C ATOM 116 CG TYR A 11 1.378 -5.816 12.928 1.00 0.00 C ATOM 117 CD1 TYR A 11 0.112 -6.195 13.357 1.00 0.00 C ATOM 118 CD2 TYR A 11 2.047 -4.834 13.648 1.00 0.00 C ATOM 119 CE1 TYR A 11 -0.469 -5.614 14.468 1.00 0.00 C ATOM 120 CE2 TYR A 11 1.474 -4.249 14.761 1.00 0.00 C ATOM 121 CZ TYR A 11 0.216 -4.643 15.167 1.00 0.00 C ATOM 122 OH TYR A 11 -0.358 -4.061 16.274 1.00 0.00 O ATOM 0 H TYR A 11 -0.807 -5.990 11.299 1.00 0.00 H new ATOM 0 HA TYR A 11 1.518 -6.672 9.629 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.499 -7.381 12.010 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.786 -5.793 11.326 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.427 -6.957 12.813 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.032 -4.523 13.332 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -1.455 -5.919 14.787 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.008 -3.488 15.310 1.00 0.00 H new ATOM 0 HH TYR A 11 0.257 -3.398 16.651 1.00 0.00 H new ATOM 132 N GLY A 12 1.361 -9.155 10.517 1.00 0.00 N ATOM 133 CA GLY A 12 0.966 -10.547 10.628 1.00 0.00 C ATOM 134 C GLY A 12 1.894 -11.475 9.870 1.00 0.00 C ATOM 135 O GLY A 12 2.375 -11.136 8.788 1.00 0.00 O ATOM 0 H GLY A 12 2.338 -9.006 10.265 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.949 -10.834 11.679 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.049 -10.665 10.249 1.00 0.00 H new ATOM 139 N TYR A 13 2.148 -12.648 10.439 1.00 0.00 N ATOM 140 CA TYR A 13 3.028 -13.627 9.811 1.00 0.00 C ATOM 141 C TYR A 13 2.442 -14.121 8.493 1.00 0.00 C ATOM 142 O TYR A 13 1.423 -14.813 8.473 1.00 0.00 O ATOM 143 CB TYR A 13 3.264 -14.809 10.753 1.00 0.00 C ATOM 144 CG TYR A 13 4.426 -14.608 11.699 1.00 0.00 C ATOM 145 CD1 TYR A 13 4.383 -13.630 12.685 1.00 0.00 C ATOM 146 CD2 TYR A 13 5.567 -15.396 11.606 1.00 0.00 C ATOM 147 CE1 TYR A 13 5.443 -13.442 13.551 1.00 0.00 C ATOM 148 CE2 TYR A 13 6.631 -15.216 12.468 1.00 0.00 C ATOM 149 CZ TYR A 13 6.565 -14.238 13.439 1.00 0.00 C ATOM 150 OH TYR A 13 7.623 -14.055 14.299 1.00 0.00 O ATOM 0 H TYR A 13 1.757 -12.944 11.333 1.00 0.00 H new ATOM 0 HA TYR A 13 3.981 -13.141 9.603 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.359 -14.985 11.335 1.00 0.00 H new ATOM 0 HB3 TYR A 13 3.441 -15.706 10.159 1.00 0.00 H new ATOM 0 HD1 TYR A 13 3.506 -13.006 12.776 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.623 -16.162 10.847 1.00 0.00 H new ATOM 0 HE1 TYR A 13 5.394 -12.677 14.311 1.00 0.00 H new ATOM 0 HE2 TYR A 13 7.510 -15.838 12.382 1.00 0.00 H new ATOM 0 HH TYR A 13 8.220 -14.830 14.252 1.00 0.00 H new ATOM 160 N LEU A 14 3.093 -13.761 7.392 1.00 0.00 N ATOM 161 CA LEU A 14 2.638 -14.168 6.067 1.00 0.00 C ATOM 162 C LEU A 14 3.629 -15.131 5.423 1.00 0.00 C ATOM 163 O LEU A 14 4.770 -15.253 5.868 1.00 0.00 O ATOM 164 CB LEU A 14 2.447 -12.941 5.173 1.00 0.00 C ATOM 165 CG LEU A 14 1.410 -11.921 5.645 1.00 0.00 C ATOM 166 CD1 LEU A 14 1.734 -10.539 5.098 1.00 0.00 C ATOM 167 CD2 LEU A 14 0.012 -12.349 5.225 1.00 0.00 C ATOM 0 H LEU A 14 3.937 -13.188 7.391 1.00 0.00 H new ATOM 0 HA LEU A 14 1.683 -14.681 6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.407 -12.434 5.076 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.164 -13.282 4.177 1.00 0.00 H new ATOM 0 HG LEU A 14 1.442 -11.875 6.734 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.986 -9.826 5.444 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.719 -10.230 5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.730 -10.569 4.008 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.713 -11.612 5.569 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.035 -12.424 4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.219 -13.319 5.666 1.00 0.00 H new ATOM 179 N MET A 15 3.186 -15.813 4.371 1.00 0.00 N ATOM 180 CA MET A 15 4.036 -16.764 3.664 1.00 0.00 C ATOM 181 C MET A 15 4.589 -16.149 2.382 1.00 0.00 C ATOM 182 O MET A 15 3.833 -15.753 1.494 1.00 0.00 O ATOM 183 CB MET A 15 3.252 -18.036 3.336 1.00 0.00 C ATOM 184 CG MET A 15 2.906 -18.868 4.560 1.00 0.00 C ATOM 185 SD MET A 15 2.652 -20.609 4.167 1.00 0.00 S ATOM 186 CE MET A 15 4.120 -21.337 4.889 1.00 0.00 C ATOM 0 H MET A 15 2.244 -15.725 3.990 1.00 0.00 H new ATOM 0 HA MET A 15 4.873 -17.019 4.315 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.331 -17.763 2.820 1.00 0.00 H new ATOM 0 HB3 MET A 15 3.836 -18.645 2.646 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.707 -18.778 5.294 1.00 0.00 H new ATOM 0 HG3 MET A 15 2.004 -18.469 5.023 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.308 -22.307 4.430 1.00 0.00 H new ATOM 0 HE2 MET A 15 4.974 -20.682 4.716 1.00 0.00 H new ATOM 0 HE3 MET A 15 3.973 -21.466 5.961 1.00 0.00 H new ATOM 196 N LYS A 16 5.912 -16.071 2.291 1.00 0.00 N ATOM 197 CA LYS A 16 6.567 -15.505 1.118 1.00 0.00 C ATOM 198 C LYS A 16 7.207 -16.601 0.270 1.00 0.00 C ATOM 199 O LYS A 16 7.722 -17.586 0.799 1.00 0.00 O ATOM 200 CB LYS A 16 7.630 -14.488 1.542 1.00 0.00 C ATOM 201 CG LYS A 16 7.884 -13.407 0.506 1.00 0.00 C ATOM 202 CD LYS A 16 8.924 -12.409 0.986 1.00 0.00 C ATOM 203 CE LYS A 16 8.872 -11.119 0.181 1.00 0.00 C ATOM 204 NZ LYS A 16 7.773 -10.224 0.638 1.00 0.00 N ATOM 0 H LYS A 16 6.552 -16.393 3.017 1.00 0.00 H new ATOM 0 HA LYS A 16 5.809 -15.001 0.518 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.320 -14.019 2.476 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.564 -15.013 1.743 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.220 -13.865 -0.424 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.952 -12.886 0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 16 8.758 -12.188 2.040 1.00 0.00 H new ATOM 0 HD3 LYS A 16 9.918 -12.850 0.905 1.00 0.00 H new ATOM 0 HE2 LYS A 16 9.825 -10.598 0.269 1.00 0.00 H new ATOM 0 HE3 LYS A 16 8.733 -11.355 -0.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.153 -9.998 -0.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.221 -10.702 1.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 8.177 -9.346 1.021 1.00 0.00 H new ATOM 218 N TYR A 17 7.171 -16.421 -1.045 1.00 0.00 N ATOM 219 CA TYR A 17 7.746 -17.395 -1.965 1.00 0.00 C ATOM 220 C TYR A 17 9.176 -17.015 -2.337 1.00 0.00 C ATOM 221 O TYR A 17 9.547 -15.841 -2.310 1.00 0.00 O ATOM 222 CB TYR A 17 6.890 -17.502 -3.229 1.00 0.00 C ATOM 223 CG TYR A 17 6.972 -18.852 -3.903 1.00 0.00 C ATOM 224 CD1 TYR A 17 8.064 -19.193 -4.691 1.00 0.00 C ATOM 225 CD2 TYR A 17 5.957 -19.789 -3.751 1.00 0.00 C ATOM 226 CE1 TYR A 17 8.143 -20.425 -5.310 1.00 0.00 C ATOM 227 CE2 TYR A 17 6.027 -21.025 -4.365 1.00 0.00 C ATOM 228 CZ TYR A 17 7.122 -21.338 -5.143 1.00 0.00 C ATOM 229 OH TYR A 17 7.197 -22.568 -5.757 1.00 0.00 O ATOM 0 H TYR A 17 6.750 -15.610 -1.498 1.00 0.00 H new ATOM 0 HA TYR A 17 7.765 -18.363 -1.464 1.00 0.00 H new ATOM 0 HB2 TYR A 17 5.851 -17.296 -2.972 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.202 -16.733 -3.935 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.866 -18.482 -4.822 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.098 -19.547 -3.142 1.00 0.00 H new ATOM 0 HE1 TYR A 17 8.999 -20.672 -5.921 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.229 -21.741 -4.236 1.00 0.00 H new ATOM 0 HH TYR A 17 6.399 -23.092 -5.537 1.00 0.00 H new ATOM 239 N THR A 18 9.977 -18.018 -2.685 1.00 0.00 N ATOM 240 CA THR A 18 11.366 -17.791 -3.062 1.00 0.00 C ATOM 241 C THR A 18 11.688 -18.450 -4.399 1.00 0.00 C ATOM 242 O THR A 18 11.935 -17.769 -5.393 1.00 0.00 O ATOM 243 CB THR A 18 12.334 -18.330 -1.992 1.00 0.00 C ATOM 244 OG1 THR A 18 12.184 -19.748 -1.864 1.00 0.00 O ATOM 245 CG2 THR A 18 12.078 -17.665 -0.647 1.00 0.00 C ATOM 0 H THR A 18 9.687 -18.995 -2.713 1.00 0.00 H new ATOM 0 HA THR A 18 11.497 -16.712 -3.150 1.00 0.00 H new ATOM 0 HB THR A 18 13.352 -18.100 -2.306 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.804 -20.082 -1.183 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.773 -18.061 0.093 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.222 -16.589 -0.740 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.055 -17.868 -0.329 1.00 0.00 H new ATOM 253 N ASN A 19 11.682 -19.779 -4.415 1.00 0.00 N ATOM 254 CA ASN A 19 11.973 -20.530 -5.631 1.00 0.00 C ATOM 255 C ASN A 19 11.313 -21.905 -5.592 1.00 0.00 C ATOM 256 O ASN A 19 11.172 -22.508 -4.528 1.00 0.00 O ATOM 257 CB ASN A 19 13.485 -20.682 -5.811 1.00 0.00 C ATOM 258 CG ASN A 19 14.188 -19.346 -5.950 1.00 0.00 C ATOM 259 OD1 ASN A 19 14.079 -18.679 -6.979 1.00 0.00 O ATOM 260 ND2 ASN A 19 14.915 -18.949 -4.912 1.00 0.00 N ATOM 0 H ASN A 19 11.479 -20.358 -3.600 1.00 0.00 H new ATOM 0 HA ASN A 19 11.567 -19.976 -6.477 1.00 0.00 H new ATOM 0 HB2 ASN A 19 13.898 -21.219 -4.957 1.00 0.00 H new ATOM 0 HB3 ASN A 19 13.684 -21.288 -6.695 1.00 0.00 H new ATOM 0 HD21 ASN A 19 15.411 -18.059 -4.948 1.00 0.00 H new ATOM 0 HD22 ASN A 19 14.977 -19.534 -4.079 1.00 0.00 H new ATOM 267 N LEU A 20 10.911 -22.395 -6.760 1.00 0.00 N ATOM 268 CA LEU A 20 10.266 -23.699 -6.861 1.00 0.00 C ATOM 269 C LEU A 20 10.888 -24.691 -5.883 1.00 0.00 C ATOM 270 O LEU A 20 10.216 -25.194 -4.982 1.00 0.00 O ATOM 271 CB LEU A 20 10.377 -24.236 -8.289 1.00 0.00 C ATOM 272 CG LEU A 20 9.359 -23.691 -9.292 1.00 0.00 C ATOM 273 CD1 LEU A 20 9.904 -22.452 -9.986 1.00 0.00 C ATOM 274 CD2 LEU A 20 8.991 -24.758 -10.312 1.00 0.00 C ATOM 0 H LEU A 20 11.021 -21.909 -7.650 1.00 0.00 H new ATOM 0 HA LEU A 20 9.213 -23.577 -6.606 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.378 -24.017 -8.662 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.280 -25.321 -8.256 1.00 0.00 H new ATOM 0 HG LEU A 20 8.457 -23.410 -8.749 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.166 -22.078 -10.696 1.00 0.00 H new ATOM 0 HD12 LEU A 20 10.115 -21.682 -9.244 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.822 -22.706 -10.517 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.266 -24.352 -11.017 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.886 -25.070 -10.851 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.558 -25.617 -9.800 1.00 0.00 H new ATOM 286 N VAL A 21 12.175 -24.966 -6.066 1.00 0.00 N ATOM 287 CA VAL A 21 12.889 -25.895 -5.198 1.00 0.00 C ATOM 288 C VAL A 21 12.466 -25.724 -3.744 1.00 0.00 C ATOM 289 O VAL A 21 12.002 -26.669 -3.104 1.00 0.00 O ATOM 290 CB VAL A 21 14.414 -25.704 -5.304 1.00 0.00 C ATOM 291 CG1 VAL A 21 14.771 -24.226 -5.255 1.00 0.00 C ATOM 292 CG2 VAL A 21 15.124 -26.470 -4.199 1.00 0.00 C ATOM 0 H VAL A 21 12.745 -24.559 -6.808 1.00 0.00 H new ATOM 0 HA VAL A 21 12.633 -26.900 -5.532 1.00 0.00 H new ATOM 0 HB VAL A 21 14.748 -26.102 -6.262 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.852 -24.110 -5.331 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.291 -23.708 -6.085 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.426 -23.799 -4.313 1.00 0.00 H new ATOM 0 HG21 VAL A 21 16.200 -26.324 -4.289 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.788 -26.104 -3.229 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.893 -27.532 -4.286 1.00 0.00 H new ATOM 302 N THR A 22 12.629 -24.511 -3.224 1.00 0.00 N ATOM 303 CA THR A 22 12.265 -24.215 -1.845 1.00 0.00 C ATOM 304 C THR A 22 10.751 -24.204 -1.666 1.00 0.00 C ATOM 305 O THR A 22 10.187 -25.080 -1.012 1.00 0.00 O ATOM 306 CB THR A 22 12.834 -22.857 -1.392 1.00 0.00 C ATOM 307 OG1 THR A 22 14.184 -22.715 -1.849 1.00 0.00 O ATOM 308 CG2 THR A 22 12.791 -22.730 0.123 1.00 0.00 C ATOM 0 H THR A 22 13.011 -23.718 -3.738 1.00 0.00 H new ATOM 0 HA THR A 22 12.695 -25.004 -1.229 1.00 0.00 H new ATOM 0 HB THR A 22 12.219 -22.068 -1.824 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.538 -21.849 -1.559 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.198 -21.763 0.419 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.759 -22.810 0.466 1.00 0.00 H new ATOM 0 HG23 THR A 22 13.385 -23.526 0.572 1.00 0.00 H new ATOM 316 N GLY A 23 10.098 -23.204 -2.252 1.00 0.00 N ATOM 317 CA GLY A 23 8.655 -23.098 -2.145 1.00 0.00 C ATOM 318 C GLY A 23 8.223 -21.992 -1.204 1.00 0.00 C ATOM 319 O GLY A 23 8.954 -21.023 -0.997 1.00 0.00 O ATOM 0 H GLY A 23 10.543 -22.466 -2.798 1.00 0.00 H new ATOM 0 HA2 GLY A 23 8.233 -22.915 -3.133 1.00 0.00 H new ATOM 0 HA3 GLY A 23 8.249 -24.047 -1.796 1.00 0.00 H new ATOM 323 N TRP A 24 7.032 -22.134 -0.633 1.00 0.00 N ATOM 324 CA TRP A 24 6.503 -21.137 0.290 1.00 0.00 C ATOM 325 C TRP A 24 7.272 -21.152 1.607 1.00 0.00 C ATOM 326 O TRP A 24 7.544 -22.215 2.164 1.00 0.00 O ATOM 327 CB TRP A 24 5.017 -21.391 0.551 1.00 0.00 C ATOM 328 CG TRP A 24 4.147 -21.092 -0.633 1.00 0.00 C ATOM 329 CD1 TRP A 24 3.838 -21.940 -1.658 1.00 0.00 C ATOM 330 CD2 TRP A 24 3.477 -19.859 -0.914 1.00 0.00 C ATOM 331 NE1 TRP A 24 3.016 -21.308 -2.559 1.00 0.00 N ATOM 332 CE2 TRP A 24 2.778 -20.031 -2.126 1.00 0.00 C ATOM 333 CE3 TRP A 24 3.396 -18.626 -0.260 1.00 0.00 C ATOM 334 CZ2 TRP A 24 2.013 -19.016 -2.694 1.00 0.00 C ATOM 335 CZ3 TRP A 24 2.636 -17.621 -0.825 1.00 0.00 C ATOM 336 CH2 TRP A 24 1.952 -17.820 -2.032 1.00 0.00 C ATOM 0 H TRP A 24 6.415 -22.930 -0.793 1.00 0.00 H new ATOM 0 HA TRP A 24 6.622 -20.155 -0.168 1.00 0.00 H new ATOM 0 HB2 TRP A 24 4.879 -22.433 0.841 1.00 0.00 H new ATOM 0 HB3 TRP A 24 4.694 -20.780 1.394 1.00 0.00 H new ATOM 0 HD1 TRP A 24 4.188 -22.958 -1.747 1.00 0.00 H new ATOM 0 HE1 TRP A 24 2.643 -21.723 -3.413 1.00 0.00 H new ATOM 0 HE3 TRP A 24 3.919 -18.462 0.671 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 1.486 -19.167 -3.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 2.567 -16.665 -0.328 1.00 0.00 H new ATOM 0 HH2 TRP A 24 1.366 -17.014 -2.448 1.00 0.00 H new ATOM 347 N GLN A 25 7.619 -19.967 2.098 1.00 0.00 N ATOM 348 CA GLN A 25 8.357 -19.846 3.349 1.00 0.00 C ATOM 349 C GLN A 25 7.587 -18.999 4.357 1.00 0.00 C ATOM 350 O GLN A 25 6.837 -18.097 3.980 1.00 0.00 O ATOM 351 CB GLN A 25 9.735 -19.230 3.096 1.00 0.00 C ATOM 352 CG GLN A 25 10.672 -20.138 2.316 1.00 0.00 C ATOM 353 CD GLN A 25 11.428 -21.102 3.208 1.00 0.00 C ATOM 354 OE1 GLN A 25 10.857 -21.698 4.122 1.00 0.00 O ATOM 355 NE2 GLN A 25 12.720 -21.261 2.948 1.00 0.00 N ATOM 0 H GLN A 25 7.401 -19.078 1.649 1.00 0.00 H new ATOM 0 HA GLN A 25 8.484 -20.846 3.764 1.00 0.00 H new ATOM 0 HB2 GLN A 25 9.611 -18.294 2.551 1.00 0.00 H new ATOM 0 HB3 GLN A 25 10.195 -18.983 4.053 1.00 0.00 H new ATOM 0 HG2 GLN A 25 10.097 -20.703 1.582 1.00 0.00 H new ATOM 0 HG3 GLN A 25 11.385 -19.528 1.761 1.00 0.00 H new ATOM 0 HE21 GLN A 25 13.153 -20.747 2.181 1.00 0.00 H new ATOM 0 HE22 GLN A 25 13.280 -21.897 3.516 1.00 0.00 H new ATOM 364 N TYR A 26 7.775 -19.294 5.638 1.00 0.00 N ATOM 365 CA TYR A 26 7.095 -18.562 6.699 1.00 0.00 C ATOM 366 C TYR A 26 7.956 -17.406 7.201 1.00 0.00 C ATOM 367 O TYR A 26 9.154 -17.567 7.438 1.00 0.00 O ATOM 368 CB TYR A 26 6.755 -19.500 7.858 1.00 0.00 C ATOM 369 CG TYR A 26 5.518 -19.092 8.625 1.00 0.00 C ATOM 370 CD1 TYR A 26 4.255 -19.208 8.056 1.00 0.00 C ATOM 371 CD2 TYR A 26 5.611 -18.590 9.917 1.00 0.00 C ATOM 372 CE1 TYR A 26 3.121 -18.835 8.753 1.00 0.00 C ATOM 373 CE2 TYR A 26 4.482 -18.216 10.621 1.00 0.00 C ATOM 374 CZ TYR A 26 3.240 -18.341 10.035 1.00 0.00 C ATOM 375 OH TYR A 26 2.114 -17.969 10.732 1.00 0.00 O ATOM 0 H TYR A 26 8.393 -20.036 5.967 1.00 0.00 H new ATOM 0 HA TYR A 26 6.172 -18.153 6.289 1.00 0.00 H new ATOM 0 HB2 TYR A 26 6.615 -20.508 7.469 1.00 0.00 H new ATOM 0 HB3 TYR A 26 7.601 -19.538 8.544 1.00 0.00 H new ATOM 0 HD1 TYR A 26 4.158 -19.596 7.053 1.00 0.00 H new ATOM 0 HD2 TYR A 26 6.582 -18.490 10.379 1.00 0.00 H new ATOM 0 HE1 TYR A 26 2.147 -18.930 8.296 1.00 0.00 H new ATOM 0 HE2 TYR A 26 4.572 -17.828 11.625 1.00 0.00 H new ATOM 0 HH TYR A 26 2.371 -17.643 11.620 1.00 0.00 H new ATOM 385 N ARG A 27 7.336 -16.242 7.362 1.00 0.00 N ATOM 386 CA ARG A 27 8.044 -15.059 7.836 1.00 0.00 C ATOM 387 C ARG A 27 7.074 -14.056 8.454 1.00 0.00 C ATOM 388 O ARG A 27 5.861 -14.268 8.454 1.00 0.00 O ATOM 389 CB ARG A 27 8.809 -14.402 6.685 1.00 0.00 C ATOM 390 CG ARG A 27 10.083 -15.138 6.302 1.00 0.00 C ATOM 391 CD ARG A 27 11.038 -14.236 5.536 1.00 0.00 C ATOM 392 NE ARG A 27 12.118 -14.992 4.908 1.00 0.00 N ATOM 393 CZ ARG A 27 11.951 -15.762 3.838 1.00 0.00 C ATOM 394 NH1 ARG A 27 10.753 -15.877 3.281 1.00 0.00 N ATOM 395 NH2 ARG A 27 12.983 -16.419 3.324 1.00 0.00 N ATOM 0 H ARG A 27 6.345 -16.093 7.171 1.00 0.00 H new ATOM 0 HA ARG A 27 8.752 -15.373 8.603 1.00 0.00 H new ATOM 0 HB2 ARG A 27 8.157 -14.343 5.813 1.00 0.00 H new ATOM 0 HB3 ARG A 27 9.060 -13.379 6.964 1.00 0.00 H new ATOM 0 HG2 ARG A 27 10.574 -15.510 7.201 1.00 0.00 H new ATOM 0 HG3 ARG A 27 9.834 -16.007 5.693 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.486 -13.689 4.772 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.461 -13.495 6.215 1.00 0.00 H new ATOM 0 HE ARG A 27 13.052 -14.925 5.313 1.00 0.00 H new ATOM 0 HH11 ARG A 27 9.957 -15.374 3.674 1.00 0.00 H new ATOM 0 HH12 ARG A 27 10.627 -16.469 2.460 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.906 -16.333 3.750 1.00 0.00 H new ATOM 0 HH22 ARG A 27 12.854 -17.010 2.503 1.00 0.00 H new ATOM 409 N PHE A 28 7.617 -12.963 8.979 1.00 0.00 N ATOM 410 CA PHE A 28 6.800 -11.927 9.602 1.00 0.00 C ATOM 411 C PHE A 28 6.746 -10.678 8.728 1.00 0.00 C ATOM 412 O PHE A 28 7.750 -10.272 8.142 1.00 0.00 O ATOM 413 CB PHE A 28 7.354 -11.573 10.984 1.00 0.00 C ATOM 414 CG PHE A 28 6.545 -10.533 11.705 1.00 0.00 C ATOM 415 CD1 PHE A 28 5.166 -10.642 11.786 1.00 0.00 C ATOM 416 CD2 PHE A 28 7.163 -9.447 12.303 1.00 0.00 C ATOM 417 CE1 PHE A 28 4.419 -9.687 12.449 1.00 0.00 C ATOM 418 CE2 PHE A 28 6.422 -8.488 12.968 1.00 0.00 C ATOM 419 CZ PHE A 28 5.048 -8.609 13.041 1.00 0.00 C ATOM 0 H PHE A 28 8.619 -12.771 8.986 1.00 0.00 H new ATOM 0 HA PHE A 28 5.788 -12.315 9.713 1.00 0.00 H new ATOM 0 HB2 PHE A 28 7.395 -12.476 11.593 1.00 0.00 H new ATOM 0 HB3 PHE A 28 8.378 -11.215 10.876 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.669 -11.483 11.326 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.237 -9.348 12.249 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.345 -9.783 12.504 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.916 -7.646 13.429 1.00 0.00 H new ATOM 0 HZ PHE A 28 4.466 -7.862 13.560 1.00 0.00 H new ATOM 429 N PHE A 29 5.565 -10.073 8.644 1.00 0.00 N ATOM 430 CA PHE A 29 5.378 -8.871 7.840 1.00 0.00 C ATOM 431 C PHE A 29 4.772 -7.747 8.675 1.00 0.00 C ATOM 432 O PHE A 29 3.972 -7.991 9.578 1.00 0.00 O ATOM 433 CB PHE A 29 4.480 -9.170 6.638 1.00 0.00 C ATOM 434 CG PHE A 29 5.157 -9.981 5.571 1.00 0.00 C ATOM 435 CD1 PHE A 29 5.462 -11.316 5.785 1.00 0.00 C ATOM 436 CD2 PHE A 29 5.489 -9.409 4.353 1.00 0.00 C ATOM 437 CE1 PHE A 29 6.086 -12.064 4.805 1.00 0.00 C ATOM 438 CE2 PHE A 29 6.113 -10.153 3.369 1.00 0.00 C ATOM 439 CZ PHE A 29 6.411 -11.483 3.595 1.00 0.00 C ATOM 0 H PHE A 29 4.724 -10.396 9.123 1.00 0.00 H new ATOM 0 HA PHE A 29 6.356 -8.548 7.482 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.593 -9.703 6.981 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.139 -8.229 6.206 1.00 0.00 H new ATOM 0 HD1 PHE A 29 5.209 -11.777 6.728 1.00 0.00 H new ATOM 0 HD2 PHE A 29 5.258 -8.370 4.170 1.00 0.00 H new ATOM 0 HE1 PHE A 29 6.320 -13.103 4.985 1.00 0.00 H new ATOM 0 HE2 PHE A 29 6.367 -9.695 2.425 1.00 0.00 H new ATOM 0 HZ PHE A 29 6.897 -12.067 2.827 1.00 0.00 H new ATOM 449 N VAL A 30 5.159 -6.513 8.366 1.00 0.00 N ATOM 450 CA VAL A 30 4.654 -5.351 9.087 1.00 0.00 C ATOM 451 C VAL A 30 4.463 -4.163 8.150 1.00 0.00 C ATOM 452 O VAL A 30 5.431 -3.607 7.629 1.00 0.00 O ATOM 453 CB VAL A 30 5.603 -4.942 10.229 1.00 0.00 C ATOM 454 CG1 VAL A 30 5.069 -3.717 10.955 1.00 0.00 C ATOM 455 CG2 VAL A 30 5.802 -6.100 11.196 1.00 0.00 C ATOM 0 H VAL A 30 5.820 -6.293 7.621 1.00 0.00 H new ATOM 0 HA VAL A 30 3.691 -5.636 9.510 1.00 0.00 H new ATOM 0 HB VAL A 30 6.571 -4.686 9.799 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.753 -3.443 11.758 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.983 -2.887 10.253 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.088 -3.941 11.374 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.475 -5.794 11.997 1.00 0.00 H new ATOM 0 HG22 VAL A 30 4.841 -6.389 11.621 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.233 -6.948 10.664 1.00 0.00 H new ATOM 465 N LEU A 31 3.209 -3.778 7.939 1.00 0.00 N ATOM 466 CA LEU A 31 2.890 -2.655 7.064 1.00 0.00 C ATOM 467 C LEU A 31 3.143 -1.327 7.770 1.00 0.00 C ATOM 468 O LEU A 31 2.951 -1.209 8.979 1.00 0.00 O ATOM 469 CB LEU A 31 1.432 -2.735 6.610 1.00 0.00 C ATOM 470 CG LEU A 31 0.901 -1.524 5.842 1.00 0.00 C ATOM 471 CD1 LEU A 31 1.209 -1.656 4.358 1.00 0.00 C ATOM 472 CD2 LEU A 31 -0.596 -1.366 6.065 1.00 0.00 C ATOM 0 H LEU A 31 2.397 -4.227 8.362 1.00 0.00 H new ATOM 0 HA LEU A 31 3.539 -2.711 6.190 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.316 -3.618 5.982 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.806 -2.885 7.490 1.00 0.00 H new ATOM 0 HG LEU A 31 1.401 -0.631 6.218 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.824 -0.785 3.828 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.288 -1.720 4.215 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.737 -2.557 3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.957 -0.499 5.511 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.112 -2.260 5.716 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.793 -1.225 7.128 1.00 0.00 H new ATOM 484 N ASN A 32 3.572 -0.328 7.005 1.00 0.00 N ATOM 485 CA ASN A 32 3.849 0.993 7.557 1.00 0.00 C ATOM 486 C ASN A 32 2.790 1.999 7.117 1.00 0.00 C ATOM 487 O ASN A 32 2.726 2.378 5.949 1.00 0.00 O ATOM 488 CB ASN A 32 5.235 1.471 7.119 1.00 0.00 C ATOM 489 CG ASN A 32 6.349 0.830 7.924 1.00 0.00 C ATOM 490 OD1 ASN A 32 6.199 -0.279 8.438 1.00 0.00 O ATOM 491 ND2 ASN A 32 7.473 1.527 8.038 1.00 0.00 N ATOM 0 H ASN A 32 3.735 -0.408 6.001 1.00 0.00 H new ATOM 0 HA ASN A 32 3.824 0.918 8.644 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.377 1.244 6.062 1.00 0.00 H new ATOM 0 HB3 ASN A 32 5.292 2.554 7.223 1.00 0.00 H new ATOM 0 HD21 ASN A 32 8.257 1.147 8.569 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.553 2.442 7.595 1.00 0.00 H new ATOM 498 N ASN A 33 1.960 2.428 8.063 1.00 0.00 N ATOM 499 CA ASN A 33 0.903 3.390 7.774 1.00 0.00 C ATOM 500 C ASN A 33 1.481 4.787 7.568 1.00 0.00 C ATOM 501 O ASN A 33 0.768 5.714 7.184 1.00 0.00 O ATOM 502 CB ASN A 33 -0.120 3.412 8.911 1.00 0.00 C ATOM 503 CG ASN A 33 -1.476 3.918 8.459 1.00 0.00 C ATOM 504 OD1 ASN A 33 -1.979 4.919 8.968 1.00 0.00 O ATOM 505 ND2 ASN A 33 -2.075 3.224 7.498 1.00 0.00 N ATOM 0 H ASN A 33 1.999 2.124 9.036 1.00 0.00 H new ATOM 0 HA ASN A 33 0.407 3.082 6.854 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.228 2.407 9.319 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.251 4.045 9.717 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.990 3.515 7.153 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.620 2.400 7.105 1.00 0.00 H new ATOM 512 N GLU A 34 2.778 4.929 7.825 1.00 0.00 N ATOM 513 CA GLU A 34 3.450 6.213 7.667 1.00 0.00 C ATOM 514 C GLU A 34 4.214 6.269 6.347 1.00 0.00 C ATOM 515 O GLU A 34 3.826 6.984 5.423 1.00 0.00 O ATOM 516 CB GLU A 34 4.409 6.459 8.834 1.00 0.00 C ATOM 517 CG GLU A 34 3.960 5.816 10.136 1.00 0.00 C ATOM 518 CD GLU A 34 2.654 6.389 10.649 1.00 0.00 C ATOM 519 OE1 GLU A 34 1.693 6.479 9.857 1.00 0.00 O ATOM 520 OE2 GLU A 34 2.592 6.746 11.844 1.00 0.00 O ATOM 0 H GLU A 34 3.383 4.172 8.143 1.00 0.00 H new ATOM 0 HA GLU A 34 2.689 6.993 7.660 1.00 0.00 H new ATOM 0 HB2 GLU A 34 5.395 6.076 8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 34 4.515 7.533 8.986 1.00 0.00 H new ATOM 0 HG2 GLU A 34 3.848 4.742 9.987 1.00 0.00 H new ATOM 0 HG3 GLU A 34 4.734 5.954 10.891 1.00 0.00 H new ATOM 527 N ALA A 35 5.302 5.510 6.267 1.00 0.00 N ATOM 528 CA ALA A 35 6.119 5.471 5.061 1.00 0.00 C ATOM 529 C ALA A 35 5.454 4.634 3.974 1.00 0.00 C ATOM 530 O ALA A 35 6.037 4.395 2.917 1.00 0.00 O ATOM 531 CB ALA A 35 7.503 4.924 5.378 1.00 0.00 C ATOM 0 H ALA A 35 5.638 4.914 7.023 1.00 0.00 H new ATOM 0 HA ALA A 35 6.220 6.490 4.688 1.00 0.00 H new ATOM 0 HB1 ALA A 35 8.102 4.901 4.468 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.987 5.565 6.115 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.412 3.914 5.779 1.00 0.00 H new ATOM 537 N GLY A 36 4.230 4.189 4.241 1.00 0.00 N ATOM 538 CA GLY A 36 3.507 3.383 3.276 1.00 0.00 C ATOM 539 C GLY A 36 4.390 2.350 2.605 1.00 0.00 C ATOM 540 O GLY A 36 4.225 2.055 1.420 1.00 0.00 O ATOM 0 H GLY A 36 3.726 4.373 5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 36 2.679 2.879 3.775 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.073 4.033 2.517 1.00 0.00 H new ATOM 544 N LEU A 37 5.333 1.799 3.362 1.00 0.00 N ATOM 545 CA LEU A 37 6.248 0.794 2.833 1.00 0.00 C ATOM 546 C LEU A 37 5.943 -0.582 3.417 1.00 0.00 C ATOM 547 O LEU A 37 5.581 -0.705 4.588 1.00 0.00 O ATOM 548 CB LEU A 37 7.696 1.181 3.141 1.00 0.00 C ATOM 549 CG LEU A 37 8.358 2.142 2.153 1.00 0.00 C ATOM 550 CD1 LEU A 37 9.500 2.892 2.822 1.00 0.00 C ATOM 551 CD2 LEU A 37 8.857 1.389 0.929 1.00 0.00 C ATOM 0 H LEU A 37 5.484 2.031 4.344 1.00 0.00 H new ATOM 0 HA LEU A 37 6.112 0.748 1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.727 1.632 4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.293 0.270 3.186 1.00 0.00 H new ATOM 0 HG LEU A 37 7.613 2.869 1.829 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.959 3.571 2.104 1.00 0.00 H new ATOM 0 HD12 LEU A 37 9.115 3.463 3.667 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.245 2.180 3.176 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.325 2.089 0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.586 0.639 1.235 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.018 0.898 0.436 1.00 0.00 H new ATOM 563 N LEU A 38 6.092 -1.614 2.595 1.00 0.00 N ATOM 564 CA LEU A 38 5.835 -2.983 3.030 1.00 0.00 C ATOM 565 C LEU A 38 7.138 -3.759 3.188 1.00 0.00 C ATOM 566 O LEU A 38 7.825 -4.043 2.207 1.00 0.00 O ATOM 567 CB LEU A 38 4.922 -3.694 2.029 1.00 0.00 C ATOM 568 CG LEU A 38 4.647 -5.173 2.306 1.00 0.00 C ATOM 569 CD1 LEU A 38 3.844 -5.336 3.587 1.00 0.00 C ATOM 570 CD2 LEU A 38 3.915 -5.807 1.132 1.00 0.00 C ATOM 0 H LEU A 38 6.390 -1.530 1.623 1.00 0.00 H new ATOM 0 HA LEU A 38 5.339 -2.942 4.000 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.968 -3.167 1.999 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.366 -3.607 1.037 1.00 0.00 H new ATOM 0 HG LEU A 38 5.602 -5.683 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.658 -6.395 3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 38 4.404 -4.918 4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.893 -4.812 3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.727 -6.859 1.346 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.966 -5.294 0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.526 -5.723 0.234 1.00 0.00 H new ATOM 582 N GLU A 39 7.472 -4.100 4.429 1.00 0.00 N ATOM 583 CA GLU A 39 8.693 -4.844 4.714 1.00 0.00 C ATOM 584 C GLU A 39 8.373 -6.180 5.378 1.00 0.00 C ATOM 585 O GLU A 39 7.251 -6.407 5.832 1.00 0.00 O ATOM 586 CB GLU A 39 9.618 -4.023 5.615 1.00 0.00 C ATOM 587 CG GLU A 39 9.568 -2.530 5.340 1.00 0.00 C ATOM 588 CD GLU A 39 10.484 -1.738 6.252 1.00 0.00 C ATOM 589 OE1 GLU A 39 10.966 -2.309 7.252 1.00 0.00 O ATOM 590 OE2 GLU A 39 10.720 -0.545 5.965 1.00 0.00 O ATOM 0 H GLU A 39 6.914 -3.873 5.252 1.00 0.00 H new ATOM 0 HA GLU A 39 9.198 -5.040 3.768 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.349 -4.201 6.656 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.642 -4.374 5.486 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.847 -2.346 4.302 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.544 -2.176 5.463 1.00 0.00 H new ATOM 597 N TYR A 40 9.366 -7.061 5.430 1.00 0.00 N ATOM 598 CA TYR A 40 9.190 -8.376 6.035 1.00 0.00 C ATOM 599 C TYR A 40 10.460 -8.818 6.755 1.00 0.00 C ATOM 600 O TYR A 40 11.538 -8.871 6.163 1.00 0.00 O ATOM 601 CB TYR A 40 8.812 -9.405 4.968 1.00 0.00 C ATOM 602 CG TYR A 40 9.916 -9.680 3.973 1.00 0.00 C ATOM 603 CD1 TYR A 40 10.215 -8.769 2.968 1.00 0.00 C ATOM 604 CD2 TYR A 40 10.661 -10.851 4.038 1.00 0.00 C ATOM 605 CE1 TYR A 40 11.223 -9.016 2.056 1.00 0.00 C ATOM 606 CE2 TYR A 40 11.671 -11.106 3.131 1.00 0.00 C ATOM 607 CZ TYR A 40 11.949 -10.186 2.142 1.00 0.00 C ATOM 608 OH TYR A 40 12.954 -10.437 1.236 1.00 0.00 O ATOM 0 H TYR A 40 10.301 -6.888 5.061 1.00 0.00 H new ATOM 0 HA TYR A 40 8.384 -8.307 6.766 1.00 0.00 H new ATOM 0 HB2 TYR A 40 8.535 -10.339 5.458 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.931 -9.053 4.432 1.00 0.00 H new ATOM 0 HD1 TYR A 40 9.650 -7.851 2.898 1.00 0.00 H new ATOM 0 HD2 TYR A 40 10.447 -11.574 4.811 1.00 0.00 H new ATOM 0 HE1 TYR A 40 11.441 -8.297 1.280 1.00 0.00 H new ATOM 0 HE2 TYR A 40 12.240 -12.021 3.196 1.00 0.00 H new ATOM 0 HH TYR A 40 13.367 -11.303 1.437 1.00 0.00 H new ATOM 618 N PHE A 41 10.324 -9.135 8.039 1.00 0.00 N ATOM 619 CA PHE A 41 11.459 -9.573 8.843 1.00 0.00 C ATOM 620 C PHE A 41 11.329 -11.048 9.211 1.00 0.00 C ATOM 621 O PHE A 41 10.349 -11.703 8.856 1.00 0.00 O ATOM 622 CB PHE A 41 11.569 -8.726 10.112 1.00 0.00 C ATOM 623 CG PHE A 41 11.570 -7.247 9.848 1.00 0.00 C ATOM 624 CD1 PHE A 41 12.757 -6.574 9.605 1.00 0.00 C ATOM 625 CD2 PHE A 41 10.385 -6.530 9.844 1.00 0.00 C ATOM 626 CE1 PHE A 41 12.761 -5.214 9.361 1.00 0.00 C ATOM 627 CE2 PHE A 41 10.383 -5.170 9.600 1.00 0.00 C ATOM 628 CZ PHE A 41 11.573 -4.510 9.360 1.00 0.00 C ATOM 0 H PHE A 41 9.439 -9.097 8.545 1.00 0.00 H new ATOM 0 HA PHE A 41 12.364 -9.444 8.249 1.00 0.00 H new ATOM 0 HB2 PHE A 41 10.738 -8.968 10.774 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.485 -8.993 10.639 1.00 0.00 H new ATOM 0 HD1 PHE A 41 13.689 -7.119 9.606 1.00 0.00 H new ATOM 0 HD2 PHE A 41 9.452 -7.040 10.034 1.00 0.00 H new ATOM 0 HE1 PHE A 41 13.693 -4.702 9.171 1.00 0.00 H new ATOM 0 HE2 PHE A 41 9.452 -4.623 9.597 1.00 0.00 H new ATOM 0 HZ PHE A 41 11.574 -3.446 9.172 1.00 0.00 H new ATOM 638 N VAL A 42 12.324 -11.563 9.926 1.00 0.00 N ATOM 639 CA VAL A 42 12.321 -12.960 10.343 1.00 0.00 C ATOM 640 C VAL A 42 11.329 -13.193 11.477 1.00 0.00 C ATOM 641 O VAL A 42 10.726 -14.260 11.578 1.00 0.00 O ATOM 642 CB VAL A 42 13.721 -13.412 10.800 1.00 0.00 C ATOM 643 CG1 VAL A 42 13.897 -14.907 10.584 1.00 0.00 C ATOM 644 CG2 VAL A 42 14.799 -12.629 10.066 1.00 0.00 C ATOM 0 H VAL A 42 13.142 -11.034 10.228 1.00 0.00 H new ATOM 0 HA VAL A 42 12.022 -13.549 9.476 1.00 0.00 H new ATOM 0 HB VAL A 42 13.819 -13.209 11.867 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.892 -15.207 10.913 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.146 -15.449 11.159 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.780 -15.138 9.525 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.782 -12.961 10.401 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.705 -12.798 8.993 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.684 -11.566 10.277 1.00 0.00 H new ATOM 654 N ASN A 43 11.166 -12.185 12.329 1.00 0.00 N ATOM 655 CA ASN A 43 10.246 -12.280 13.457 1.00 0.00 C ATOM 656 C ASN A 43 10.075 -10.924 14.135 1.00 0.00 C ATOM 657 O ASN A 43 10.949 -10.061 14.047 1.00 0.00 O ATOM 658 CB ASN A 43 10.752 -13.309 14.470 1.00 0.00 C ATOM 659 CG ASN A 43 12.265 -13.319 14.576 1.00 0.00 C ATOM 660 OD1 ASN A 43 12.855 -12.491 15.270 1.00 0.00 O ATOM 661 ND2 ASN A 43 12.900 -14.260 13.888 1.00 0.00 N ATOM 0 H ASN A 43 11.658 -11.294 12.260 1.00 0.00 H new ATOM 0 HA ASN A 43 9.276 -12.601 13.077 1.00 0.00 H new ATOM 0 HB2 ASN A 43 10.323 -13.093 15.449 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.404 -14.301 14.181 1.00 0.00 H new ATOM 0 HD21 ASN A 43 13.918 -14.317 13.922 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.370 -14.926 13.326 1.00 0.00 H new ATOM 668 N GLU A 44 8.945 -10.744 14.811 1.00 0.00 N ATOM 669 CA GLU A 44 8.661 -9.493 15.504 1.00 0.00 C ATOM 670 C GLU A 44 9.840 -9.074 16.377 1.00 0.00 C ATOM 671 O GLU A 44 10.029 -7.891 16.656 1.00 0.00 O ATOM 672 CB GLU A 44 7.401 -9.634 16.361 1.00 0.00 C ATOM 673 CG GLU A 44 6.110 -9.449 15.582 1.00 0.00 C ATOM 674 CD GLU A 44 4.882 -9.822 16.390 1.00 0.00 C ATOM 675 OE1 GLU A 44 4.739 -11.014 16.734 1.00 0.00 O ATOM 676 OE2 GLU A 44 4.065 -8.923 16.677 1.00 0.00 O ATOM 0 H GLU A 44 8.212 -11.448 14.894 1.00 0.00 H new ATOM 0 HA GLU A 44 8.496 -8.721 14.753 1.00 0.00 H new ATOM 0 HB2 GLU A 44 7.397 -10.620 16.826 1.00 0.00 H new ATOM 0 HB3 GLU A 44 7.437 -8.902 17.167 1.00 0.00 H new ATOM 0 HG2 GLU A 44 6.028 -8.410 15.263 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.145 -10.058 14.679 1.00 0.00 H new ATOM 683 N GLN A 45 10.629 -10.055 16.806 1.00 0.00 N ATOM 684 CA GLN A 45 11.788 -9.788 17.648 1.00 0.00 C ATOM 685 C GLN A 45 12.934 -9.205 16.829 1.00 0.00 C ATOM 686 O GLN A 45 13.697 -8.370 17.316 1.00 0.00 O ATOM 687 CB GLN A 45 12.245 -11.071 18.345 1.00 0.00 C ATOM 688 CG GLN A 45 13.667 -11.001 18.878 1.00 0.00 C ATOM 689 CD GLN A 45 13.801 -10.058 20.057 1.00 0.00 C ATOM 690 OE1 GLN A 45 13.496 -8.869 19.954 1.00 0.00 O ATOM 691 NE2 GLN A 45 14.260 -10.584 21.187 1.00 0.00 N ATOM 0 H GLN A 45 10.486 -11.040 16.584 1.00 0.00 H new ATOM 0 HA GLN A 45 11.496 -9.057 18.402 1.00 0.00 H new ATOM 0 HB2 GLN A 45 11.567 -11.287 19.170 1.00 0.00 H new ATOM 0 HB3 GLN A 45 12.169 -11.902 17.644 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.989 -11.999 19.177 1.00 0.00 H new ATOM 0 HG3 GLN A 45 14.335 -10.676 18.080 1.00 0.00 H new ATOM 0 HE21 GLN A 45 14.501 -11.574 21.228 1.00 0.00 H new ATOM 0 HE22 GLN A 45 14.372 -9.998 22.014 1.00 0.00 H new ATOM 700 N SER A 46 13.050 -9.650 15.582 1.00 0.00 N ATOM 701 CA SER A 46 14.106 -9.175 14.695 1.00 0.00 C ATOM 702 C SER A 46 13.649 -7.946 13.916 1.00 0.00 C ATOM 703 O SER A 46 14.110 -7.697 12.802 1.00 0.00 O ATOM 704 CB SER A 46 14.523 -10.282 13.725 1.00 0.00 C ATOM 705 OG SER A 46 15.510 -11.121 14.301 1.00 0.00 O ATOM 0 H SER A 46 12.426 -10.339 15.163 1.00 0.00 H new ATOM 0 HA SER A 46 14.963 -8.897 15.308 1.00 0.00 H new ATOM 0 HB2 SER A 46 13.652 -10.876 13.450 1.00 0.00 H new ATOM 0 HB3 SER A 46 14.909 -9.839 12.807 1.00 0.00 H new ATOM 0 HG SER A 46 15.075 -11.831 14.818 1.00 0.00 H new ATOM 711 N ARG A 47 12.741 -7.180 14.511 1.00 0.00 N ATOM 712 CA ARG A 47 12.220 -5.977 13.874 1.00 0.00 C ATOM 713 C ARG A 47 13.308 -4.915 13.746 1.00 0.00 C ATOM 714 O ARG A 47 13.515 -4.350 12.672 1.00 0.00 O ATOM 715 CB ARG A 47 11.040 -5.420 14.673 1.00 0.00 C ATOM 716 CG ARG A 47 9.698 -6.006 14.266 1.00 0.00 C ATOM 717 CD ARG A 47 8.547 -5.296 14.961 1.00 0.00 C ATOM 718 NE ARG A 47 8.320 -3.960 14.418 1.00 0.00 N ATOM 719 CZ ARG A 47 7.567 -3.042 15.015 1.00 0.00 C ATOM 720 NH1 ARG A 47 6.973 -3.315 16.168 1.00 0.00 N ATOM 721 NH2 ARG A 47 7.408 -1.848 14.458 1.00 0.00 N ATOM 0 H ARG A 47 12.351 -7.371 15.434 1.00 0.00 H new ATOM 0 HA ARG A 47 11.878 -6.245 12.874 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.206 -5.615 15.733 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.007 -4.338 14.549 1.00 0.00 H new ATOM 0 HG2 ARG A 47 9.577 -5.926 13.186 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.674 -7.068 14.512 1.00 0.00 H new ATOM 0 HD2 ARG A 47 7.639 -5.889 14.856 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.758 -5.223 16.028 1.00 0.00 H new ATOM 0 HE ARG A 47 8.764 -3.718 13.532 1.00 0.00 H new ATOM 0 HH11 ARG A 47 7.093 -4.231 16.599 1.00 0.00 H new ATOM 0 HH12 ARG A 47 6.396 -2.609 16.624 1.00 0.00 H new ATOM 0 HH21 ARG A 47 7.864 -1.634 13.571 1.00 0.00 H new ATOM 0 HH22 ARG A 47 6.830 -1.144 14.917 1.00 0.00 H new ATOM 735 N ASN A 48 14.000 -4.648 14.849 1.00 0.00 N ATOM 736 CA ASN A 48 15.066 -3.653 14.860 1.00 0.00 C ATOM 737 C ASN A 48 16.109 -3.960 13.790 1.00 0.00 C ATOM 738 O ASN A 48 16.809 -3.065 13.317 1.00 0.00 O ATOM 739 CB ASN A 48 15.732 -3.604 16.237 1.00 0.00 C ATOM 740 CG ASN A 48 14.755 -3.243 17.339 1.00 0.00 C ATOM 741 OD1 ASN A 48 13.910 -4.051 17.725 1.00 0.00 O ATOM 742 ND2 ASN A 48 14.866 -2.023 17.851 1.00 0.00 N ATOM 0 H ASN A 48 13.842 -5.107 15.746 1.00 0.00 H new ATOM 0 HA ASN A 48 14.623 -2.681 14.642 1.00 0.00 H new ATOM 0 HB2 ASN A 48 16.180 -4.573 16.456 1.00 0.00 H new ATOM 0 HB3 ASN A 48 16.542 -2.875 16.220 1.00 0.00 H new ATOM 0 HD21 ASN A 48 14.236 -1.723 18.595 1.00 0.00 H new ATOM 0 HD22 ASN A 48 15.581 -1.386 17.501 1.00 0.00 H new ATOM 749 N GLN A 49 16.205 -5.231 13.412 1.00 0.00 N ATOM 750 CA GLN A 49 17.162 -5.656 12.398 1.00 0.00 C ATOM 751 C GLN A 49 16.746 -5.162 11.016 1.00 0.00 C ATOM 752 O GLN A 49 15.576 -4.860 10.779 1.00 0.00 O ATOM 753 CB GLN A 49 17.287 -7.181 12.391 1.00 0.00 C ATOM 754 CG GLN A 49 18.437 -7.693 11.540 1.00 0.00 C ATOM 755 CD GLN A 49 18.507 -9.207 11.503 1.00 0.00 C ATOM 756 OE1 GLN A 49 18.264 -9.876 12.508 1.00 0.00 O ATOM 757 NE2 GLN A 49 18.840 -9.756 10.341 1.00 0.00 N ATOM 0 H GLN A 49 15.632 -5.984 13.793 1.00 0.00 H new ATOM 0 HA GLN A 49 18.131 -5.220 12.644 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.420 -7.531 13.415 1.00 0.00 H new ATOM 0 HB3 GLN A 49 16.355 -7.612 12.025 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.329 -7.313 10.524 1.00 0.00 H new ATOM 0 HG3 GLN A 49 19.376 -7.299 11.930 1.00 0.00 H new ATOM 0 HE21 GLN A 49 19.033 -9.163 9.534 1.00 0.00 H new ATOM 0 HE22 GLN A 49 18.903 -10.770 10.256 1.00 0.00 H new ATOM 766 N LYS A 50 17.711 -5.082 10.107 1.00 0.00 N ATOM 767 CA LYS A 50 17.446 -4.625 8.747 1.00 0.00 C ATOM 768 C LYS A 50 16.380 -5.489 8.081 1.00 0.00 C ATOM 769 O LYS A 50 16.382 -6.715 8.192 1.00 0.00 O ATOM 770 CB LYS A 50 18.732 -4.654 7.918 1.00 0.00 C ATOM 771 CG LYS A 50 18.578 -4.045 6.535 1.00 0.00 C ATOM 772 CD LYS A 50 18.670 -2.529 6.579 1.00 0.00 C ATOM 773 CE LYS A 50 18.099 -1.899 5.318 1.00 0.00 C ATOM 774 NZ LYS A 50 19.129 -1.759 4.252 1.00 0.00 N ATOM 0 H LYS A 50 18.685 -5.328 10.287 1.00 0.00 H new ATOM 0 HA LYS A 50 17.078 -3.600 8.800 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.514 -4.118 8.457 1.00 0.00 H new ATOM 0 HB3 LYS A 50 19.065 -5.687 7.816 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.352 -4.438 5.875 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.618 -4.340 6.112 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.131 -2.156 7.450 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.712 -2.230 6.697 1.00 0.00 H new ATOM 0 HE2 LYS A 50 17.275 -2.509 4.949 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.688 -0.918 5.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 18.700 -1.326 3.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.904 -1.156 4.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 19.504 -2.697 4.006 1.00 0.00 H new ATOM 788 N PRO A 51 15.447 -4.837 7.372 1.00 0.00 N ATOM 789 CA PRO A 51 14.359 -5.527 6.672 1.00 0.00 C ATOM 790 C PRO A 51 14.856 -6.324 5.471 1.00 0.00 C ATOM 791 O PRO A 51 15.565 -5.797 4.614 1.00 0.00 O ATOM 792 CB PRO A 51 13.450 -4.383 6.216 1.00 0.00 C ATOM 793 CG PRO A 51 14.349 -3.199 6.120 1.00 0.00 C ATOM 794 CD PRO A 51 15.383 -3.376 7.197 1.00 0.00 C ATOM 0 HA PRO A 51 13.861 -6.257 7.310 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.985 -4.606 5.256 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.643 -4.211 6.928 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.816 -3.142 5.137 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.792 -2.273 6.262 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.347 -2.964 6.900 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.093 -2.873 8.119 1.00 0.00 H new ATOM 802 N ARG A 52 14.478 -7.597 5.415 1.00 0.00 N ATOM 803 CA ARG A 52 14.887 -8.467 4.318 1.00 0.00 C ATOM 804 C ARG A 52 14.659 -7.788 2.971 1.00 0.00 C ATOM 805 O ARG A 52 15.511 -7.841 2.086 1.00 0.00 O ATOM 806 CB ARG A 52 14.116 -9.787 4.373 1.00 0.00 C ATOM 807 CG ARG A 52 14.414 -10.617 5.611 1.00 0.00 C ATOM 808 CD ARG A 52 15.783 -11.272 5.526 1.00 0.00 C ATOM 809 NE ARG A 52 15.804 -12.376 4.570 1.00 0.00 N ATOM 810 CZ ARG A 52 16.702 -13.354 4.596 1.00 0.00 C ATOM 811 NH1 ARG A 52 17.648 -13.365 5.525 1.00 0.00 N ATOM 812 NH2 ARG A 52 16.655 -14.323 3.691 1.00 0.00 N ATOM 0 H ARG A 52 13.890 -8.049 6.115 1.00 0.00 H new ATOM 0 HA ARG A 52 15.952 -8.671 4.426 1.00 0.00 H new ATOM 0 HB2 ARG A 52 13.047 -9.575 4.337 1.00 0.00 H new ATOM 0 HB3 ARG A 52 14.355 -10.374 3.486 1.00 0.00 H new ATOM 0 HG2 ARG A 52 14.368 -9.982 6.496 1.00 0.00 H new ATOM 0 HG3 ARG A 52 13.649 -11.384 5.729 1.00 0.00 H new ATOM 0 HD2 ARG A 52 16.524 -10.527 5.235 1.00 0.00 H new ATOM 0 HD3 ARG A 52 16.070 -11.640 6.511 1.00 0.00 H new ATOM 0 HE ARG A 52 15.090 -12.397 3.842 1.00 0.00 H new ATOM 0 HH11 ARG A 52 17.687 -12.621 6.222 1.00 0.00 H new ATOM 0 HH12 ARG A 52 18.337 -14.117 5.543 1.00 0.00 H new ATOM 0 HH21 ARG A 52 15.929 -14.317 2.975 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.345 -15.074 3.712 1.00 0.00 H new ATOM 826 N GLY A 53 13.502 -7.149 2.824 1.00 0.00 N ATOM 827 CA GLY A 53 13.182 -6.469 1.583 1.00 0.00 C ATOM 828 C GLY A 53 11.917 -5.640 1.685 1.00 0.00 C ATOM 829 O GLY A 53 10.874 -6.134 2.114 1.00 0.00 O ATOM 0 H GLY A 53 12.781 -7.090 3.543 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.014 -5.823 1.301 1.00 0.00 H new ATOM 0 HA3 GLY A 53 13.067 -7.206 0.788 1.00 0.00 H new ATOM 833 N THR A 54 12.008 -4.374 1.291 1.00 0.00 N ATOM 834 CA THR A 54 10.863 -3.473 1.342 1.00 0.00 C ATOM 835 C THR A 54 10.224 -3.316 -0.033 1.00 0.00 C ATOM 836 O THR A 54 10.835 -3.640 -1.053 1.00 0.00 O ATOM 837 CB THR A 54 11.265 -2.083 1.871 1.00 0.00 C ATOM 838 OG1 THR A 54 11.660 -1.241 0.782 1.00 0.00 O ATOM 839 CG2 THR A 54 12.404 -2.194 2.873 1.00 0.00 C ATOM 0 H THR A 54 12.863 -3.949 0.933 1.00 0.00 H new ATOM 0 HA THR A 54 10.141 -3.919 2.026 1.00 0.00 H new ATOM 0 HB THR A 54 10.402 -1.646 2.374 1.00 0.00 H new ATOM 0 HG1 THR A 54 11.913 -0.359 1.126 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.670 -1.200 3.233 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.090 -2.812 3.714 1.00 0.00 H new ATOM 0 HG23 THR A 54 13.269 -2.650 2.391 1.00 0.00 H new ATOM 847 N LEU A 55 8.993 -2.818 -0.055 1.00 0.00 N ATOM 848 CA LEU A 55 8.271 -2.617 -1.306 1.00 0.00 C ATOM 849 C LEU A 55 7.341 -1.412 -1.211 1.00 0.00 C ATOM 850 O LEU A 55 6.540 -1.307 -0.283 1.00 0.00 O ATOM 851 CB LEU A 55 7.468 -3.870 -1.661 1.00 0.00 C ATOM 852 CG LEU A 55 6.732 -3.838 -3.001 1.00 0.00 C ATOM 853 CD1 LEU A 55 7.687 -4.155 -4.142 1.00 0.00 C ATOM 854 CD2 LEU A 55 5.565 -4.815 -2.992 1.00 0.00 C ATOM 0 H LEU A 55 8.474 -2.546 0.780 1.00 0.00 H new ATOM 0 HA LEU A 55 9.002 -2.427 -2.092 1.00 0.00 H new ATOM 0 HB2 LEU A 55 8.146 -4.724 -1.662 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.737 -4.044 -0.872 1.00 0.00 H new ATOM 0 HG LEU A 55 6.337 -2.833 -3.153 1.00 0.00 H new ATOM 0 HD11 LEU A 55 7.146 -4.128 -5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.489 -3.417 -4.161 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.112 -5.148 -3.996 1.00 0.00 H new ATOM 0 HD21 LEU A 55 5.053 -4.779 -3.953 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.937 -5.824 -2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.868 -4.542 -2.199 1.00 0.00 H new ATOM 866 N GLN A 56 7.452 -0.508 -2.179 1.00 0.00 N ATOM 867 CA GLN A 56 6.619 0.689 -2.204 1.00 0.00 C ATOM 868 C GLN A 56 5.192 0.350 -2.621 1.00 0.00 C ATOM 869 O GLN A 56 4.973 -0.370 -3.596 1.00 0.00 O ATOM 870 CB GLN A 56 7.210 1.727 -3.160 1.00 0.00 C ATOM 871 CG GLN A 56 8.213 2.660 -2.501 1.00 0.00 C ATOM 872 CD GLN A 56 9.095 3.373 -3.507 1.00 0.00 C ATOM 873 OE1 GLN A 56 8.682 4.354 -4.127 1.00 0.00 O ATOM 874 NE2 GLN A 56 10.318 2.884 -3.674 1.00 0.00 N ATOM 0 H GLN A 56 8.110 -0.581 -2.955 1.00 0.00 H new ATOM 0 HA GLN A 56 6.594 1.106 -1.197 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.696 1.211 -3.988 1.00 0.00 H new ATOM 0 HB3 GLN A 56 6.400 2.320 -3.585 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.678 3.399 -1.904 1.00 0.00 H new ATOM 0 HG3 GLN A 56 8.839 2.089 -1.815 1.00 0.00 H new ATOM 0 HE21 GLN A 56 10.619 2.069 -3.139 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.957 3.323 -4.337 1.00 0.00 H new ATOM 883 N LEU A 57 4.224 0.874 -1.877 1.00 0.00 N ATOM 884 CA LEU A 57 2.816 0.627 -2.169 1.00 0.00 C ATOM 885 C LEU A 57 2.233 1.747 -3.025 1.00 0.00 C ATOM 886 O LEU A 57 1.405 1.504 -3.902 1.00 0.00 O ATOM 887 CB LEU A 57 2.021 0.495 -0.869 1.00 0.00 C ATOM 888 CG LEU A 57 2.317 -0.743 -0.023 1.00 0.00 C ATOM 889 CD1 LEU A 57 1.838 -0.541 1.406 1.00 0.00 C ATOM 890 CD2 LEU A 57 1.667 -1.975 -0.636 1.00 0.00 C ATOM 0 H LEU A 57 4.388 1.472 -1.067 1.00 0.00 H new ATOM 0 HA LEU A 57 2.744 -0.306 -2.727 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.209 1.379 -0.260 1.00 0.00 H new ATOM 0 HB3 LEU A 57 0.959 0.497 -1.114 1.00 0.00 H new ATOM 0 HG LEU A 57 3.396 -0.897 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.057 -1.433 1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.350 0.316 1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.763 -0.361 1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.888 -2.847 -0.021 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.588 -1.830 -0.686 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.059 -2.131 -1.641 1.00 0.00 H new ATOM 902 N ALA A 58 2.672 2.974 -2.764 1.00 0.00 N ATOM 903 CA ALA A 58 2.197 4.130 -3.513 1.00 0.00 C ATOM 904 C ALA A 58 2.144 3.833 -5.007 1.00 0.00 C ATOM 905 O ALA A 58 3.134 3.997 -5.719 1.00 0.00 O ATOM 906 CB ALA A 58 3.087 5.335 -3.244 1.00 0.00 C ATOM 0 H ALA A 58 3.356 3.193 -2.039 1.00 0.00 H new ATOM 0 HA ALA A 58 1.185 4.357 -3.179 1.00 0.00 H new ATOM 0 HB1 ALA A 58 2.721 6.191 -3.810 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.070 5.569 -2.180 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.108 5.108 -3.550 1.00 0.00 H new ATOM 912 N GLY A 59 0.980 3.393 -5.478 1.00 0.00 N ATOM 913 CA GLY A 59 0.821 3.079 -6.885 1.00 0.00 C ATOM 914 C GLY A 59 0.850 1.587 -7.153 1.00 0.00 C ATOM 915 O GLY A 59 1.206 1.153 -8.249 1.00 0.00 O ATOM 0 H GLY A 59 0.145 3.249 -4.910 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.123 3.491 -7.242 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.615 3.563 -7.454 1.00 0.00 H new ATOM 919 N ALA A 60 0.477 0.800 -6.150 1.00 0.00 N ATOM 920 CA ALA A 60 0.462 -0.652 -6.283 1.00 0.00 C ATOM 921 C ALA A 60 -0.954 -1.167 -6.514 1.00 0.00 C ATOM 922 O ALA A 60 -1.929 -0.435 -6.339 1.00 0.00 O ATOM 923 CB ALA A 60 1.067 -1.301 -5.047 1.00 0.00 C ATOM 0 H ALA A 60 0.181 1.143 -5.236 1.00 0.00 H new ATOM 0 HA ALA A 60 1.064 -0.919 -7.152 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.049 -2.385 -5.160 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.097 -0.965 -4.927 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.489 -1.018 -4.168 1.00 0.00 H new ATOM 929 N VAL A 61 -1.062 -2.432 -6.909 1.00 0.00 N ATOM 930 CA VAL A 61 -2.360 -3.046 -7.164 1.00 0.00 C ATOM 931 C VAL A 61 -2.463 -4.411 -6.493 1.00 0.00 C ATOM 932 O VAL A 61 -1.510 -5.191 -6.499 1.00 0.00 O ATOM 933 CB VAL A 61 -2.617 -3.207 -8.674 1.00 0.00 C ATOM 934 CG1 VAL A 61 -3.770 -4.168 -8.920 1.00 0.00 C ATOM 935 CG2 VAL A 61 -2.893 -1.855 -9.314 1.00 0.00 C ATOM 0 H VAL A 61 -0.266 -3.052 -7.059 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.114 -2.380 -6.744 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.722 -3.626 -9.135 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -3.937 -4.269 -9.992 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.528 -5.143 -8.497 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -4.673 -3.782 -8.447 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.072 -1.987 -10.381 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.772 -1.406 -8.851 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -2.033 -1.201 -9.169 1.00 0.00 H new ATOM 945 N ILE A 62 -3.626 -4.693 -5.916 1.00 0.00 N ATOM 946 CA ILE A 62 -3.855 -5.966 -5.242 1.00 0.00 C ATOM 947 C ILE A 62 -4.831 -6.836 -6.027 1.00 0.00 C ATOM 948 O ILE A 62 -5.970 -6.441 -6.275 1.00 0.00 O ATOM 949 CB ILE A 62 -4.402 -5.758 -3.818 1.00 0.00 C ATOM 950 CG1 ILE A 62 -3.400 -4.967 -2.974 1.00 0.00 C ATOM 951 CG2 ILE A 62 -4.708 -7.098 -3.167 1.00 0.00 C ATOM 952 CD1 ILE A 62 -3.287 -3.513 -3.375 1.00 0.00 C ATOM 0 H ILE A 62 -4.424 -4.058 -5.901 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.890 -6.470 -5.182 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.328 -5.186 -3.881 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.695 -5.025 -1.926 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.419 -5.435 -3.056 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.094 -6.934 -2.161 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.453 -7.629 -3.759 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.796 -7.693 -3.113 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.559 -3.014 -2.735 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.962 -3.446 -4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -4.258 -3.029 -3.266 1.00 0.00 H new ATOM 964 N SER A 63 -4.377 -8.023 -6.415 1.00 0.00 N ATOM 965 CA SER A 63 -5.209 -8.949 -7.174 1.00 0.00 C ATOM 966 C SER A 63 -5.232 -10.325 -6.513 1.00 0.00 C ATOM 967 O SER A 63 -4.368 -11.169 -6.747 1.00 0.00 O ATOM 968 CB SER A 63 -4.696 -9.070 -8.610 1.00 0.00 C ATOM 969 OG SER A 63 -5.539 -9.905 -9.384 1.00 0.00 O ATOM 0 H SER A 63 -3.437 -8.366 -6.216 1.00 0.00 H new ATOM 0 HA SER A 63 -6.225 -8.555 -7.191 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.642 -8.081 -9.065 1.00 0.00 H new ATOM 0 HB3 SER A 63 -3.684 -9.474 -8.605 1.00 0.00 H new ATOM 0 HG SER A 63 -5.190 -9.965 -10.298 1.00 0.00 H new ATOM 975 N PRO A 64 -6.247 -10.556 -5.666 1.00 0.00 N ATOM 976 CA PRO A 64 -6.409 -11.827 -4.954 1.00 0.00 C ATOM 977 C PRO A 64 -6.798 -12.969 -5.887 1.00 0.00 C ATOM 978 O PRO A 64 -7.764 -12.863 -6.643 1.00 0.00 O ATOM 979 CB PRO A 64 -7.539 -11.537 -3.964 1.00 0.00 C ATOM 980 CG PRO A 64 -8.314 -10.428 -4.588 1.00 0.00 C ATOM 981 CD PRO A 64 -7.313 -9.595 -5.340 1.00 0.00 C ATOM 0 HA PRO A 64 -5.482 -12.150 -4.481 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -8.163 -12.417 -3.807 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -7.147 -11.246 -2.989 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -9.080 -10.817 -5.259 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -8.825 -9.834 -3.830 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -7.748 -9.157 -6.238 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -6.939 -8.771 -4.733 1.00 0.00 H new ATOM 989 N SER A 65 -6.040 -14.059 -5.828 1.00 0.00 N ATOM 990 CA SER A 65 -6.304 -15.220 -6.671 1.00 0.00 C ATOM 991 C SER A 65 -7.675 -15.814 -6.362 1.00 0.00 C ATOM 992 O SER A 65 -8.431 -15.274 -5.554 1.00 0.00 O ATOM 993 CB SER A 65 -5.219 -16.279 -6.470 1.00 0.00 C ATOM 994 OG SER A 65 -5.569 -17.177 -5.431 1.00 0.00 O ATOM 0 H SER A 65 -5.238 -14.163 -5.206 1.00 0.00 H new ATOM 0 HA SER A 65 -6.295 -14.894 -7.711 1.00 0.00 H new ATOM 0 HB2 SER A 65 -5.070 -16.832 -7.398 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.272 -15.794 -6.232 1.00 0.00 H new ATOM 0 HG SER A 65 -4.860 -17.845 -5.323 1.00 0.00 H new ATOM 1000 N ASP A 66 -7.989 -16.930 -7.012 1.00 0.00 N ATOM 1001 CA ASP A 66 -9.268 -17.600 -6.807 1.00 0.00 C ATOM 1002 C ASP A 66 -9.067 -19.092 -6.565 1.00 0.00 C ATOM 1003 O ASP A 66 -9.712 -19.682 -5.699 1.00 0.00 O ATOM 1004 CB ASP A 66 -10.179 -17.385 -8.016 1.00 0.00 C ATOM 1005 CG ASP A 66 -11.335 -18.366 -8.052 1.00 0.00 C ATOM 1006 OD1 ASP A 66 -11.956 -18.589 -6.992 1.00 0.00 O ATOM 1007 OD2 ASP A 66 -11.618 -18.911 -9.139 1.00 0.00 O ATOM 0 H ASP A 66 -7.375 -17.389 -7.685 1.00 0.00 H new ATOM 0 HA ASP A 66 -9.740 -17.168 -5.925 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -10.570 -16.368 -7.996 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -9.594 -17.484 -8.930 1.00 0.00 H new ATOM 1012 N GLU A 67 -8.168 -19.696 -7.336 1.00 0.00 N ATOM 1013 CA GLU A 67 -7.884 -21.121 -7.205 1.00 0.00 C ATOM 1014 C GLU A 67 -7.786 -21.523 -5.737 1.00 0.00 C ATOM 1015 O GLU A 67 -8.621 -22.274 -5.231 1.00 0.00 O ATOM 1016 CB GLU A 67 -6.583 -21.473 -7.930 1.00 0.00 C ATOM 1017 CG GLU A 67 -6.110 -22.894 -7.676 1.00 0.00 C ATOM 1018 CD GLU A 67 -4.623 -23.065 -7.913 1.00 0.00 C ATOM 1019 OE1 GLU A 67 -4.231 -23.294 -9.077 1.00 0.00 O ATOM 1020 OE2 GLU A 67 -3.850 -22.971 -6.937 1.00 0.00 O ATOM 0 H GLU A 67 -7.624 -19.222 -8.057 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.706 -21.673 -7.661 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.725 -21.332 -9.002 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.803 -20.778 -7.618 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.345 -23.173 -6.649 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.658 -23.577 -8.325 1.00 0.00 H new ATOM 1027 N ASP A 68 -6.761 -21.020 -5.059 1.00 0.00 N ATOM 1028 CA ASP A 68 -6.553 -21.326 -3.648 1.00 0.00 C ATOM 1029 C ASP A 68 -7.485 -20.498 -2.769 1.00 0.00 C ATOM 1030 O ASP A 68 -8.136 -19.567 -3.242 1.00 0.00 O ATOM 1031 CB ASP A 68 -5.097 -21.065 -3.257 1.00 0.00 C ATOM 1032 CG ASP A 68 -4.842 -21.305 -1.782 1.00 0.00 C ATOM 1033 OD1 ASP A 68 -5.031 -22.452 -1.326 1.00 0.00 O ATOM 1034 OD2 ASP A 68 -4.455 -20.345 -1.082 1.00 0.00 O ATOM 0 H ASP A 68 -6.061 -20.398 -5.463 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.779 -22.381 -3.493 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.445 -21.710 -3.845 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -4.836 -20.036 -3.505 1.00 0.00 H new ATOM 1039 N SER A 69 -7.544 -20.845 -1.487 1.00 0.00 N ATOM 1040 CA SER A 69 -8.401 -20.137 -0.543 1.00 0.00 C ATOM 1041 C SER A 69 -7.732 -18.854 -0.059 1.00 0.00 C ATOM 1042 O SER A 69 -8.304 -17.768 -0.157 1.00 0.00 O ATOM 1043 CB SER A 69 -8.731 -21.035 0.651 1.00 0.00 C ATOM 1044 OG SER A 69 -8.785 -22.398 0.265 1.00 0.00 O ATOM 0 H SER A 69 -7.009 -21.611 -1.079 1.00 0.00 H new ATOM 0 HA SER A 69 -9.325 -19.873 -1.057 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.978 -20.903 1.428 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.688 -20.737 1.080 1.00 0.00 H new ATOM 0 HG SER A 69 -8.996 -22.951 1.046 1.00 0.00 H new ATOM 1050 N HIS A 70 -6.517 -18.988 0.463 1.00 0.00 N ATOM 1051 CA HIS A 70 -5.769 -17.840 0.962 1.00 0.00 C ATOM 1052 C HIS A 70 -4.594 -17.516 0.043 1.00 0.00 C ATOM 1053 O HIS A 70 -3.589 -18.228 0.028 1.00 0.00 O ATOM 1054 CB HIS A 70 -5.263 -18.111 2.379 1.00 0.00 C ATOM 1055 CG HIS A 70 -6.161 -19.008 3.174 1.00 0.00 C ATOM 1056 ND1 HIS A 70 -5.687 -20.008 3.997 1.00 0.00 N ATOM 1057 CD2 HIS A 70 -7.510 -19.052 3.269 1.00 0.00 C ATOM 1058 CE1 HIS A 70 -6.707 -20.629 4.563 1.00 0.00 C ATOM 1059 NE2 HIS A 70 -7.825 -20.067 4.138 1.00 0.00 N ATOM 0 H HIS A 70 -6.030 -19.880 0.551 1.00 0.00 H new ATOM 0 HA HIS A 70 -6.440 -16.981 0.982 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.272 -18.561 2.322 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.153 -17.162 2.904 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -8.209 -18.408 2.756 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.639 -21.455 5.255 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -8.768 -20.343 4.411 1.00 0.00 H new ATOM 1068 N THR A 71 -4.728 -16.438 -0.723 1.00 0.00 N ATOM 1069 CA THR A 71 -3.679 -16.021 -1.646 1.00 0.00 C ATOM 1070 C THR A 71 -3.942 -14.617 -2.178 1.00 0.00 C ATOM 1071 O THR A 71 -5.091 -14.190 -2.291 1.00 0.00 O ATOM 1072 CB THR A 71 -3.557 -16.994 -2.833 1.00 0.00 C ATOM 1073 OG1 THR A 71 -3.851 -18.328 -2.406 1.00 0.00 O ATOM 1074 CG2 THR A 71 -2.159 -16.944 -3.432 1.00 0.00 C ATOM 0 H THR A 71 -5.553 -15.838 -0.723 1.00 0.00 H new ATOM 0 HA THR A 71 -2.744 -16.025 -1.086 1.00 0.00 H new ATOM 0 HB THR A 71 -4.274 -16.692 -3.597 1.00 0.00 H new ATOM 0 HG1 THR A 71 -3.296 -18.553 -1.630 1.00 0.00 H new ATOM 0 HG21 THR A 71 -2.097 -17.640 -4.269 1.00 0.00 H new ATOM 0 HG22 THR A 71 -1.950 -15.934 -3.784 1.00 0.00 H new ATOM 0 HG23 THR A 71 -1.428 -17.223 -2.673 1.00 0.00 H new ATOM 1082 N PHE A 72 -2.870 -13.903 -2.506 1.00 0.00 N ATOM 1083 CA PHE A 72 -2.984 -12.546 -3.027 1.00 0.00 C ATOM 1084 C PHE A 72 -1.625 -12.021 -3.480 1.00 0.00 C ATOM 1085 O PHE A 72 -0.585 -12.423 -2.957 1.00 0.00 O ATOM 1086 CB PHE A 72 -3.575 -11.617 -1.964 1.00 0.00 C ATOM 1087 CG PHE A 72 -2.721 -11.494 -0.735 1.00 0.00 C ATOM 1088 CD1 PHE A 72 -1.732 -10.526 -0.657 1.00 0.00 C ATOM 1089 CD2 PHE A 72 -2.906 -12.345 0.342 1.00 0.00 C ATOM 1090 CE1 PHE A 72 -0.944 -10.409 0.473 1.00 0.00 C ATOM 1091 CE2 PHE A 72 -2.122 -12.233 1.475 1.00 0.00 C ATOM 1092 CZ PHE A 72 -1.139 -11.264 1.540 1.00 0.00 C ATOM 0 H PHE A 72 -1.912 -14.242 -2.420 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.650 -12.569 -3.890 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.719 -10.627 -2.397 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.560 -11.986 -1.677 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.575 -9.855 -1.489 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.672 -13.105 0.296 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -0.177 -9.650 0.521 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -2.278 -12.902 2.308 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.524 -11.175 2.424 1.00 0.00 H new ATOM 1102 N THR A 73 -1.642 -11.119 -4.456 1.00 0.00 N ATOM 1103 CA THR A 73 -0.412 -10.539 -4.982 1.00 0.00 C ATOM 1104 C THR A 73 -0.419 -9.021 -4.846 1.00 0.00 C ATOM 1105 O THR A 73 -1.433 -8.369 -5.097 1.00 0.00 O ATOM 1106 CB THR A 73 -0.204 -10.910 -6.462 1.00 0.00 C ATOM 1107 OG1 THR A 73 -1.315 -10.454 -7.242 1.00 0.00 O ATOM 1108 CG2 THR A 73 -0.045 -12.414 -6.626 1.00 0.00 C ATOM 0 H THR A 73 -2.494 -10.774 -4.898 1.00 0.00 H new ATOM 0 HA THR A 73 0.409 -10.950 -4.394 1.00 0.00 H new ATOM 0 HB THR A 73 0.708 -10.425 -6.811 1.00 0.00 H new ATOM 0 HG1 THR A 73 -2.134 -10.898 -6.936 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.101 -12.652 -7.680 1.00 0.00 H new ATOM 0 HG22 THR A 73 0.819 -12.753 -6.055 1.00 0.00 H new ATOM 0 HG23 THR A 73 -0.941 -12.917 -6.261 1.00 0.00 H new ATOM 1116 N VAL A 74 0.720 -8.462 -4.448 1.00 0.00 N ATOM 1117 CA VAL A 74 0.846 -7.019 -4.281 1.00 0.00 C ATOM 1118 C VAL A 74 1.736 -6.416 -5.361 1.00 0.00 C ATOM 1119 O VAL A 74 2.946 -6.287 -5.183 1.00 0.00 O ATOM 1120 CB VAL A 74 1.423 -6.662 -2.898 1.00 0.00 C ATOM 1121 CG1 VAL A 74 1.713 -5.172 -2.808 1.00 0.00 C ATOM 1122 CG2 VAL A 74 0.468 -7.095 -1.795 1.00 0.00 C ATOM 0 H VAL A 74 1.568 -8.987 -4.235 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.158 -6.602 -4.367 1.00 0.00 H new ATOM 0 HB VAL A 74 2.362 -7.199 -2.766 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.120 -4.939 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.437 -4.895 -3.575 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.790 -4.612 -2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.891 -6.835 -0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.488 -6.587 -1.922 1.00 0.00 H new ATOM 0 HG23 VAL A 74 0.316 -8.173 -1.848 1.00 0.00 H new ATOM 1132 N ASN A 75 1.127 -6.047 -6.484 1.00 0.00 N ATOM 1133 CA ASN A 75 1.865 -5.456 -7.595 1.00 0.00 C ATOM 1134 C ASN A 75 2.530 -4.150 -7.173 1.00 0.00 C ATOM 1135 O ASN A 75 2.306 -3.655 -6.069 1.00 0.00 O ATOM 1136 CB ASN A 75 0.929 -5.206 -8.779 1.00 0.00 C ATOM 1137 CG ASN A 75 0.788 -6.424 -9.672 1.00 0.00 C ATOM 1138 OD1 ASN A 75 1.651 -6.702 -10.504 1.00 0.00 O ATOM 1139 ND2 ASN A 75 -0.306 -7.158 -9.501 1.00 0.00 N ATOM 0 H ASN A 75 0.125 -6.147 -6.648 1.00 0.00 H new ATOM 0 HA ASN A 75 2.643 -6.157 -7.897 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.054 -4.916 -8.407 1.00 0.00 H new ATOM 0 HB3 ASN A 75 1.307 -4.370 -9.367 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.456 -7.990 -10.072 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -0.995 -6.890 -8.799 1.00 0.00 H new ATOM 1146 N ALA A 76 3.350 -3.596 -8.061 1.00 0.00 N ATOM 1147 CA ALA A 76 4.046 -2.346 -7.782 1.00 0.00 C ATOM 1148 C ALA A 76 4.172 -1.496 -9.041 1.00 0.00 C ATOM 1149 O ALA A 76 4.551 -1.992 -10.102 1.00 0.00 O ATOM 1150 CB ALA A 76 5.420 -2.628 -7.193 1.00 0.00 C ATOM 0 H ALA A 76 3.548 -3.993 -8.979 1.00 0.00 H new ATOM 0 HA ALA A 76 3.459 -1.786 -7.054 1.00 0.00 H new ATOM 0 HB1 ALA A 76 5.929 -1.686 -6.989 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.310 -3.189 -6.265 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.007 -3.212 -7.902 1.00 0.00 H new ATOM 1156 N ALA A 77 3.852 -0.212 -8.917 1.00 0.00 N ATOM 1157 CA ALA A 77 3.931 0.708 -10.045 1.00 0.00 C ATOM 1158 C ALA A 77 5.111 0.368 -10.949 1.00 0.00 C ATOM 1159 O ALA A 77 4.933 0.037 -12.121 1.00 0.00 O ATOM 1160 CB ALA A 77 4.038 2.143 -9.550 1.00 0.00 C ATOM 0 H ALA A 77 3.536 0.215 -8.046 1.00 0.00 H new ATOM 0 HA ALA A 77 3.017 0.605 -10.630 1.00 0.00 H new ATOM 0 HB1 ALA A 77 4.096 2.819 -10.403 1.00 0.00 H new ATOM 0 HB2 ALA A 77 3.160 2.388 -8.952 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.934 2.251 -8.939 1.00 0.00 H new ATOM 1166 N SER A 78 6.317 0.453 -10.396 1.00 0.00 N ATOM 1167 CA SER A 78 7.528 0.159 -11.154 1.00 0.00 C ATOM 1168 C SER A 78 7.337 -1.081 -12.022 1.00 0.00 C ATOM 1169 O SER A 78 7.606 -1.059 -13.223 1.00 0.00 O ATOM 1170 CB SER A 78 8.711 -0.045 -10.206 1.00 0.00 C ATOM 1171 OG SER A 78 9.907 -0.284 -10.928 1.00 0.00 O ATOM 0 H SER A 78 6.482 0.723 -9.426 1.00 0.00 H new ATOM 0 HA SER A 78 7.736 1.008 -11.805 1.00 0.00 H new ATOM 0 HB2 SER A 78 8.833 0.836 -9.576 1.00 0.00 H new ATOM 0 HB3 SER A 78 8.509 -0.886 -9.542 1.00 0.00 H new ATOM 0 HG SER A 78 10.649 -0.410 -10.300 1.00 0.00 H new ATOM 1177 N GLY A 79 6.871 -2.162 -11.405 1.00 0.00 N ATOM 1178 CA GLY A 79 6.652 -3.397 -12.135 1.00 0.00 C ATOM 1179 C GLY A 79 7.136 -4.615 -11.373 1.00 0.00 C ATOM 1180 O GLY A 79 7.943 -5.392 -11.881 1.00 0.00 O ATOM 0 H GLY A 79 6.641 -2.205 -10.412 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.589 -3.505 -12.349 1.00 0.00 H new ATOM 0 HA3 GLY A 79 7.167 -3.344 -13.094 1.00 0.00 H new ATOM 1184 N GLU A 80 6.642 -4.780 -10.150 1.00 0.00 N ATOM 1185 CA GLU A 80 7.032 -5.911 -9.316 1.00 0.00 C ATOM 1186 C GLU A 80 5.817 -6.514 -8.616 1.00 0.00 C ATOM 1187 O GLU A 80 4.894 -5.799 -8.227 1.00 0.00 O ATOM 1188 CB GLU A 80 8.068 -5.475 -8.278 1.00 0.00 C ATOM 1189 CG GLU A 80 8.422 -6.562 -7.278 1.00 0.00 C ATOM 1190 CD GLU A 80 9.333 -7.622 -7.866 1.00 0.00 C ATOM 1191 OE1 GLU A 80 10.054 -7.313 -8.837 1.00 0.00 O ATOM 1192 OE2 GLU A 80 9.324 -8.761 -7.354 1.00 0.00 O ATOM 0 H GLU A 80 5.972 -4.146 -9.715 1.00 0.00 H new ATOM 0 HA GLU A 80 7.473 -6.671 -9.961 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.975 -5.158 -8.793 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.687 -4.607 -7.739 1.00 0.00 H new ATOM 0 HG2 GLU A 80 8.908 -6.110 -6.413 1.00 0.00 H new ATOM 0 HG3 GLU A 80 7.507 -7.033 -6.920 1.00 0.00 H new ATOM 1199 N GLN A 81 5.827 -7.834 -8.459 1.00 0.00 N ATOM 1200 CA GLN A 81 4.726 -8.534 -7.807 1.00 0.00 C ATOM 1201 C GLN A 81 5.225 -9.340 -6.613 1.00 0.00 C ATOM 1202 O GLN A 81 6.314 -9.914 -6.650 1.00 0.00 O ATOM 1203 CB GLN A 81 4.020 -9.457 -8.802 1.00 0.00 C ATOM 1204 CG GLN A 81 2.683 -9.980 -8.303 1.00 0.00 C ATOM 1205 CD GLN A 81 2.161 -11.134 -9.136 1.00 0.00 C ATOM 1206 OE1 GLN A 81 1.212 -10.980 -9.905 1.00 0.00 O ATOM 1207 NE2 GLN A 81 2.780 -12.300 -8.987 1.00 0.00 N ATOM 0 H GLN A 81 6.585 -8.440 -8.774 1.00 0.00 H new ATOM 0 HA GLN A 81 4.016 -7.789 -7.448 1.00 0.00 H new ATOM 0 HB2 GLN A 81 3.864 -8.919 -9.737 1.00 0.00 H new ATOM 0 HB3 GLN A 81 4.671 -10.302 -9.026 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.787 -10.302 -7.267 1.00 0.00 H new ATOM 0 HG3 GLN A 81 1.954 -9.170 -8.313 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.563 -12.383 -8.338 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.473 -13.113 -9.521 1.00 0.00 H new ATOM 1216 N TYR A 82 4.423 -9.379 -5.555 1.00 0.00 N ATOM 1217 CA TYR A 82 4.784 -10.113 -4.348 1.00 0.00 C ATOM 1218 C TYR A 82 3.823 -11.274 -4.108 1.00 0.00 C ATOM 1219 O TYR A 82 2.605 -11.097 -4.109 1.00 0.00 O ATOM 1220 CB TYR A 82 4.785 -9.178 -3.138 1.00 0.00 C ATOM 1221 CG TYR A 82 6.114 -8.500 -2.898 1.00 0.00 C ATOM 1222 CD1 TYR A 82 6.998 -8.269 -3.945 1.00 0.00 C ATOM 1223 CD2 TYR A 82 6.488 -8.090 -1.624 1.00 0.00 C ATOM 1224 CE1 TYR A 82 8.214 -7.650 -3.730 1.00 0.00 C ATOM 1225 CE2 TYR A 82 7.701 -7.470 -1.400 1.00 0.00 C ATOM 1226 CZ TYR A 82 8.561 -7.252 -2.456 1.00 0.00 C ATOM 1227 OH TYR A 82 9.772 -6.635 -2.236 1.00 0.00 O ATOM 0 H TYR A 82 3.518 -8.911 -5.509 1.00 0.00 H new ATOM 0 HA TYR A 82 5.787 -10.518 -4.486 1.00 0.00 H new ATOM 0 HB2 TYR A 82 4.018 -8.416 -3.278 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.511 -9.747 -2.250 1.00 0.00 H new ATOM 0 HD1 TYR A 82 6.730 -8.579 -4.944 1.00 0.00 H new ATOM 0 HD2 TYR A 82 5.818 -8.259 -0.794 1.00 0.00 H new ATOM 0 HE1 TYR A 82 8.889 -7.479 -4.555 1.00 0.00 H new ATOM 0 HE2 TYR A 82 7.975 -7.157 -0.403 1.00 0.00 H new ATOM 0 HH TYR A 82 9.860 -6.418 -1.284 1.00 0.00 H new ATOM 1237 N LYS A 83 4.381 -12.462 -3.902 1.00 0.00 N ATOM 1238 CA LYS A 83 3.576 -13.653 -3.658 1.00 0.00 C ATOM 1239 C LYS A 83 3.432 -13.916 -2.162 1.00 0.00 C ATOM 1240 O LYS A 83 4.239 -14.632 -1.567 1.00 0.00 O ATOM 1241 CB LYS A 83 4.207 -14.868 -4.342 1.00 0.00 C ATOM 1242 CG LYS A 83 3.294 -16.081 -4.389 1.00 0.00 C ATOM 1243 CD LYS A 83 3.619 -16.978 -5.573 1.00 0.00 C ATOM 1244 CE LYS A 83 2.859 -16.552 -6.819 1.00 0.00 C ATOM 1245 NZ LYS A 83 3.054 -17.510 -7.942 1.00 0.00 N ATOM 0 H LYS A 83 5.388 -12.626 -3.899 1.00 0.00 H new ATOM 0 HA LYS A 83 2.584 -13.483 -4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.489 -14.596 -5.359 1.00 0.00 H new ATOM 0 HB3 LYS A 83 5.125 -15.134 -3.817 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.393 -16.648 -3.464 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.256 -15.754 -4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.690 -16.948 -5.771 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.369 -18.010 -5.328 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.797 -16.475 -6.588 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.191 -15.560 -7.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.520 -17.184 -8.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.065 -17.565 -8.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.714 -18.451 -7.659 1.00 0.00 H new ATOM 1259 N LEU A 84 2.401 -13.333 -1.560 1.00 0.00 N ATOM 1260 CA LEU A 84 2.151 -13.506 -0.134 1.00 0.00 C ATOM 1261 C LEU A 84 0.826 -14.224 0.104 1.00 0.00 C ATOM 1262 O LEU A 84 -0.013 -14.312 -0.793 1.00 0.00 O ATOM 1263 CB LEU A 84 2.141 -12.148 0.570 1.00 0.00 C ATOM 1264 CG LEU A 84 3.233 -11.164 0.147 1.00 0.00 C ATOM 1265 CD1 LEU A 84 3.120 -9.870 0.937 1.00 0.00 C ATOM 1266 CD2 LEU A 84 4.610 -11.785 0.330 1.00 0.00 C ATOM 0 H LEU A 84 1.725 -12.737 -2.037 1.00 0.00 H new ATOM 0 HA LEU A 84 2.954 -14.117 0.279 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.172 -11.680 0.399 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.228 -12.317 1.643 1.00 0.00 H new ATOM 0 HG LEU A 84 3.098 -10.933 -0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.905 -9.182 0.623 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.146 -9.416 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.228 -10.082 2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.375 -11.071 0.024 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.755 -12.045 1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.688 -12.684 -0.281 1.00 0.00 H new ATOM 1278 N ARG A 85 0.645 -14.734 1.318 1.00 0.00 N ATOM 1279 CA ARG A 85 -0.578 -15.444 1.673 1.00 0.00 C ATOM 1280 C ARG A 85 -1.035 -15.067 3.080 1.00 0.00 C ATOM 1281 O ARG A 85 -0.217 -14.790 3.956 1.00 0.00 O ATOM 1282 CB ARG A 85 -0.360 -16.955 1.584 1.00 0.00 C ATOM 1283 CG ARG A 85 -1.416 -17.767 2.316 1.00 0.00 C ATOM 1284 CD ARG A 85 -1.016 -19.230 2.427 1.00 0.00 C ATOM 1285 NE ARG A 85 -0.572 -19.775 1.147 1.00 0.00 N ATOM 1286 CZ ARG A 85 -0.215 -21.043 0.972 1.00 0.00 C ATOM 1287 NH1 ARG A 85 -0.250 -21.891 1.991 1.00 0.00 N ATOM 1288 NH2 ARG A 85 0.177 -21.464 -0.223 1.00 0.00 N ATOM 0 H ARG A 85 1.329 -14.669 2.072 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.356 -15.154 0.966 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.349 -17.251 0.535 1.00 0.00 H new ATOM 0 HB3 ARG A 85 0.621 -17.197 1.994 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -1.568 -17.354 3.313 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.367 -17.688 1.790 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -0.217 -19.333 3.161 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -1.863 -19.810 2.794 1.00 0.00 H new ATOM 0 HE ARG A 85 -0.534 -19.148 0.343 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -0.551 -21.570 2.911 1.00 0.00 H new ATOM 0 HH12 ARG A 85 0.024 -22.864 1.855 1.00 0.00 H new ATOM 0 HH21 ARG A 85 0.205 -20.814 -1.009 1.00 0.00 H new ATOM 0 HH22 ARG A 85 0.451 -22.437 -0.356 1.00 0.00 H new ATOM 1302 N ALA A 86 -2.348 -15.059 3.287 1.00 0.00 N ATOM 1303 CA ALA A 86 -2.914 -14.718 4.586 1.00 0.00 C ATOM 1304 C ALA A 86 -3.064 -15.958 5.462 1.00 0.00 C ATOM 1305 O ALA A 86 -3.166 -17.078 4.959 1.00 0.00 O ATOM 1306 CB ALA A 86 -4.258 -14.027 4.411 1.00 0.00 C ATOM 0 H ALA A 86 -3.039 -15.285 2.572 1.00 0.00 H new ATOM 0 HA ALA A 86 -2.228 -14.033 5.085 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.669 -13.778 5.389 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.125 -13.114 3.830 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.944 -14.693 3.888 1.00 0.00 H new ATOM 1312 N THR A 87 -3.077 -15.751 6.775 1.00 0.00 N ATOM 1313 CA THR A 87 -3.213 -16.852 7.721 1.00 0.00 C ATOM 1314 C THR A 87 -4.463 -17.675 7.431 1.00 0.00 C ATOM 1315 O THR A 87 -4.504 -18.875 7.702 1.00 0.00 O ATOM 1316 CB THR A 87 -3.273 -16.341 9.172 1.00 0.00 C ATOM 1317 OG1 THR A 87 -3.023 -17.418 10.082 1.00 0.00 O ATOM 1318 CG2 THR A 87 -4.631 -15.722 9.472 1.00 0.00 C ATOM 0 H THR A 87 -2.995 -14.831 7.208 1.00 0.00 H new ATOM 0 HA THR A 87 -2.332 -17.482 7.602 1.00 0.00 H new ATOM 0 HB THR A 87 -2.507 -15.576 9.296 1.00 0.00 H new ATOM 0 HG1 THR A 87 -3.061 -17.084 11.003 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.650 -15.368 10.503 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.806 -14.884 8.797 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.411 -16.470 9.331 1.00 0.00 H new ATOM 1326 N ASP A 88 -5.479 -17.023 6.878 1.00 0.00 N ATOM 1327 CA ASP A 88 -6.731 -17.695 6.549 1.00 0.00 C ATOM 1328 C ASP A 88 -7.600 -16.819 5.652 1.00 0.00 C ATOM 1329 O ASP A 88 -7.288 -15.651 5.419 1.00 0.00 O ATOM 1330 CB ASP A 88 -7.493 -18.053 7.826 1.00 0.00 C ATOM 1331 CG ASP A 88 -7.772 -16.841 8.693 1.00 0.00 C ATOM 1332 OD1 ASP A 88 -7.930 -15.736 8.133 1.00 0.00 O ATOM 1333 OD2 ASP A 88 -7.832 -16.997 9.931 1.00 0.00 O ATOM 0 H ASP A 88 -5.461 -16.029 6.648 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.491 -18.611 6.009 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -8.436 -18.531 7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -6.916 -18.780 8.398 1.00 0.00 H new ATOM 1338 N ALA A 89 -8.690 -17.391 5.152 1.00 0.00 N ATOM 1339 CA ALA A 89 -9.604 -16.661 4.281 1.00 0.00 C ATOM 1340 C ALA A 89 -10.118 -15.397 4.961 1.00 0.00 C ATOM 1341 O ALA A 89 -10.083 -14.310 4.384 1.00 0.00 O ATOM 1342 CB ALA A 89 -10.767 -17.553 3.871 1.00 0.00 C ATOM 0 H ALA A 89 -8.962 -18.357 5.335 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.056 -16.364 3.387 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -11.442 -16.996 3.221 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -10.387 -18.424 3.338 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.307 -17.879 4.760 1.00 0.00 H new ATOM 1348 N LYS A 90 -10.597 -15.546 6.192 1.00 0.00 N ATOM 1349 CA LYS A 90 -11.119 -14.416 6.952 1.00 0.00 C ATOM 1350 C LYS A 90 -10.059 -13.331 7.111 1.00 0.00 C ATOM 1351 O LYS A 90 -10.381 -12.164 7.329 1.00 0.00 O ATOM 1352 CB LYS A 90 -11.598 -14.880 8.329 1.00 0.00 C ATOM 1353 CG LYS A 90 -10.468 -15.179 9.299 1.00 0.00 C ATOM 1354 CD LYS A 90 -10.980 -15.342 10.720 1.00 0.00 C ATOM 1355 CE LYS A 90 -11.334 -16.790 11.023 1.00 0.00 C ATOM 1356 NZ LYS A 90 -12.651 -17.171 10.443 1.00 0.00 N ATOM 0 H LYS A 90 -10.634 -16.438 6.684 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.962 -13.998 6.402 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -12.240 -14.111 8.759 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.209 -15.775 8.209 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.954 -16.089 8.990 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.736 -14.372 9.266 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -10.222 -14.997 11.423 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.859 -14.714 10.866 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.559 -17.445 10.625 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.355 -16.941 12.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.078 -17.926 11.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.280 -16.343 10.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.516 -17.510 9.469 1.00 0.00 H new ATOM 1370 N GLU A 91 -8.794 -13.724 6.997 1.00 0.00 N ATOM 1371 CA GLU A 91 -7.688 -12.783 7.127 1.00 0.00 C ATOM 1372 C GLU A 91 -7.324 -12.180 5.773 1.00 0.00 C ATOM 1373 O GLU A 91 -6.900 -11.027 5.688 1.00 0.00 O ATOM 1374 CB GLU A 91 -6.466 -13.478 7.733 1.00 0.00 C ATOM 1375 CG GLU A 91 -5.298 -12.540 7.990 1.00 0.00 C ATOM 1376 CD GLU A 91 -5.451 -11.759 9.281 1.00 0.00 C ATOM 1377 OE1 GLU A 91 -6.077 -12.288 10.224 1.00 0.00 O ATOM 1378 OE2 GLU A 91 -4.944 -10.620 9.349 1.00 0.00 O ATOM 0 H GLU A 91 -8.510 -14.687 6.815 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.006 -11.978 7.790 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.755 -13.950 8.672 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.141 -14.274 7.063 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.374 -13.117 8.026 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.206 -11.843 7.157 1.00 0.00 H new ATOM 1385 N ARG A 92 -7.492 -12.969 4.717 1.00 0.00 N ATOM 1386 CA ARG A 92 -7.180 -12.515 3.367 1.00 0.00 C ATOM 1387 C ARG A 92 -7.826 -11.161 3.086 1.00 0.00 C ATOM 1388 O ARG A 92 -7.172 -10.242 2.594 1.00 0.00 O ATOM 1389 CB ARG A 92 -7.655 -13.542 2.338 1.00 0.00 C ATOM 1390 CG ARG A 92 -7.489 -13.084 0.898 1.00 0.00 C ATOM 1391 CD ARG A 92 -8.039 -14.110 -0.080 1.00 0.00 C ATOM 1392 NE ARG A 92 -9.486 -13.995 -0.238 1.00 0.00 N ATOM 1393 CZ ARG A 92 -10.070 -13.133 -1.064 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -9.333 -12.317 -1.804 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -11.393 -13.088 -1.152 1.00 0.00 N ATOM 0 H ARG A 92 -7.842 -13.925 4.770 1.00 0.00 H new ATOM 0 HA ARG A 92 -6.098 -12.406 3.288 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.101 -14.470 2.481 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.706 -13.767 2.520 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -8.002 -12.133 0.756 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -6.433 -12.911 0.690 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -7.557 -13.981 -1.049 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.791 -15.112 0.269 1.00 0.00 H new ATOM 0 HE ARG A 92 -10.082 -14.610 0.316 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.316 -12.350 -1.740 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -9.783 -11.656 -2.437 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.963 -13.716 -0.585 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -11.840 -12.426 -1.786 1.00 0.00 H new ATOM 1409 N GLN A 93 -9.112 -11.048 3.400 1.00 0.00 N ATOM 1410 CA GLN A 93 -9.846 -9.808 3.180 1.00 0.00 C ATOM 1411 C GLN A 93 -9.139 -8.632 3.847 1.00 0.00 C ATOM 1412 O GLN A 93 -8.922 -7.591 3.225 1.00 0.00 O ATOM 1413 CB GLN A 93 -11.272 -9.932 3.718 1.00 0.00 C ATOM 1414 CG GLN A 93 -11.337 -10.251 5.203 1.00 0.00 C ATOM 1415 CD GLN A 93 -12.581 -11.032 5.578 1.00 0.00 C ATOM 1416 OE1 GLN A 93 -12.861 -12.087 5.009 1.00 0.00 O ATOM 1417 NE2 GLN A 93 -13.336 -10.517 6.541 1.00 0.00 N ATOM 0 H GLN A 93 -9.667 -11.800 3.808 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.885 -9.624 2.106 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.804 -8.999 3.532 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.794 -10.712 3.164 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.454 -10.823 5.487 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -11.311 -9.322 5.772 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -13.067 -9.640 6.986 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -14.185 -10.999 6.836 1.00 0.00 H new ATOM 1426 N HIS A 94 -8.782 -8.804 5.115 1.00 0.00 N ATOM 1427 CA HIS A 94 -8.099 -7.757 5.866 1.00 0.00 C ATOM 1428 C HIS A 94 -6.893 -7.231 5.093 1.00 0.00 C ATOM 1429 O HIS A 94 -6.885 -6.087 4.640 1.00 0.00 O ATOM 1430 CB HIS A 94 -7.653 -8.285 7.230 1.00 0.00 C ATOM 1431 CG HIS A 94 -7.070 -7.231 8.120 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -7.836 -6.279 8.760 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -5.788 -6.983 8.477 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -7.050 -5.490 9.471 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -5.802 -5.896 9.316 1.00 0.00 N ATOM 0 H HIS A 94 -8.954 -9.659 5.644 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.800 -6.936 6.014 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -8.507 -8.740 7.731 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -6.914 -9.073 7.081 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -8.851 -6.197 8.695 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -4.916 -7.537 8.161 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -7.373 -4.655 10.076 1.00 0.00 H new ATOM 1444 N TRP A 95 -5.878 -8.074 4.946 1.00 0.00 N ATOM 1445 CA TRP A 95 -4.666 -7.694 4.228 1.00 0.00 C ATOM 1446 C TRP A 95 -5.005 -7.112 2.860 1.00 0.00 C ATOM 1447 O TRP A 95 -4.597 -5.999 2.529 1.00 0.00 O ATOM 1448 CB TRP A 95 -3.743 -8.903 4.068 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.851 -9.130 5.250 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -2.884 -10.189 6.111 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -1.795 -8.276 5.703 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -1.913 -10.046 7.072 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -1.230 -8.881 6.843 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.269 -7.061 5.256 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -0.168 -8.309 7.540 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -0.216 -6.495 5.948 1.00 0.00 C ATOM 1457 CH2 TRP A 95 0.326 -7.119 7.079 1.00 0.00 C ATOM 0 H TRP A 95 -5.869 -9.025 5.314 1.00 0.00 H new ATOM 0 HA TRP A 95 -4.152 -6.929 4.810 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -4.349 -9.794 3.903 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -3.128 -8.766 3.179 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -3.573 -11.018 6.046 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.730 -10.701 7.832 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -1.679 -6.573 4.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.250 -8.788 8.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 0.196 -5.555 5.611 1.00 0.00 H new ATOM 0 HH2 TRP A 95 1.150 -6.652 7.597 1.00 0.00 H new ATOM 1468 N VAL A 96 -5.754 -7.873 2.067 1.00 0.00 N ATOM 1469 CA VAL A 96 -6.148 -7.431 0.734 1.00 0.00 C ATOM 1470 C VAL A 96 -6.841 -6.075 0.787 1.00 0.00 C ATOM 1471 O VAL A 96 -6.749 -5.282 -0.149 1.00 0.00 O ATOM 1472 CB VAL A 96 -7.087 -8.450 0.061 1.00 0.00 C ATOM 1473 CG1 VAL A 96 -7.730 -7.846 -1.178 1.00 0.00 C ATOM 1474 CG2 VAL A 96 -6.331 -9.723 -0.287 1.00 0.00 C ATOM 0 H VAL A 96 -6.100 -8.797 2.324 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.235 -7.345 0.145 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.880 -8.707 0.764 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.390 -8.580 -1.640 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.308 -6.966 -0.896 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.954 -7.559 -1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.010 -10.431 -0.762 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.516 -9.487 -0.972 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.924 -10.165 0.623 1.00 0.00 H new ATOM 1484 N SER A 97 -7.536 -5.814 1.890 1.00 0.00 N ATOM 1485 CA SER A 97 -8.249 -4.554 2.065 1.00 0.00 C ATOM 1486 C SER A 97 -7.302 -3.456 2.538 1.00 0.00 C ATOM 1487 O SER A 97 -6.987 -2.528 1.792 1.00 0.00 O ATOM 1488 CB SER A 97 -9.392 -4.725 3.067 1.00 0.00 C ATOM 1489 OG SER A 97 -10.151 -3.534 3.183 1.00 0.00 O ATOM 0 H SER A 97 -7.620 -6.459 2.676 1.00 0.00 H new ATOM 0 HA SER A 97 -8.663 -4.262 1.100 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.039 -5.543 2.749 1.00 0.00 H new ATOM 0 HB3 SER A 97 -8.988 -4.999 4.042 1.00 0.00 H new ATOM 0 HG SER A 97 -10.876 -3.670 3.828 1.00 0.00 H new ATOM 1495 N ARG A 98 -6.851 -3.568 3.783 1.00 0.00 N ATOM 1496 CA ARG A 98 -5.941 -2.584 4.358 1.00 0.00 C ATOM 1497 C ARG A 98 -4.921 -2.118 3.323 1.00 0.00 C ATOM 1498 O ARG A 98 -4.642 -0.924 3.205 1.00 0.00 O ATOM 1499 CB ARG A 98 -5.220 -3.174 5.571 1.00 0.00 C ATOM 1500 CG ARG A 98 -6.160 -3.681 6.652 1.00 0.00 C ATOM 1501 CD ARG A 98 -6.913 -2.538 7.316 1.00 0.00 C ATOM 1502 NE ARG A 98 -6.154 -1.949 8.416 1.00 0.00 N ATOM 1503 CZ ARG A 98 -5.286 -0.955 8.260 1.00 0.00 C ATOM 1504 NH1 ARG A 98 -5.069 -0.443 7.057 1.00 0.00 N ATOM 1505 NH2 ARG A 98 -4.634 -0.472 9.310 1.00 0.00 N ATOM 0 H ARG A 98 -7.101 -4.330 4.413 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.529 -1.723 4.677 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -4.584 -3.995 5.241 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -4.565 -2.415 5.998 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -6.872 -4.383 6.217 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.591 -4.228 7.403 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -7.133 -1.770 6.575 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.870 -2.903 7.690 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.298 -2.321 9.355 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -5.569 -0.812 6.248 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -4.402 0.320 6.940 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -4.799 -0.864 10.237 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -3.968 0.291 9.190 1.00 0.00 H new ATOM 1519 N LEU A 99 -4.367 -3.067 2.577 1.00 0.00 N ATOM 1520 CA LEU A 99 -3.377 -2.754 1.552 1.00 0.00 C ATOM 1521 C LEU A 99 -4.014 -1.990 0.396 1.00 0.00 C ATOM 1522 O LEU A 99 -3.489 -0.970 -0.050 1.00 0.00 O ATOM 1523 CB LEU A 99 -2.727 -4.038 1.034 1.00 0.00 C ATOM 1524 CG LEU A 99 -1.996 -4.887 2.074 1.00 0.00 C ATOM 1525 CD1 LEU A 99 -1.891 -6.330 1.607 1.00 0.00 C ATOM 1526 CD2 LEU A 99 -0.614 -4.314 2.354 1.00 0.00 C ATOM 0 H LEU A 99 -4.586 -4.059 2.662 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.611 -2.123 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -3.500 -4.652 0.572 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.019 -3.772 0.249 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.571 -4.867 3.000 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -1.368 -6.919 2.360 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.891 -6.738 1.458 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.339 -6.369 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.108 -4.931 3.097 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -0.031 -4.303 1.433 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.712 -3.297 2.733 1.00 0.00 H new ATOM 1538 N GLN A 100 -5.148 -2.490 -0.084 1.00 0.00 N ATOM 1539 CA GLN A 100 -5.856 -1.853 -1.188 1.00 0.00 C ATOM 1540 C GLN A 100 -6.212 -0.410 -0.846 1.00 0.00 C ATOM 1541 O GLN A 100 -6.430 0.413 -1.735 1.00 0.00 O ATOM 1542 CB GLN A 100 -7.125 -2.637 -1.528 1.00 0.00 C ATOM 1543 CG GLN A 100 -6.888 -3.790 -2.490 1.00 0.00 C ATOM 1544 CD GLN A 100 -8.123 -4.647 -2.689 1.00 0.00 C ATOM 1545 OE1 GLN A 100 -9.089 -4.549 -1.932 1.00 0.00 O ATOM 1546 NE2 GLN A 100 -8.097 -5.495 -3.711 1.00 0.00 N ATOM 0 H GLN A 100 -5.596 -3.334 0.274 1.00 0.00 H new ATOM 0 HA GLN A 100 -5.196 -1.849 -2.056 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -7.559 -3.026 -0.607 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.857 -1.956 -1.963 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.566 -3.394 -3.453 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -6.076 -4.412 -2.113 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -7.275 -5.543 -4.313 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -8.899 -6.098 -3.894 1.00 0.00 H new ATOM 1555 N ILE A 101 -6.270 -0.111 0.447 1.00 0.00 N ATOM 1556 CA ILE A 101 -6.599 1.233 0.906 1.00 0.00 C ATOM 1557 C ILE A 101 -5.351 2.106 0.991 1.00 0.00 C ATOM 1558 O ILE A 101 -5.320 3.216 0.458 1.00 0.00 O ATOM 1559 CB ILE A 101 -7.287 1.205 2.284 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -8.561 0.361 2.224 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -7.602 2.619 2.747 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -9.000 -0.167 3.573 1.00 0.00 C ATOM 0 H ILE A 101 -6.094 -0.781 1.195 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.287 1.657 0.174 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.607 0.751 3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.365 0.961 1.798 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.399 -0.479 1.549 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.088 2.583 3.722 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -6.677 3.191 2.823 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -8.267 3.098 2.028 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.909 -0.756 3.455 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.213 -0.794 3.992 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -9.194 0.669 4.245 1.00 0.00 H new ATOM 1574 N CYS A 102 -4.324 1.596 1.662 1.00 0.00 N ATOM 1575 CA CYS A 102 -3.073 2.329 1.816 1.00 0.00 C ATOM 1576 C CYS A 102 -2.418 2.578 0.461 1.00 0.00 C ATOM 1577 O CYS A 102 -1.861 3.649 0.216 1.00 0.00 O ATOM 1578 CB CYS A 102 -2.114 1.557 2.725 1.00 0.00 C ATOM 1579 SG CYS A 102 -0.587 2.445 3.110 1.00 0.00 S ATOM 0 H CYS A 102 -4.333 0.679 2.108 1.00 0.00 H new ATOM 0 HA CYS A 102 -3.299 3.293 2.273 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -2.627 1.317 3.656 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -1.861 0.610 2.248 1.00 0.00 H new ATOM 0 HG CYS A 102 0.157 1.713 3.885 1.00 0.00 H new ATOM 1585 N THR A 103 -2.489 1.582 -0.416 1.00 0.00 N ATOM 1586 CA THR A 103 -1.901 1.692 -1.745 1.00 0.00 C ATOM 1587 C THR A 103 -2.480 2.879 -2.507 1.00 0.00 C ATOM 1588 O THR A 103 -1.757 3.599 -3.194 1.00 0.00 O ATOM 1589 CB THR A 103 -2.128 0.409 -2.567 1.00 0.00 C ATOM 1590 OG1 THR A 103 -1.132 0.300 -3.591 1.00 0.00 O ATOM 1591 CG2 THR A 103 -3.512 0.408 -3.198 1.00 0.00 C ATOM 0 H THR A 103 -2.948 0.690 -0.230 1.00 0.00 H new ATOM 0 HA THR A 103 -0.830 1.841 -1.605 1.00 0.00 H new ATOM 0 HB THR A 103 -2.052 -0.445 -1.894 1.00 0.00 H new ATOM 0 HG1 THR A 103 -0.361 0.858 -3.358 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.649 -0.508 -3.773 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.269 0.461 -2.415 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.611 1.270 -3.858 1.00 0.00 H new ATOM 1599 N GLN A 104 -3.788 3.076 -2.379 1.00 0.00 N ATOM 1600 CA GLN A 104 -4.464 4.177 -3.055 1.00 0.00 C ATOM 1601 C GLN A 104 -4.344 5.467 -2.250 1.00 0.00 C ATOM 1602 O GLN A 104 -3.807 6.464 -2.733 1.00 0.00 O ATOM 1603 CB GLN A 104 -5.938 3.837 -3.280 1.00 0.00 C ATOM 1604 CG GLN A 104 -6.654 4.812 -4.202 1.00 0.00 C ATOM 1605 CD GLN A 104 -8.162 4.741 -4.069 1.00 0.00 C ATOM 1606 OE1 GLN A 104 -8.699 3.830 -3.437 1.00 0.00 O ATOM 1607 NE2 GLN A 104 -8.855 5.703 -4.666 1.00 0.00 N ATOM 0 H GLN A 104 -4.401 2.488 -1.814 1.00 0.00 H new ATOM 0 HA GLN A 104 -3.982 4.328 -4.021 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.011 2.833 -3.699 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -6.449 3.818 -2.317 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -6.321 5.826 -3.981 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -6.374 4.602 -5.234 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -8.369 6.438 -5.179 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -9.874 5.707 -4.612 1.00 0.00 H new ATOM 1616 N HIS A 105 -4.848 5.440 -1.021 1.00 0.00 N ATOM 1617 CA HIS A 105 -4.797 6.608 -0.148 1.00 0.00 C ATOM 1618 C HIS A 105 -3.485 7.364 -0.329 1.00 0.00 C ATOM 1619 O HIS A 105 -3.432 8.583 -0.163 1.00 0.00 O ATOM 1620 CB HIS A 105 -4.959 6.186 1.313 1.00 0.00 C ATOM 1621 CG HIS A 105 -5.535 7.259 2.185 1.00 0.00 C ATOM 1622 ND1 HIS A 105 -6.726 7.895 1.909 1.00 0.00 N ATOM 1623 CD2 HIS A 105 -5.076 7.806 3.336 1.00 0.00 C ATOM 1624 CE1 HIS A 105 -6.975 8.788 2.850 1.00 0.00 C ATOM 1625 NE2 HIS A 105 -5.989 8.753 3.728 1.00 0.00 N ATOM 0 H HIS A 105 -5.296 4.623 -0.607 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.618 7.271 -0.420 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.602 5.307 1.360 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -3.987 5.891 1.708 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.162 7.546 3.849 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -7.838 9.436 2.894 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -5.918 9.335 4.562 1.00 0.00 H new ATOM 1634 N HIS A 106 -2.428 6.634 -0.670 1.00 0.00 N ATOM 1635 CA HIS A 106 -1.116 7.236 -0.873 1.00 0.00 C ATOM 1636 C HIS A 106 -0.967 7.746 -2.304 1.00 0.00 C ATOM 1637 O HIS A 106 -0.902 8.952 -2.541 1.00 0.00 O ATOM 1638 CB HIS A 106 -0.013 6.224 -0.563 1.00 0.00 C ATOM 1639 CG HIS A 106 0.418 6.228 0.872 1.00 0.00 C ATOM 1640 ND1 HIS A 106 1.623 6.747 1.295 1.00 0.00 N ATOM 1641 CD2 HIS A 106 -0.206 5.773 1.984 1.00 0.00 C ATOM 1642 CE1 HIS A 106 1.723 6.610 2.605 1.00 0.00 C ATOM 1643 NE2 HIS A 106 0.627 6.022 3.048 1.00 0.00 N ATOM 0 H HIS A 106 -2.455 5.624 -0.812 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.024 8.083 -0.193 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.363 5.226 -0.826 1.00 0.00 H new ATOM 0 HB3 HIS A 106 0.850 6.435 -1.194 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -1.177 5.302 2.027 1.00 0.00 H new ATOM 0 HE1 HIS A 106 2.559 6.925 3.211 1.00 0.00 H new ATOM 0 HE2 HIS A 106 0.431 5.790 4.022 1.00 0.00 H new ATOM 1652 N THR A 107 -0.913 6.818 -3.254 1.00 0.00 N ATOM 1653 CA THR A 107 -0.770 7.172 -4.661 1.00 0.00 C ATOM 1654 C THR A 107 -1.635 8.377 -5.015 1.00 0.00 C ATOM 1655 O THR A 107 -1.287 9.164 -5.894 1.00 0.00 O ATOM 1656 CB THR A 107 -1.150 5.995 -5.578 1.00 0.00 C ATOM 1657 OG1 THR A 107 -0.482 6.120 -6.839 1.00 0.00 O ATOM 1658 CG2 THR A 107 -2.655 5.944 -5.799 1.00 0.00 C ATOM 0 H THR A 107 -0.966 5.815 -3.075 1.00 0.00 H new ATOM 0 HA THR A 107 0.279 7.422 -4.819 1.00 0.00 H new ATOM 0 HB THR A 107 -0.838 5.070 -5.092 1.00 0.00 H new ATOM 0 HG1 THR A 107 -0.438 7.065 -7.094 1.00 0.00 H new ATOM 0 HG21 THR A 107 -2.899 5.104 -6.450 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.159 5.819 -4.841 1.00 0.00 H new ATOM 0 HG23 THR A 107 -2.986 6.872 -6.265 1.00 0.00 H new ATOM 1666 N GLU A 108 -2.762 8.514 -4.324 1.00 0.00 N ATOM 1667 CA GLU A 108 -3.676 9.624 -4.567 1.00 0.00 C ATOM 1668 C GLU A 108 -2.994 10.961 -4.288 1.00 0.00 C ATOM 1669 O GLU A 108 -3.028 11.871 -5.116 1.00 0.00 O ATOM 1670 CB GLU A 108 -4.926 9.485 -3.695 1.00 0.00 C ATOM 1671 CG GLU A 108 -6.172 10.092 -4.317 1.00 0.00 C ATOM 1672 CD GLU A 108 -7.307 10.243 -3.322 1.00 0.00 C ATOM 1673 OE1 GLU A 108 -7.524 9.308 -2.523 1.00 0.00 O ATOM 1674 OE2 GLU A 108 -7.976 11.297 -3.342 1.00 0.00 O ATOM 0 H GLU A 108 -3.064 7.871 -3.592 1.00 0.00 H new ATOM 0 HA GLU A 108 -3.969 9.597 -5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -5.106 8.428 -3.499 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -4.742 9.961 -2.732 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -5.927 11.069 -4.733 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -6.502 9.466 -5.146 1.00 0.00 H new ATOM 1681 N ALA A 109 -2.378 11.071 -3.116 1.00 0.00 N ATOM 1682 CA ALA A 109 -1.687 12.295 -2.728 1.00 0.00 C ATOM 1683 C ALA A 109 -0.997 12.939 -3.926 1.00 0.00 C ATOM 1684 O ALA A 109 -0.864 14.161 -3.994 1.00 0.00 O ATOM 1685 CB ALA A 109 -0.677 12.004 -1.628 1.00 0.00 C ATOM 0 H ALA A 109 -2.343 10.328 -2.418 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.429 12.998 -2.349 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.168 12.926 -1.348 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.193 11.596 -0.759 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.055 11.281 -1.988 1.00 0.00 H new ATOM 1691 N ILE A 110 -0.560 12.109 -4.868 1.00 0.00 N ATOM 1692 CA ILE A 110 0.116 12.599 -6.063 1.00 0.00 C ATOM 1693 C ILE A 110 -0.752 13.606 -6.811 1.00 0.00 C ATOM 1694 O ILE A 110 -1.685 13.231 -7.519 1.00 0.00 O ATOM 1695 CB ILE A 110 0.482 11.446 -7.015 1.00 0.00 C ATOM 1696 CG1 ILE A 110 1.355 10.418 -6.294 1.00 0.00 C ATOM 1697 CG2 ILE A 110 1.194 11.983 -8.248 1.00 0.00 C ATOM 1698 CD1 ILE A 110 1.926 9.360 -7.212 1.00 0.00 C ATOM 0 H ILE A 110 -0.662 11.095 -4.827 1.00 0.00 H new ATOM 0 HA ILE A 110 1.031 13.088 -5.730 1.00 0.00 H new ATOM 0 HB ILE A 110 -0.436 10.954 -7.335 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.175 10.935 -5.795 1.00 0.00 H new ATOM 0 HG13 ILE A 110 0.764 9.933 -5.517 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.446 11.156 -8.912 1.00 0.00 H new ATOM 0 HG22 ILE A 110 0.540 12.681 -8.771 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.106 12.497 -7.946 1.00 0.00 H new ATOM 0 HD11 ILE A 110 2.534 8.665 -6.633 1.00 0.00 H new ATOM 0 HD12 ILE A 110 1.112 8.817 -7.692 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.544 9.835 -7.974 1.00 0.00 H new ATOM 1710 N GLY A 111 -0.435 14.887 -6.650 1.00 0.00 N ATOM 1711 CA GLY A 111 -1.194 15.929 -7.318 1.00 0.00 C ATOM 1712 C GLY A 111 -0.588 16.324 -8.650 1.00 0.00 C ATOM 1713 O GLY A 111 0.526 16.846 -8.704 1.00 0.00 O ATOM 0 H GLY A 111 0.334 15.222 -6.069 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -2.216 15.586 -7.475 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.248 16.806 -6.673 1.00 0.00 H new ATOM 1717 N LYS A 112 -1.321 16.073 -9.730 1.00 0.00 N ATOM 1718 CA LYS A 112 -0.850 16.405 -11.069 1.00 0.00 C ATOM 1719 C LYS A 112 -1.028 17.892 -11.355 1.00 0.00 C ATOM 1720 O LYS A 112 -2.147 18.404 -11.355 1.00 0.00 O ATOM 1721 CB LYS A 112 -1.602 15.579 -12.115 1.00 0.00 C ATOM 1722 CG LYS A 112 -1.425 14.080 -11.950 1.00 0.00 C ATOM 1723 CD LYS A 112 -2.374 13.304 -12.848 1.00 0.00 C ATOM 1724 CE LYS A 112 -3.744 13.145 -12.206 1.00 0.00 C ATOM 1725 NZ LYS A 112 -3.826 11.914 -11.371 1.00 0.00 N ATOM 0 H LYS A 112 -2.244 15.640 -9.703 1.00 0.00 H new ATOM 0 HA LYS A 112 0.213 16.168 -11.123 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -2.664 15.819 -12.060 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -1.261 15.869 -13.109 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -0.396 13.806 -12.184 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -1.600 13.804 -10.910 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -2.476 13.819 -13.803 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -1.954 12.321 -13.060 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -3.959 14.017 -11.589 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -4.507 13.108 -12.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -4.775 11.842 -10.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -3.646 11.079 -11.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -3.115 11.960 -10.614 1.00 0.00 H new ATOM 1739 N ASN A 113 0.082 18.580 -11.600 1.00 0.00 N ATOM 1740 CA ASN A 113 0.048 20.010 -11.889 1.00 0.00 C ATOM 1741 C ASN A 113 0.400 20.278 -13.348 1.00 0.00 C ATOM 1742 O ASN A 113 1.356 19.716 -13.880 1.00 0.00 O ATOM 1743 CB ASN A 113 1.016 20.760 -10.972 1.00 0.00 C ATOM 1744 CG ASN A 113 0.556 22.175 -10.679 1.00 0.00 C ATOM 1745 OD1 ASN A 113 -0.374 22.388 -9.900 1.00 0.00 O ATOM 1746 ND2 ASN A 113 1.206 23.150 -11.303 1.00 0.00 N ATOM 0 H ASN A 113 1.016 18.171 -11.604 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.965 20.369 -11.707 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.121 20.214 -10.035 1.00 0.00 H new ATOM 0 HB3 ASN A 113 2.002 20.790 -11.436 1.00 0.00 H new ATOM 0 HD21 ASN A 113 0.941 24.122 -11.145 1.00 0.00 H new ATOM 0 HD22 ASN A 113 1.971 22.927 -11.940 1.00 0.00 H new ATOM 1753 N ASN A 114 -0.379 21.143 -13.990 1.00 0.00 N ATOM 1754 CA ASN A 114 -0.149 21.487 -15.389 1.00 0.00 C ATOM 1755 C ASN A 114 1.305 21.884 -15.619 1.00 0.00 C ATOM 1756 O ASN A 114 2.014 21.256 -16.406 1.00 0.00 O ATOM 1757 CB ASN A 114 -1.075 22.628 -15.814 1.00 0.00 C ATOM 1758 CG ASN A 114 -2.541 22.267 -15.672 1.00 0.00 C ATOM 1759 OD1 ASN A 114 -3.109 22.346 -14.583 1.00 0.00 O ATOM 1760 ND2 ASN A 114 -3.161 21.867 -16.777 1.00 0.00 N ATOM 0 H ASN A 114 -1.175 21.618 -13.564 1.00 0.00 H new ATOM 0 HA ASN A 114 -0.367 20.607 -15.994 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -0.861 23.510 -15.210 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -0.868 22.893 -16.851 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -4.148 21.610 -16.744 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -2.650 21.817 -17.659 1.00 0.00 H new ATOM 1767 N SER A 115 1.744 22.931 -14.928 1.00 0.00 N ATOM 1768 CA SER A 115 3.113 23.414 -15.059 1.00 0.00 C ATOM 1769 C SER A 115 4.105 22.396 -14.505 1.00 0.00 C ATOM 1770 O SER A 115 4.243 22.244 -13.292 1.00 0.00 O ATOM 1771 CB SER A 115 3.277 24.750 -14.331 1.00 0.00 C ATOM 1772 OG SER A 115 4.594 25.253 -14.478 1.00 0.00 O ATOM 0 H SER A 115 1.171 23.461 -14.271 1.00 0.00 H new ATOM 0 HA SER A 115 3.321 23.557 -16.119 1.00 0.00 H new ATOM 0 HB2 SER A 115 2.562 25.473 -14.725 1.00 0.00 H new ATOM 0 HB3 SER A 115 3.050 24.621 -13.273 1.00 0.00 H new ATOM 0 HG SER A 115 4.672 26.108 -14.005 1.00 0.00 H new ATOM 1778 N GLY A 116 4.793 21.699 -15.404 1.00 0.00 N ATOM 1779 CA GLY A 116 5.763 20.703 -14.987 1.00 0.00 C ATOM 1780 C GLY A 116 7.083 20.837 -15.720 1.00 0.00 C ATOM 1781 O GLY A 116 7.141 21.303 -16.859 1.00 0.00 O ATOM 0 H GLY A 116 4.696 21.806 -16.414 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.935 20.795 -13.915 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.354 19.707 -15.160 1.00 0.00 H new ATOM 1785 N PRO A 117 8.175 20.424 -15.060 1.00 0.00 N ATOM 1786 CA PRO A 117 9.521 20.491 -15.637 1.00 0.00 C ATOM 1787 C PRO A 117 9.714 19.497 -16.777 1.00 0.00 C ATOM 1788 O PRO A 117 9.032 18.474 -16.843 1.00 0.00 O ATOM 1789 CB PRO A 117 10.430 20.135 -14.458 1.00 0.00 C ATOM 1790 CG PRO A 117 9.575 19.317 -13.554 1.00 0.00 C ATOM 1791 CD PRO A 117 8.180 19.858 -13.701 1.00 0.00 C ATOM 0 HA PRO A 117 9.729 21.468 -16.074 1.00 0.00 H new ATOM 0 HB2 PRO A 117 11.306 19.576 -14.788 1.00 0.00 H new ATOM 0 HB3 PRO A 117 10.795 21.030 -13.955 1.00 0.00 H new ATOM 0 HG2 PRO A 117 9.615 18.263 -13.827 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.916 19.392 -12.521 1.00 0.00 H new ATOM 0 HD2 PRO A 117 7.431 19.074 -13.590 1.00 0.00 H new ATOM 0 HD3 PRO A 117 7.962 20.616 -12.949 1.00 0.00 H new ATOM 1799 N SER A 118 10.647 19.803 -17.673 1.00 0.00 N ATOM 1800 CA SER A 118 10.927 18.938 -18.812 1.00 0.00 C ATOM 1801 C SER A 118 12.428 18.837 -19.062 1.00 0.00 C ATOM 1802 O SER A 118 13.052 19.778 -19.551 1.00 0.00 O ATOM 1803 CB SER A 118 10.224 19.465 -20.065 1.00 0.00 C ATOM 1804 OG SER A 118 10.619 20.797 -20.348 1.00 0.00 O ATOM 0 H SER A 118 11.222 20.644 -17.632 1.00 0.00 H new ATOM 0 HA SER A 118 10.547 17.943 -18.582 1.00 0.00 H new ATOM 0 HB2 SER A 118 10.459 18.824 -20.915 1.00 0.00 H new ATOM 0 HB3 SER A 118 9.144 19.424 -19.924 1.00 0.00 H new ATOM 0 HG SER A 118 11.583 20.890 -20.201 1.00 0.00 H new ATOM 1810 N SER A 119 13.002 17.687 -18.722 1.00 0.00 N ATOM 1811 CA SER A 119 14.431 17.463 -18.905 1.00 0.00 C ATOM 1812 C SER A 119 14.738 17.063 -20.345 1.00 0.00 C ATOM 1813 O SER A 119 13.936 16.402 -21.003 1.00 0.00 O ATOM 1814 CB SER A 119 14.926 16.378 -17.946 1.00 0.00 C ATOM 1815 OG SER A 119 14.457 15.099 -18.338 1.00 0.00 O ATOM 0 H SER A 119 12.499 16.896 -18.319 1.00 0.00 H new ATOM 0 HA SER A 119 14.951 18.396 -18.686 1.00 0.00 H new ATOM 0 HB2 SER A 119 16.016 16.378 -17.923 1.00 0.00 H new ATOM 0 HB3 SER A 119 14.586 16.599 -16.934 1.00 0.00 H new ATOM 0 HG SER A 119 14.788 14.423 -17.711 1.00 0.00 H new ATOM 1821 N GLY A 120 15.908 17.470 -20.829 1.00 0.00 N ATOM 1822 CA GLY A 120 16.302 17.146 -22.188 1.00 0.00 C ATOM 1823 C GLY A 120 15.406 17.799 -23.222 1.00 0.00 C ATOM 1824 O GLY A 120 15.350 17.358 -24.370 1.00 0.00 O ATOM 0 H GLY A 120 16.590 18.018 -20.304 1.00 0.00 H new ATOM 0 HA2 GLY A 120 17.332 17.465 -22.350 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.278 16.065 -22.322 1.00 0.00 H new TER 1828 GLY A 120